#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 4.51 -1.01 1.96 1.01 -1.26 -0.09 116.67 121.79 3fef s ASP 8 Ca 0.00 -1.29 0.00 0.00 0.71 0.00 0.00 52.55 51.97 3fef s ASP 8 Cb 0.00 0.26 0.00 0.00 1.01 0.00 0.00 42.92 44.19 3fef s ASP 8 CO 0.00 -0.95 0.00 0.00 0.21 0.00 0.00 175.17 174.43 3fef n GLN 9 N -1.57 -2.12 -2.25 8.23 6.02 -1.01 -4.87 117.38 119.81 3fef n GLN 9 Ca -0.05 0.57 -0.40 0.00 -0.01 0.00 0.00 57.00 57.11 3fef n GLN 9 Cb 0.65 -5.10 -0.03 0.00 1.02 0.00 0.00 30.24 26.78 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 -2.47 3.00 -0.15 5.09 -1.09 -0.86 -4.87 121.20 119.85 3fef s ILE 10 Ca 0.00 1.00 0.01 0.00 -2.23 0.00 0.00 60.65 59.43 3fef s ILE 10 Cb 0.00 -3.63 -0.00 0.00 -1.58 0.00 0.00 42.46 37.25 3fef s ILE 10 CO 0.00 0.23 -0.17 -0.75 -1.23 0.00 0.00 174.94 173.03 3fef s LYS 11 N -1.70 3.19 -0.17 2.79 2.20 -1.26 -0.77 119.74 124.02 3fef s LYS 11 Ca 0.48 -0.77 -0.01 0.00 -0.36 0.00 0.00 55.97 55.31 3fef s LYS 11 Cb -0.37 -2.58 -0.01 0.00 -1.51 0.00 0.00 37.83 33.37 3fef s LYS 11 CO 0.48 0.04 -0.12 0.42 -0.36 0.00 0.00 175.35 175.82 3fef s ILE 12 N 0.74 2.96 -0.14 5.43 1.01 -0.44 0.17 121.20 130.94 3fef s ILE 12 Ca -0.07 -0.66 -0.19 0.00 0.00 0.00 0.00 60.65 59.73 3fef s ILE 12 Cb -0.16 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.00 3fef s ILE 12 CO 0.01 0.49 0.50 0.00 0.00 0.00 0.00 174.94 175.94 3fef s ALA 13 N 0.88 3.49 -0.33 9.38 0.00 0.46 -0.89 121.76 134.75 3fef s ALA 13 Ca -0.03 -0.25 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 3fef s ALA 13 Cb -0.15 -2.72 0.05 0.00 0.00 0.00 0.00 23.12 20.30 3fef s ALA 13 CO -0.00 -0.16 0.07 -0.47 0.00 0.00 0.00 175.76 175.20 3fef s TYR 14 N 0.99 3.30 -0.31 0.00 5.04 0.36 -0.21 117.35 126.50 3fef s TYR 14 Ca 0.26 -1.73 -0.21 0.00 -2.44 0.00 0.00 57.07 52.95 3fef s TYR 14 Cb -0.15 -2.33 -0.01 0.00 0.35 0.00 0.00 41.96 39.82 3fef s TYR 14 CO 0.10 -0.79 0.64 0.42 -1.34 0.00 0.00 175.55 174.58 3fef s ILE 15 N 1.31 4.91 0.00 3.14 1.01 0.13 -0.79 121.20 130.92 3fef s ILE 15 Ca -0.02 0.83 0.00 0.00 0.00 0.00 0.00 60.65 61.46 3fef s ILE 15 Cb -0.20 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.24 3fef s ILE 15 CO 0.00 -0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.37 3fef n GLY 16 N 4.45 1.74 0.00 6.18 0.00 0.67 -0.60 105.19 117.63 3fef n GLY 16 Ca -0.01 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.03 -0.62 0.13 -0.02 0.00 0.49 -1.11 105.19 103.03 3fef n GLY 17 Ca 0.00 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.09 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 0.18 -0.93 3.44 -0.02 0.00 -1.26 -4.37 105.19 102.23 3fef n GLY 18 Ca 0.07 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.99 -1.32 -0.88 1.61 2.88 -0.27 -4.68 113.62 109.96 3fef n SER 19 Ca 0.11 0.77 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 3fef n SER 19 Cb 0.32 -1.12 0.18 0.00 -0.75 0.00 0.00 64.21 62.84 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 0.31 1.93 0.00 -1.46 6.02 -1.26 -4.47 117.38 118.45 3fef n GLN 20 Ca 0.11 -3.43 0.00 0.00 -0.01 0.00 0.00 57.00 53.67 3fef n GLN 20 Cb 0.46 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 29.97 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 -1.06 0.31 0.33 1.08 0.00 -1.26 -4.79 105.19 99.80 3fef n GLY 21 Ca 0.24 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.34 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 0.60 0.26 1.61 4.06 -1.95 -2.17 115.95 118.36 3fef h TRP 22 Ca 0.00 0.01 0.01 0.00 2.06 0.00 0.00 58.89 60.97 3fef h TRP 22 Cb 0.00 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 27.93 3fef h TRP 22 CO 0.00 0.35 -0.32 0.00 -3.56 0.00 0.00 178.44 174.91 3fef h ALA 23 N 1.69 -0.64 -0.67 1.49 0.00 -1.88 -1.54 119.26 117.71 3fef h ALA 23 Ca 0.21 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3fef h ALA 23 Cb 0.07 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3fef h ALA 23 CO -0.05 -0.90 0.27 0.00 0.00 0.00 0.00 179.25 178.57 3fef h ARG 24 N -0.63 1.00 -0.45 0.00 2.47 -1.73 -2.32 114.38 112.71 3fef h ARG 24 Ca -0.00 -0.18 -0.04 0.00 -1.26 0.00 0.00 59.98 58.50 3fef h ARG 24 Cb 0.60 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.73 3fef h ARG 24 CO -0.10 0.83 0.11 1.03 0.56 0.00 0.00 179.97 182.40 3fef h SER 25 N 0.95 0.62 0.00 7.04 0.87 -1.40 -1.66 113.55 119.97 3fef h SER 25 Ca 0.22 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 3fef h SER 25 Cb 0.20 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 3fef h SER 25 CO -0.02 0.61 0.00 -0.11 -0.53 0.00 0.00 176.83 176.79 3fef n LEU 26 N -4.31 1.03 0.00 2.23 7.94 -0.58 -2.15 117.00 121.16 3fef n LEU 26 Ca 0.03 -0.51 0.00 0.00 -1.11 0.00 0.00 56.01 54.42 3fef n LEU 26 Cb 0.20 -0.20 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3fef n LEU 26 CO 0.39 0.18 0.00 -1.20 -1.11 0.00 0.00 177.39 175.65 3fef n SER 28 N 0.70 0.00 -0.04 1.96 7.64 -0.62 -0.26 113.62 122.99 3fef n SER 28 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 3fef n SER 28 Cb 0.18 0.00 0.23 0.00 -1.01 0.00 0.00 64.21 63.61 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 0.60 -0.69 6.43 3.32 -1.65 -2.09 116.42 122.33 3fef h ASP 29 Ca 0.00 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 56.87 3fef h ASP 29 Cb 0.00 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3fef h ASP 29 CO 0.00 0.69 0.25 -0.07 -1.72 0.00 0.00 179.24 178.39 3fef h LEU 30 N 0.59 0.98 -1.26 1.55 3.38 -0.90 -2.96 115.31 116.70 3fef h LEU 30 Ca 0.12 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3fef h LEU 30 Cb 0.42 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3fef h LEU 30 CO 0.02 0.90 0.00 0.77 0.09 0.00 0.00 178.44 180.22 3fef h SER 31 N 1.00 0.00 0.00 -0.43 4.64 -1.62 -2.85 113.55 114.30 3fef h SER 31 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3fef h SER 31 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3fef h SER 31 CO -0.01 0.00 -0.99 2.30 -0.87 0.00 0.00 176.83 177.25 3fef n ILE 32 N -2.86 0.00 -2.85 0.95 -5.35 -1.13 -4.68 119.36 103.44 3fef n ILE 32 Ca 0.01 -0.05 -0.43 0.00 -0.27 0.00 0.00 62.75 62.01 3fef n ILE 32 Cb 0.29 0.95 -0.04 0.00 -1.74 0.00 0.00 39.64 39.10 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 -2.96 6.33 0.00 7.28 -1.08 -1.08 -4.87 116.67 120.29 3fef s ASP 33 Ca 0.07 -0.40 0.26 0.00 -0.52 0.00 0.00 52.55 51.96 3fef s ASP 33 Cb 0.15 -2.43 1.54 0.00 -1.46 0.00 0.00 42.92 40.72 3fef s ASP 33 CO 0.82 -1.22 1.99 -0.62 0.52 0.00 0.00 175.17 176.67 3fef n GLU 34 N 7.41 1.03 0.00 4.34 1.02 -1.26 -4.84 120.64 128.34 3fef n GLU 34 Ca 0.01 -0.05 0.11 0.00 -0.02 0.00 0.00 57.16 57.22 3fef n GLU 34 Cb 0.47 -1.41 0.66 0.00 -0.02 0.00 0.00 31.44 31.14 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 -0.86 0.73 0.00 3.49 1.74 -1.26 -4.78 116.66 115.72 3fef n ARG 35 Ca 0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 3fef n ARG 35 Cb 0.10 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 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 -0.97 0.00 0.00 0.55 2.88 0.87 -0.39 113.62 116.55 3fef n SER 37 Ca 0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.71 3fef n SER 37 Cb 0.08 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 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 -0.17 -0.61 3.26 0.46 0.00 -1.10 -2.03 105.19 105.00 3fef n GLY 38 Ca 0.00 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.26 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 1.51 -0.20 2.61 -4.23 0.05 -0.96 115.64 110.42 3fef s THR 39 Ca 0.00 -1.65 0.02 0.00 -1.18 0.00 0.00 61.69 58.87 3fef s THR 39 Cb 0.00 -1.54 0.03 0.00 1.34 0.00 0.00 72.50 72.33 3fef s THR 39 CO 0.00 -0.27 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.95 3fef s VAL 40 N -1.72 2.05 -0.36 2.29 1.01 0.66 -1.32 120.40 123.00 3fef s VAL 40 Ca 0.08 -1.12 -0.24 0.00 0.00 0.00 0.00 61.98 60.70 3fef s VAL 40 Cb -0.07 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.37 3fef s VAL 40 CO 0.04 0.36 0.84 0.00 0.00 0.00 0.00 175.10 176.34 3fef s ALA 41 N 1.25 3.44 -0.36 5.51 0.00 -0.07 -0.94 121.76 130.59 3fef s ALA 41 Ca 0.01 -0.55 -0.19 0.00 0.00 0.00 0.00 51.96 51.23 3fef s ALA 41 Cb -0.15 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.55 3fef s ALA 41 CO -0.10 -1.49 0.54 -0.51 0.00 0.00 0.00 175.76 174.19 3fef s LEU 42 N 3.22 4.38 -0.04 0.00 1.43 0.15 -0.49 118.68 127.33 3fef s LEU 42 Ca 0.34 -0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 3fef s LEU 42 Cb -0.13 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 3fef s LEU 42 CO 0.17 -0.53 -0.12 -0.47 0.23 0.00 0.00 176.35 175.63 3fef s TYR 43 N 2.46 2.75 -0.25 0.29 5.04 0.03 -1.01 117.35 126.66 3fef s TYR 43 Ca 0.19 -0.12 -0.25 0.00 -2.44 0.00 0.00 57.07 54.45 3fef s TYR 43 Cb -0.15 -1.63 0.07 0.00 0.35 0.00 0.00 41.96 40.60 3fef s TYR 43 CO 0.14 0.24 0.74 0.34 -1.34 0.00 0.00 175.55 175.67 3fef s ASP 44 N -0.87 -0.72 0.44 4.32 -1.08 -1.26 0.19 116.67 117.69 3fef s ASP 44 Ca 0.12 1.34 0.21 0.00 -0.52 0.00 0.00 52.55 53.71 3fef s ASP 44 Cb -0.11 1.35 1.18 0.00 -1.46 0.00 0.00 42.92 43.88 3fef s ASP 44 CO 0.02 -0.27 1.85 -0.07 0.52 0.00 0.00 175.17 177.22 3fef h LEU 45 N 4.77 0.31 -8.05 -1.34 3.38 -1.97 -3.17 115.31 109.24 3fef h LEU 45 Ca -0.29 0.04 -0.70 0.00 0.09 0.00 0.00 57.88 57.02 3fef h LEU 45 Cb 1.16 -0.02 -0.19 0.00 0.09 0.00 0.00 40.66 41.70 3fef h LEU 45 CO 0.08 0.11 0.52 -0.62 0.09 0.00 0.00 178.44 178.63 3fef s ASP 46 N -5.58 6.46 0.34 -0.43 -1.08 -1.26 -4.92 116.67 110.20 3fef s ASP 46 Ca -0.07 -1.81 0.03 0.00 -0.52 0.00 0.00 52.55 50.18 3fef s ASP 46 Cb 0.23 -2.36 0.65 0.00 -1.46 0.00 0.00 42.92 39.98 3fef s ASP 46 CO 0.78 -1.08 1.97 0.15 0.52 0.00 0.00 175.17 177.51 3fef h PHE 47 N 8.90 0.85 -0.70 -5.34 3.04 -1.95 -1.71 116.94 120.02 3fef h PHE 47 Ca -0.03 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.92 3fef h PHE 47 Cb 1.05 -0.28 -0.03 0.00 2.56 0.00 0.00 35.95 39.24 3fef h PHE 47 CO 1.04 0.48 0.35 1.49 -2.02 0.00 0.00 178.31 179.65 3fef h GLU 48 N 0.87 1.00 -0.50 1.11 4.81 -1.91 -0.40 114.58 119.55 3fef h GLU 48 Ca 0.30 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.31 3fef h GLU 48 Cb 0.11 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3fef h GLU 48 CO -0.09 0.76 -0.04 0.00 -0.73 0.00 0.00 179.01 178.91 3fef h ALA 49 N 1.39 0.68 -0.74 2.92 0.00 -1.68 -2.32 119.26 119.51 3fef h ALA 49 Ca 0.25 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3fef h ALA 49 Cb 0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3fef h ALA 49 CO -0.03 0.53 0.49 0.00 0.00 0.00 0.00 179.25 180.23 3fef h ALA 50 N 0.92 1.46 -0.65 0.00 0.00 -1.15 -2.70 119.26 117.15 3fef h ALA 50 Ca 0.14 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3fef h ALA 50 Cb 0.58 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3fef h ALA 50 CO 0.03 0.50 0.06 0.37 0.00 0.00 0.00 179.25 180.21 3fef h GLN 51 N 1.01 1.11 -0.74 0.00 4.15 -0.69 -1.19 115.11 118.75 3fef h GLN 51 Ca 0.27 -0.32 -0.03 0.00 0.77 0.00 0.00 58.65 59.34 3fef h GLN 51 Cb -0.11 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.43 3fef h GLN 51 CO -0.06 1.04 0.33 0.87 -1.93 0.00 0.00 178.83 179.08 3fef h LYS 52 N 1.02 1.08 0.00 1.69 1.57 -1.18 -0.99 116.57 119.77 3fef h LYS 52 Ca 0.19 -0.17 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 3fef h LYS 52 Cb 0.50 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 3fef h LYS 52 CO 0.02 0.86 -0.34 -0.91 -0.57 0.00 0.00 179.45 178.51 3fef h ASN 53 N 1.05 0.00 0.24 0.86 2.35 -1.15 -0.45 115.58 118.48 3fef h ASN 53 Ca 0.25 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.99 3fef h ASN 53 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3fef h ASN 53 CO -0.03 0.34 -0.12 -0.08 -1.65 0.00 0.00 177.43 175.90 3fef h GLU 54 N 0.00 -0.31 -0.07 0.81 4.81 -0.64 0.38 114.58 119.56 3fef h GLU 54 Ca -0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3fef h GLU 54 Cb 0.62 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 3fef h GLU 54 CO 0.04 -0.17 0.03 0.28 -0.73 0.00 0.00 179.01 178.47 3fef h VAL 55 N -0.38 1.09 -0.57 0.32 2.07 -0.87 0.84 116.25 118.75 3fef h VAL 55 Ca -0.03 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 3fef h VAL 55 Cb 0.29 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 3fef h VAL 55 CO 0.05 0.07 0.21 0.40 0.02 0.00 0.00 177.57 178.33 3fef h ILE 56 N 0.01 1.21 -0.25 4.57 2.04 -1.13 -2.82 117.51 121.14 3fef h ILE 56 Ca 0.02 -0.69 -0.14 0.00 1.00 0.00 0.00 64.86 65.06 3fef h ILE 56 Cb 0.09 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3fef h ILE 56 CO -0.00 0.27 -0.41 1.23 0.00 0.00 0.00 178.15 179.23 3fef h GLY 57 N 0.95 0.65 -1.19 5.37 0.00 0.16 -2.89 103.07 106.13 3fef h GLY 57 Ca 0.19 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3fef h GLY 57 CO -0.01 0.60 0.00 0.70 0.00 0.00 0.00 176.54 177.82 3fef n ASN 58 N -4.03 1.63 -0.34 0.19 3.02 0.25 -1.67 115.26 114.32 3fef n ASN 58 Ca -0.02 -2.12 0.04 0.00 -0.03 0.00 0.00 54.58 52.45 3fef n ASN 58 Cb 0.53 -0.34 0.03 0.00 -0.61 0.00 0.00 39.78 39.39 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 0.11 0.00 -3.92 3.10 8.25 -1.09 -5.02 115.22 116.64 3fef n HIS 59 Ca 0.07 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.23 3fef n HIS 59 Cb 0.33 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.40 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 -0.75 6.36 0.77 0.41 0.01 -0.67 -3.94 113.70 115.88 3fef s SER 60 Ca 0.10 0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.61 3fef s SER 60 Cb 0.07 -1.95 0.00 0.00 0.21 0.00 0.00 66.02 64.35 3fef s SER 60 CO 0.11 0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.52 3fef n GLY 61 N 0.12 0.27 0.58 3.44 0.00 -1.26 -3.72 105.19 104.63 3fef n GLY 61 Ca -0.05 -0.95 0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.29 1.72 0.00 1.61 3.02 -1.26 -4.72 115.26 113.33 3fef n ASN 62 Ca 0.00 -1.86 0.00 0.00 -0.03 0.00 0.00 54.58 52.69 3fef n ASN 62 Cb 0.00 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 3fef n ASN 62 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fef n GLY 63 N 1.08 0.39 0.25 7.41 0.00 -1.24 -4.95 105.19 108.12 3fef n GLY 63 Ca 0.13 -0.98 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 0.84 -5.21 1.61 2.43 -1.85 -3.42 114.38 108.78 3fef h ARG 64 Ca 0.00 -0.19 -0.67 0.00 -0.81 0.00 0.00 59.98 58.30 3fef h ARG 64 Cb 0.53 -0.12 -0.34 0.00 -0.42 0.00 0.00 29.97 29.62 3fef h ARG 64 CO 0.00 0.78 -0.87 -1.58 -1.51 0.00 0.00 179.97 176.79 3fef s TRP 65 N -5.36 2.64 -0.10 2.20 0.52 -1.26 -2.72 118.94 114.85 3fef s TRP 65 Ca -0.13 -1.29 -0.15 0.00 0.02 0.00 0.00 56.10 54.56 3fef s TRP 65 Cb 0.12 -1.79 -0.05 0.00 -1.15 0.00 0.00 33.47 30.60 3fef s TRP 65 CO 0.80 -0.58 0.35 0.50 0.02 0.00 0.00 176.95 178.04 3fef s ARG 66 N 0.74 4.12 -0.02 4.98 3.52 -0.13 -4.84 118.95 127.31 3fef s ARG 66 Ca -0.09 0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.76 3fef s ARG 66 Cb -0.16 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 3fef s ARG 66 CO -0.00 0.39 0.01 0.71 -0.81 0.00 0.00 175.30 175.60 3fef s TYR 67 N -0.03 3.13 -0.11 5.12 1.51 -1.26 -0.25 117.35 125.45 3fef s TYR 67 Ca 0.20 0.13 -0.04 0.00 -1.01 0.00 0.00 57.07 56.35 3fef s TYR 67 Cb -0.14 -1.71 0.06 0.00 -0.11 0.00 0.00 41.96 40.05 3fef s TYR 67 CO 0.08 0.48 0.23 -2.00 -1.11 0.00 0.00 175.55 173.23 3fef s GLU 68 N -1.40 0.13 -0.16 -0.62 2.12 -0.11 -4.90 118.70 113.76 3fef s GLU 68 Ca 0.18 0.66 -0.28 0.00 0.36 0.00 0.00 54.97 55.88 3fef s GLU 68 Cb -0.12 -0.11 -0.01 0.00 0.26 0.00 0.00 34.13 34.16 3fef s GLU 68 CO 0.09 -0.27 0.98 0.00 -0.54 0.00 0.00 175.26 175.52 3fef s ALA 69 N 2.15 3.51 0.11 6.30 0.00 -1.26 0.34 121.76 132.91 3fef s ALA 69 Ca -0.00 0.24 0.10 0.00 0.00 0.00 0.00 51.96 52.30 3fef s ALA 69 Cb -0.12 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3fef s ALA 69 CO -0.08 -0.75 -0.26 0.14 0.00 0.00 0.00 175.76 174.81 3fef s VAL 70 N 2.39 2.19 -0.71 0.00 -7.23 -0.18 -4.89 120.40 111.97 3fef s VAL 70 Ca 0.45 -1.67 0.23 0.00 -1.81 0.00 0.00 61.98 59.18 3fef s VAL 70 Cb -0.17 -1.93 -0.14 0.00 0.56 0.00 0.00 36.38 34.71 3fef s VAL 70 CO 0.13 0.13 1.01 -1.54 -0.31 0.00 0.00 175.10 174.53 3fef n SER 71 N 1.10 0.64 -4.37 4.85 3.41 -1.26 -4.38 113.62 113.60 3fef n SER 71 Ca -0.18 -0.38 -0.22 0.00 -0.26 0.00 0.00 58.87 57.83 3fef n SER 71 Cb 0.53 0.85 -0.11 0.00 -0.26 0.00 0.00 64.21 65.22 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 -3.15 2.01 0.14 6.66 -4.23 -1.26 -4.97 115.64 110.84 3fef s THR 72 Ca 0.05 -2.09 -0.16 0.00 -1.18 0.00 0.00 61.69 58.30 3fef s THR 72 Cb 0.15 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.98 3fef s THR 72 CO 0.81 -0.36 1.76 -0.07 -0.54 0.00 0.00 174.62 176.22 3fef h LEU 73 N 2.90 0.49 -0.53 4.79 3.38 -1.99 -2.16 115.31 122.19 3fef h LEU 73 Ca -0.41 -0.07 0.10 0.00 0.09 0.00 0.00 57.88 57.59 3fef h LEU 73 Cb 1.22 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.74 3fef h LEU 73 CO 0.55 0.42 -0.24 0.50 0.09 0.00 0.00 178.44 179.75 3fef h LYS 74 N 0.51 -0.11 -0.22 1.13 3.64 -1.96 0.18 116.57 119.75 3fef h LYS 74 Ca 0.14 0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.41 3fef h LYS 74 Cb 0.03 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3fef h LYS 74 CO -0.02 -0.08 -0.37 -0.22 -2.27 0.00 0.00 179.45 176.49 3fef h LYS 75 N -0.12 0.47 -0.35 1.90 3.64 -1.90 -1.83 116.57 118.38 3fef h LYS 75 Ca 0.24 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 3fef h LYS 75 Cb 0.50 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3fef h LYS 75 CO -0.60 0.77 -0.02 0.00 -2.27 0.00 0.00 179.45 177.33 3fef h ALA 76 N 1.21 0.48 0.05 5.00 0.00 -0.73 -3.34 119.26 121.92 3fef h ALA 76 Ca 0.04 -0.26 -0.25 0.00 0.00 0.00 0.00 54.91 54.44 3fef h ALA 76 Cb 0.83 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 3fef h ALA 76 CO 0.07 0.27 -1.25 -0.07 0.00 0.00 0.00 179.25 178.26 3fef h LEU 77 N 0.44 0.16 -9.72 0.00 3.38 -0.47 -3.41 115.31 105.68 3fef h LEU 77 Ca 0.10 -0.19 -0.53 0.00 0.09 0.00 0.00 57.88 57.35 3fef h LEU 77 Cb 0.49 -0.05 0.06 0.00 0.09 0.00 0.00 40.66 41.26 3fef h LEU 77 CO 0.02 1.15 0.87 -0.94 0.09 0.00 0.00 178.44 179.64 3fef s SER 78 N -6.76 6.50 -0.51 -0.43 1.04 -0.70 -0.91 113.70 111.93 3fef s SER 78 Ca -0.03 2.79 0.00 0.00 0.48 0.00 0.00 55.95 59.19 3fef s SER 78 Cb 0.09 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.59 3fef s SER 78 CO 0.84 -0.85 0.00 0.00 0.98 0.00 0.00 173.24 174.21 3fef n ALA 79 N 2.92 -0.07 -1.89 5.32 0.00 -1.26 -4.99 120.51 120.53 3fef n ALA 79 Ca 0.10 0.08 -0.41 0.00 0.00 0.00 0.00 53.44 53.21 3fef n ALA 79 Cb 0.38 -1.33 -0.04 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.63 3.43 -0.01 0.00 0.00 -0.08 -4.67 121.76 118.80 3fef s ALA 80 Ca 0.00 0.95 0.08 0.00 0.00 0.00 0.00 51.96 52.99 3fef s ALA 80 Cb 0.00 -3.38 -0.23 0.00 0.00 0.00 0.00 23.12 19.51 3fef s ALA 80 CO 0.00 -0.29 0.81 -0.44 0.00 0.00 0.00 175.76 175.84 3fef h ASP 81 N 4.40 0.07 -3.68 0.00 3.32 -0.61 -3.40 116.42 116.51 3fef h ASP 81 Ca -0.46 -0.12 -0.34 0.00 0.02 0.00 0.00 57.03 56.13 3fef h ASP 81 Cb 1.21 -0.02 -0.31 0.00 0.22 0.00 0.00 39.33 40.43 3fef h ASP 81 CO 0.70 1.10 -0.75 -0.63 -1.72 0.00 0.00 179.24 177.94 3fef s ILE 82 N -2.62 0.33 -0.17 0.35 -1.09 -1.01 -2.05 121.20 114.94 3fef s ILE 82 Ca -0.05 -0.09 0.01 0.00 -2.23 0.00 0.00 60.65 58.29 3fef s ILE 82 Cb 0.08 -0.34 0.01 0.00 -1.58 0.00 0.00 42.46 40.63 3fef s ILE 82 CO 0.82 0.14 -0.18 -0.69 -1.23 0.00 0.00 174.94 173.80 3fef s VAL 83 N 0.43 2.29 -0.11 2.92 1.01 0.91 -0.40 120.40 127.43 3fef s VAL 83 Ca -0.05 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 3fef s VAL 83 Cb -0.08 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 3fef s VAL 83 CO -0.01 0.53 -0.02 -0.63 0.00 0.00 0.00 175.10 174.98 3fef s ILE 84 N 1.08 4.12 -0.16 2.22 1.01 0.70 0.21 121.20 130.39 3fef s ILE 84 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.35 3fef s ILE 84 Cb -0.14 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.59 3fef s ILE 84 CO -0.07 0.56 -0.15 -0.63 0.00 0.00 0.00 174.94 174.66 3fef s ILE 85 N -0.40 1.63 -0.44 2.92 1.01 -0.53 0.20 121.20 125.60 3fef s ILE 85 Ca 0.07 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 60.09 3fef s ILE 85 Cb -0.12 -1.53 0.20 0.00 0.01 0.00 0.00 42.46 41.02 3fef s ILE 85 CO 0.02 0.45 0.53 -0.24 0.00 0.00 0.00 174.94 175.70 3fef n SER 86 N 4.75 -1.18 -4.58 3.58 2.88 0.23 -0.42 113.62 118.88 3fef n SER 86 Ca -0.17 -2.68 -0.25 0.00 -1.33 0.00 0.00 58.87 54.44 3fef n SER 86 Cb 0.50 0.16 -0.09 0.00 -0.75 0.00 0.00 64.21 64.03 3fef n SER 86 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 3fef s ILE 87 N -0.05 2.58 -0.32 2.46 -4.36 -1.26 -4.47 121.20 115.77 3fef s ILE 87 Ca 0.33 -2.10 -0.12 0.00 -0.26 0.00 0.00 60.65 58.50 3fef s ILE 87 Cb 0.09 -2.68 -0.03 0.00 1.25 0.00 0.00 42.46 41.09 3fef s ILE 87 CO -0.15 -0.25 0.22 -0.22 0.24 0.00 0.00 174.94 174.78 3fef s LEU 88 N -3.65 4.37 -0.78 0.37 2.96 -1.26 -4.69 118.68 116.01 3fef s LEU 88 Ca 0.33 -0.32 -0.25 0.00 -0.22 0.00 0.00 54.13 53.67 3fef s LEU 88 Cb -0.01 -2.13 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 3fef s LEU 88 CO 0.18 -0.18 1.83 -2.84 -1.32 0.00 0.00 176.35 174.01 3fef s PRO 89 N 1.73 2.70 0.94 0.98 0.02 -1.26 -4.72 135.00 135.39 3fef s PRO 89 Ca 0.06 0.03 0.00 0.00 0.02 0.00 0.00 61.00 61.12 3fef s PRO 89 Cb -0.17 -4.74 0.00 0.00 0.02 0.00 0.00 34.50 29.61 3fef s PRO 89 CO 0.10 -2.94 0.00 0.41 -0.33 0.00 0.00 177.00 174.25 3fef n GLY 90 N 6.27 -1.23 3.10 0.52 0.00 -1.26 -4.82 105.19 107.78 3fef n GLY 90 Ca 0.29 -1.67 -0.26 0.00 0.00 0.00 0.00 46.02 44.38 3fef n GLY 90 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3fef n SER 91 N 0.13 2.52 0.16 1.61 3.41 -1.26 -5.02 113.62 115.17 3fef n SER 91 Ca 0.00 -2.94 0.01 0.00 -0.26 0.00 0.00 58.87 55.68 3fef n SER 91 Cb 0.00 0.52 0.24 0.00 -0.26 0.00 0.00 64.21 64.71 3fef n SER 91 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3fef h LEU 92 N 0.00 0.00 -0.33 1.04 3.38 -1.99 -2.83 115.31 114.59 3fef h LEU 92 Ca -0.34 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3fef h LEU 92 Cb 1.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 3fef h LEU 92 CO 0.55 0.52 0.04 0.44 0.09 0.00 0.00 178.44 180.08 3fef h ASP 93 N 0.00 0.54 0.00 -0.43 3.32 -2.00 -0.73 116.42 117.12 3fef h ASP 93 Ca -0.01 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3fef h ASP 93 Cb 0.96 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.36 3fef h ASP 93 CO 0.07 0.68 0.00 0.47 -1.72 0.00 0.00 179.24 178.74 3fef n ASP 94 N -4.58 0.00 0.00 6.45 8.00 -1.07 -2.64 116.55 122.71 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 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 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 0.61 0.00 0.17 -1.24 2.13 -0.28 -1.46 120.64 120.57 3fef n GLU 96 Ca 0.00 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.68 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 0.74 -0.62 6.31 2.07 -1.80 -1.05 116.25 121.90 3fef h VAL 97 Ca 0.00 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.47 3fef h VAL 97 Cb 0.00 0.83 -0.11 0.00 -1.52 0.00 0.00 31.29 30.48 3fef h VAL 97 CO 0.00 0.03 -0.38 0.44 0.02 0.00 0.00 177.57 177.68 3fef h ASP 98 N -0.46 -1.32 0.61 0.57 3.32 -1.55 -2.45 116.42 115.14 3fef h ASP 98 Ca -0.04 0.24 -0.28 0.00 0.02 0.00 0.00 57.03 56.98 3fef h ASP 98 Cb 0.34 0.63 -0.02 0.00 0.22 0.00 0.00 39.33 40.51 3fef h ASP 98 CO 0.06 -0.32 -1.38 0.58 -1.72 0.00 0.00 179.24 176.47 3fef h VAL 99 N -0.18 1.31 0.00 -1.35 2.07 -1.84 -3.29 116.25 112.97 3fef h VAL 99 Ca 0.22 -2.97 -0.16 0.00 0.82 0.00 0.00 66.70 64.60 3fef h VAL 99 Cb 0.56 2.77 -0.03 0.00 -1.52 0.00 0.00 31.29 33.07 3fef h VAL 99 CO -0.71 0.83 -1.61 1.41 0.02 0.00 0.00 177.57 177.51 3fef n HIS 100 N -3.39 0.00 -0.24 1.57 8.25 -0.40 -4.46 115.22 116.54 3fef n HIS 100 Ca -0.11 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.39 3fef n HIS 100 Cb 1.02 -0.43 0.15 0.00 1.12 0.00 0.00 29.99 31.85 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 -0.27 -1.74 2.41 5.85 -1.51 -0.98 115.31 119.07 3fef h LEU 101 Ca -0.24 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3fef h LEU 101 Cb 1.45 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.78 3fef h LEU 101 CO -0.02 -0.14 0.09 -0.65 -0.34 0.00 0.00 178.44 177.38 3fef h PRO 102 N 0.13 0.00 -0.51 5.25 0.11 -1.82 -1.77 132.00 133.39 3fef h PRO 102 Ca 0.39 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.56 3fef h PRO 102 Cb 0.68 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.76 3fef h PRO 102 CO -0.61 0.00 0.34 0.93 -0.21 0.00 0.00 178.00 178.46 3fef h GLU 103 N 0.00 0.45 0.00 1.05 5.08 -0.88 0.13 114.58 120.40 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 0.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3fef h GLU 103 CO 0.00 0.30 0.07 0.07 -1.00 0.00 0.00 179.01 178.45 3fef h ARG 104 N 0.46 0.00 -0.55 2.33 0.11 -1.50 0.16 114.38 115.40 3fef h ARG 104 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 3fef h ARG 104 Cb 0.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.37 3fef h ARG 104 CO -0.06 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.01 3fef n GLY 106 N 1.08 0.63 3.59 0.00 0.00 0.56 -4.99 105.19 106.07 3fef n GLY 106 Ca 0.18 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 5.28 0.09 -0.61 1.01 -0.88 -4.97 121.20 119.12 3fef s ILE 107 Ca 0.00 0.26 0.04 0.00 0.00 0.00 0.00 60.65 60.94 3fef s ILE 107 Cb 0.00 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 3fef s ILE 107 CO 0.00 0.22 0.07 -0.31 0.00 0.00 0.00 174.94 174.92 3fef s TYR 108 N 1.84 3.14 -0.01 3.97 2.02 -1.26 -2.55 117.35 124.49 3fef s TYR 108 Ca 0.09 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 3fef s TYR 108 Cb -0.16 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 39.81 3fef s TYR 108 CO 0.11 0.51 -0.04 -0.65 -1.57 0.00 0.00 175.55 173.91 3fef s GLN 109 N -2.45 0.41 0.02 -0.62 -0.21 -1.26 -5.00 119.66 110.55 3fef s GLN 109 Ca 0.29 -0.13 -0.02 0.00 0.02 0.00 0.00 55.36 55.51 3fef s GLN 109 Cb -0.12 -0.43 -0.27 0.00 1.00 0.00 0.00 33.01 33.20 3fef s GLN 109 CO 0.21 0.06 0.92 0.66 -2.12 0.00 0.00 175.29 175.02 3fef h SER 110 N 6.28 0.35 0.00 5.90 4.64 -1.91 -3.42 113.55 125.38 3fef h SER 110 Ca -0.30 -0.47 0.00 0.00 -0.47 0.00 0.00 61.79 60.55 3fef h SER 110 Cb 1.18 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3fef h SER 110 CO 0.50 1.38 -0.63 0.52 -0.87 0.00 0.00 176.83 177.73 3fef n VAL 111 N -3.44 0.31 -1.40 0.95 0.31 -1.26 0.02 118.33 113.82 3fef n VAL 111 Ca -0.14 0.10 -0.02 0.00 -0.01 0.00 0.00 64.34 64.27 3fef n VAL 111 Cb 1.03 -1.41 -0.01 0.00 -0.91 0.00 0.00 33.84 32.55 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 2.95 0.47 0.11 2.92 0.00 -1.26 -4.88 105.19 105.51 3fef n GLY 112 Ca 0.00 -0.91 0.02 0.00 0.00 0.00 0.00 46.02 45.13 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 1.58 0.89 0.00 1.61 5.75 -1.26 -3.02 116.55 122.10 3fef n ASP 113 Ca -0.03 -0.95 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 3fef n ASP 113 Cb 0.23 0.44 0.00 0.00 -1.03 0.00 0.00 41.12 40.76 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 -0.33 0.00 -3.05 2.12 -1.04 -1.26 -3.12 114.28 107.60 3fef n THR 114 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3fef n THR 114 Cb 0.10 -0.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 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 -2.29 0.00 -3.76 12.58 0.24 -1.26 -4.44 118.33 119.39 3fef n VAL 115 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.35 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 4.48 -1.35 0.20 7.63 0.00 -1.26 -1.28 105.19 113.61 3fef n GLY 116 Ca 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 46.02 44.84 3fef n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fef h PRO 117 N 0.00 0.64 -0.40 1.61 0.13 -1.92 -0.35 132.00 131.71 3fef h PRO 117 Ca 0.01 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 3fef h PRO 117 Cb 0.35 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.32 3fef h PRO 117 CO 0.00 0.44 0.21 0.78 -0.23 0.00 0.00 178.00 179.21 3fef h GLY 118 N 0.64 0.61 1.00 1.56 0.00 -1.71 -0.07 103.07 105.09 3fef h GLY 118 Ca 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 3fef h GLY 118 CO -0.03 0.27 0.39 -1.33 0.00 0.00 0.00 176.54 175.84 3fef h GLY 119 N 0.51 0.98 0.99 4.60 0.00 -0.90 0.25 103.07 109.50 3fef h GLY 119 Ca 0.14 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 3fef h GLY 119 CO -0.02 0.40 0.31 -2.22 0.00 0.00 0.00 176.54 175.01 3fef h ILE 120 N 0.91 1.20 -0.30 2.60 1.08 -0.76 0.83 117.51 123.07 3fef h ILE 120 Ca 0.24 -0.51 -0.18 0.00 -0.39 0.00 0.00 64.86 64.02 3fef h ILE 120 Cb -0.01 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 34.20 3fef h ILE 120 CO -0.04 0.21 -0.53 0.40 -0.69 0.00 0.00 178.15 177.50 3fef h ILE 121 N 0.79 1.27 -0.49 -0.67 1.08 -0.67 -1.91 117.51 116.91 3fef h ILE 121 Ca 0.20 -1.71 -0.06 0.00 -0.39 0.00 0.00 64.86 62.91 3fef h ILE 121 Cb 0.06 1.61 -0.02 0.00 -3.07 0.00 0.00 36.82 35.41 3fef h ILE 121 CO -0.03 0.56 0.08 -0.09 -0.69 0.00 0.00 178.15 177.98 3fef h ARG 122 N 0.67 0.82 -0.56 2.37 2.43 -0.38 -2.20 114.38 117.53 3fef h ARG 122 Ca 0.02 -0.22 0.11 0.00 -0.81 0.00 0.00 59.98 59.08 3fef h ARG 122 Cb 1.14 -0.10 -0.10 0.00 -0.42 0.00 0.00 29.97 30.50 3fef h ARG 122 CO 0.12 0.82 -0.02 0.78 -1.51 0.00 0.00 179.97 180.15 3fef h GLY 123 N 0.69 0.55 0.80 2.80 0.00 -0.72 0.78 103.07 107.98 3fef h GLY 123 Ca 0.15 0.09 0.05 0.00 0.00 0.00 0.00 47.33 47.62 3fef h GLY 123 CO 0.01 -0.18 0.57 1.41 0.00 0.00 0.00 176.54 178.36 3fef h LEU 124 N 0.09 0.93 -0.27 3.11 -0.00 -0.87 -0.77 115.31 117.54 3fef h LEU 124 Ca 0.28 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.15 3fef h LEU 124 Cb 0.44 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.89 3fef h LEU 124 CO -0.49 0.62 0.09 -0.09 -0.00 0.00 0.00 178.44 178.57 3fef h ARG 125 N 1.08 0.42 0.00 1.13 2.43 -0.73 -3.15 114.38 115.57 3fef h ARG 125 Ca 0.37 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.37 3fef h ARG 125 Cb 0.08 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3fef h ARG 125 CO -0.14 0.47 -0.40 0.00 -1.51 0.00 0.00 179.97 178.39 3fef h ALA 126 N 0.93 1.31 -0.00 2.80 0.00 -0.28 -3.36 119.26 120.66 3fef h ALA 126 Ca 0.09 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.66 3fef h ALA 126 Cb 0.22 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3fef h ALA 126 CO -0.00 0.50 -0.39 0.28 0.00 0.00 0.00 179.25 179.64 3fef h VAL 127 N 0.00 0.20 0.00 0.00 2.07 -1.11 -1.17 116.25 116.24 3fef h VAL 127 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 3fef h VAL 127 Cb 0.72 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3fef h VAL 127 CO 0.05 0.00 -0.11 1.55 0.02 0.00 0.00 177.57 179.09 3fef h PRO 128 N -0.54 0.00 -0.30 1.57 0.13 -1.74 -0.82 132.00 130.30 3fef h PRO 128 Ca 0.05 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.07 3fef h PRO 128 Cb 0.63 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 3fef h PRO 128 CO -0.30 0.11 -0.24 0.82 -0.23 0.00 0.00 178.00 178.16 3fef h ILE 129 N 0.00 1.30 -0.01 -3.56 2.04 -1.45 -2.07 117.51 113.75 3fef h ILE 129 Ca -0.00 -1.38 -0.17 0.00 1.00 0.00 0.00 64.86 64.31 3fef h ILE 129 Cb 0.23 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3fef h ILE 129 CO 0.01 0.44 -0.75 -0.26 0.00 0.00 0.00 178.15 177.60 3fef h PHE 130 N 0.44 0.17 -0.41 1.37 0.04 -0.80 -1.38 116.94 116.37 3fef h PHE 130 Ca 0.06 -0.08 0.04 0.00 2.80 0.00 0.00 57.97 60.78 3fef h PHE 130 Cb 0.79 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.88 3fef h PHE 130 CO 0.07 0.82 0.17 0.00 -0.60 0.00 0.00 178.31 178.77 3fef h ALA 131 N 1.15 0.49 -0.46 2.45 0.00 -1.14 0.91 119.26 122.67 3fef h ALA 131 Ca -0.02 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3fef h ALA 131 Cb 1.32 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3fef h ALA 131 CO 0.11 -0.20 -0.02 1.49 0.00 0.00 0.00 179.25 180.62 3fef h GLU 132 N 0.35 0.77 -0.45 0.00 4.81 -0.98 -1.96 114.58 117.11 3fef h GLU 132 Ca 0.18 -0.21 -0.13 0.00 -0.13 0.00 0.00 59.36 59.07 3fef h GLU 132 Cb 0.13 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3fef h GLU 132 CO -0.16 0.79 -0.24 0.82 -0.73 0.00 0.00 179.01 179.49 3fef h ILE 133 N 0.71 1.27 -0.69 2.32 2.04 -0.92 -2.39 117.51 119.87 3fef h ILE 133 Ca 0.14 -1.40 -0.06 0.00 1.00 0.00 0.00 64.86 64.53 3fef h ILE 133 Cb 0.47 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3fef h ILE 133 CO 0.02 0.48 0.18 0.00 0.00 0.00 0.00 178.15 178.84 3fef h ALA 134 N 0.84 0.90 -0.57 1.87 0.00 -0.65 0.13 119.26 121.78 3fef h ALA 134 Ca 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3fef h ALA 134 Cb 0.82 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3fef h ALA 134 CO 0.07 0.61 0.31 0.00 0.00 0.00 0.00 179.25 180.24 3fef h ARG 135 N 1.02 0.80 -0.55 0.00 3.08 -1.33 -0.39 114.38 117.01 3fef h ARG 135 Ca 0.22 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 3fef h ARG 135 Cb 0.34 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3fef h ARG 135 CO -0.00 0.62 0.21 0.00 -1.07 0.00 0.00 179.97 179.72 3fef h ALA 136 N 1.14 0.71 -0.54 0.04 0.00 -0.94 0.12 119.26 119.80 3fef h ALA 136 Ca 0.20 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3fef h ALA 136 Cb 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3fef h ALA 136 CO -0.03 0.34 0.08 0.82 0.00 0.00 0.00 179.25 180.45 3fef h ILE 137 N 0.75 1.24 -0.28 0.00 2.04 -0.83 0.20 117.51 120.62 3fef h ILE 137 Ca 0.18 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 3fef h ILE 137 Cb 0.21 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 3fef h ILE 137 CO -0.01 0.34 0.13 -0.09 0.00 0.00 0.00 178.15 178.51 3fef h ARG 138 N 0.81 0.41 -0.15 2.37 2.43 -0.63 -0.29 114.38 119.33 3fef h ARG 138 Ca 0.17 -0.07 -0.16 0.00 -0.81 0.00 0.00 59.98 59.12 3fef h ARG 138 Cb 0.37 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 3fef h ARG 138 CO 0.01 0.41 -0.56 -0.44 -1.51 0.00 0.00 179.97 177.87 3fef h ASP 139 N 0.32 0.52 0.00 -3.80 3.32 -0.12 -3.35 116.42 113.31 3fef h ASP 139 Ca 0.10 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.86 3fef h ASP 139 Cb 0.14 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3fef h ASP 139 CO -0.01 0.97 -0.33 -1.22 -1.72 0.00 0.00 179.24 176.93 3fef n TYR 140 N -3.94 0.00 -2.69 4.55 4.01 0.64 -4.84 117.16 114.89 3fef n TYR 140 Ca -0.03 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.65 3fef n TYR 140 Cb 0.61 -0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.74 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 -1.17 1.88 0.06 -0.72 0.00 -0.38 -4.05 120.51 116.13 3fef n ALA 141 Ca 0.00 -1.61 0.21 0.00 0.00 0.00 0.00 53.44 52.04 3fef n ALA 141 Cb 0.01 -0.96 0.74 0.00 0.00 0.00 0.00 19.45 19.24 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 2.05 0.00 -0.01 0.00 0.13 -1.24 -1.64 132.00 131.28 3fef h PRO 142 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 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 0.02 0.00 -0.33 0.39 -0.23 0.00 0.00 178.00 177.85 3fef n GLU 143 N -3.91 0.92 -1.84 0.86 -0.58 -1.26 -4.67 120.64 110.16 3fef n GLU 143 Ca 0.08 -0.62 -0.35 0.00 -0.42 0.00 0.00 57.16 55.85 3fef n GLU 143 Cb 0.62 -1.49 0.05 0.00 -0.57 0.00 0.00 31.44 30.05 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 -2.50 4.93 0.04 1.62 1.04 -0.62 -5.00 113.70 113.21 3fef s SER 144 Ca 0.23 2.33 -0.21 0.00 0.48 0.00 0.00 55.95 58.77 3fef s SER 144 Cb 0.19 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.66 3fef s SER 144 CO 0.54 -1.76 0.63 0.26 0.98 0.00 0.00 173.24 173.89 3fef s TRP 145 N -1.79 3.74 -0.16 5.02 0.52 -0.87 -4.37 118.94 121.02 3fef s TRP 145 Ca 0.75 1.30 -0.01 0.00 0.02 0.00 0.00 56.10 58.16 3fef s TRP 145 Cb -0.29 -2.63 -0.01 0.00 -1.15 0.00 0.00 33.47 29.39 3fef s TRP 145 CO 0.37 0.41 -0.11 0.08 0.02 0.00 0.00 176.95 177.72 3fef s VAL 146 N -0.46 3.03 -0.27 4.03 1.01 0.40 -0.07 120.40 128.08 3fef s VAL 146 Ca 0.32 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.63 3fef s VAL 146 Cb -0.19 -2.31 0.03 0.00 0.00 0.00 0.00 36.38 33.91 3fef s VAL 146 CO 0.19 0.49 -0.02 -0.63 0.00 0.00 0.00 175.10 175.13 3fef s ILE 147 N 0.83 3.09 -0.17 2.22 1.01 0.13 -0.96 121.20 127.34 3fef s ILE 147 Ca -0.04 -1.04 -0.14 0.00 0.00 0.00 0.00 60.65 59.44 3fef s ILE 147 Cb -0.15 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 3fef s ILE 147 CO 0.01 0.12 0.31 0.21 0.00 0.00 0.00 174.94 175.59 3fef s ASN 148 N 1.34 6.42 -0.01 3.58 2.47 0.65 -1.46 114.94 127.94 3fef s ASN 148 Ca -0.00 0.49 0.13 0.00 0.42 0.00 0.00 52.86 53.90 3fef s ASN 148 Cb -0.17 -2.19 -0.16 0.00 -1.45 0.00 0.00 41.25 37.27 3fef s ASN 148 CO -0.03 0.05 0.49 -1.22 -3.72 0.00 0.00 177.10 172.68 3fef n TYR 149 N 3.83 0.00 -2.18 0.43 4.01 0.44 -1.25 117.16 122.44 3fef n TYR 149 Ca -0.11 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.23 3fef n TYR 149 Cb 0.52 -0.09 -0.02 0.00 -0.31 0.00 0.00 39.34 39.44 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 -2.45 2.86 0.04 -0.72 2.01 -1.22 -4.96 115.64 111.21 3fef s THR 150 Ca 0.02 0.83 0.01 0.00 0.31 0.00 0.00 61.69 62.86 3fef s THR 150 Cb 0.10 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 3fef s THR 150 CO 0.55 0.17 0.10 0.20 -0.69 0.00 0.00 174.62 174.95 3fef s ASN 151 N -0.68 5.70 1.01 3.53 0.01 -1.26 -4.84 114.94 118.41 3fef s ASN 151 Ca 0.51 0.09 -0.17 0.00 -0.71 0.00 0.00 52.86 52.58 3fef s ASN 151 Cb -0.37 -1.61 0.23 0.00 0.41 0.00 0.00 41.25 39.91 3fef s ASN 151 CO 0.49 0.22 1.34 -2.16 -1.51 0.00 0.00 177.10 175.47 3fef s PRO 152 N -2.12 0.21 0.00 -0.60 0.04 -1.18 -4.76 135.00 126.59 3fef s PRO 152 Ca 0.27 -0.51 0.00 0.00 0.04 0.00 0.00 61.00 60.80 3fef s PRO 152 Cb -0.12 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3fef s PRO 152 CO 0.19 -2.69 0.00 0.43 0.04 0.00 0.00 177.00 174.97 3fef n SER 154 N -3.94 0.00 -0.14 6.66 7.64 -1.26 -0.48 113.62 122.11 3fef n SER 154 Ca 0.17 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.95 3fef n SER 154 Cb 0.59 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.78 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 1.22 -0.17 0.44 2.07 -1.96 -1.69 116.25 116.16 3fef h VAL 155 Ca 0.00 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 3fef h VAL 155 Cb 0.00 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 3fef h VAL 155 CO 0.00 0.26 0.11 0.00 0.02 0.00 0.00 177.57 177.96 3fef h THR 157 N 0.21 1.23 -0.60 0.00 2.02 -1.79 -3.01 112.91 110.98 3fef h THR 157 Ca 0.06 -0.82 0.08 0.00 0.77 0.00 0.00 66.41 66.50 3fef h THR 157 Cb 0.02 1.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.44 3fef h THR 157 CO -0.01 0.28 0.25 -0.09 0.37 0.00 0.00 175.52 176.32 3fef h ARG 158 N 0.43 0.45 -0.94 6.66 9.65 -1.13 -1.78 114.38 127.73 3fef h ARG 158 Ca 0.11 -0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.04 3fef h ARG 158 Cb 0.34 -0.10 -0.07 0.00 -1.39 0.00 0.00 29.97 28.76 3fef h ARG 158 CO 0.01 0.30 0.60 0.28 2.80 0.00 0.00 179.97 183.96 3fef h VAL 159 N 0.46 1.02 -0.50 0.20 2.07 -1.24 0.81 116.25 119.08 3fef h VAL 159 Ca 0.29 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 67.53 3fef h VAL 159 Cb 0.31 -0.08 -0.06 0.00 -1.52 0.00 0.00 31.29 29.94 3fef h VAL 159 CO -0.26 0.19 0.18 -0.07 0.02 0.00 0.00 177.57 177.63 3fef h LEU 160 N 1.02 0.18 -0.28 2.57 3.38 -1.19 -0.71 115.31 120.27 3fef h LEU 160 Ca 0.42 0.06 -0.20 0.00 0.09 0.00 0.00 57.88 58.25 3fef h LEU 160 Cb 0.29 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3fef h LEU 160 CO -0.18 0.13 -0.74 1.88 0.09 0.00 0.00 178.44 179.62 3fef h TYR 161 N 0.35 0.84 -0.70 1.13 -1.99 -1.14 -0.24 116.97 115.22 3fef h TYR 161 Ca 0.24 -0.36 -0.02 0.00 2.00 0.00 0.00 58.73 60.59 3fef h TYR 161 Cb 0.26 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 38.83 3fef h TYR 161 CO -0.16 1.16 0.36 0.87 -0.00 0.00 0.00 178.16 180.39 3fef h LYS 162 N 0.43 1.00 0.10 4.88 1.57 -0.58 -2.47 116.57 121.50 3fef h LYS 162 Ca -0.04 -0.13 -0.28 0.00 -1.87 0.00 0.00 60.65 58.33 3fef h LYS 162 Cb 1.34 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 3fef h LYS 162 CO 0.14 0.77 -1.33 0.28 -0.57 0.00 0.00 179.45 178.74 3fef h VAL 163 N 0.98 1.38 -2.67 0.50 2.07 -1.15 -3.41 116.25 113.94 3fef h VAL 163 Ca 0.24 -3.01 -0.60 0.00 0.82 0.00 0.00 66.70 64.16 3fef h VAL 163 Cb 0.08 2.84 -0.39 0.00 -1.52 0.00 0.00 31.29 32.30 3fef h VAL 163 CO -0.03 0.86 -0.83 0.12 0.02 0.00 0.00 177.57 177.70 3fef s PHE 164 N -2.65 1.50 0.44 1.57 5.36 -0.10 -4.89 117.98 119.21 3fef s PHE 164 Ca -0.05 -2.27 0.13 0.00 -0.96 0.00 0.00 56.93 53.79 3fef s PHE 164 Cb 0.07 -1.38 1.03 0.00 -0.34 0.00 0.00 43.02 42.41 3fef s PHE 164 CO 0.86 -0.78 2.01 -1.35 -1.46 0.00 0.00 175.22 174.49 3fef h PRO 165 N 6.29 0.38 -0.15 10.12 0.11 -1.66 0.49 132.00 147.59 3fef h PRO 165 Ca 0.12 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3fef h PRO 165 Cb 0.91 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.94 3fef h PRO 165 CO 0.41 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 3fef n GLY 166 N -1.52 0.00 3.67 -0.55 0.00 -1.26 -4.94 105.19 100.59 3fef n GLY 166 Ca 0.08 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 3fef n GLY 166 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3fef n ILE 167 N 0.08 4.07 -3.62 -0.61 3.06 0.16 -4.96 119.36 117.54 3fef n ILE 167 Ca 0.14 -0.50 -0.39 0.00 -2.50 0.00 0.00 62.75 59.50 3fef n ILE 167 Cb 0.25 -1.34 -0.08 0.00 0.54 0.00 0.00 39.64 39.01 3fef n ILE 167 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 3fef s LYS 168 N -2.94 2.67 -0.00 9.51 1.02 -1.26 -5.01 119.74 123.73 3fef s LYS 168 Ca 0.77 -2.29 0.01 0.00 0.02 0.00 0.00 55.97 54.47 3fef s LYS 168 Cb -0.41 -3.88 -0.00 0.00 -0.52 0.00 0.00 37.83 33.02 3fef s LYS 168 CO 0.46 -1.19 -0.02 0.00 -0.92 0.00 0.00 175.35 173.68 3fef s ALA 169 N 0.38 0.18 0.15 5.17 0.00 -1.26 -0.45 121.76 125.94 3fef s ALA 169 Ca 0.14 -0.09 0.06 0.00 0.00 0.00 0.00 51.96 52.07 3fef s ALA 169 Cb -0.20 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 3fef s ALA 169 CO -0.04 0.04 -0.13 0.96 0.00 0.00 0.00 175.76 176.59 3fef s ILE 170 N -0.04 1.43 -0.11 0.00 -4.36 -0.14 -4.87 121.20 113.11 3fef s ILE 170 Ca 0.01 -1.96 -0.03 0.00 -0.26 0.00 0.00 60.65 58.40 3fef s ILE 170 Cb -0.01 -1.78 -0.03 0.00 1.25 0.00 0.00 42.46 41.89 3fef s ILE 170 CO -0.00 -0.55 0.02 -0.83 0.24 0.00 0.00 174.94 173.81 3fef s GLY 171 N -2.91 1.87 -0.03 6.27 0.00 -0.31 -0.25 107.32 111.96 3fef s GLY 171 Ca 0.15 -0.78 0.06 0.00 0.00 0.00 0.00 44.72 44.15 3fef s GLY 171 CO 0.04 -0.43 -0.22 0.00 0.00 0.00 0.00 173.10 172.49 3fef n HIS 174 N 1.34 0.00 -0.31 0.00 1.44 -1.26 -4.63 115.22 111.80 3fef n HIS 174 Ca -0.22 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.50 3fef n HIS 174 Cb 0.56 0.00 0.14 0.00 0.12 0.00 0.00 29.99 30.81 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 4.60 0.92 -0.11 -1.40 4.39 -1.98 -0.98 114.58 120.02 3fef h GLU 175 Ca 0.00 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 3fef h GLU 175 Cb 0.98 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.42 3fef h GLU 175 CO 0.00 0.61 -0.04 0.28 -1.16 0.00 0.00 179.01 178.70 3fef h VAL 176 N 0.94 1.10 -0.97 3.13 2.07 -1.82 -2.12 116.25 118.59 3fef h VAL 176 Ca 0.38 -0.40 0.05 0.00 0.82 0.00 0.00 66.70 67.55 3fef h VAL 176 Cb 0.20 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.96 3fef h VAL 176 CO -0.18 0.13 0.62 -0.26 0.02 0.00 0.00 177.57 177.90 3fef h PHE 177 N 0.15 1.16 -0.82 1.57 0.04 -1.50 -1.29 116.94 116.25 3fef h PHE 177 Ca 0.04 0.03 0.11 0.00 2.80 0.00 0.00 57.97 60.94 3fef h PHE 177 Cb 0.17 -0.38 -0.06 0.00 2.20 0.00 0.00 35.95 37.88 3fef h PHE 177 CO 0.00 0.63 0.54 0.78 -0.60 0.00 0.00 178.31 179.66 3fef h GLY 178 N 1.17 1.10 1.81 -1.45 0.00 -1.41 -1.53 103.07 102.75 3fef h GLY 178 Ca 0.40 -0.31 -0.21 0.00 0.00 0.00 0.00 47.33 47.22 3fef h GLY 178 CO -0.15 0.16 -0.94 -0.84 0.00 0.00 0.00 176.54 174.77 3fef h THR 179 N 0.74 1.53 -0.63 4.70 2.02 -1.26 -2.12 112.91 117.89 3fef h THR 179 Ca 0.39 -2.79 -0.04 0.00 0.77 0.00 0.00 66.41 64.73 3fef h THR 179 Cb 0.50 2.58 -0.03 0.00 -1.74 0.00 0.00 68.15 69.46 3fef h THR 179 CO -0.16 0.81 0.22 1.56 0.37 0.00 0.00 175.52 178.32 3fef h GLN 180 N 0.08 0.93 -0.43 6.66 4.20 -0.84 -0.37 115.11 125.35 3fef h GLN 180 Ca -0.05 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.47 3fef h GLN 180 Cb 1.60 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 29.20 3fef h GLN 180 CO 0.14 0.79 0.18 0.87 -0.67 0.00 0.00 178.83 180.13 3fef h LYS 181 N 0.91 0.64 -0.26 1.46 1.57 -1.16 0.19 116.57 119.93 3fef h LYS 181 Ca 0.21 -0.11 0.05 0.00 -1.87 0.00 0.00 60.65 58.92 3fef h LYS 181 Cb 0.22 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 3fef h LYS 181 CO -0.01 0.59 -0.02 1.25 -0.57 0.00 0.00 179.45 180.69 3fef h LEU 182 N 0.56 -0.13 -1.04 2.94 5.85 -0.94 0.14 115.31 122.68 3fef h LEU 182 Ca 0.15 0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 3fef h LEU 182 Cb 0.18 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3fef h LEU 182 CO -0.01 -0.04 -0.10 -0.07 -0.34 0.00 0.00 178.44 177.88 3fef h LEU 183 N 0.06 0.55 -0.17 2.25 3.38 -0.65 -2.56 115.31 118.18 3fef h LEU 183 Ca 0.12 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3fef h LEU 183 Cb 0.17 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3fef h LEU 183 CO -0.22 0.69 0.07 0.00 0.09 0.00 0.00 178.44 179.07 3fef h ALA 184 N 1.37 0.22 0.00 1.53 0.00 0.16 -1.54 119.26 121.00 3fef h ALA 184 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fef h ALA 184 Cb 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3fef h ALA 184 CO 0.03 -0.20 0.00 0.39 0.00 0.00 0.00 179.25 179.46 3fef n GLU 185 N -4.87 0.26 0.00 0.00 1.02 -0.04 -2.39 120.64 114.62 3fef n GLU 185 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 3fef n GLU 185 Cb 0.11 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 1.26 0.00 -0.08 2.62 0.31 -0.58 -1.17 118.33 120.70 3fef n VAL 187 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 3fef n VAL 187 Cb 0.13 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.03 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 1.15 -0.47 2.52 2.02 -1.45 0.28 112.91 116.96 3fef h THR 188 Ca 0.00 -0.44 -0.12 0.00 0.77 0.00 0.00 66.41 66.62 3fef h THR 188 Cb 0.00 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3fef h THR 188 CO 0.00 0.15 -0.17 -0.08 0.37 0.00 0.00 175.52 175.79 3fef h GLU 189 N 0.28 0.95 0.00 6.66 4.81 -1.43 1.05 114.58 126.90 3fef h GLU 189 Ca 0.09 -0.39 -0.05 0.00 -0.13 0.00 0.00 59.36 58.88 3fef h GLU 189 Cb 0.13 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3fef h GLU 189 CO -0.01 1.05 -1.05 0.00 -0.73 0.00 0.00 179.01 178.28 3fef h ARG 190 N 0.80 0.00 0.00 1.92 2.47 -1.80 -3.37 114.38 114.40 3fef h ARG 190 Ca 0.11 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.83 3fef h ARG 190 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 3fef h ARG 190 CO 0.06 0.09 -0.09 1.28 0.56 0.00 0.00 179.97 181.86 3fef n LEU 191 N -2.77 0.00 0.00 3.04 4.77 0.96 -4.99 117.00 118.01 3fef n LEU 191 Ca -0.02 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 3fef n LEU 191 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 3fef n LEU 191 CO 0.40 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3fef n GLY 192 N 1.04 1.71 3.83 -0.72 0.00 0.36 -4.96 105.19 106.44 3fef n GLY 192 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.11 4.74 0.54 -0.61 -4.36 -1.25 -4.89 121.20 113.24 3fef s ILE 193 Ca 0.00 1.07 -0.08 0.00 -0.26 0.00 0.00 60.65 61.39 3fef s ILE 193 Cb 0.00 -3.82 -0.04 0.00 1.25 0.00 0.00 42.46 39.85 3fef s ILE 193 CO 0.00 0.33 0.89 -1.61 0.24 0.00 0.00 174.94 174.78 3fef s GLU 194 N -1.71 3.58 -0.16 0.37 0.41 -1.26 -3.24 118.70 116.69 3fef s GLU 194 Ca 0.37 0.44 -0.01 0.00 -0.41 0.00 0.00 54.97 55.35 3fef s GLU 194 Cb -0.17 -2.25 0.04 0.00 -1.78 0.00 0.00 34.13 29.97 3fef s GLU 194 CO 0.20 -0.35 -0.02 0.08 -0.49 0.00 0.00 175.26 174.68 3fef s VAL 195 N -2.91 0.84 0.30 2.63 1.01 -1.26 -4.98 120.40 116.03 3fef s VAL 195 Ca 0.51 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.01 3fef s VAL 195 Cb -0.11 -1.09 0.17 0.00 0.00 0.00 0.00 36.38 35.36 3fef s VAL 195 CO 0.48 0.07 1.86 -0.65 0.00 0.00 0.00 175.10 176.86 3fef h PRO 196 N 8.19 0.78 -2.89 2.72 0.11 -2.00 -3.45 132.00 135.46 3fef h PRO 196 Ca -0.21 -0.14 -0.14 0.00 0.11 0.00 0.00 66.00 65.61 3fef h PRO 196 Cb 1.12 -0.13 -0.26 0.00 0.11 0.00 0.00 31.00 31.84 3fef h PRO 196 CO 0.36 0.68 -0.34 1.03 -0.21 0.00 0.00 178.00 179.52 3fef s ARG 197 N -5.26 0.37 0.58 1.05 0.52 -1.26 -5.02 118.95 109.93 3fef s ARG 197 Ca -0.09 0.53 0.28 0.00 -0.52 0.00 0.00 55.73 55.92 3fef s ARG 197 Cb 0.16 0.11 1.62 0.00 0.52 0.00 0.00 34.95 37.36 3fef s ARG 197 CO 0.79 -0.08 2.08 0.07 0.02 0.00 0.00 175.30 178.18 3fef h ARG 198 N 6.08 0.00 0.00 3.54 -0.00 -1.91 -0.15 114.38 121.94 3fef h ARG 198 Ca -0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 59.65 3fef h ARG 198 Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.15 3fef h ARG 198 CO 0.31 0.00 -0.13 0.93 -0.00 0.00 0.00 179.97 181.08 3fef h GLU 199 N 0.00 0.00 0.00 0.08 3.07 -1.95 -1.87 114.58 113.91 3fef h GLU 199 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3fef h GLU 199 Cb 0.56 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.47 3fef h GLU 199 CO -0.00 0.13 0.00 -0.25 -1.40 0.00 0.00 179.01 177.49 3fef n ASP 200 N -3.47 0.28 -4.54 1.42 8.00 -0.07 -4.32 116.55 113.85 3fef n ASP 200 Ca -0.01 0.57 -0.42 0.00 0.71 0.00 0.00 54.79 55.64 3fef n ASP 200 Cb 0.29 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 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 -3.13 4.12 -0.43 0.53 -1.09 -0.70 -4.40 121.20 116.09 3fef s ILE 201 Ca 0.06 0.42 -0.16 0.00 -2.23 0.00 0.00 60.65 58.75 3fef s ILE 201 Cb 0.10 -4.70 0.03 0.00 -1.58 0.00 0.00 42.46 36.31 3fef s ILE 201 CO 0.32 -1.39 0.36 -0.13 -1.23 0.00 0.00 174.94 172.87 3fef s ARG 202 N 4.67 3.00 -0.06 2.79 0.52 -0.10 -4.92 118.95 124.86 3fef s ARG 202 Ca 0.34 -1.03 0.04 0.00 -0.52 0.00 0.00 55.73 54.56 3fef s ARG 202 Cb -0.10 -4.01 -0.02 0.00 0.52 0.00 0.00 34.95 31.33 3fef s ARG 202 CO 0.19 -0.85 -0.15 0.14 0.02 0.00 0.00 175.30 174.65 3fef s VAL 203 N 1.80 2.94 -0.58 3.52 -7.23 -1.26 -1.16 120.40 118.42 3fef s VAL 203 Ca 0.07 -0.76 -0.22 0.00 -1.81 0.00 0.00 61.98 59.25 3fef s VAL 203 Cb -0.20 -2.15 0.06 0.00 0.56 0.00 0.00 36.38 34.65 3fef s VAL 203 CO 0.10 0.58 0.87 0.21 -0.31 0.00 0.00 175.10 176.55 3fef s ASN 204 N -0.55 6.25 -0.03 4.85 2.47 0.16 -4.96 114.94 123.13 3fef s ASN 204 Ca 0.08 -0.76 0.04 0.00 0.42 0.00 0.00 52.86 52.64 3fef s ASN 204 Cb -0.11 -2.39 -0.03 0.00 -1.45 0.00 0.00 41.25 37.27 3fef s ASN 204 CO 0.01 -1.23 -0.14 0.54 -3.72 0.00 0.00 177.10 172.56 3fef s VAL 205 N 3.65 3.10 0.10 -5.21 0.11 -1.26 -1.79 120.40 119.10 3fef s VAL 205 Ca 0.23 -0.77 -0.25 0.00 -2.93 0.00 0.00 61.98 58.26 3fef s VAL 205 Cb -0.16 -2.24 0.08 0.00 -1.53 0.00 0.00 36.38 32.53 3fef s VAL 205 CO 0.14 0.54 0.68 -1.48 -3.33 0.00 0.00 175.10 171.65 3fef s LEU 206 N -0.88 -0.52 0.00 2.54 2.34 0.26 -3.85 118.68 118.57 3fef s LEU 206 Ca 0.12 0.04 0.00 0.00 0.06 0.00 0.00 54.13 54.35 3fef s LEU 206 Cb -0.11 2.45 0.00 0.00 -0.56 0.00 0.00 46.19 47.97 3fef s LEU 206 CO 0.02 -0.86 0.00 0.61 -1.06 0.00 0.00 176.35 175.06 3fef n GLY 207 N -0.27 0.67 3.50 -3.48 0.00 -0.93 0.20 105.19 104.88 3fef n GLY 207 Ca -0.15 -1.52 -0.24 0.00 0.00 0.00 0.00 46.02 44.11 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 -4.00 2.03 0.27 -0.61 -4.36 -1.08 0.04 121.20 113.48 3fef s ILE 208 Ca 0.00 -2.18 -0.30 0.00 -0.26 0.00 0.00 60.65 57.90 3fef s ILE 208 Cb 0.00 -2.57 -0.13 0.00 1.25 0.00 0.00 42.46 41.02 3fef s ILE 208 CO 0.00 -0.24 1.43 -3.20 0.24 0.00 0.00 174.94 173.17 3fef n ASN 209 N -0.71 3.02 0.00 4.36 5.15 -1.26 -1.30 115.26 124.52 3fef n ASN 209 Ca -0.05 1.15 0.00 0.00 -0.60 0.00 0.00 54.58 55.08 3fef n ASN 209 Cb 0.63 -1.48 0.00 0.00 -0.53 0.00 0.00 39.78 38.41 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 1.72 0.00 -2.90 1.20 8.25 -1.26 -4.80 115.22 117.42 3fef n HIS 210 Ca 0.10 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.43 3fef n HIS 210 Cb 0.33 -0.90 0.03 0.00 1.12 0.00 0.00 29.99 30.57 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 -2.20 -0.76 -3.95 4.41 7.35 -0.42 -4.04 117.46 117.84 3fef n PHE 211 Ca 0.00 -2.94 -0.29 0.00 -0.76 0.00 0.00 57.45 53.46 3fef n PHE 211 Cb 0.11 0.38 -0.04 0.00 0.35 0.00 0.00 39.48 40.28 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 -1.53 5.20 0.04 -2.13 -4.23 -1.14 -2.64 115.64 109.21 3fef s THR 212 Ca 0.30 -0.56 0.03 0.00 -1.18 0.00 0.00 61.69 60.28 3fef s THR 212 Cb 0.36 -3.57 -0.02 0.00 1.34 0.00 0.00 72.50 70.61 3fef s THR 212 CO -0.05 0.06 -0.10 0.26 -0.54 0.00 0.00 174.62 174.25 3fef s TRP 213 N -1.57 0.85 -0.24 3.99 0.52 0.13 -0.03 118.94 122.59 3fef s TRP 213 Ca 0.34 -0.39 -0.04 0.00 0.02 0.00 0.00 56.10 56.02 3fef s TRP 213 Cb -0.12 -0.51 0.00 0.00 -1.15 0.00 0.00 33.47 31.69 3fef s TRP 213 CO 0.27 -0.02 -0.01 0.42 0.02 0.00 0.00 176.95 177.63 3fef s ILE 214 N -1.03 3.46 -0.05 2.03 1.01 0.11 -0.57 121.20 126.16 3fef s ILE 214 Ca -0.04 -0.62 0.16 0.00 0.00 0.00 0.00 60.65 60.16 3fef s ILE 214 Cb -0.08 -2.66 -0.25 0.00 0.01 0.00 0.00 42.46 39.48 3fef s ILE 214 CO 0.01 0.30 0.37 0.35 0.00 0.00 0.00 174.94 175.97 3fef n THR 215 N 4.80 0.00 -3.91 2.92 -2.24 -0.74 -1.29 114.28 113.81 3fef n THR 215 Ca -0.17 -0.36 -0.11 0.00 -2.27 0.00 0.00 64.05 61.14 3fef n THR 215 Cb 0.49 0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 68.76 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 -3.11 0.18 -0.13 -0.78 1.02 -1.25 -4.99 119.74 110.68 3fef s LYS 216 Ca -0.06 -0.26 -0.26 0.00 0.02 0.00 0.00 55.97 55.41 3fef s LYS 216 Cb 0.11 0.07 0.06 0.00 -0.52 0.00 0.00 37.83 37.55 3fef s LYS 216 CO 0.68 -0.03 0.64 0.00 -0.92 0.00 0.00 175.35 175.72 3fef s ALA 217 N -0.70 -1.62 0.13 5.17 0.00 -1.26 0.40 121.76 123.88 3fef s ALA 217 Ca -0.08 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.20 3fef s ALA 217 Cb -0.05 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.64 3fef s ALA 217 CO -0.00 -0.34 0.36 -1.54 0.00 0.00 0.00 175.76 174.24 3fef s SER 218 N -0.55 -0.13 -0.23 0.00 1.04 -0.31 -0.87 113.70 112.65 3fef s SER 218 Ca -0.07 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 55.90 3fef s SER 218 Cb -0.02 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.60 3fef s SER 218 CO 0.06 -0.86 -0.10 -0.47 0.98 0.00 0.00 173.24 172.84 3fef s TYR 219 N -3.85 2.84 0.00 5.02 5.04 -0.60 -0.92 117.35 124.87 3fef s TYR 219 Ca 0.06 -1.97 0.00 0.00 -2.44 0.00 0.00 57.07 52.72 3fef s TYR 219 Cb 0.02 -1.78 0.00 0.00 0.35 0.00 0.00 41.96 40.55 3fef s TYR 219 CO -0.09 -0.82 0.00 0.54 -1.34 0.00 0.00 175.55 173.84 3fef n ARG 220 N 4.56 0.00 -0.00 4.97 1.74 -1.26 -0.46 116.66 126.21 3fef n ARG 220 Ca -0.14 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.09 3fef n ARG 220 Cb 0.44 0.00 0.81 0.00 -1.02 0.00 0.00 32.46 32.70 3fef n ARG 220 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 3fef n HIS 221 N 14.00 0.00 -3.59 -1.55 1.44 -1.26 -4.84 115.22 119.42 3fef n HIS 221 Ca 0.00 -0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.35 3fef n HIS 221 Cb 0.00 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.03 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 -2.00 5.33 -0.14 0.61 1.01 0.40 -5.06 121.20 121.35 3fef s ILE 222 Ca 0.44 0.41 -0.29 0.00 0.00 0.00 0.00 60.65 61.21 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 0.35 0.38 1.09 -0.62 0.00 0.00 0.00 174.94 176.14 3fef s ASP 223 N 0.58 7.12 0.13 3.58 -1.08 -1.26 -1.56 116.67 124.18 3fef s ASP 223 Ca 0.13 1.56 0.24 0.00 -0.52 0.00 0.00 52.55 53.96 3fef s ASP 223 Cb -0.13 -2.55 0.35 0.00 -1.46 0.00 0.00 42.92 39.13 3fef s ASP 223 CO 0.03 -0.58 1.33 -0.07 0.52 0.00 0.00 175.17 176.39 3fef h LEU 224 N 8.71 0.00 -0.13 -1.34 3.38 -1.36 -3.39 115.31 121.19 3fef h LEU 224 Ca -0.27 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 3fef h LEU 224 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 3fef h LEU 224 CO 0.91 0.10 -0.12 -0.07 0.09 0.00 0.00 178.44 179.35 3fef h LEU 225 N 0.00 0.33 -1.47 1.67 4.07 -1.93 0.91 115.31 118.90 3fef h LEU 225 Ca 0.00 -0.48 0.05 0.00 0.08 0.00 0.00 57.88 57.53 3fef h LEU 225 Cb 0.76 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.37 3fef h LEU 225 CO 0.00 0.74 0.42 -0.65 -1.08 0.00 0.00 178.44 177.87 3fef h PRO 226 N -0.07 0.64 -0.24 1.13 0.11 -1.97 0.47 132.00 132.07 3fef h PRO 226 Ca 0.02 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.95 3fef h PRO 226 Cb 0.65 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 3fef h PRO 226 CO 0.03 0.43 -0.44 0.82 -0.21 0.00 0.00 178.00 178.62 3fef h ILE 227 N 0.66 1.30 0.00 4.15 2.04 -1.68 -2.74 117.51 121.24 3fef h ILE 227 Ca 0.27 -1.63 -0.09 0.00 1.00 0.00 0.00 64.86 64.41 3fef h ILE 227 Cb 0.21 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3fef h ILE 227 CO -0.08 0.52 -0.41 0.15 0.00 0.00 0.00 178.15 178.33 3fef h PHE 228 N 0.49 0.00 -0.15 1.37 3.04 0.10 -1.03 116.94 120.76 3fef h PHE 228 Ca 0.03 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.98 3fef h PHE 228 Cb 0.97 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.47 3fef h PHE 228 CO 0.04 0.41 0.09 -0.09 -2.02 0.00 0.00 178.31 176.74 3fef h ARG 229 N 0.00 0.20 -0.33 1.11 2.43 -0.65 0.24 114.38 117.38 3fef h ARG 229 Ca -0.00 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3fef h ARG 229 Cb 0.75 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 3fef h ARG 229 CO 0.05 0.19 -0.01 0.93 -1.51 0.00 0.00 179.97 179.62 3fef h GLU 230 N 0.16 0.59 -0.24 0.20 5.08 -1.35 -1.72 114.58 117.30 3fef h GLU 230 Ca 0.05 -0.19 0.06 0.00 -1.00 0.00 0.00 59.36 58.27 3fef h GLU 230 Cb 0.04 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 3fef h GLU 230 CO -0.01 0.73 -0.12 0.35 -1.00 0.00 0.00 179.01 178.96 3fef h PHE 231 N 0.40 -0.28 -0.51 4.33 3.57 -1.01 -1.31 116.94 122.12 3fef h PHE 231 Ca 0.09 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 3fef h PHE 231 Cb 0.46 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 3fef h PHE 231 CO 0.04 -0.18 -0.04 1.03 -2.23 0.00 0.00 178.31 176.93 3fef h SER 232 N -0.09 0.88 0.56 0.41 0.87 -0.47 -1.95 113.55 113.76 3fef h SER 232 Ca 0.13 -0.25 -0.10 0.00 -1.23 0.00 0.00 61.79 60.34 3fef h SER 232 Cb 0.28 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 3fef h SER 232 CO -0.30 0.96 -0.47 0.00 -0.53 0.00 0.00 176.83 176.49 3fef h ALA 233 N 1.13 1.13 0.22 6.23 0.00 -0.93 -0.86 119.26 126.18 3fef h ALA 233 Ca 0.15 -0.43 -0.31 0.00 0.00 0.00 0.00 54.91 54.32 3fef h ALA 233 Cb 0.54 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.29 3fef h ALA 233 CO 0.03 0.59 -1.38 1.25 0.00 0.00 0.00 179.25 179.74 3fef h HIS 234 N 0.00 0.83 -0.53 0.00 6.17 -1.06 -3.38 115.15 117.19 3fef h HIS 234 Ca -0.00 -0.61 0.00 0.00 0.71 0.00 0.00 60.37 60.47 3fef h HIS 234 Cb 0.88 -0.03 0.00 0.00 2.52 0.00 0.00 27.41 30.78 3fef h HIS 234 CO 0.00 1.53 0.00 0.66 0.71 0.00 0.00 177.93 180.83 3fef n TYR 235 N -3.80 0.80 -0.17 5.26 4.01 -0.75 -4.61 117.16 117.90 3fef n TYR 235 Ca -0.18 -0.53 -0.05 0.00 -0.16 0.00 0.00 57.90 56.98 3fef n TYR 235 Cb 1.03 -0.06 0.04 0.00 -0.31 0.00 0.00 39.34 40.05 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 3.11 0.72 0.06 2.72 0.00 -1.33 1.18 103.07 109.53 3fef h GLY 236 Ca 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 3fef h GLY 236 CO 0.04 0.18 -0.00 0.83 0.00 0.00 0.00 176.54 177.58 3fef h GLU 237 N 0.58 -0.00 0.00 4.80 5.08 -1.86 -3.32 114.58 119.86 3fef h GLU 237 Ca 0.21 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 3fef h GLU 237 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3fef h GLU 237 CO -0.11 0.93 -0.39 0.66 -1.00 0.00 0.00 179.01 179.10 3fef h SER 238 N -0.94 0.00 -3.88 1.42 4.64 -1.84 -3.50 113.55 109.46 3fef h SER 238 Ca -0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 3fef h SER 238 Cb 0.93 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.98 3fef h SER 238 CO 0.00 0.39 -0.22 0.61 -0.87 0.00 0.00 176.83 176.74 3fef n GLY 239 N -0.10 -2.16 2.90 -0.77 0.00 0.41 -4.96 105.19 100.51 3fef n GLY 239 Ca -0.01 -1.40 -0.21 0.00 0.00 0.00 0.00 46.02 44.39 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 -2.37 0.87 -0.07 1.61 5.04 0.15 -4.84 117.35 117.75 3fef s TYR 240 Ca 0.00 -0.27 -0.03 0.00 -2.44 0.00 0.00 57.07 54.33 3fef s TYR 240 Cb 0.00 -0.76 -0.04 0.00 0.35 0.00 0.00 41.96 41.52 3fef s TYR 240 CO 0.00 -0.23 0.07 -1.21 -1.34 0.00 0.00 175.55 172.85 3fef s GLU 241 N 0.99 3.15 0.64 4.97 2.02 -1.26 -4.12 118.70 125.09 3fef s GLU 241 Ca -0.10 -0.35 -0.16 0.00 0.02 0.00 0.00 54.97 54.38 3fef s GLU 241 Cb -0.14 -2.94 -0.01 0.00 0.10 0.00 0.00 34.13 31.14 3fef s GLU 241 CO -0.00 0.71 1.12 -0.51 0.02 0.00 0.00 175.26 176.60 3fef s LEU 242 N -1.24 3.44 -0.37 1.80 1.43 -1.26 -4.87 118.68 117.61 3fef s LEU 242 Ca 0.17 2.06 -0.44 0.00 -1.03 0.00 0.00 54.13 54.89 3fef s LEU 242 Cb -0.12 -4.56 -0.19 0.00 0.03 0.00 0.00 46.19 41.36 3fef s LEU 242 CO 0.07 -1.61 1.58 -0.62 0.23 0.00 0.00 176.35 176.01 3fef n GLU 243 N -2.25 0.36 -1.94 1.70 -0.58 -1.26 -0.45 120.64 116.22 3fef n GLU 243 Ca 0.11 0.13 -0.14 0.00 -0.42 0.00 0.00 57.16 56.84 3fef n GLU 243 Cb 0.52 -1.69 -0.03 0.00 -0.57 0.00 0.00 31.44 29.67 3fef n GLU 243 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fef n GLY 244 N 3.77 0.41 3.30 0.62 0.00 -1.26 -5.01 105.19 107.02 3fef n GLY 244 Ca 0.28 -0.33 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 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 -4.13 1.16 -0.05 1.61 2.02 0.41 -5.13 118.70 114.59 3fef s GLU 245 Ca 0.00 -1.23 0.04 0.00 0.02 0.00 0.00 54.97 53.80 3fef s GLU 245 Cb 0.00 -1.36 -0.00 0.00 0.10 0.00 0.00 34.13 32.87 3fef s GLU 245 CO 0.00 0.30 -0.18 0.00 0.02 0.00 0.00 175.26 175.41 3fef h TRP 247 N 6.29 0.00 -0.00 0.00 5.08 -1.92 0.37 115.95 125.77 3fef h TRP 247 Ca -0.32 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.65 3fef h TRP 247 Cb 1.18 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.34 3fef h TRP 247 CO 0.44 0.00 -0.02 0.54 -1.28 0.00 0.00 178.44 178.12 3fef n ARG 248 N -3.35 0.26 -0.16 0.12 1.74 -1.26 -4.19 116.66 109.82 3fef n ARG 248 Ca -0.02 -0.01 0.13 0.00 -0.77 0.00 0.00 57.85 57.18 3fef n ARG 248 Cb 0.19 -1.50 0.47 0.00 -1.02 0.00 0.00 32.46 30.60 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 0.04 0.45 -4.64 0.55 3.32 -1.31 -3.45 116.42 111.38 3fef h ASP 249 Ca 0.00 0.02 0.08 0.00 0.02 0.00 0.00 57.03 57.15 3fef h ASP 249 Cb 0.38 -0.07 -0.16 0.00 0.22 0.00 0.00 39.33 39.70 3fef h ASP 249 CO 0.00 0.25 0.45 -0.94 -1.72 0.00 0.00 179.24 177.28 3fef s SER 250 N -6.03 -0.41 0.09 6.45 1.04 -1.26 -5.01 113.70 108.57 3fef s SER 250 Ca -0.08 0.09 0.05 0.00 0.48 0.00 0.00 55.95 56.49 3fef s SER 250 Cb 0.21 0.41 0.29 0.00 0.10 0.00 0.00 66.02 67.03 3fef s SER 250 CO 0.77 -0.63 1.10 1.33 0.98 0.00 0.00 173.24 176.79 3fef n VAL 251 N -0.08 1.47 0.77 5.02 0.24 -1.26 -1.55 118.33 122.94 3fef n VAL 251 Ca -0.10 0.57 0.11 0.00 -2.04 0.00 0.00 64.34 62.88 3fef n VAL 251 Cb 0.61 -1.57 0.09 0.00 -1.47 0.00 0.00 33.84 31.51 3fef n VAL 251 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3fef n PHE 252 N -1.65 0.17 -3.13 6.34 3.72 -1.26 -4.38 117.46 117.27 3fef n PHE 252 Ca -0.00 0.05 -0.23 0.00 -0.05 0.00 0.00 57.45 57.22 3fef n PHE 252 Cb 0.09 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.29 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 -4.15 -0.07 -0.18 0.00 1.04 -1.26 -4.30 113.70 104.77 3fef s SER 254 Ca 0.45 -0.99 0.16 0.00 0.48 0.00 0.00 55.95 56.06 3fef s SER 254 Cb -0.10 0.82 0.53 0.00 0.10 0.00 0.00 66.02 67.36 3fef s SER 254 CO 0.37 -1.59 1.42 0.00 0.98 0.00 0.00 173.24 174.42 3fef n ALA 255 N -0.51 3.04 -1.77 5.32 0.00 -0.79 -4.62 120.51 121.18 3fef n ALA 255 Ca -0.07 -2.35 -0.21 0.00 0.00 0.00 0.00 53.44 50.81 3fef n ALA 255 Cb 0.60 -0.71 -0.07 0.00 0.00 0.00 0.00 19.45 19.26 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 -0.55 -0.23 -0.20 0.00 -0.00 -1.26 0.34 115.22 113.32 3fef n HIS 256 Ca 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.89 3fef n HIS 256 Cb 0.90 -3.57 0.12 0.00 -0.00 0.00 0.00 29.99 27.44 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 0.00 0.99 -0.27 -0.41 3.08 -1.89 -1.26 114.38 114.62 3fef h ARG 257 Ca -0.44 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 59.36 3fef h ARG 257 Cb 1.35 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 3fef h ARG 257 CO 0.61 0.88 0.02 0.28 -1.07 0.00 0.00 179.97 180.69 3fef h VAL 258 N 0.95 1.25 -0.60 2.04 2.07 -1.89 -0.69 116.25 119.37 3fef h VAL 258 Ca 0.20 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 3fef h VAL 258 Cb 0.33 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 3fef h VAL 258 CO -0.00 0.27 0.31 0.00 0.02 0.00 0.00 177.57 178.17 3fef h ALA 259 N 0.84 0.77 -0.80 1.67 0.00 -1.90 0.19 119.26 120.02 3fef h ALA 259 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3fef h ALA 259 Cb 0.38 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3fef h ALA 259 CO 0.01 0.31 0.52 0.74 0.00 0.00 0.00 179.25 180.83 3fef h PHE 260 N 0.81 1.03 -0.23 0.00 0.04 -1.08 0.87 116.94 118.37 3fef h PHE 260 Ca 0.21 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.97 3fef h PHE 260 Cb 0.08 -0.34 -0.01 0.00 2.20 0.00 0.00 35.95 37.88 3fef h PHE 260 CO -0.01 0.66 0.04 0.22 -0.60 0.00 0.00 178.31 178.63 3fef h ASP 261 N 1.09 0.37 -0.73 2.17 3.58 -0.23 -2.13 116.42 120.55 3fef h ASP 261 Ca 0.29 -0.26 0.04 0.00 0.42 0.00 0.00 57.03 57.53 3fef h ASP 261 Cb -0.10 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 40.80 3fef h ASP 261 CO -0.06 0.53 0.44 -0.07 -2.88 0.00 0.00 179.24 177.20 3fef h LEU 262 N 0.19 0.71 -0.16 2.28 3.38 -0.44 -2.58 115.31 118.69 3fef h LEU 262 Ca 0.07 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3fef h LEU 262 Cb 0.32 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3fef h LEU 262 CO 0.00 0.48 0.01 0.15 0.09 0.00 0.00 178.44 179.17 3fef h PHE 263 N 0.85 0.00 -0.71 1.13 3.57 -0.62 0.12 116.94 121.28 3fef h PHE 263 Ca 0.31 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.89 3fef h PHE 263 Cb 0.09 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 3fef h PHE 263 CO -0.05 -0.01 0.39 0.93 -2.23 0.00 0.00 178.31 177.34 3fef h GLU 264 N 0.06 0.68 -0.28 1.11 4.39 -1.23 0.29 114.58 119.59 3fef h GLU 264 Ca 0.08 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.68 3fef h GLU 264 Cb 0.09 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 3fef h GLU 264 CO -0.12 0.45 -0.05 1.15 -1.16 0.00 0.00 179.01 179.27 3fef h THR 265 N 0.70 1.28 0.00 1.13 2.02 -1.07 -3.39 112.91 113.57 3fef h THR 265 Ca 0.33 -1.06 -0.13 0.00 0.77 0.00 0.00 66.41 66.31 3fef h THR 265 Cb 0.25 1.40 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3fef h THR 265 CO -0.21 0.34 -1.80 -1.22 0.37 0.00 0.00 175.52 173.00 3fef n TYR 266 N -4.52 0.00 -1.01 3.16 4.01 0.37 -5.02 117.16 114.15 3fef n TYR 266 Ca -0.03 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3fef n TYR 266 Cb 0.30 -0.51 -0.00 0.00 -0.31 0.00 0.00 39.34 38.82 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 1.96 0.41 3.15 2.72 0.00 1.00 -4.85 105.19 109.57 3fef n GLY 267 Ca -0.13 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.01 1.05 -0.38 4.61 0.00 -1.26 -5.00 121.76 118.77 3fef s ALA 268 Ca 0.00 -0.96 -0.26 0.00 0.00 0.00 0.00 51.96 50.74 3fef s ALA 268 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.07 3fef s ALA 268 CO 0.00 0.12 0.96 0.42 0.00 0.00 0.00 175.76 177.27 3fef s ILE 269 N -1.32 4.53 0.35 0.00 1.01 -0.41 -4.29 121.20 121.07 3fef s ILE 269 Ca -0.03 1.22 -0.28 0.00 0.00 0.00 0.00 60.65 61.55 3fef s ILE 269 Cb -0.10 -4.38 -0.11 0.00 0.01 0.00 0.00 42.46 37.88 3fef s ILE 269 CO 0.02 -0.60 1.45 -2.84 0.00 0.00 0.00 174.94 172.97 3fef s PRO 270 N 3.62 4.17 -0.34 2.79 0.02 -1.26 0.09 135.00 144.09 3fef s PRO 270 Ca 0.40 2.48 0.08 0.00 0.02 0.00 0.00 61.00 63.98 3fef s PRO 270 Cb -0.11 -3.00 0.45 0.00 0.02 0.00 0.00 34.50 31.85 3fef s PRO 270 CO 0.20 -0.46 1.14 0.00 -0.33 0.00 0.00 177.00 177.56 3fef n ALA 271 N 0.77 4.74 -2.76 -1.55 0.00 0.95 -4.85 120.51 117.82 3fef n ALA 271 Ca 0.02 -3.85 -0.10 0.00 0.00 0.00 0.00 53.44 49.51 3fef n ALA 271 Cb 0.40 -0.48 -0.08 0.00 0.00 0.00 0.00 19.45 19.28 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 -3.57 -0.27 0.75 0.00 0.00 -1.26 -3.58 121.76 113.82 3fef s ALA 272 Ca 0.47 -0.41 -0.16 0.00 0.00 0.00 0.00 51.96 51.86 3fef s ALA 272 Cb 0.40 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.82 3fef s ALA 272 CO -0.05 -0.39 0.55 0.41 0.00 0.00 0.00 175.76 176.29 3fef n GLY 273 N 0.53 -1.49 0.36 0.00 0.00 -1.26 -4.66 105.19 98.67 3fef n GLY 273 Ca -0.18 -0.42 0.07 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.50 0.75 0.24 1.61 5.19 -1.95 -1.85 116.42 119.92 3fef h ASP 274 Ca -0.45 0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 55.95 3fef h ASP 274 Cb 1.34 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 40.70 3fef h ASP 274 CO 0.42 0.46 -0.13 0.08 -3.12 0.00 0.00 179.24 176.95 3fef h ARG 275 N 0.84 0.00 0.04 3.56 0.11 -1.89 -1.60 114.38 115.44 3fef h ARG 275 Ca 0.38 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.21 3fef h ARG 275 Cb 0.37 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.43 3fef h ARG 275 CO -0.15 0.13 -1.37 0.45 0.10 0.00 0.00 179.97 179.13 3fef h HIS 276 N 0.00 0.15 -1.00 4.08 3.86 -1.75 -3.38 115.15 117.10 3fef h HIS 276 Ca -0.00 -0.11 0.22 0.00 -1.16 0.00 0.00 60.37 59.32 3fef h HIS 276 Cb 0.28 -0.01 -0.11 0.00 1.06 0.00 0.00 27.41 28.64 3fef h HIS 276 CO 0.00 1.54 0.62 -0.07 0.86 0.00 0.00 177.93 180.88 3fef h LEU 277 N -0.71 0.66 -1.97 2.43 3.38 -1.20 -1.63 115.31 116.27 3fef h LEU 277 Ca -0.34 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 3fef h LEU 277 Cb 1.49 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 3fef h LEU 277 CO -0.11 0.18 -0.09 0.00 0.09 0.00 0.00 178.44 178.50 3fef h ALA 278 N 1.66 1.59 -0.00 1.53 0.00 -1.48 -2.53 119.26 120.04 3fef h ALA 278 Ca 0.60 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3fef h ALA 278 Cb 1.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3fef h ALA 278 CO -0.38 0.12 -0.06 0.39 0.00 0.00 0.00 179.25 179.31 3fef n GLU 279 N -4.06 0.22 0.00 0.00 1.02 -0.61 -3.88 120.64 113.33 3fef n GLU 279 Ca -0.02 -0.03 0.11 0.00 -0.02 0.00 0.00 57.16 57.19 3fef n GLU 279 Cb 0.18 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.98 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 -1.36 0.04 -4.03 -0.32 3.72 -0.95 -4.58 117.46 109.98 3fef n PHE 280 Ca 0.10 0.01 -0.10 0.00 -0.05 0.00 0.00 57.45 57.42 3fef n PHE 280 Cb 0.30 -0.26 -0.08 0.00 -0.94 0.00 0.00 39.48 38.50 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 -3.73 1.31 0.36 4.37 0.05 -1.25 -4.90 118.68 114.88 3fef s LEU 281 Ca 0.01 -0.99 -0.28 0.00 0.05 0.00 0.00 54.13 52.92 3fef s LEU 281 Cb 0.15 0.83 -0.10 0.00 -2.05 0.00 0.00 46.19 45.02 3fef s LEU 281 CO 0.87 -0.82 1.29 -2.84 -0.55 0.00 0.00 176.35 174.31 3fef s PRO 282 N -3.99 4.22 0.00 1.48 0.02 -1.26 -4.97 135.00 130.50 3fef s PRO 282 Ca 0.19 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.38 3fef s PRO 282 Cb 0.05 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.62 3fef s PRO 282 CO 0.00 -0.28 0.00 0.41 -0.33 0.00 0.00 177.00 176.80 3fef n GLY 283 N 0.75 0.43 0.14 0.52 0.00 -1.26 -4.98 105.19 100.80 3fef n GLY 283 Ca 0.01 -0.82 0.04 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.05 1.18 0.04 1.61 -0.04 -1.26 -4.52 135.00 131.97 3fef n PRO 284 Ca 0.00 -0.28 -0.12 0.00 -0.04 0.00 0.00 63.50 63.05 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 0.49 -0.04 0.00 0.54 0.05 -1.93 -2.22 116.97 113.86 3fef h TYR 285 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3fef h TYR 285 Cb 0.11 0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.87 3fef h TYR 285 CO 0.04 0.08 0.00 1.28 -1.05 0.00 0.00 178.16 178.52 3fef n LEU 286 N -5.06 0.73 -0.01 3.88 4.77 -1.26 -2.20 117.00 117.84 3fef n LEU 286 Ca -0.08 0.61 -0.05 0.00 -0.03 0.00 0.00 56.01 56.46 3fef n LEU 286 Cb 0.10 -0.42 -0.12 0.00 -2.33 0.00 0.00 43.42 40.64 3fef n LEU 286 CO 0.33 -0.32 -0.53 0.29 -1.33 0.00 0.00 177.39 175.84 3fef n LYS 287 N -2.22 0.64 -2.94 3.23 5.02 -1.10 -4.48 118.16 116.31 3fef n LYS 287 Ca 0.04 0.21 -0.24 0.00 -2.02 0.00 0.00 58.31 56.30 3fef n LYS 287 Cb 0.35 -1.75 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 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 -2.92 2.58 -0.21 1.97 6.02 -0.85 -4.91 117.38 119.06 3fef n GLN 288 Ca -0.16 -4.37 0.00 0.00 -0.01 0.00 0.00 57.00 52.46 3fef n GLN 288 Cb 0.97 -2.06 0.24 0.00 1.02 0.00 0.00 30.24 30.41 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 2.94 0.98 -0.60 -1.09 0.13 -1.66 -1.72 132.00 130.97 3fef h PRO 289 Ca 0.13 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 65.11 3fef h PRO 289 Cb 0.70 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.59 3fef h PRO 289 CO 0.73 0.67 0.08 1.05 -0.23 0.00 0.00 178.00 180.29 3fef h GLU 290 N 1.00 0.99 -0.23 0.86 9.09 -1.88 0.35 114.58 124.77 3fef h GLU 290 Ca 0.27 -0.26 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 3fef h GLU 290 Cb -0.07 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 26.90 3fef h GLU 290 CO -0.05 0.93 0.09 0.28 0.05 0.00 0.00 179.01 180.31 3fef h VAL 291 N 0.93 1.09 -0.20 -1.06 2.07 -1.77 -2.69 116.25 114.62 3fef h VAL 291 Ca 0.18 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3fef h VAL 291 Cb 0.43 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3fef h VAL 291 CO 0.01 0.11 0.00 0.79 0.02 0.00 0.00 177.57 178.50 3fef n TRP 292 N -4.44 0.24 -3.39 1.57 7.02 0.07 -4.97 117.44 113.53 3fef n TRP 292 Ca 0.00 -0.12 -0.18 0.00 -1.02 0.00 0.00 57.50 56.18 3fef n TRP 292 Cb 0.12 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.09 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 1.27 -6.59 -4.18 -0.99 5.02 0.10 -4.30 118.16 108.49 3fef n LYS 293 Ca 0.17 0.77 -0.16 0.00 -2.02 0.00 0.00 58.31 57.07 3fef n LYS 293 Cb 0.57 -5.58 -0.07 0.00 -0.02 0.00 0.00 35.03 29.93 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 -3.31 1.31 0.24 2.13 -0.71 -1.11 -1.89 117.98 114.63 3fef s PHE 294 Ca 0.24 -1.42 0.12 0.00 -1.04 0.00 0.00 56.93 54.82 3fef s PHE 294 Cb -0.10 -0.42 -0.05 0.00 -1.21 0.00 0.00 43.02 41.23 3fef s PHE 294 CO 0.66 -0.91 -0.22 -1.01 -1.34 0.00 0.00 175.22 172.41 3fef s HIS 295 N -3.53 2.29 0.47 3.49 3.76 -1.26 -4.34 115.29 116.16 3fef s HIS 295 Ca 0.36 -0.35 -0.07 0.00 -0.15 0.00 0.00 55.06 54.85 3fef s HIS 295 Cb 0.02 -1.06 -0.05 0.00 1.11 0.00 0.00 32.58 32.61 3fef s HIS 295 CO 0.21 0.61 0.81 -0.51 -0.85 0.00 0.00 174.74 175.00 3fef s LEU 296 N -3.09 3.65 -0.43 0.89 1.43 -1.26 -4.79 118.68 115.08 3fef s LEU 296 Ca 0.25 1.04 -0.03 0.00 -1.03 0.00 0.00 54.13 54.36 3fef s LEU 296 Cb -0.06 -3.98 0.11 0.00 0.03 0.00 0.00 46.19 42.29 3fef s LEU 296 CO 0.12 -0.55 0.23 -0.89 0.23 0.00 0.00 176.35 175.49 3fef s THR 297 N -2.67 3.40 0.59 5.49 2.01 0.10 -4.94 115.64 119.63 3fef s THR 297 Ca 0.49 -2.09 -0.18 0.00 0.31 0.00 0.00 61.69 60.22 3fef s THR 297 Cb -0.10 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 3fef s THR 297 CO 0.42 -0.71 1.18 -2.16 -0.69 0.00 0.00 174.62 172.65 3fef s PRO 298 N 1.08 3.00 0.53 4.92 0.04 -1.26 -4.76 135.00 138.55 3fef s PRO 298 Ca 0.09 1.73 0.31 0.00 0.04 0.00 0.00 61.00 63.17 3fef s PRO 298 Cb -0.23 -1.94 1.37 0.00 0.04 0.00 0.00 34.50 33.74 3fef s PRO 298 CO -0.04 -1.16 2.00 0.82 0.04 0.00 0.00 177.00 178.66 3fef h ILE 299 N 0.82 0.28 -0.61 0.56 1.08 -1.98 -2.49 117.51 115.17 3fef h ILE 299 Ca -0.50 -0.64 -0.05 0.00 -0.39 0.00 0.00 64.86 63.29 3fef h ILE 299 Cb 1.28 1.50 -0.03 0.00 -3.07 0.00 0.00 36.82 36.50 3fef h ILE 299 CO 0.55 0.09 0.19 0.77 -0.69 0.00 0.00 178.15 179.06 3fef h SER 300 N 0.00 0.85 -0.80 1.72 4.64 -1.99 -0.95 113.55 117.02 3fef h SER 300 Ca -0.00 -0.14 0.01 0.00 -0.47 0.00 0.00 61.79 61.19 3fef h SER 300 Cb 0.49 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.31 3fef h SER 300 CO 0.01 0.80 0.53 0.15 -0.87 0.00 0.00 176.83 177.45 3fef h PHE 301 N 0.89 1.00 -0.78 4.77 3.57 -1.82 -1.62 116.94 122.95 3fef h PHE 301 Ca 0.20 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 3fef h PHE 301 Cb 0.26 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 3fef h PHE 301 CO 0.02 0.62 0.30 0.00 -2.23 0.00 0.00 178.31 177.02 3fef h ARG 302 N 1.07 1.18 -0.38 1.11 3.08 -1.20 -0.25 114.38 118.99 3fef h ARG 302 Ca 0.30 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 60.02 3fef h ARG 302 Cb -0.09 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.75 3fef h ARG 302 CO -0.08 0.96 -0.24 0.87 -1.07 0.00 0.00 179.97 180.42 3fef h LYS 303 N 1.14 0.76 -0.30 0.04 1.57 -0.96 -1.49 116.57 117.34 3fef h LYS 303 Ca 0.26 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 3fef h LYS 303 Cb 0.23 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3fef h LYS 303 CO -0.02 0.93 -0.30 0.37 -0.57 0.00 0.00 179.45 179.86 3fef h GLN 304 N 0.66 0.63 -0.27 3.15 5.75 -1.02 -2.52 115.11 121.49 3fef h GLN 304 Ca 0.09 -0.28 -0.11 0.00 -0.15 0.00 0.00 58.65 58.20 3fef h GLN 304 Cb 0.75 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.27 3fef h GLN 304 CO 0.06 0.86 -0.29 0.22 -2.65 0.00 0.00 178.83 177.03 3fef h ASP 305 N 0.54 0.56 -0.33 -0.69 3.58 -0.83 -2.10 116.42 117.15 3fef h ASP 305 Ca 0.07 -0.21 -0.09 0.00 0.42 0.00 0.00 57.03 57.21 3fef h ASP 305 Cb 0.79 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.66 3fef h ASP 305 CO 0.06 0.83 -0.12 -0.09 -2.88 0.00 0.00 179.24 177.05 3fef h ARG 306 N 0.48 0.77 -0.33 0.28 2.43 -1.09 -1.14 114.38 115.77 3fef h ARG 306 Ca 0.06 -0.26 -0.16 0.00 -0.81 0.00 0.00 59.98 58.81 3fef h ARG 306 Cb 0.75 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 3fef h ARG 306 CO 0.06 0.86 -0.43 0.00 -1.51 0.00 0.00 179.97 178.94 3fef h ALA 307 N 1.17 0.61 -0.07 2.80 0.00 -1.06 -1.12 119.26 121.60 3fef h ALA 307 Ca 0.12 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 3fef h ALA 307 Cb 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3fef h ALA 307 CO 0.04 0.68 -0.38 1.05 0.00 0.00 0.00 179.25 180.63 3fef h GLU 308 N 0.68 0.14 -0.31 0.00 4.11 -1.25 -2.24 114.58 115.70 3fef h GLU 308 Ca 0.05 -0.06 -0.12 0.00 0.07 0.00 0.00 59.36 59.30 3fef h GLU 308 Cb 1.01 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 3fef h GLU 308 CO 0.10 0.51 -0.31 0.87 0.07 0.00 0.00 179.01 180.25 3fef h LYS 309 N 0.12 0.64 -0.19 1.06 1.57 -0.97 -1.29 116.57 117.52 3fef h LYS 309 Ca 0.01 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.45 3fef h LYS 309 Cb 0.73 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3fef h LYS 309 CO 0.05 0.87 -0.14 0.00 -0.57 0.00 0.00 179.45 179.67 3fef h ARG 310 N 0.55 0.30 -0.13 3.15 3.08 -0.96 -0.54 114.38 119.83 3fef h ARG 310 Ca 0.07 -0.08 -0.19 0.00 0.07 0.00 0.00 59.98 59.85 3fef h ARG 310 Cb 0.80 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.82 3fef h ARG 310 CO 0.07 0.45 -0.65 1.96 -1.07 0.00 0.00 179.97 180.73 3fef h GLN 311 N 0.28 0.68 -0.81 0.04 4.20 -1.16 -2.38 115.11 115.96 3fef h GLN 311 Ca 0.06 -0.55 -0.02 0.00 0.06 0.00 0.00 58.65 58.19 3fef h GLN 311 Cb 0.43 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 3fef h GLN 311 CO 0.03 1.17 0.42 1.49 -0.67 0.00 0.00 178.83 181.26 3fef h GLU 312 N 0.36 1.14 -0.41 1.46 4.81 -1.03 0.13 114.58 121.04 3fef h GLU 312 Ca -0.04 -0.15 0.04 0.00 -0.13 0.00 0.00 59.36 59.08 3fef h GLU 312 Cb 1.29 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 3fef h GLU 312 CO 0.13 0.86 0.17 1.15 -0.73 0.00 0.00 179.01 180.59 3fef h THR 313 N 1.13 0.91 -0.34 0.32 2.02 -1.07 -0.43 112.91 115.46 3fef h THR 313 Ca 0.28 -0.12 -0.14 0.00 0.77 0.00 0.00 66.41 67.20 3fef h THR 313 Cb 0.07 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 3fef h THR 313 CO -0.04 0.06 -0.35 -0.33 0.37 0.00 0.00 175.52 175.24 3fef h GLU 314 N 0.35 0.77 0.16 6.66 4.39 -1.07 -2.07 114.58 123.78 3fef h GLU 314 Ca 0.19 -0.38 0.01 0.00 0.34 0.00 0.00 59.36 59.52 3fef h GLU 314 Cb 0.14 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 3fef h GLU 314 CO -0.17 1.00 -0.26 -0.09 -1.16 0.00 0.00 179.01 178.33 3fef h ARG 315 N 0.64 -0.47 -0.85 2.33 2.43 -0.73 -1.09 114.38 116.65 3fef h ARG 315 Ca 0.06 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.34 3fef h ARG 315 Cb 0.89 0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.49 3fef h ARG 315 CO 0.08 -0.32 0.55 -0.07 -1.51 0.00 0.00 179.97 178.70 3fef h LEU 316 N -0.49 0.81 0.37 3.80 3.38 -0.98 -0.55 115.31 121.66 3fef h LEU 316 Ca 0.02 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3fef h LEU 316 Cb 0.50 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3fef h LEU 316 CO -0.12 0.51 -0.18 0.40 0.09 0.00 0.00 178.44 179.14 3fef h ILE 317 N 0.92 0.00 -0.97 1.22 2.04 -1.00 -0.56 117.51 119.16 3fef h ILE 317 Ca 0.37 -0.22 0.24 0.00 1.00 0.00 0.00 64.86 66.25 3fef h ILE 317 Cb 0.25 0.00 -0.18 0.00 -0.74 0.00 0.00 36.82 36.15 3fef h ILE 317 CO -0.14 0.00 -0.06 0.58 0.00 0.00 0.00 178.15 178.53 3fef h VAL 318 N -0.72 0.04 0.00 1.67 2.07 -1.15 1.30 116.25 119.46 3fef h VAL 318 Ca -0.05 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3fef h VAL 318 Cb 0.38 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 3fef h VAL 318 CO 0.08 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.68 3fef n GLN 319 N -5.52 0.71 -3.52 1.57 6.02 -0.22 -4.84 117.38 111.58 3fef n GLN 319 Ca 0.20 0.01 -0.25 0.00 -0.01 0.00 0.00 57.00 56.95 3fef n GLN 319 Cb 0.66 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.40 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 -1.12 -3.15 -3.71 -1.09 6.02 0.45 -4.91 117.38 109.86 3fef n GLN 320 Ca 0.19 0.41 -0.35 0.00 -0.01 0.00 0.00 57.00 57.24 3fef n GLN 320 Cb 0.16 -5.10 -0.05 0.00 1.02 0.00 0.00 30.24 26.27 3fef n GLN 320 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3fef s ARG 321 N -6.17 3.63 0.00 -1.09 0.52 -0.52 -4.97 118.95 110.35 3fef s ARG 321 Ca 0.46 -0.00 0.00 0.00 -0.52 0.00 0.00 55.73 55.66 3fef s ARG 321 Cb -0.25 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.17 3fef s ARG 321 CO 0.56 0.62 0.00 0.41 0.02 0.00 0.00 175.30 176.91 3fef n GLY 322 N 1.05 0.68 3.92 -3.53 0.00 -1.25 -4.50 105.19 101.54 3fef n GLY 322 Ca -0.10 -1.82 -0.28 0.00 0.00 0.00 0.00 46.02 43.82 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 1.06 2.08 0.23 1.61 -7.23 -1.26 -4.96 120.40 111.93 3fef s VAL 323 Ca 0.00 -0.10 -0.30 0.00 -1.81 0.00 0.00 61.98 59.77 3fef s VAL 323 Cb 0.00 -2.98 -0.09 0.00 0.56 0.00 0.00 36.38 33.87 3fef s VAL 323 CO 0.00 0.00 1.14 0.00 -0.31 0.00 0.00 175.10 175.93 3fef s ALA 324 N -3.52 3.41 -1.26 1.32 0.00 -1.26 -4.85 121.76 115.60 3fef s ALA 324 Ca 0.64 0.91 -0.17 0.00 0.00 0.00 0.00 51.96 53.33 3fef s ALA 324 Cb -0.09 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 3fef s ALA 324 CO 0.48 -0.25 2.01 0.39 0.00 0.00 0.00 175.76 178.39 3fef n GLU 325 N 1.88 2.56 -3.78 0.00 1.02 -1.26 -4.53 120.64 116.52 3fef n GLU 325 Ca 0.02 -2.62 -0.14 0.00 -0.02 0.00 0.00 57.16 54.40 3fef n GLU 325 Cb 0.45 -3.32 -0.15 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 4.15 0.05 0.41 3.49 2.20 -1.26 -4.99 119.74 123.80 3fef s LYS 326 Ca 0.53 0.24 -0.24 0.00 -0.36 0.00 0.00 55.97 56.14 3fef s LYS 326 Cb 0.10 -0.13 -0.11 0.00 -1.51 0.00 0.00 37.83 36.18 3fef s LYS 326 CO 0.02 -0.12 0.97 0.00 -0.36 0.00 0.00 175.35 175.86 3fef n ALA 327 N 3.85 0.01 0.01 3.13 0.00 -1.26 -4.47 120.51 121.78 3fef n ALA 327 Ca -0.23 0.23 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 3fef n ALA 327 Cb 0.54 -2.05 -0.12 0.00 0.00 0.00 0.00 19.45 17.82 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 1.48 0.00 0.00 0.00 4.64 -1.93 -3.48 113.55 114.26 3fef h SER 328 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3fef h SER 328 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 3fef h SER 328 CO 0.56 0.89 0.00 0.61 -0.87 0.00 0.00 176.83 178.02 3fef n GLY 329 N 1.47 1.83 3.72 -0.77 0.00 -1.26 -5.09 105.19 105.10 3fef n GLY 329 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.82 0.98 0.00 1.61 0.41 -1.26 -4.99 118.70 114.63 3fef s GLU 330 Ca 0.00 0.57 0.13 0.00 -0.41 0.00 0.00 54.97 55.25 3fef s GLU 330 Cb 0.00 -1.80 0.08 0.00 -1.78 0.00 0.00 34.13 30.63 3fef s GLU 330 CO 0.00 -2.37 0.87 0.39 -0.49 0.00 0.00 175.26 173.67 3fef n GLU 331 N -3.93 1.06 -0.17 1.61 -0.58 -1.26 -4.78 120.64 112.59 3fef n GLU 331 Ca 0.06 -1.16 -0.09 0.00 -0.42 0.00 0.00 57.16 55.55 3fef n GLU 331 Cb 0.57 -1.23 -0.04 0.00 -0.57 0.00 0.00 31.44 30.17 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 2.59 -0.51 1.43 0.62 0.00 -1.99 0.13 103.07 105.35 3fef h GLY 332 Ca 0.00 0.55 -0.14 0.00 0.00 0.00 0.00 47.33 47.74 3fef h GLY 332 CO 0.00 -0.17 -0.42 -2.08 0.00 0.00 0.00 176.54 173.87 3fef h VAL 333 N -0.27 1.30 -0.66 4.60 2.07 -1.95 -1.51 116.25 119.82 3fef h VAL 333 Ca 0.16 -1.59 0.05 0.00 0.82 0.00 0.00 66.70 66.14 3fef h VAL 333 Cb 0.57 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 3fef h VAL 333 CO -0.63 0.51 0.38 0.78 0.02 0.00 0.00 177.57 178.63 3fef h ASN 334 N 0.51 0.59 -0.39 0.57 4.21 -1.71 0.28 115.58 119.63 3fef h ASN 334 Ca 0.04 0.02 -0.07 0.00 1.21 0.00 0.00 56.30 57.50 3fef h ASN 334 Cb 0.94 -0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 38.02 3fef h ASN 334 CO 0.08 0.39 -0.04 0.40 -1.29 0.00 0.00 177.43 176.98 3fef h ILE 335 N 0.72 1.27 -0.06 2.81 2.04 -0.50 -1.06 117.51 122.72 3fef h ILE 335 Ca 0.29 -1.08 0.03 0.00 1.00 0.00 0.00 64.86 65.10 3fef h ILE 335 Cb 0.14 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3fef h ILE 335 CO -0.16 0.36 -0.09 0.40 0.00 0.00 0.00 178.15 178.66 3fef h ILE 336 N 0.54 0.75 -0.45 -0.67 2.04 -0.93 -0.21 117.51 118.58 3fef h ILE 336 Ca 0.11 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.04 3fef h ILE 336 Cb 0.53 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 3fef h ILE 336 CO 0.03 0.00 0.11 0.00 0.00 0.00 0.00 178.15 178.29 3fef h ALA 337 N 0.92 0.51 -0.92 1.87 0.00 -0.81 -1.12 119.26 119.71 3fef h ALA 337 Ca 0.06 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3fef h ALA 337 Cb 0.21 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 3fef h ALA 337 CO -0.14 -0.29 0.61 0.00 0.00 0.00 0.00 179.25 179.42 3fef h ALA 338 N 1.33 1.37 0.00 0.00 0.00 -0.81 0.59 119.26 121.75 3fef h ALA 338 Ca 0.22 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3fef h ALA 338 Cb 0.26 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3fef h ALA 338 CO -0.27 0.57 -0.14 -0.07 0.00 0.00 0.00 179.25 179.34 3fef h LEU 339 N 1.21 0.00 -0.22 0.00 3.38 0.06 -1.99 115.31 117.76 3fef h LEU 339 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 3fef h LEU 339 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3fef h LEU 339 CO -0.09 0.14 -0.32 0.18 0.09 0.00 0.00 178.44 178.44 3fef n LEU 340 N -3.33 0.66 0.00 1.67 4.77 -0.53 -0.06 117.00 120.18 3fef n LEU 340 Ca -0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3fef n LEU 340 Cb 0.36 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 3fef n LEU 340 CO 0.31 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 3fef n GLY 341 N 1.41 1.00 1.59 -0.72 0.00 -0.77 -4.89 105.19 102.81 3fef n GLY 341 Ca 0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 4.83 0.00 0.99 4.77 0.12 -4.89 117.00 122.82 3fef n LEU 342 Ca 0.00 -2.50 0.00 0.00 -0.03 0.00 0.00 56.01 53.48 3fef n LEU 342 Cb 0.00 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.51 3fef n LEU 342 CO 0.00 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 3fef n GLY 343 N 1.03 2.18 3.56 -0.72 0.00 -1.26 -4.81 105.19 105.17 3fef n GLY 343 Ca 0.26 0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.99 3fef n GLY 343 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3fef n GLU 344 N 0.00 -0.54 -3.64 1.61 -0.00 -1.26 -4.10 120.64 112.70 3fef n GLU 344 Ca 0.00 -0.10 -0.12 0.00 -0.00 0.00 0.00 57.16 56.93 3fef n GLU 344 Cb 0.00 -2.17 -0.07 0.00 -0.00 0.00 0.00 31.44 29.20 3fef n GLU 344 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 3fef s LEU 345 N -4.59 -0.68 -0.24 -1.84 2.96 -0.72 -5.00 118.68 108.57 3fef s LEU 345 Ca 0.63 1.40 -0.01 0.00 -0.22 0.00 0.00 54.13 55.93 3fef s LEU 345 Cb -0.22 2.34 0.02 0.00 0.50 0.00 0.00 46.19 48.84 3fef s LEU 345 CO 0.62 -0.24 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.64 3fef s VAL 346 N 0.66 2.74 0.20 1.68 1.01 -1.26 -0.17 120.40 125.26 3fef s VAL 346 Ca -0.02 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 3fef s VAL 346 Cb -0.05 -2.36 0.03 0.00 0.00 0.00 0.00 36.38 34.00 3fef s VAL 346 CO -0.04 0.25 0.53 0.28 0.00 0.00 0.00 175.10 176.13 3fef s THR 347 N 1.32 0.02 0.06 3.92 -1.32 -0.95 -4.94 115.64 113.75 3fef s THR 347 Ca 0.01 -0.82 -0.28 0.00 -1.21 0.00 0.00 61.69 59.38 3fef s THR 347 Cb -0.16 -1.63 -0.05 0.00 -1.51 0.00 0.00 72.50 69.15 3fef s THR 347 CO -0.06 -0.10 0.91 0.54 -2.21 0.00 0.00 174.62 173.69 3fef s ASN 348 N -2.88 7.37 0.15 8.08 4.22 -1.26 -1.09 114.94 129.53 3fef s ASN 348 Ca 0.10 1.65 -0.04 0.00 -2.14 0.00 0.00 52.86 52.43 3fef s ASN 348 Cb -0.01 -2.55 -0.03 0.00 1.28 0.00 0.00 41.25 39.94 3fef s ASN 348 CO -0.02 -0.10 0.15 0.68 -2.04 0.00 0.00 177.10 175.77 3fef s VAL 349 N 0.28 0.08 -0.02 3.54 -7.23 -0.25 -4.77 120.40 112.03 3fef s VAL 349 Ca 0.46 -1.73 -0.01 0.00 -1.81 0.00 0.00 61.98 58.89 3fef s VAL 349 Cb -0.22 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 3fef s VAL 349 CO 0.27 -0.38 0.07 0.20 -0.31 0.00 0.00 175.10 174.96 3fef s ASN 350 N -3.03 5.63 0.16 4.85 0.01 0.46 -1.77 114.94 121.26 3fef s ASN 350 Ca 0.22 0.15 -0.30 0.00 -0.71 0.00 0.00 52.86 52.23 3fef s ASN 350 Cb 0.06 -1.62 -0.07 0.00 0.41 0.00 0.00 41.25 40.03 3fef s ASN 350 CO 0.02 0.29 1.02 -2.84 -1.51 0.00 0.00 177.10 174.08 3fef s PRO 352 N -1.58 4.68 -0.10 -0.60 0.02 -1.26 -1.17 135.00 134.98 3fef s PRO 352 Ca 0.21 1.58 -0.30 0.00 0.02 0.00 0.00 61.00 62.51 3fef s PRO 352 Cb -0.12 -3.31 -0.02 0.00 0.02 0.00 0.00 34.50 31.06 3fef s PRO 352 CO 0.12 0.20 1.23 1.21 -0.33 0.00 0.00 177.00 179.43 3fef s ASN 353 N -0.25 7.00 -0.16 2.53 2.47 0.20 -4.76 114.94 121.96 3fef s ASN 353 Ca 0.47 1.76 0.16 0.00 0.42 0.00 0.00 52.86 55.67 3fef s ASN 353 Cb -0.27 -2.55 0.44 0.00 -1.45 0.00 0.00 41.25 37.42 3fef s ASN 353 CO 0.33 -0.66 1.19 0.00 -3.72 0.00 0.00 177.10 174.23 3fef n GLN 354 N 5.82 1.42 0.00 0.43 1.13 -1.26 0.42 117.38 125.34 3fef n GLN 354 Ca 0.12 -3.06 0.00 0.00 -1.94 0.00 0.00 57.00 52.13 3fef n GLN 354 Cb 0.46 -1.22 0.00 0.00 0.11 0.00 0.00 30.24 29.59 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 -0.51 1.88 0.26 1.08 0.00 -1.26 -4.98 105.19 101.66 3fef n GLY 355 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 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 0.39 0.00 -4.81 1.61 -0.00 -1.92 -3.36 115.11 107.03 3fef h GLN 356 Ca 0.00 0.00 -0.61 0.00 -0.00 0.00 0.00 58.65 58.04 3fef h GLN 356 Cb 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 27.48 27.13 3fef h GLN 356 CO 0.00 0.11 -0.84 0.08 -0.00 0.00 0.00 178.83 178.18 3fef s VAL 357 N -3.93 1.67 0.60 1.86 1.01 -1.26 -1.33 120.40 119.02 3fef s VAL 357 Ca -0.01 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.07 3fef s VAL 357 Cb 0.11 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 3fef s VAL 357 CO 0.57 0.47 1.19 -0.76 0.00 0.00 0.00 175.10 176.58 3fef s LEU 358 N 1.22 3.64 -1.55 3.92 1.43 -0.75 -3.91 118.68 122.68 3fef s LEU 358 Ca -0.00 2.34 -0.04 0.00 -1.03 0.00 0.00 54.13 55.40 3fef s LEU 358 Cb -0.14 -4.59 0.01 0.00 0.03 0.00 0.00 46.19 41.50 3fef s LEU 358 CO -0.07 -1.59 0.44 0.59 0.23 0.00 0.00 176.35 175.95 3fef n ASN 359 N -1.66 -5.69 -4.03 2.29 3.02 -1.26 -4.74 115.26 103.19 3fef n ASN 359 Ca 0.13 -0.22 -0.17 0.00 -0.03 0.00 0.00 54.58 54.29 3fef n ASN 359 Cb 0.50 -4.64 -0.14 0.00 -0.61 0.00 0.00 39.78 34.89 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 -6.48 2.07 0.63 3.41 1.02 -1.25 -4.95 118.68 113.12 3fef s LEU 360 Ca 0.24 -0.23 -0.18 0.00 0.02 0.00 0.00 54.13 53.98 3fef s LEU 360 Cb -0.11 -0.40 -0.03 0.00 0.02 0.00 0.00 46.19 45.66 3fef s LEU 360 CO 0.29 0.05 0.98 -2.65 0.02 0.00 0.00 176.35 175.05 3fef n PRO 361 N 2.58 0.82 -2.84 1.29 -0.02 -1.26 -4.93 135.00 130.64 3fef n PRO 361 Ca -0.15 0.33 -0.32 0.00 -2.02 0.00 0.00 63.50 61.33 3fef n PRO 361 Cb 0.57 -2.20 -0.06 0.00 -0.02 0.00 0.00 33.50 31.78 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 -1.56 4.54 0.00 4.25 -4.36 -1.26 -3.45 121.20 119.36 3fef s ILE 362 Ca 0.77 1.19 0.00 0.00 -0.26 0.00 0.00 60.65 62.34 3fef s ILE 362 Cb -0.40 -3.64 0.00 0.00 1.25 0.00 0.00 42.46 39.68 3fef s ILE 362 CO 0.46 -0.37 0.00 0.00 0.24 0.00 0.00 174.94 175.28 3fef n GLN 363 N -0.80 0.00 -1.88 0.37 1.13 0.17 -4.85 117.38 111.51 3fef n GLN 363 Ca 0.05 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.72 3fef n GLN 363 Cb 0.54 -0.22 0.01 0.00 0.11 0.00 0.00 30.24 30.68 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 -1.40 3.15 -0.22 -1.58 0.00 -1.22 -4.11 121.76 116.37 3fef s ALA 364 Ca 0.00 1.35 -0.29 0.00 0.00 0.00 0.00 51.96 53.02 3fef s ALA 364 Cb 0.00 -3.55 -0.00 0.00 0.00 0.00 0.00 23.12 19.57 3fef s ALA 364 CO 0.00 -1.11 1.24 0.42 0.00 0.00 0.00 175.76 176.31 3fef s ILE 365 N -1.26 4.30 0.13 0.00 -1.09 -1.26 0.60 121.20 122.63 3fef s ILE 365 Ca 0.62 1.54 0.07 0.00 -2.23 0.00 0.00 60.65 60.65 3fef s ILE 365 Cb -0.41 -4.11 -0.04 0.00 -1.58 0.00 0.00 42.46 36.32 3fef s ILE 365 CO 0.52 -0.27 -0.16 0.68 -1.23 0.00 0.00 174.94 174.48 3fef s VAL 366 N 3.74 1.50 -0.25 2.92 -7.23 -1.26 -4.75 120.40 115.07 3fef s VAL 366 Ca 0.53 -1.75 -0.08 0.00 -1.81 0.00 0.00 61.98 58.88 3fef s VAL 366 Cb -0.19 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 3fef s VAL 366 CO 0.16 -0.35 0.10 -0.70 -0.31 0.00 0.00 175.10 174.00 3fef s GLU 367 N -2.60 3.75 0.24 4.82 2.12 0.11 -4.16 118.70 122.96 3fef s GLU 367 Ca 0.10 -0.43 -0.09 0.00 0.36 0.00 0.00 54.97 54.91 3fef s GLU 367 Cb -0.06 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 3fef s GLU 367 CO 0.04 -0.15 0.37 0.95 -0.54 0.00 0.00 175.26 175.94 3fef s THR 368 N 1.54 0.00 0.58 -1.70 -4.23 -0.73 -2.19 115.64 108.92 3fef s THR 368 Ca 0.06 -1.60 -0.20 0.00 -1.18 0.00 0.00 61.69 58.77 3fef s THR 368 Cb -0.15 -2.31 -0.04 0.00 1.34 0.00 0.00 72.50 71.34 3fef s THR 368 CO 0.05 0.00 1.27 0.59 -0.54 0.00 0.00 174.62 175.99 3fef n ASN 369 N -0.38 2.17 -4.05 3.99 3.02 -1.25 -1.09 115.26 117.67 3fef n ASN 369 Ca -0.00 0.91 -0.09 0.00 -0.03 0.00 0.00 54.58 55.36 3fef n ASN 369 Cb 0.63 -1.54 -0.11 0.00 -0.61 0.00 0.00 39.78 38.16 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 -1.35 0.42 -0.25 5.41 0.00 -0.25 -1.67 121.76 124.09 3fef s ALA 370 Ca 0.76 -0.89 -0.15 0.00 0.00 0.00 0.00 51.96 51.68 3fef s ALA 370 Cb -0.41 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 3fef s ALA 370 CO 0.46 -0.20 0.38 0.12 0.00 0.00 0.00 175.76 176.52 3fef s PHE 371 N -2.37 3.29 -0.13 0.00 5.36 0.25 -2.25 117.98 122.13 3fef s PHE 371 Ca -0.05 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.40 3fef s PHE 371 Cb -0.03 -2.55 -0.01 0.00 -0.34 0.00 0.00 43.02 40.09 3fef s PHE 371 CO -0.04 -0.15 -0.14 0.42 -1.46 0.00 0.00 175.22 173.85 3fef s ILE 372 N 1.79 2.92 0.00 3.12 1.01 0.76 -0.83 121.20 129.98 3fef s ILE 372 Ca 0.16 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 60.11 3fef s ILE 372 Cb -0.15 -2.22 0.00 0.00 0.01 0.00 0.00 42.46 40.10 3fef s ILE 372 CO 0.09 0.53 0.00 1.07 0.00 0.00 0.00 174.94 176.63 3fef n THR 373 N 3.56 0.00 -1.56 2.92 5.66 -0.50 -1.76 114.28 122.60 3fef n THR 373 Ca -0.18 0.00 -0.51 0.00 -3.05 0.00 0.00 64.05 60.31 3fef n THR 373 Cb 0.53 0.00 -0.06 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 1.42 -2.23 1.09 0.63 -1.08 -1.48 116.66 115.00 3fef n ARG 374 Ca 0.00 0.45 -0.16 0.00 -0.92 0.00 0.00 57.85 57.23 3fef n ARG 374 Cb 0.00 -2.50 -0.02 0.00 0.45 0.00 0.00 32.46 30.39 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 8.47 -4.55 -3.77 6.15 5.15 0.92 -4.94 115.26 122.69 3fef n ASN 375 Ca 0.33 0.17 -0.17 0.00 -0.60 0.00 0.00 54.58 54.31 3fef n ASN 375 Cb 0.24 -3.89 -0.16 0.00 -0.53 0.00 0.00 39.78 35.44 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 -4.69 0.14 -0.19 1.20 3.00 -0.55 -5.12 118.95 112.73 3fef s ARG 376 Ca 0.00 0.17 0.01 0.00 0.00 0.00 0.00 55.73 55.90 3fef s ARG 376 Cb 0.00 -0.43 0.04 0.00 0.00 0.00 0.00 34.95 34.56 3fef s ARG 376 CO 0.00 -0.19 -0.09 0.08 0.00 0.00 0.00 175.30 175.10 3fef s VAL 377 N 1.28 1.54 -0.27 3.52 1.01 -1.26 -1.41 120.40 124.80 3fef s VAL 377 Ca -0.06 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 60.99 3fef s VAL 377 Cb -0.13 -1.63 0.08 0.00 0.00 0.00 0.00 36.38 34.70 3fef s VAL 377 CO -0.03 0.16 0.03 -1.10 0.00 0.00 0.00 175.10 174.17 3fef s GLN 378 N 1.44 1.09 0.72 2.72 -0.21 -0.01 -4.94 119.66 120.47 3fef s GLN 378 Ca -0.01 -1.05 -0.16 0.00 0.02 0.00 0.00 55.36 54.17 3fef s GLN 378 Cb -0.16 -2.36 0.03 0.00 1.00 0.00 0.00 33.01 31.51 3fef s GLN 378 CO -0.08 -0.80 1.16 -2.30 -2.12 0.00 0.00 175.29 171.15 3fef n PRO 379 N 4.75 0.61 -4.45 2.91 -0.02 -1.26 -0.58 135.00 136.95 3fef n PRO 379 Ca -0.05 0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 61.36 3fef n PRO 379 Cb 0.43 -2.40 -0.11 0.00 -0.02 0.00 0.00 33.50 31.40 3fef n PRO 379 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3fef s ILE 380 N -1.77 3.94 0.00 4.25 1.01 -0.67 -4.80 121.20 123.17 3fef s ILE 380 Ca 0.77 -0.36 -0.30 0.00 0.00 0.00 0.00 60.65 60.75 3fef s ILE 380 Cb -0.34 -2.68 -0.07 0.00 0.01 0.00 0.00 42.46 39.38 3fef s ILE 380 CO 0.47 0.55 1.66 -0.76 0.00 0.00 0.00 174.94 176.85 3fef s LEU 381 N -0.24 4.35 0.00 2.97 1.43 -1.26 -4.75 118.68 121.17 3fef s LEU 381 Ca 0.04 2.36 0.03 0.00 -1.03 0.00 0.00 54.13 55.53 3fef s LEU 381 Cb -0.13 -3.55 0.03 0.00 0.03 0.00 0.00 46.19 42.58 3fef s LEU 381 CO 0.02 -0.90 0.62 -1.20 0.23 0.00 0.00 176.35 175.12 3fef n SER 382 N 6.44 1.31 0.00 2.29 7.64 -0.44 -5.06 113.62 125.80 3fef n SER 382 Ca 0.17 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.88 3fef n SER 382 Cb 0.42 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 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 0.18 -0.16 3.80 0.23 0.00 -1.23 -4.93 105.19 103.08 3fef n GLY 383 Ca 0.02 -1.04 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.19 3.62 0.68 4.61 0.00 -1.26 -1.82 121.76 126.40 3fef s ALA 384 Ca 0.00 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 50.81 3fef s ALA 384 Cb 0.00 -1.47 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 3fef s ALA 384 CO 0.00 0.71 1.07 -0.51 0.00 0.00 0.00 175.76 177.03 3fef s LEU 385 N -2.56 3.02 0.53 0.00 1.43 -1.26 -5.00 118.68 114.84 3fef s LEU 385 Ca 0.30 1.25 -0.22 0.00 -1.03 0.00 0.00 54.13 54.44 3fef s LEU 385 Cb -0.12 -4.14 -0.06 0.00 0.03 0.00 0.00 46.19 41.90 3fef s LEU 385 CO 0.23 -1.18 1.29 -2.65 0.23 0.00 0.00 176.35 174.27 3fef n PRO 386 N -2.92 1.62 -0.33 1.29 -0.02 -1.26 -4.70 135.00 128.68 3fef n PRO 386 Ca 0.07 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.24 3fef n PRO 386 Cb 0.56 -2.48 0.26 0.00 -0.02 0.00 0.00 33.50 31.82 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 1.42 0.71 -0.17 -0.52 1.63 -1.96 0.75 116.57 118.44 3fef h LYS 387 Ca -0.50 -0.04 -0.09 0.00 -0.85 0.00 0.00 60.65 59.17 3fef h LYS 387 Cb 1.31 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.77 3fef h LYS 387 CO 0.57 0.47 -0.28 0.78 -3.45 0.00 0.00 179.45 177.54 3fef h GLY 388 N 0.73 0.34 1.48 5.01 0.00 -1.95 -3.03 103.07 105.65 3fef h GLY 388 Ca 0.51 -0.27 -0.28 0.00 0.00 0.00 0.00 47.33 47.29 3fef h GLY 388 CO -0.36 0.25 -1.22 -2.08 0.00 0.00 0.00 176.54 173.13 3fef h VAL 389 N 0.28 1.40 0.00 4.60 2.07 -1.27 -2.97 116.25 120.36 3fef h VAL 389 Ca 0.04 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.79 3fef h VAL 389 Cb 0.64 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 3fef h VAL 389 CO 0.05 0.82 0.00 1.21 0.02 0.00 0.00 177.57 179.67 3fef n GLU 390 N -3.65 0.00 0.00 1.57 2.13 -0.32 -0.83 120.64 119.54 3fef n GLU 390 Ca -0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.72 3fef n GLU 390 Cb 0.99 -1.40 0.00 0.00 0.27 0.00 0.00 31.44 31.30 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 0.90 0.00 -0.19 4.31 4.77 -1.13 -0.62 117.00 125.04 3fef n LEU 392 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3fef n LEU 392 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 3fef n LEU 392 CO 0.00 0.00 0.87 0.00 -1.33 0.00 0.00 177.39 176.93 3fef h ALA 393 N 0.00 0.72 -0.89 -1.18 0.00 -1.29 -1.15 119.26 115.47 3fef h ALA 393 Ca 0.00 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.73 3fef h ALA 393 Cb 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 3fef h ALA 393 CO 0.00 0.46 0.56 0.00 0.00 0.00 0.00 179.25 180.27 3fef h ALA 394 N 0.99 1.22 -0.19 0.00 0.00 -1.12 0.19 119.26 120.35 3fef h ALA 394 Ca 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3fef h ALA 394 Cb 0.40 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3fef h ALA 394 CO 0.01 0.33 0.05 -0.09 0.00 0.00 0.00 179.25 179.55 3fef h ARG 395 N 1.03 0.31 -0.80 0.00 2.43 -1.69 0.30 114.38 115.96 3fef h ARG 395 Ca 0.38 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 59.45 3fef h ARG 395 Cb 0.14 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 3fef h ARG 395 CO -0.16 0.44 0.39 0.45 -1.51 0.00 0.00 179.97 179.57 3fef h HIS 396 N 0.13 1.15 -0.42 2.20 3.86 -0.89 -2.56 115.15 118.62 3fef h HIS 396 Ca 0.06 -0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 3fef h HIS 396 Cb 0.27 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 3fef h HIS 396 CO 0.01 0.83 0.18 0.82 0.86 0.00 0.00 177.93 180.63 3fef h ILE 397 N 1.14 1.19 -0.77 2.45 2.04 -0.37 0.04 117.51 123.23 3fef h ILE 397 Ca 0.28 -0.57 0.18 0.00 1.00 0.00 0.00 64.86 65.75 3fef h ILE 397 Cb 0.11 0.79 -0.13 0.00 -0.74 0.00 0.00 36.82 36.85 3fef h ILE 397 CO -0.04 0.21 0.09 0.28 0.00 0.00 0.00 178.15 178.69 3fef h SER 398 N 0.53 -0.20 -0.43 1.72 0.02 -0.68 0.25 113.55 114.77 3fef h SER 398 Ca 0.14 0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 61.17 3fef h SER 398 Cb 0.16 0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 3fef h SER 398 CO -0.01 -0.14 -0.13 0.78 -1.14 0.00 0.00 176.83 176.18 3fef h ASN 399 N 0.16 0.85 -0.44 3.07 2.35 -1.00 -2.12 115.58 118.45 3fef h ASN 399 Ca 0.44 -0.37 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 3fef h ASN 399 Cb 0.79 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.91 3fef h ASN 399 CO -0.63 1.03 0.07 1.56 -1.65 0.00 0.00 177.43 177.82 3fef h GLN 400 N 0.67 0.73 -0.74 0.81 4.20 -0.20 -0.39 115.11 120.19 3fef h GLN 400 Ca 0.10 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 3fef h GLN 400 Cb 0.68 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 3fef h GLN 400 CO 0.05 0.76 0.32 0.93 -0.67 0.00 0.00 178.83 180.22 3fef h GLU 401 N 0.59 1.08 -0.64 1.46 4.39 -0.98 -0.17 114.58 120.31 3fef h GLU 401 Ca 0.13 -0.17 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 3fef h GLU 401 Cb 0.38 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 3fef h GLU 401 CO 0.01 0.86 0.09 0.00 -1.16 0.00 0.00 179.01 178.80 3fef h ALA 402 N 1.29 0.94 -0.24 3.43 0.00 -1.08 -2.19 119.26 121.41 3fef h ALA 402 Ca 0.25 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3fef h ALA 402 Cb 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3fef h ALA 402 CO -0.03 0.66 -0.10 0.28 0.00 0.00 0.00 179.25 180.05 3fef h VAL 403 N 0.99 1.30 -0.24 0.00 2.07 -0.61 0.90 116.25 120.65 3fef h VAL 403 Ca 0.19 -1.17 0.05 0.00 0.82 0.00 0.00 66.70 66.60 3fef h VAL 403 Cb 0.45 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 3fef h VAL 403 CO 0.02 0.36 -0.06 0.00 0.02 0.00 0.00 177.57 177.90 3fef h ALA 404 N 0.73 0.16 0.29 1.67 0.00 -0.92 -0.26 119.26 120.94 3fef h ALA 404 Ca 0.06 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3fef h ALA 404 Cb 0.60 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3fef h ALA 404 CO 0.03 -0.47 -0.14 -0.44 0.00 0.00 0.00 179.25 178.23 3fef h ASP 405 N -0.00 -0.33 -0.93 0.00 3.32 -1.30 -2.74 116.42 114.44 3fef h ASP 405 Ca 0.12 -0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.27 3fef h ASP 405 Cb 0.18 0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.75 3fef h ASP 405 CO -0.25 -0.21 0.59 0.00 -1.72 0.00 0.00 179.24 177.65 3fef h ALA 406 N 0.28 1.65 -0.05 3.45 0.00 -0.56 0.32 119.26 124.34 3fef h ALA 406 Ca -0.04 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 3fef h ALA 406 Cb 0.32 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3fef h ALA 406 CO 0.07 0.14 -0.61 0.78 0.00 0.00 0.00 179.25 179.63 3fef h GLY 407 N 0.88 0.18 0.14 0.00 0.00 -1.01 1.73 103.07 104.99 3fef h GLY 407 Ca 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 3fef h GLY 407 CO -0.21 0.20 -0.07 1.41 0.00 0.00 0.00 176.54 177.87 3fef h LEU 408 N 0.12 -0.16 0.00 3.11 3.38 -0.80 -3.32 115.31 117.63 3fef h LEU 408 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fef h LEU 408 Cb 1.10 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3fef h LEU 408 CO 0.09 0.19 0.00 0.35 0.09 0.00 0.00 178.44 179.15 3fef n THR 409 N -4.19 0.00 -0.97 0.22 -2.24 0.97 -4.90 114.28 103.17 3fef n THR 409 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 3fef n THR 409 Cb 0.08 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 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 -1.00 -0.87 -2.16 -0.78 5.02 0.56 -4.94 118.16 113.99 3fef n LYS 410 Ca 0.16 0.22 -0.30 0.00 -2.02 0.00 0.00 58.31 56.36 3fef n LYS 410 Cb 0.07 -3.94 -0.05 0.00 -0.02 0.00 0.00 35.03 31.10 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 -2.07 5.43 0.53 4.39 -1.08 0.72 -4.81 116.67 119.78 3fef s ASP 411 Ca 0.00 -1.12 0.19 0.00 -0.52 0.00 0.00 52.55 51.10 3fef s ASP 411 Cb 0.00 -2.57 1.35 0.00 -1.46 0.00 0.00 42.92 40.24 3fef s ASP 411 CO 0.00 -2.53 2.15 0.71 0.52 0.00 0.00 175.17 176.01 3fef h THR 412 N 6.85 0.91 -0.38 1.71 1.35 -1.92 -0.67 112.91 120.77 3fef h THR 412 Ca 0.16 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 66.08 3fef h THR 412 Cb 0.98 0.97 -0.05 0.00 -1.73 0.00 0.00 68.15 68.33 3fef h THR 412 CO 1.26 0.00 0.09 1.23 -0.25 0.00 0.00 175.52 177.85 3fef h GLY 413 N 0.00 0.45 0.99 5.82 0.00 -1.98 0.68 103.07 109.02 3fef h GLY 413 Ca 0.03 -0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.21 3fef h GLY 413 CO -0.00 -0.02 -0.24 -2.00 0.00 0.00 0.00 176.54 174.28 3fef h LEU 414 N 0.22 0.78 -1.53 3.11 5.85 -1.56 -2.73 115.31 119.45 3fef h LEU 414 Ca 0.18 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.47 3fef h LEU 414 Cb 0.20 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3fef h LEU 414 CO -0.23 1.05 0.33 0.00 -0.34 0.00 0.00 178.44 179.26 3fef h ALA 415 N 0.75 1.69 -0.24 1.25 0.00 -0.98 -2.37 119.26 119.35 3fef h ALA 415 Ca 0.06 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 3fef h ALA 415 Cb 0.80 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3fef h ALA 415 CO 0.06 0.28 -0.43 0.35 0.00 0.00 0.00 179.25 179.51 3fef h PHE 416 N 0.64 0.72 -0.62 0.00 3.57 -0.63 0.14 116.94 120.77 3fef h PHE 416 Ca 0.19 -0.22 0.03 0.00 3.53 0.00 0.00 57.97 61.50 3fef h PHE 416 Cb -0.02 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 3fef h PHE 416 CO -0.00 0.93 0.38 1.96 -2.23 0.00 0.00 178.31 179.35 3fef h GLN 417 N 0.49 0.73 -0.12 1.11 1.08 -1.14 0.37 115.11 117.63 3fef h GLN 417 Ca 0.04 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3fef h GLN 417 Cb 0.95 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 28.21 3fef h GLN 417 CO 0.09 0.48 0.07 0.00 -0.95 0.00 0.00 178.83 178.52 3fef h ALA 418 N 1.27 0.15 -0.57 3.87 0.00 -1.18 -0.19 119.26 122.61 3fef h ALA 418 Ca 0.25 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.24 3fef h ALA 418 Cb 0.02 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 3fef h ALA 418 CO -0.10 -0.33 -0.05 0.35 0.00 0.00 0.00 179.25 179.12 3fef h PHE 419 N 0.12 -0.13 0.00 0.00 3.04 -0.55 -1.07 116.94 118.35 3fef h PHE 419 Ca 0.04 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 62.00 3fef h PHE 419 Cb 0.04 0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.69 3fef h PHE 419 CO -0.05 -0.18 -0.20 -0.07 -2.02 0.00 0.00 178.31 175.79 3fef h LEU 420 N 0.07 0.00 -1.03 0.59 3.38 -0.58 -2.86 115.31 114.88 3fef h LEU 420 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3fef h LEU 420 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3fef h LEU 420 CO -0.52 0.20 0.00 -3.20 0.09 0.00 0.00 178.44 175.00 3fef n ASN 421 N -3.46 1.56 -4.68 -0.43 5.15 -0.11 -4.89 115.26 108.41 3fef n ASN 421 Ca -0.00 -1.62 -0.41 0.00 -0.60 0.00 0.00 54.58 51.95 3fef n ASN 421 Cb 0.37 -0.07 -0.05 0.00 -0.53 0.00 0.00 39.78 39.51 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 -1.72 6.91 0.57 1.20 -1.08 -0.93 -4.92 116.67 116.69 3fef s ASP 422 Ca 0.34 1.11 0.33 0.00 -0.52 0.00 0.00 52.55 53.81 3fef s ASP 422 Cb 0.19 -2.42 1.45 0.00 -1.46 0.00 0.00 42.92 40.67 3fef s ASP 422 CO 0.29 -0.30 1.77 -0.65 0.52 0.00 0.00 175.17 176.80 3fef h PRO 423 N 7.23 0.00 0.00 4.34 0.11 -1.90 0.15 132.00 141.93 3fef h PRO 423 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3fef h PRO 423 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3fef h PRO 423 CO 0.80 0.00 -0.18 -0.07 -0.21 0.00 0.00 178.00 178.34 3fef h LEU 424 N 0.00 0.00 -7.43 2.35 3.38 -1.93 -3.41 115.31 108.28 3fef h LEU 424 Ca 0.44 -0.04 -0.75 0.00 0.09 0.00 0.00 57.88 57.63 3fef h LEU 424 Cb 1.99 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 42.56 3fef h LEU 424 CO -0.00 0.02 1.43 0.52 0.09 0.00 0.00 178.44 180.49 3fef n VAL 425 N -2.48 4.32 -2.55 1.22 0.31 0.54 -4.84 118.33 114.84 3fef n VAL 425 Ca 0.04 -4.73 -0.37 0.00 -0.01 0.00 0.00 64.34 59.28 3fef n VAL 425 Cb 0.47 -2.44 0.01 0.00 -0.91 0.00 0.00 33.84 30.96 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 4.98 4.30 -4.36 5.55 6.02 -1.26 -4.86 117.38 127.75 3fef n GLN 426 Ca 0.36 -4.48 -0.19 0.00 -0.01 0.00 0.00 57.00 52.68 3fef n GLN 426 Cb 0.41 -2.36 -0.09 0.00 1.02 0.00 0.00 30.24 29.21 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 -4.61 0.51 0.64 5.09 -4.36 -1.26 -5.12 121.20 112.09 3fef s ILE 427 Ca 0.44 -2.00 -0.18 0.00 -0.26 0.00 0.00 60.65 58.66 3fef s ILE 427 Cb 0.27 -2.56 -0.01 0.00 1.25 0.00 0.00 42.46 41.42 3fef s ILE 427 CO -0.19 0.00 1.23 -1.81 0.24 0.00 0.00 174.94 174.41 3fef s ASP 428 N -3.40 4.77 0.34 4.36 1.01 -1.26 -4.76 116.67 117.73 3fef s ASP 428 Ca 0.35 2.45 0.02 0.00 0.71 0.00 0.00 52.55 56.08 3fef s ASP 428 Cb 0.06 -2.60 0.61 0.00 1.01 0.00 0.00 42.92 41.99 3fef s ASP 428 CO 0.16 -1.88 1.98 -0.09 0.21 0.00 0.00 175.17 175.55 3fef h ARG 429 N 0.49 0.82 0.00 8.23 2.43 -1.99 0.06 114.38 124.41 3fef h ARG 429 Ca -0.50 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 58.46 3fef h ARG 429 Cb 1.31 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 3fef h ARG 429 CO 0.53 0.57 -0.66 0.66 -1.51 0.00 0.00 179.97 179.56 3fef h SER 430 N 0.83 0.00 -0.34 -3.80 4.64 -1.99 -1.09 113.55 111.81 3fef h SER 430 Ca 0.22 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.50 3fef h SER 430 Cb -0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 3fef h SER 430 CO -0.04 0.66 0.04 0.44 -0.87 0.00 0.00 176.83 177.06 3fef h ASP 431 N 0.00 0.55 -0.82 4.97 3.32 -1.72 -2.24 116.42 120.49 3fef h ASP 431 Ca -0.01 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 3fef h ASP 431 Cb 1.35 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.72 3fef h ASP 431 CO 0.09 0.69 0.37 0.00 -1.72 0.00 0.00 179.24 178.66 3fef h ALA 432 N 0.88 1.06 -0.38 3.45 0.00 -0.70 -0.25 119.26 123.32 3fef h ALA 432 Ca 0.10 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 3fef h ALA 432 Cb 0.38 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3fef h ALA 432 CO 0.01 0.64 -0.39 1.49 0.00 0.00 0.00 179.25 181.00 3fef h GLU 433 N 1.17 0.92 -0.33 0.00 4.81 -1.17 0.35 114.58 120.32 3fef h GLU 433 Ca 0.28 -0.48 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 3fef h GLU 433 Cb 0.16 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3fef h GLU 433 CO -0.03 1.14 0.16 0.37 -0.73 0.00 0.00 179.01 179.91 3fef h GLN 434 N 0.75 0.48 0.22 1.92 5.75 -1.04 0.59 115.11 123.78 3fef h GLN 434 Ca 0.06 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 3fef h GLN 434 Cb 0.98 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.45 3fef h GLN 434 CO 0.09 0.44 -0.11 1.25 -2.65 0.00 0.00 178.83 177.86 3fef h LEU 435 N 0.40 -0.25 -0.11 -2.39 5.85 -0.84 -0.21 115.31 117.76 3fef h LEU 435 Ca 0.11 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.84 3fef h LEU 435 Cb 0.12 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 3fef h LEU 435 CO -0.01 -0.15 -0.06 0.15 -0.34 0.00 0.00 178.44 178.02 3fef h PHE 436 N -0.33 -0.14 -0.77 1.25 3.57 -0.23 -2.39 116.94 117.89 3fef h PHE 436 Ca -0.03 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 3fef h PHE 436 Cb 0.25 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 3fef h PHE 436 CO -0.05 -0.10 0.50 -0.91 -2.23 0.00 0.00 178.31 175.52 3fef h ASN 437 N -0.05 0.82 0.00 0.41 2.35 -0.80 -1.58 115.58 116.74 3fef h ASN 437 Ca 0.06 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3fef h ASN 437 Cb 0.15 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3fef h ASN 437 CO -0.14 0.57 0.00 0.47 -1.65 0.00 0.00 177.43 176.68 3fef n ASP 438 N -4.60 0.00 0.00 5.81 8.00 -0.10 -5.09 116.55 120.57 3fef n ASP 438 Ca 0.09 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.59 3fef n ASP 438 Cb 0.08 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 3fef n ASP 438 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99