#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fyu n LEU 3 N 0.00 2.54 0.00 1.69 4.32 -1.26 -4.73 117.00 119.55 3fyu n LEU 3 Ca 0.00 1.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.99 3fyu n LEU 3 Cb 0.00 -1.34 0.00 0.00 -1.62 0.00 0.00 43.42 40.46 3fyu n LEU 3 CO 0.00 -1.62 0.00 2.22 -1.22 0.00 0.00 177.39 176.77 3fyu n PHE 4 N -0.65 0.00 -0.11 -1.77 -1.74 -1.26 -5.09 117.46 106.84 3fyu n PHE 4 Ca 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.99 3fyu n PHE 4 Cb 0.40 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.40 3fyu n PHE 4 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 3fyu n ASP 5 N -0.48 0.00 -4.71 5.98 -0.08 -1.26 -5.02 116.55 110.98 3fyu n ASP 5 Ca 0.00 -0.08 -0.32 0.00 -1.51 0.00 0.00 54.79 52.88 3fyu n ASP 5 Cb 0.00 0.00 0.12 0.00 2.34 0.00 0.00 41.12 43.58 3fyu n ASP 5 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3fyu s LEU 6 N 0.00 3.06 0.65 -2.67 1.43 -1.26 -4.96 118.68 114.93 3fyu s LEU 6 Ca 0.00 2.16 -0.17 0.00 -1.03 0.00 0.00 54.13 55.10 3fyu s LEU 6 Cb 0.00 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.65 3fyu s LEU 6 CO 0.00 -2.55 1.16 -0.94 0.23 0.00 0.00 176.35 174.26 3fyu s SER 7 N -2.61 4.96 0.29 2.29 1.04 -1.26 -4.70 113.70 113.71 3fyu s SER 7 Ca 0.68 2.22 0.03 0.00 0.48 0.00 0.00 55.95 59.36 3fyu s SER 7 Cb -0.24 -2.58 0.64 0.00 0.10 0.00 0.00 66.02 63.94 3fyu s SER 7 CO 0.53 -1.74 1.80 0.25 0.98 0.00 0.00 173.24 175.06 3fyu h LEU 8 N 0.33 0.83 -1.52 2.42 5.85 -1.99 0.26 115.31 121.48 3fyu h LEU 8 Ca -0.48 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.31 3fyu h LEU 8 Cb 1.28 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 3fyu h LEU 8 CO 0.53 0.37 0.29 -0.08 -0.34 0.00 0.00 178.44 179.21 3fyu h GLU 9 N 0.86 0.61 0.09 1.25 4.81 -2.01 -2.41 114.58 117.77 3fyu h GLU 9 Ca 0.53 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.45 3fyu h GLU 9 Cb 0.69 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 3fyu h GLU 9 CO -0.33 0.42 -1.28 0.93 -0.73 0.00 0.00 179.01 178.02 3fyu h GLU 10 N 0.62 0.19 -0.82 1.92 5.08 -0.96 -3.33 114.58 117.28 3fyu h GLU 10 Ca 0.17 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 3fyu h GLU 10 Cb -0.05 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3fyu h GLU 10 CO -0.03 1.11 0.53 -0.07 -1.00 0.00 0.00 179.01 179.55 3fyu h LEU 11 N 0.05 0.96 -1.83 1.33 3.38 -0.36 -0.88 115.31 117.96 3fyu h LEU 11 Ca -0.14 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.81 3fyu h LEU 11 Cb 1.94 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.44 3fyu h LEU 11 CO 0.17 0.71 0.14 0.11 0.09 0.00 0.00 178.44 179.66 3fyu h LYS 12 N 1.12 0.23 -0.01 1.13 1.57 -1.55 -1.90 116.57 117.15 3fyu h LYS 12 Ca 0.30 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 3fyu h LYS 12 Cb -0.10 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.16 3fyu h LYS 12 CO -0.06 0.15 -0.47 1.63 -0.57 0.00 0.00 179.45 180.13 3fyu n LYS 13 N -4.50 0.98 -2.18 3.15 5.02 -0.88 -4.91 118.16 114.84 3fyu n LYS 13 Ca 0.01 -0.76 -0.43 0.00 -2.02 0.00 0.00 58.31 55.11 3fyu n LYS 13 Cb 0.11 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 3fyu n LYS 13 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3fyu s TYR 14 N -2.54 2.12 -0.43 2.13 5.04 -0.39 -4.90 117.35 118.38 3fyu s TYR 14 Ca 0.19 0.64 0.05 0.00 -2.44 0.00 0.00 57.07 55.51 3fyu s TYR 14 Cb 0.18 -4.19 0.19 0.00 0.35 0.00 0.00 41.96 38.48 3fyu s TYR 14 CO 0.59 -2.49 0.45 1.17 -1.34 0.00 0.00 175.55 173.93 3fyu n LYS 15 N 8.17 0.34 -1.71 4.97 4.81 -1.26 -4.11 118.16 129.37 3fyu n LYS 15 Ca 0.19 -2.93 -0.42 0.00 -0.87 0.00 0.00 58.31 54.29 3fyu n LYS 15 Cb 0.47 -1.56 -0.00 0.00 0.02 0.00 0.00 35.03 33.96 3fyu n LYS 15 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3fyu n PRO 16 N 2.62 2.16 -1.67 1.64 -0.04 -1.26 -4.90 135.00 133.55 3fyu n PRO 16 Ca 0.26 0.76 -0.44 0.00 -0.04 0.00 0.00 63.50 64.04 3fyu n PRO 16 Cb 0.51 -2.39 -0.02 0.00 -0.04 0.00 0.00 33.50 31.56 3fyu n PRO 16 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3fyu n LYS 17 N 0.40 1.94 -1.72 0.54 4.81 -1.26 -4.89 118.16 117.98 3fyu n LYS 17 Ca 0.05 0.68 -0.38 0.00 -0.87 0.00 0.00 58.31 57.79 3fyu n LYS 17 Cb 0.37 -2.26 0.06 0.00 0.02 0.00 0.00 35.03 33.22 3fyu n LYS 17 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3fyu n LYS 18 N 1.24 1.32 -0.21 1.64 5.02 -1.26 -4.92 118.16 120.98 3fyu n LYS 18 Ca 0.09 0.50 0.07 0.00 -2.02 0.00 0.00 58.31 56.94 3fyu n LYS 18 Cb 0.33 -2.50 0.18 0.00 -0.02 0.00 0.00 35.03 33.02 3fyu n LYS 18 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3fyu n THR 19 N -1.54 0.98 -1.82 -0.18 -2.24 -1.26 -5.02 114.28 103.20 3fyu n THR 19 Ca 0.13 -0.99 -0.42 0.00 -2.27 0.00 0.00 64.05 60.50 3fyu n THR 19 Cb 0.46 0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 3fyu n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fyu s ALA 20 N -1.00 3.78 0.78 6.98 0.00 -1.26 -4.85 121.76 126.18 3fyu s ALA 20 Ca 0.28 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.52 3fyu s ALA 20 Cb 0.15 -3.70 0.06 0.00 0.00 0.00 0.00 23.12 19.63 3fyu s ALA 20 CO 0.19 -1.04 1.09 1.03 0.00 0.00 0.00 175.76 177.03 3fyu s ARG 21 N 2.06 2.21 0.48 0.00 3.00 -1.26 -4.90 118.95 120.54 3fyu s ARG 21 Ca 0.75 0.82 0.22 0.00 0.00 0.00 0.00 55.73 57.53 3fyu s ARG 21 Cb -0.45 -1.92 1.25 0.00 0.00 0.00 0.00 34.95 33.84 3fyu s ARG 21 CO 0.33 -1.58 1.93 -1.35 0.00 0.00 0.00 175.30 174.64 3fyu h PRO 22 N -1.07 0.19 -0.63 3.54 0.11 -2.04 -0.52 132.00 131.58 3fyu h PRO 22 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3fyu h PRO 22 Cb 1.25 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3fyu h PRO 22 CO 0.57 0.12 0.00 -0.40 -0.21 0.00 0.00 178.00 178.08 3fyu n ASP 23 N -4.41 4.02 0.03 -2.05 5.75 -1.26 -4.59 116.55 114.04 3fyu n ASP 23 Ca 0.14 -2.35 -0.10 0.00 -0.01 0.00 0.00 54.79 52.47 3fyu n ASP 23 Cb 0.65 -0.52 -0.06 0.00 -1.03 0.00 0.00 41.12 40.16 3fyu n ASP 23 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 3fyu h PHE 24 N 3.45 -1.03 -0.90 2.11 3.57 -1.43 0.36 116.94 123.07 3fyu h PHE 24 Ca 0.00 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.67 3fyu h PHE 24 Cb 1.23 0.45 -0.07 0.00 2.79 0.00 0.00 35.95 40.35 3fyu h PHE 24 CO 0.64 -0.37 0.58 1.03 -2.23 0.00 0.00 178.31 177.95 3fyu h SER 25 N -0.44 0.70 -0.24 0.41 0.87 -1.82 -2.32 113.55 110.70 3fyu h SER 25 Ca 0.01 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.57 3fyu h SER 25 Cb 0.47 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.32 3fyu h SER 25 CO -0.23 0.36 0.02 -0.78 -0.53 0.00 0.00 176.83 175.67 3fyu h ASP 26 N 0.74 0.41 -0.95 6.23 3.58 -1.56 -2.15 116.42 122.71 3fyu h ASP 26 Ca 0.45 -0.28 0.07 0.00 0.42 0.00 0.00 57.03 57.69 3fyu h ASP 26 Cb 0.66 -0.11 -0.06 0.00 1.72 0.00 0.00 39.33 41.54 3fyu h ASP 26 CO -0.21 0.59 0.61 0.15 -2.88 0.00 0.00 179.24 177.50 3fyu h PHE 27 N 0.21 1.10 -0.04 0.28 3.57 0.23 -1.55 116.94 120.75 3fyu h PHE 27 Ca 0.07 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.43 3fyu h PHE 27 Cb 0.37 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 3fyu h PHE 27 CO 0.03 0.55 -0.74 -1.49 -2.23 0.00 0.00 178.31 174.43 3fyu h TRP 28 N 1.06 0.32 -0.09 0.41 4.06 -1.38 -1.02 115.95 119.31 3fyu h TRP 28 Ca 0.42 -0.15 -0.01 0.00 2.06 0.00 0.00 58.89 61.21 3fyu h TRP 28 Cb 0.24 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.35 3fyu h TRP 28 CO -0.00 0.89 0.04 -0.22 -3.56 0.00 0.00 178.44 175.59 3fyu h LYS 29 N 0.16 0.14 -0.32 0.49 3.64 -0.68 0.37 116.57 120.36 3fyu h LYS 29 Ca -0.03 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.24 3fyu h LYS 29 Cb 1.31 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.09 3fyu h LYS 29 CO 0.11 0.25 -0.17 0.87 -2.27 0.00 0.00 179.45 178.25 3fyu h LYS 30 N -0.00 0.57 -0.41 1.90 1.57 -1.30 -1.49 116.57 117.41 3fyu h LYS 30 Ca 0.03 -0.19 -0.11 0.00 -1.87 0.00 0.00 60.65 58.51 3fyu h LYS 30 Cb 0.17 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 3fyu h LYS 30 CO -0.00 0.72 -0.19 0.77 -0.57 0.00 0.00 179.45 180.17 3fyu h SER 31 N 0.52 0.80 0.32 0.86 0.02 -0.90 -1.02 113.55 114.16 3fyu h SER 31 Ca 0.09 -0.28 -0.12 0.00 -0.84 0.00 0.00 61.79 60.64 3fyu h SER 31 Cb 0.59 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 3fyu h SER 31 CO 0.04 0.98 -0.50 -0.07 -1.14 0.00 0.00 176.83 176.14 3fyu h LEU 32 N 0.70 0.23 -0.42 5.07 3.38 -0.66 -2.30 115.31 121.31 3fyu h LEU 32 Ca 0.10 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3fyu h LEU 32 Cb 0.70 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3fyu h LEU 32 CO 0.05 0.70 -0.06 -0.08 0.09 0.00 0.00 178.44 179.14 3fyu h GLU 33 N 0.17 0.78 0.00 1.13 4.57 -0.76 -0.03 114.58 120.44 3fyu h GLU 33 Ca 0.01 -0.28 -0.07 0.00 -1.18 0.00 0.00 59.36 57.84 3fyu h GLU 33 Cb 0.95 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.47 3fyu h GLU 33 CO 0.08 0.89 -0.32 0.93 -1.18 0.00 0.00 179.01 179.40 3fyu h GLU 34 N 0.61 0.00 -0.14 1.92 5.08 -1.07 -1.92 114.58 119.06 3fyu h GLU 34 Ca 0.11 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 3fyu h GLU 34 Cb 0.57 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 3fyu h GLU 34 CO 0.03 0.32 -0.05 1.25 -1.00 0.00 0.00 179.01 179.56 3fyu h LEU 35 N 0.00 0.28 -1.91 1.33 5.85 -0.92 -2.91 115.31 117.03 3fyu h LEU 35 Ca -0.00 -0.40 0.09 0.00 0.84 0.00 0.00 57.88 58.41 3fyu h LEU 35 Cb 0.60 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 3fyu h LEU 35 CO 0.04 0.61 0.26 -0.09 -0.34 0.00 0.00 178.44 178.93 3fyu h ARG 36 N -0.05 0.10 0.00 1.25 2.43 -0.49 -0.32 114.38 117.29 3fyu h ARG 36 Ca 0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3fyu h ARG 36 Cb 0.50 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3fyu h ARG 36 CO 0.02 0.07 0.00 1.04 -1.51 0.00 0.00 179.97 179.58 3fyu n GLN 37 N -4.45 0.64 -4.04 0.20 6.02 -0.77 -4.53 117.38 110.45 3fyu n GLN 37 Ca 0.06 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.71 3fyu n GLN 37 Cb 0.38 -1.36 -0.15 0.00 1.02 0.00 0.00 30.24 30.13 3fyu n GLN 37 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3fyu s VAL 38 N -2.00 2.42 0.17 5.09 1.01 -0.13 -5.09 120.40 121.87 3fyu s VAL 38 Ca 0.22 -1.26 -0.32 0.00 0.00 0.00 0.00 61.98 60.63 3fyu s VAL 38 Cb 0.10 -2.27 -0.10 0.00 0.00 0.00 0.00 36.38 34.11 3fyu s VAL 38 CO 0.17 0.18 1.62 -1.61 0.00 0.00 0.00 175.10 175.45 3fyu s GLU 39 N 1.23 4.19 0.18 2.72 0.41 -1.26 -4.86 118.70 121.31 3fyu s GLU 39 Ca -0.02 2.43 -0.13 0.00 -0.41 0.00 0.00 54.97 56.83 3fyu s GLU 39 Cb -0.17 -3.16 0.18 0.00 -1.78 0.00 0.00 34.13 29.20 3fyu s GLU 39 CO -0.07 -0.66 1.71 0.00 -0.49 0.00 0.00 175.26 175.75 3fyu h ALA 40 N 6.90 0.51 -6.75 5.21 0.00 -1.94 -3.38 119.26 119.81 3fyu h ALA 40 Ca -0.43 0.12 -0.55 0.00 0.00 0.00 0.00 54.91 54.05 3fyu h ALA 40 Cb 1.20 0.17 -0.17 0.00 0.00 0.00 0.00 17.79 18.99 3fyu h ALA 40 CO 0.93 -0.34 -0.87 0.39 0.00 0.00 0.00 179.25 179.35 3fyu n GLU 41 N -5.15 -2.73 -1.33 0.00 1.02 -1.26 0.51 120.64 111.70 3fyu n GLU 41 Ca 0.05 0.33 -0.35 0.00 -0.02 0.00 0.00 57.16 57.17 3fyu n GLU 41 Cb 0.25 -4.70 0.11 0.00 -0.02 0.00 0.00 31.44 27.08 3fyu n GLU 41 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3fyu s PRO 42 N -6.90 1.94 -0.00 3.49 0.04 -1.26 -4.59 135.00 127.73 3fyu s PRO 42 Ca 0.42 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3fyu s PRO 42 Cb -0.23 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.51 3fyu s PRO 42 CO 0.93 -2.01 -0.00 0.95 0.04 0.00 0.00 177.00 176.91 3fyu s THR 43 N -1.87 0.03 -0.07 1.26 -4.23 -0.28 -4.97 115.64 105.51 3fyu s THR 43 Ca 0.77 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 61.32 3fyu s THR 43 Cb -0.32 -0.04 -0.01 0.00 1.34 0.00 0.00 72.50 73.46 3fyu s THR 43 CO 0.47 0.02 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.59 3fyu s LEU 44 N 0.08 2.30 -0.07 4.79 2.01 -1.26 -1.84 118.68 124.68 3fyu s LEU 44 Ca -0.01 -0.42 -0.01 0.00 0.01 0.00 0.00 54.13 53.71 3fyu s LEU 44 Cb -0.01 -1.44 0.03 0.00 0.01 0.00 0.00 46.19 44.77 3fyu s LEU 44 CO -0.00 0.26 -0.02 -0.70 1.01 0.00 0.00 176.35 176.89 3fyu s GLU 45 N -0.22 0.83 0.46 1.70 2.12 -0.56 -4.95 118.70 118.09 3fyu s GLU 45 Ca -0.01 -0.01 -0.25 0.00 0.36 0.00 0.00 54.97 55.06 3fyu s GLU 45 Cb -0.13 -1.05 -0.08 0.00 0.26 0.00 0.00 34.13 33.12 3fyu s GLU 45 CO 0.03 -0.24 1.41 -1.13 -0.54 0.00 0.00 175.26 174.79 3fyu n SER 46 N 4.83 3.16 -3.81 -1.70 3.41 -1.26 -0.18 113.62 118.07 3fyu n SER 46 Ca -0.12 1.10 -0.26 0.00 -0.26 0.00 0.00 58.87 59.33 3fyu n SER 46 Cb 0.50 -1.59 -0.17 0.00 -0.26 0.00 0.00 64.21 62.69 3fyu n SER 46 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3fyu s TYR 47 N -1.21 1.13 0.34 7.33 5.04 0.58 -4.76 117.35 125.80 3fyu s TYR 47 Ca 0.63 -0.64 -0.29 0.00 -2.44 0.00 0.00 57.07 54.33 3fyu s TYR 47 Cb -0.45 -1.05 -0.11 0.00 0.35 0.00 0.00 41.96 40.70 3fyu s TYR 47 CO 0.56 -0.49 1.48 -0.51 -1.34 0.00 0.00 175.55 175.25 3fyu s ASP 48 N 1.82 6.43 -0.20 4.32 1.01 -1.26 -4.31 116.67 124.48 3fyu s ASP 48 Ca 0.03 2.95 -0.13 0.00 0.71 0.00 0.00 52.55 56.10 3fyu s ASP 48 Cb -0.14 -2.65 0.06 0.00 1.01 0.00 0.00 42.92 41.20 3fyu s ASP 48 CO -0.07 -0.82 0.51 -0.47 0.21 0.00 0.00 175.17 174.53 3fyu s TYR 49 N -0.79 -0.71 -0.54 4.23 6.14 -1.26 -5.07 117.35 119.35 3fyu s TYR 49 Ca 0.55 1.52 -0.16 0.00 0.64 0.00 0.00 57.07 59.62 3fyu s TYR 49 Cb -0.45 0.34 -0.15 0.00 0.42 0.00 0.00 41.96 42.12 3fyu s TYR 49 CO 0.57 -0.37 1.76 -0.35 0.64 0.00 0.00 175.55 177.80 3fyu n PRO 50 N 3.93 1.12 -3.90 4.97 -0.04 -1.26 -4.79 135.00 135.03 3fyu n PRO 50 Ca -0.20 -1.37 -0.11 0.00 -0.04 0.00 0.00 63.50 61.78 3fyu n PRO 50 Cb 0.56 -2.57 -0.11 0.00 -0.04 0.00 0.00 33.50 31.34 3fyu n PRO 50 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3fyu s VAL 51 N 4.98 0.07 -0.08 0.52 0.11 -1.26 -5.15 120.40 119.58 3fyu s VAL 51 Ca 0.46 -0.55 -0.00 0.00 -2.93 0.00 0.00 61.98 58.96 3fyu s VAL 51 Cb 0.11 -0.26 -0.03 0.00 -1.53 0.00 0.00 36.38 34.67 3fyu s VAL 51 CO 0.11 -0.30 -0.05 -0.75 -3.33 0.00 0.00 175.10 170.77 3fyu s LYS 52 N -0.94 2.93 0.00 1.54 2.20 -1.26 -4.51 119.74 119.69 3fyu s LYS 52 Ca -0.10 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 54.98 3fyu s LYS 52 Cb -0.06 -2.67 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 3fyu s LYS 52 CO 0.00 0.60 0.00 0.41 -0.36 0.00 0.00 175.35 176.01 3fyu n GLY 53 N 2.41 0.72 3.00 5.54 0.00 -1.26 -5.03 105.19 110.58 3fyu n GLY 53 Ca -0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 3fyu n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fyu s VAL 54 N -2.20 0.00 -0.17 1.61 1.01 -1.26 -0.07 120.40 119.32 3fyu s VAL 54 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 3fyu s VAL 54 Cb 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 3fyu s VAL 54 CO 0.00 -0.01 0.01 -0.54 0.00 0.00 0.00 175.10 174.57 3fyu s LYS 55 N 0.04 3.80 -0.08 2.72 -0.14 0.05 -4.82 119.74 121.31 3fyu s LYS 55 Ca -0.00 -0.44 0.01 0.00 -1.36 0.00 0.00 55.97 54.18 3fyu s LYS 55 Cb -0.01 -3.07 -0.03 0.00 -1.68 0.00 0.00 37.83 33.04 3fyu s LYS 55 CO 0.00 0.22 -0.11 0.08 -0.76 0.00 0.00 175.35 174.79 3fyu s VAL 56 N 0.46 3.35 0.16 3.17 1.01 -1.26 -0.01 120.40 127.28 3fyu s VAL 56 Ca -0.00 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.41 3fyu s VAL 56 Cb -0.13 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 3fyu s VAL 56 CO 0.02 0.57 -0.04 -0.31 0.00 0.00 0.00 175.10 175.34 3fyu s TYR 57 N -0.44 1.25 -0.26 5.22 1.51 0.28 -0.31 117.35 124.60 3fyu s TYR 57 Ca 0.06 -0.90 -0.07 0.00 -1.01 0.00 0.00 57.07 55.14 3fyu s TYR 57 Cb -0.12 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.01 3fyu s TYR 57 CO 0.02 -0.07 0.08 0.50 -1.11 0.00 0.00 175.55 174.97 3fyu s ARG 58 N -3.84 3.58 -0.08 -0.62 3.52 0.74 0.59 118.95 122.85 3fyu s ARG 58 Ca 0.21 -0.53 0.01 0.00 -0.13 0.00 0.00 55.73 55.28 3fyu s ARG 58 Cb 0.05 -3.35 -0.03 0.00 -1.56 0.00 0.00 34.95 30.06 3fyu s ARG 58 CO 0.02 -0.23 -0.07 -1.17 -0.81 0.00 0.00 175.30 173.04 3fyu s LEU 59 N 1.61 3.14 0.09 -0.88 2.96 -0.15 -1.50 118.68 123.93 3fyu s LEU 59 Ca 0.06 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.93 3fyu s LEU 59 Cb -0.15 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 3fyu s LEU 59 CO 0.04 0.34 -0.06 0.42 -1.32 0.00 0.00 176.35 175.77 3fyu s THR 60 N -0.66 0.59 -0.02 3.68 -4.23 -0.77 -2.22 115.64 112.01 3fyu s THR 60 Ca 0.10 -1.88 -0.29 0.00 -1.18 0.00 0.00 61.69 58.44 3fyu s THR 60 Cb -0.11 -1.62 0.10 0.00 1.34 0.00 0.00 72.50 72.21 3fyu s THR 60 CO 0.02 -0.89 0.87 -0.72 -0.54 0.00 0.00 174.62 173.36 3fyu s TYR 61 N -3.62 -0.39 0.05 3.99 1.13 -0.78 -1.12 117.35 116.60 3fyu s TYR 61 Ca 0.10 0.37 -0.20 0.00 -1.41 0.00 0.00 57.07 55.93 3fyu s TYR 61 Cb 0.05 0.51 -0.06 0.00 -1.10 0.00 0.00 41.96 41.36 3fyu s TYR 61 CO -0.06 -0.54 0.60 -0.65 -2.51 0.00 0.00 175.55 172.40 3fyu s GLN 62 N -2.63 4.28 0.00 -3.49 -1.52 0.18 -0.88 119.66 115.60 3fyu s GLN 62 Ca 0.02 0.78 0.00 0.00 -1.95 0.00 0.00 55.36 54.21 3fyu s GLN 62 Cb -0.01 -3.28 -0.00 0.00 -0.22 0.00 0.00 33.01 29.50 3fyu s GLN 62 CO -0.06 0.52 0.00 0.45 -0.25 0.00 0.00 175.29 175.95 3fyu n SER 63 N 2.14 0.57 -3.94 5.90 2.88 -0.06 -4.28 113.62 116.83 3fyu n SER 63 Ca -0.08 -1.01 -0.46 0.00 -1.33 0.00 0.00 58.87 55.99 3fyu n SER 63 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 3fyu n SER 63 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 3fyu n PHE 64 N -0.00 -0.15 -1.37 0.66 7.35 -1.26 -0.27 117.46 122.43 3fyu n PHE 64 Ca -0.00 0.89 -0.13 0.00 -0.76 0.00 0.00 57.45 57.45 3fyu n PHE 64 Cb 0.00 -1.78 -0.05 0.00 0.35 0.00 0.00 39.48 38.00 3fyu n PHE 64 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3fyu n GLY 65 N 1.65 1.31 3.40 7.13 0.00 -1.26 -2.64 105.19 114.79 3fyu n GLY 65 Ca 0.17 -0.27 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 3fyu n GLY 65 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fyu n HIS 66 N -2.53 -2.45 -3.20 1.61 8.25 0.63 -4.73 115.22 112.81 3fyu n HIS 66 Ca -0.13 0.80 -0.39 0.00 -0.26 0.00 0.00 57.72 57.75 3fyu n HIS 66 Cb 0.47 -4.66 -0.06 0.00 1.12 0.00 0.00 29.99 26.86 3fyu n HIS 66 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3fyu s SER 67 N -3.06 7.01 -0.64 0.41 0.01 -0.93 -4.80 113.70 111.69 3fyu s SER 67 Ca 0.48 1.20 -0.25 0.00 1.31 0.00 0.00 55.95 58.69 3fyu s SER 67 Cb -0.22 -2.37 0.04 0.00 0.21 0.00 0.00 66.02 63.69 3fyu s SER 67 CO 0.60 0.13 1.08 -0.75 0.41 0.00 0.00 173.24 174.71 3fyu s LYS 68 N -0.37 3.25 0.16 12.44 2.47 -1.26 -0.88 119.74 135.55 3fyu s LYS 68 Ca 0.31 -0.35 -0.17 0.00 -1.56 0.00 0.00 55.97 54.21 3fyu s LYS 68 Cb -0.19 -4.13 -0.07 0.00 -1.46 0.00 0.00 37.83 31.98 3fyu s LYS 68 CO 0.18 -1.80 0.61 0.42 0.16 0.00 0.00 175.35 174.92 3fyu s ILE 69 N 4.63 4.75 0.41 5.43 -1.09 -0.06 -1.10 121.20 134.16 3fyu s ILE 69 Ca 0.31 1.03 0.04 0.00 -2.23 0.00 0.00 60.65 59.80 3fyu s ILE 69 Cb -0.12 -3.80 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 3fyu s ILE 69 CO 0.16 0.28 0.13 -1.61 -1.23 0.00 0.00 174.94 172.66 3fyu s GLU 70 N -1.85 1.92 0.00 2.79 2.02 -1.26 -1.87 118.70 120.46 3fyu s GLU 70 Ca 0.38 -2.17 0.00 0.00 0.02 0.00 0.00 54.97 53.20 3fyu s GLU 70 Cb -0.16 -0.63 0.00 0.00 0.10 0.00 0.00 34.13 33.44 3fyu s GLU 70 CO 0.20 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.42 3fyu n GLY 71 N -0.91 3.35 3.79 -1.39 0.00 -0.94 -0.65 105.19 108.44 3fyu n GLY 71 Ca -0.06 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 3fyu n GLY 71 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fyu s PHE 72 N -2.00 3.78 -0.21 1.61 0.40 -1.23 -0.98 117.98 119.35 3fyu s PHE 72 Ca 0.00 1.57 0.01 0.00 -0.60 0.00 0.00 56.93 57.91 3fyu s PHE 72 Cb 0.00 -2.74 0.05 0.00 0.51 0.00 0.00 43.02 40.84 3fyu s PHE 72 CO 0.00 0.40 -0.10 -0.47 0.70 0.00 0.00 175.22 175.76 3fyu s TYR 73 N -1.36 2.45 -0.13 0.36 5.04 0.20 -1.22 117.35 122.68 3fyu s TYR 73 Ca 0.41 -1.64 -0.01 0.00 -2.44 0.00 0.00 57.07 53.38 3fyu s TYR 73 Cb -0.20 -1.64 -0.02 0.00 0.35 0.00 0.00 41.96 40.44 3fyu s TYR 73 CO 0.24 -0.75 -0.09 0.00 -1.34 0.00 0.00 175.55 173.61 3fyu s ALA 74 N 1.38 2.82 -0.03 3.97 0.00 -0.04 0.99 121.76 130.86 3fyu s ALA 74 Ca -0.02 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.14 3fyu s ALA 74 Cb -0.17 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 3fyu s ALA 74 CO -0.08 0.28 -0.22 0.08 0.00 0.00 0.00 175.76 175.82 3fyu s VAL 75 N 0.20 1.79 0.21 0.00 1.01 0.99 -0.28 120.40 124.31 3fyu s VAL 75 Ca -0.05 -0.95 -0.32 0.00 0.00 0.00 0.00 61.98 60.66 3fyu s VAL 75 Cb -0.14 -1.50 -0.13 0.00 0.00 0.00 0.00 36.38 34.61 3fyu s VAL 75 CO 0.04 0.50 1.65 -2.65 0.00 0.00 0.00 175.10 174.65 3fyu n PRO 76 N 2.70 2.55 -1.90 2.72 -0.02 -1.26 -0.77 135.00 139.02 3fyu n PRO 76 Ca -0.16 0.92 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 3fyu n PRO 76 Cb 0.52 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 3fyu n PRO 76 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3fyu n ASP 77 N 3.53 4.18 -3.68 2.55 2.03 0.90 -4.76 116.55 121.30 3fyu n ASP 77 Ca 0.15 -2.90 -0.08 0.00 0.52 0.00 0.00 54.79 52.48 3fyu n ASP 77 Cb 0.33 -1.63 -0.02 0.00 -0.72 0.00 0.00 41.12 39.09 3fyu n ASP 77 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fyu s GLN 78 N 2.65 1.43 0.28 -0.67 -2.07 -1.26 -4.83 119.66 115.19 3fyu s GLN 78 Ca 0.46 -0.71 -0.30 0.00 -1.82 0.00 0.00 55.36 52.99 3fyu s GLN 78 Cb 0.12 0.54 -0.11 0.00 -1.09 0.00 0.00 33.01 32.48 3fyu s GLN 78 CO -0.06 -0.65 1.50 0.95 -1.32 0.00 0.00 175.29 175.72 3fyu s THR 79 N -3.66 2.35 0.00 3.63 -4.23 -1.26 -5.02 115.64 107.44 3fyu s THR 79 Ca 0.08 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 3fyu s THR 79 Cb -0.03 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.62 3fyu s THR 79 CO -0.01 0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 3fyu n GLY 80 N 1.94 1.18 3.76 3.99 0.00 -1.26 -4.87 105.19 109.93 3fyu n GLY 80 Ca 0.06 -1.81 -0.34 0.00 0.00 0.00 0.00 46.02 43.94 3fyu n GLY 80 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fyu s PRO 81 N 2.11 2.86 0.17 1.61 0.02 -1.26 -5.11 135.00 135.39 3fyu s PRO 81 Ca 0.00 1.50 0.08 0.00 0.02 0.00 0.00 61.00 62.60 3fyu s PRO 81 Cb 0.00 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 3fyu s PRO 81 CO 0.00 -1.22 -0.05 -1.01 -0.33 0.00 0.00 177.00 174.38 3fyu s HIS 82 N -2.13 2.74 0.54 6.54 3.76 0.46 -4.73 115.29 122.47 3fyu s HIS 82 Ca 0.70 -0.18 -0.18 0.00 -0.15 0.00 0.00 55.06 55.25 3fyu s HIS 82 Cb -0.23 -1.34 -0.06 0.00 1.11 0.00 0.00 32.58 32.06 3fyu s HIS 82 CO 0.38 0.51 1.06 -1.25 -0.85 0.00 0.00 174.74 174.58 3fyu s PRO 83 N -2.82 3.54 0.22 8.40 0.04 -1.26 -0.74 135.00 142.39 3fyu s PRO 83 Ca 0.26 1.32 0.09 0.00 0.04 0.00 0.00 61.00 62.70 3fyu s PRO 83 Cb -0.09 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 3fyu s PRO 83 CO 0.17 -0.64 -0.16 0.00 0.04 0.00 0.00 177.00 176.41 3fyu s ALA 84 N -2.17 2.18 -0.01 8.56 0.00 0.78 -1.09 121.76 130.01 3fyu s ALA 84 Ca 0.66 -1.71 0.00 0.00 0.00 0.00 0.00 51.96 50.91 3fyu s ALA 84 Cb -0.17 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 22.85 3fyu s ALA 84 CO 0.28 0.11 0.01 -0.51 0.00 0.00 0.00 175.76 175.66 3fyu s LEU 85 N -3.36 1.43 -0.32 0.00 1.43 0.04 0.59 118.68 118.48 3fyu s LEU 85 Ca 0.24 0.01 -0.06 0.00 -1.03 0.00 0.00 54.13 53.30 3fyu s LEU 85 Cb -0.02 -0.07 0.03 0.00 0.03 0.00 0.00 46.19 46.16 3fyu s LEU 85 CO 0.09 -0.08 0.07 -0.69 0.23 0.00 0.00 176.35 175.98 3fyu s VAL 86 N 0.67 3.65 -0.18 -1.59 1.01 0.15 -0.78 120.40 123.33 3fyu s VAL 86 Ca -0.06 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.73 3fyu s VAL 86 Cb -0.08 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 3fyu s VAL 86 CO -0.02 -0.09 0.20 -0.60 0.00 0.00 0.00 175.10 174.59 3fyu s ARG 87 N 1.40 4.21 -0.18 2.72 3.52 0.61 -2.08 118.95 129.16 3fyu s ARG 87 Ca -0.01 -0.08 -0.04 0.00 -0.13 0.00 0.00 55.73 55.46 3fyu s ARG 87 Cb -0.19 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.76 3fyu s ARG 87 CO 0.02 0.28 -0.02 -0.06 -0.81 0.00 0.00 175.30 174.70 3fyu s PHE 88 N 0.39 3.02 0.70 5.12 0.40 -0.11 -2.53 117.98 124.98 3fyu s PHE 88 Ca 0.12 -0.41 -0.11 0.00 -0.60 0.00 0.00 56.93 55.93 3fyu s PHE 88 Cb -0.12 -2.02 0.01 0.00 0.51 0.00 0.00 43.02 41.40 3fyu s PHE 88 CO 0.01 -0.16 1.09 -3.38 0.70 0.00 0.00 175.22 173.48 3fyu s HIS 89 N 0.70 3.33 0.73 0.36 -3.43 -1.26 -3.65 115.29 112.07 3fyu s HIS 89 Ca -0.01 1.04 -0.11 0.00 -0.80 0.00 0.00 55.06 55.17 3fyu s HIS 89 Cb -0.14 -3.05 0.03 0.00 -1.43 0.00 0.00 32.58 27.99 3fyu s HIS 89 CO 0.02 -1.15 1.09 0.20 -2.00 0.00 0.00 174.74 172.90 3fyu s GLY 90 N -4.35 1.63 -0.26 -1.38 0.00 -1.26 -2.52 107.32 99.18 3fyu s GLY 90 Ca 0.58 -0.25 -0.36 0.00 0.00 0.00 0.00 44.72 44.69 3fyu s GLY 90 CO 0.52 0.12 2.00 2.98 0.00 0.00 0.00 173.10 178.72 3fyu n TYR 91 N -3.12 1.93 -1.27 1.90 9.36 -1.26 -1.10 117.16 123.59 3fyu n TYR 91 Ca 0.07 0.25 -0.11 0.00 3.32 0.00 0.00 57.90 61.42 3fyu n TYR 91 Cb 0.56 -2.56 -0.05 0.00 -0.63 0.00 0.00 39.34 36.67 3fyu n TYR 91 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 3fyu n ASN 92 N 7.93 -3.67 -1.73 2.98 5.15 -1.26 -4.80 115.26 119.86 3fyu n ASN 92 Ca 0.32 0.28 -0.06 0.00 -0.60 0.00 0.00 54.58 54.52 3fyu n ASN 92 Cb 0.23 -3.21 0.27 0.00 -0.53 0.00 0.00 39.78 36.53 3fyu n ASN 92 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fyu n ALA 93 N 0.58 4.45 -2.92 5.20 0.00 -0.26 -4.95 120.51 122.62 3fyu n ALA 93 Ca -0.11 -2.56 -0.37 0.00 0.00 0.00 0.00 53.44 50.40 3fyu n ALA 93 Cb 0.43 -1.11 -0.12 0.00 0.00 0.00 0.00 19.45 18.65 3fyu n ALA 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fyu s SER 94 N -1.46 5.40 -0.17 0.00 0.15 -1.26 -4.65 113.70 111.71 3fyu s SER 94 Ca 0.52 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 57.02 3fyu s SER 94 Cb 0.43 -1.98 -0.00 0.00 -1.71 0.00 0.00 66.02 62.75 3fyu s SER 94 CO 0.10 -0.03 -0.12 -0.31 1.20 0.00 0.00 173.24 174.08 3fyu s TYR 95 N 1.58 2.84 -1.62 3.44 1.51 -1.26 -4.69 117.35 119.15 3fyu s TYR 95 Ca 0.06 -0.98 -0.16 0.00 -1.01 0.00 0.00 57.07 54.98 3fyu s TYR 95 Cb -0.15 -1.94 0.12 0.00 -0.11 0.00 0.00 41.96 39.88 3fyu s TYR 95 CO 0.05 -0.47 0.90 -0.25 -1.11 0.00 0.00 175.55 174.68 3fyu n ASP 96 N 4.19 -4.12 -0.08 2.29 10.43 -1.26 -0.71 116.55 127.29 3fyu n ASP 96 Ca -0.19 -0.89 -0.01 0.00 2.57 0.00 0.00 54.79 56.27 3fyu n ASP 96 Cb 0.52 -3.36 -0.00 0.00 1.84 0.00 0.00 41.12 40.12 3fyu n ASP 96 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3fyu n GLY 97 N -1.55 0.23 2.61 0.44 0.00 -1.26 -2.73 105.19 102.92 3fyu n GLY 97 Ca 0.06 -0.02 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3fyu n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fyu n GLY 98 N -0.11 -0.50 0.28 -0.02 0.00 0.11 -4.67 105.19 100.28 3fyu n GLY 98 Ca -0.01 0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.08 3fyu n GLY 98 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fyu h ILE 99 N -0.31 0.78 -0.60 -0.61 2.10 -1.73 -2.06 117.51 115.09 3fyu h ILE 99 Ca -0.41 -0.20 -0.00 0.00 1.08 0.00 0.00 64.86 65.32 3fyu h ILE 99 Cb 1.30 0.15 -0.03 0.00 -1.09 0.00 0.00 36.82 37.15 3fyu h ILE 99 CO 0.48 0.11 0.37 0.45 -1.08 0.00 0.00 178.15 178.48 3fyu h HIS 100 N 0.59 0.77 0.02 2.19 3.86 -1.89 -0.75 115.15 119.94 3fyu h HIS 100 Ca 0.39 0.01 -0.22 0.00 -1.16 0.00 0.00 60.37 59.39 3fyu h HIS 100 Cb 0.49 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.70 3fyu h HIS 100 CO -0.11 0.51 -0.96 -0.44 0.86 0.00 0.00 177.93 177.79 3fyu h ASP 101 N 0.82 0.40 -0.05 2.45 3.32 -1.79 -2.41 116.42 119.16 3fyu h ASP 101 Ca 0.22 -0.34 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3fyu h ASP 101 Cb -0.05 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 3fyu h ASP 101 CO -0.04 1.16 0.02 0.40 -1.72 0.00 0.00 179.24 179.06 3fyu h ILE 102 N 0.16 1.10 -0.33 0.35 1.08 -0.79 -1.34 117.51 117.73 3fyu h ILE 102 Ca -0.07 -0.30 0.03 0.00 -0.39 0.00 0.00 64.86 64.13 3fyu h ILE 102 Cb 1.60 1.22 -0.03 0.00 -3.07 0.00 0.00 36.82 36.54 3fyu h ILE 102 CO 0.16 0.08 0.15 0.58 -0.69 0.00 0.00 178.15 178.43 3fyu h VAL 103 N -0.04 0.96 -1.00 1.67 2.07 -1.19 -1.90 116.25 116.83 3fyu h VAL 103 Ca 0.02 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.51 3fyu h VAL 103 Cb 0.12 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 30.43 3fyu h VAL 103 CO -0.00 0.06 0.64 0.78 0.02 0.00 0.00 177.57 179.07 3fyu h ASN 104 N 0.32 0.99 -0.65 0.57 2.35 -1.22 0.53 115.58 118.46 3fyu h ASN 104 Ca 0.14 0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 3fyu h ASN 104 Cb 0.08 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 3fyu h ASN 104 CO -0.12 0.59 0.31 -0.50 -1.65 0.00 0.00 177.43 176.07 3fyu h TRP 105 N 1.10 0.96 -0.62 1.19 4.06 -0.50 -1.56 115.95 120.58 3fyu h TRP 105 Ca 0.45 -0.04 -0.08 0.00 2.06 0.00 0.00 58.89 61.29 3fyu h TRP 105 Cb 0.29 -0.30 -0.02 0.00 -1.00 0.00 0.00 29.16 28.13 3fyu h TRP 105 CO -0.00 0.71 0.09 0.00 -3.56 0.00 0.00 178.44 175.68 3fyu h ALA 106 N 1.38 0.83 0.00 1.49 0.00 -0.28 -1.60 119.26 121.08 3fyu h ALA 106 Ca 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3fyu h ALA 106 Cb 0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3fyu h ALA 106 CO -0.03 0.60 -0.04 -0.07 0.00 0.00 0.00 179.25 179.70 3fyu h LEU 107 N 0.95 0.00 -0.14 0.00 3.38 -0.33 0.55 115.31 119.72 3fyu h LEU 107 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3fyu h LEU 107 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3fyu h LEU 107 CO 0.01 0.04 0.00 1.41 0.09 0.00 0.00 178.44 180.00 3fyu n HIS 108 N -4.00 0.01 -0.18 1.13 8.25 -0.65 -4.88 115.22 114.91 3fyu n HIS 108 Ca -0.03 -0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 3fyu n HIS 108 Cb 0.13 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.24 3fyu n HIS 108 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fyu n GLY 109 N 0.96 0.90 3.25 -1.41 0.00 0.19 -5.08 105.19 104.00 3fyu n GLY 109 Ca 0.20 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3fyu n GLY 109 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fyu s TYR 110 N -2.00 2.69 -0.26 1.61 2.02 -0.91 -4.27 117.35 116.23 3fyu s TYR 110 Ca 0.00 -1.02 -0.29 0.00 -0.37 0.00 0.00 57.07 55.39 3fyu s TYR 110 Cb 0.00 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 3fyu s TYR 110 CO 0.00 -0.43 1.58 0.00 -1.57 0.00 0.00 175.55 175.13 3fyu s ALA 111 N 0.55 3.22 -0.09 3.71 0.00 -0.25 -3.22 121.76 125.68 3fyu s ALA 111 Ca -0.12 0.35 0.04 0.00 0.00 0.00 0.00 51.96 52.23 3fyu s ALA 111 Cb -0.16 -3.87 -0.00 0.00 0.00 0.00 0.00 23.12 19.09 3fyu s ALA 111 CO 0.04 -2.04 -0.23 0.99 0.00 0.00 0.00 175.76 174.52 3fyu s THR 112 N 5.29 2.17 -0.20 0.00 2.01 0.61 -0.78 115.64 124.74 3fyu s THR 112 Ca 0.69 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 3fyu s THR 112 Cb -0.23 -1.82 -0.00 0.00 0.01 0.00 0.00 72.50 70.46 3fyu s THR 112 CO 0.29 0.56 -0.09 0.12 -0.69 0.00 0.00 174.62 174.82 3fyu s PHE 113 N 0.22 2.90 -0.84 4.92 5.36 0.04 -0.86 117.98 129.73 3fyu s PHE 113 Ca -0.15 -1.02 -0.14 0.00 -0.96 0.00 0.00 56.93 54.66 3fyu s PHE 113 Cb -0.17 -2.03 0.21 0.00 -0.34 0.00 0.00 43.02 40.69 3fyu s PHE 113 CO 0.07 -0.54 0.80 0.20 -1.46 0.00 0.00 175.22 174.29 3fyu s GLY 114 N 1.27 2.61 0.07 13.12 0.00 -0.36 -0.28 107.32 123.75 3fyu s GLY 114 Ca 0.03 -3.28 -0.31 0.00 0.00 0.00 0.00 44.72 41.16 3fyu s GLY 114 CO -0.04 1.32 1.57 -0.29 0.00 0.00 0.00 173.10 175.66 3fyu s MET 115 N 0.36 4.23 -0.19 2.90 1.75 -1.05 -3.51 119.30 123.79 3fyu s MET 115 Ca 0.19 2.24 -0.22 0.00 -1.25 0.00 0.00 55.69 56.65 3fyu s MET 115 Cb -0.10 -3.50 -0.02 0.00 2.84 0.00 0.00 34.83 34.05 3fyu s MET 115 CO -0.09 -0.66 0.69 -0.51 -0.65 0.00 0.00 175.02 173.80 3fyu s LEU 116 N 2.25 4.16 0.00 4.11 1.43 0.17 -4.34 118.68 126.46 3fyu s LEU 116 Ca 0.71 0.95 -0.30 0.00 -1.03 0.00 0.00 54.13 54.45 3fyu s LEU 116 Cb -0.38 -3.00 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 3fyu s LEU 116 CO 0.31 -0.31 1.40 -0.69 0.23 0.00 0.00 176.35 177.29 3fyu s VAL 117 N 1.95 3.71 -0.11 -1.59 1.01 -1.26 -4.40 120.40 119.71 3fyu s VAL 117 Ca 0.32 1.10 -0.13 0.00 0.00 0.00 0.00 61.98 63.27 3fyu s VAL 117 Cb -0.16 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 3fyu s VAL 117 CO 0.11 0.00 0.42 0.54 0.00 0.00 0.00 175.10 176.17 3fyu n ARG 118 N 5.31 0.00 -0.30 2.72 1.74 -1.24 -0.18 116.66 124.71 3fyu n ARG 118 Ca 0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 3fyu n ARG 118 Cb 0.44 -0.43 0.00 0.00 -1.02 0.00 0.00 32.46 31.45 3fyu n ARG 118 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fyu n GLY 119 N 0.98 0.62 0.00 -0.13 0.00 -1.02 -4.82 105.19 100.81 3fyu n GLY 119 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3fyu n GLY 119 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fyu n GLN 120 N -2.00 0.00 0.16 1.61 6.02 0.75 -4.76 117.38 119.17 3fyu n GLN 120 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.12 3fyu n GLN 120 Cb 0.00 0.00 0.44 0.00 1.02 0.00 0.00 30.24 31.70 3fyu n GLN 120 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 3fyu h GLY 121 N 0.00 0.00 0.00 1.08 0.00 -1.84 -3.48 103.07 98.83 3fyu h GLY 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fyu h GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3fyu n GLY 122 N 0.65 -0.54 0.74 4.60 0.00 -1.26 -4.54 105.19 104.84 3fyu n GLY 122 Ca 0.03 -1.06 0.01 0.00 0.00 0.00 0.00 46.02 45.00 3fyu n GLY 122 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3fyu n SER 123 N 0.14 -3.99 -4.87 1.61 7.64 -1.26 -2.45 113.62 110.44 3fyu n SER 123 Ca 0.00 0.88 -0.33 0.00 1.01 0.00 0.00 58.87 60.43 3fyu n SER 123 Cb 0.00 -1.93 -0.05 0.00 -1.01 0.00 0.00 64.21 61.22 3fyu n SER 123 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3fyu s GLU 124 N -4.59 3.81 -0.31 1.43 2.12 -0.26 -2.60 118.70 118.31 3fyu s GLU 124 Ca 0.00 0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.60 3fyu s GLU 124 Cb 0.00 -2.78 0.10 0.00 0.26 0.00 0.00 34.13 31.71 3fyu s GLU 124 CO 0.00 0.40 0.08 0.34 -0.54 0.00 0.00 175.26 175.54 3fyu s ASP 125 N -2.15 4.13 0.20 -1.70 -1.08 -1.26 -4.44 116.67 110.37 3fyu s ASP 125 Ca 0.43 -1.68 0.26 0.00 -0.52 0.00 0.00 52.55 51.03 3fyu s ASP 125 Cb -0.12 -1.03 0.83 0.00 -1.46 0.00 0.00 42.92 41.14 3fyu s ASP 125 CO 0.21 -0.39 1.78 0.35 0.52 0.00 0.00 175.17 177.63 3fyu n THR 126 N 4.72 0.59 -1.76 1.71 -2.24 -1.26 -4.85 114.28 111.18 3fyu n THR 126 Ca -0.02 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 3fyu n THR 126 Cb 0.42 -0.60 -0.02 0.00 -2.10 0.00 0.00 70.33 68.03 3fyu n THR 126 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fyu s SER 127 N -4.47 6.37 0.69 3.42 1.04 -1.26 -4.98 113.70 114.51 3fyu s SER 127 Ca 0.11 2.94 -0.11 0.00 0.48 0.00 0.00 55.95 59.37 3fyu s SER 127 Cb 0.12 -2.63 0.01 0.00 0.10 0.00 0.00 66.02 63.62 3fyu s SER 127 CO 0.59 -0.93 1.06 -0.69 0.98 0.00 0.00 173.24 174.24 3fyu s VAL 128 N 0.25 4.05 -0.54 5.02 1.01 -1.26 -5.02 120.40 123.93 3fyu s VAL 128 Ca 0.66 0.67 -0.17 0.00 0.00 0.00 0.00 61.98 63.14 3fyu s VAL 128 Cb -0.48 -3.42 0.11 0.00 0.00 0.00 0.00 36.38 32.59 3fyu s VAL 128 CO 0.45 -0.87 0.53 -0.89 0.00 0.00 0.00 175.10 174.31 3fyu s THR 129 N -3.05 5.12 0.23 3.92 2.01 -1.26 -4.84 115.64 117.78 3fyu s THR 129 Ca 0.58 -1.27 -0.08 0.00 0.31 0.00 0.00 61.69 61.23 3fyu s THR 129 Cb -0.14 -4.33 0.23 0.00 0.01 0.00 0.00 72.50 68.28 3fyu s THR 129 CO 0.55 -0.86 1.66 -0.65 -0.69 0.00 0.00 174.62 174.63 3fyu h PRO 130 N 8.93 0.15 0.00 4.92 0.11 -1.95 -3.47 132.00 140.69 3fyu h PRO 130 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3fyu h PRO 130 Cb 1.10 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3fyu h PRO 130 CO 1.02 0.10 0.00 0.41 -0.21 0.00 0.00 178.00 179.32 3fyu n GLY 131 N -1.38 2.71 3.76 -0.55 0.00 -1.26 -5.11 105.19 103.36 3fyu n GLY 131 Ca 0.12 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 3fyu n GLY 131 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fyu s GLY 132 N -0.13 2.57 0.23 -0.02 0.00 -1.26 -4.81 107.32 103.90 3fyu s GLY 132 Ca 0.00 0.87 -0.20 0.00 0.00 0.00 0.00 44.72 45.39 3fyu s GLY 132 CO 0.00 1.25 0.62 -2.38 0.00 0.00 0.00 173.10 172.59 3fyu s HIS 133 N -1.81 -0.18 0.56 1.90 -0.00 -1.26 -4.88 115.29 109.62 3fyu s HIS 133 Ca 0.74 -0.20 -0.18 0.00 -0.00 0.00 0.00 55.06 55.43 3fyu s HIS 133 Cb -0.27 0.54 -0.05 0.00 -0.00 0.00 0.00 32.58 32.80 3fyu s HIS 133 CO 0.34 -1.05 1.07 0.00 -0.00 0.00 0.00 174.74 175.10 3fyu s ALA 134 N -3.89 2.75 -0.25 -1.38 0.00 -1.26 -4.90 121.76 112.83 3fyu s ALA 134 Ca 0.10 0.55 -0.39 0.00 0.00 0.00 0.00 51.96 52.22 3fyu s ALA 134 Cb -0.03 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.67 3fyu s ALA 134 CO 0.01 -0.68 1.76 -0.11 0.00 0.00 0.00 175.76 176.74 3fyu n LEU 135 N -1.59 2.54 0.00 0.00 0.00 -1.26 -4.65 117.00 112.03 3fyu n LEU 135 Ca 0.10 1.06 0.00 0.00 0.00 0.00 0.00 56.01 57.17 3fyu n LEU 135 Cb 0.52 -1.17 0.00 0.00 0.00 0.00 0.00 43.42 42.77 3fyu n LEU 135 CO 0.44 -0.38 0.00 0.61 0.00 0.00 0.00 177.39 178.06 3fyu n GLY 136 N 4.21 0.70 0.06 -3.96 0.00 -1.26 -4.89 105.19 100.05 3fyu n GLY 136 Ca 0.26 -2.16 -0.01 0.00 0.00 0.00 0.00 46.02 44.11 3fyu n GLY 136 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3fyu n TRP 137 N 1.42 0.04 -0.38 1.61 8.01 -1.26 -4.52 117.44 122.36 3fyu n TRP 137 Ca 0.00 0.01 0.33 0.00 -1.31 0.00 0.00 57.50 56.53 3fyu n TRP 137 Cb 0.00 -0.79 0.65 0.00 -2.01 0.00 0.00 31.31 29.16 3fyu n TRP 137 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.69 177.20 3fyu h MET 138 N 0.00 0.15 -0.16 -0.99 2.86 -1.90 -1.88 114.93 113.00 3fyu h MET 138 Ca -0.30 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 3fyu h MET 138 Cb 1.69 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 33.32 3fyu h MET 138 CO 0.02 0.10 0.00 0.25 1.06 0.00 0.00 176.91 178.34 3fyu n THR 139 N -4.42 0.80 -1.88 2.22 -2.24 -1.26 -4.88 114.28 102.62 3fyu n THR 139 Ca 0.29 -0.90 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 3fyu n THR 139 Cb 1.22 0.62 -0.03 0.00 -2.10 0.00 0.00 70.33 70.05 3fyu n THR 139 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3fyu s LYS 140 N -0.91 4.17 -1.68 -0.78 2.20 -0.71 -1.95 119.74 120.09 3fyu s LYS 140 Ca 0.12 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.10 3fyu s LYS 140 Cb 0.07 -3.90 0.00 0.00 -1.51 0.00 0.00 37.83 32.48 3fyu s LYS 140 CO 0.09 -0.84 0.00 0.41 -0.36 0.00 0.00 175.35 174.64 3fyu n GLY 141 N 4.21 -0.01 0.00 5.54 0.00 -1.26 -1.96 105.19 111.70 3fyu n GLY 141 Ca 0.18 -0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.17 3fyu n GLY 141 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3fyu n ILE 142 N -3.74 0.75 1.33 -0.61 3.06 -0.82 -2.29 119.36 117.03 3fyu n ILE 142 Ca -0.22 0.19 0.03 0.00 -2.50 0.00 0.00 62.75 60.25 3fyu n ILE 142 Cb 0.66 -0.95 0.09 0.00 0.54 0.00 0.00 39.64 39.99 3fyu n ILE 142 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 3fyu n LEU 143 N -1.36 1.13 -3.64 9.51 4.77 -1.26 -4.29 117.00 121.86 3fyu n LEU 143 Ca 0.06 -0.56 -0.03 0.00 -0.03 0.00 0.00 56.01 55.44 3fyu n LEU 143 Cb 0.13 -0.14 -0.07 0.00 -2.33 0.00 0.00 43.42 41.01 3fyu n LEU 143 CO 0.12 0.28 0.60 -0.55 -1.33 0.00 0.00 177.39 176.50 3fyu s SER 144 N -1.00 -0.62 0.53 -1.43 0.15 -1.15 -4.94 113.70 105.25 3fyu s SER 144 Ca 0.14 0.99 0.21 0.00 0.70 0.00 0.00 55.95 57.99 3fyu s SER 144 Cb 0.07 1.25 1.38 0.00 -1.71 0.00 0.00 66.02 67.02 3fyu s SER 144 CO 0.10 -0.16 2.09 0.07 1.20 0.00 0.00 173.24 176.54 3fyu h LYS 145 N 6.30 0.00 0.00 5.44 2.10 -1.85 -0.13 116.57 128.42 3fyu h LYS 145 Ca -0.29 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.25 3fyu h LYS 145 Cb 1.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 3fyu h LYS 145 CO 0.19 0.00 -0.56 -0.44 -2.00 0.00 0.00 179.45 176.64 3fyu h ASP 146 N 0.00 0.00 0.00 7.07 3.32 -1.95 -3.27 116.42 121.58 3fyu h ASP 146 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3fyu h ASP 146 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3fyu h ASP 146 CO -0.00 0.56 -1.32 0.35 -1.72 0.00 0.00 179.24 177.11 3fyu n THR 147 N -3.60 0.00 -1.66 0.35 -2.24 -0.58 -4.98 114.28 101.58 3fyu n THR 147 Ca -0.00 -0.19 -0.46 0.00 -2.27 0.00 0.00 64.05 61.13 3fyu n THR 147 Cb 0.63 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 3fyu n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fyu n TYR 148 N -1.75 2.15 -0.30 4.78 9.36 -0.17 -4.49 117.16 126.75 3fyu n TYR 148 Ca 0.01 0.39 0.10 0.00 3.32 0.00 0.00 57.90 61.72 3fyu n TYR 148 Cb 0.40 -2.48 0.22 0.00 -0.63 0.00 0.00 39.34 36.85 3fyu n TYR 148 CO 0.00 0.00 0.00 -0.92 0.22 0.00 0.00 176.86 176.16 3fyu h TYR 149 N 4.78 -0.03 0.00 2.98 3.20 -1.65 -0.76 116.97 125.49 3fyu h TYR 149 Ca -0.45 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.48 3fyu h TYR 149 Cb 1.27 0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.69 3fyu h TYR 149 CO 0.59 -0.32 0.00 0.66 -1.64 0.00 0.00 178.16 177.45 3fyu n TYR 150 N -5.40 0.17 -0.01 -3.82 4.01 -1.26 -3.14 117.16 107.70 3fyu n TYR 150 Ca 0.18 0.06 -0.12 0.00 -0.16 0.00 0.00 57.90 57.87 3fyu n TYR 150 Cb 0.60 -0.60 -0.07 0.00 -0.31 0.00 0.00 39.34 38.96 3fyu n TYR 150 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3fyu h ARG 151 N 0.00 0.12 -0.59 -0.72 2.43 -1.44 0.14 114.38 114.32 3fyu h ARG 151 Ca 0.00 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 3fyu h ARG 151 Cb 0.33 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3fyu h ARG 151 CO 0.00 0.31 0.01 0.78 -1.51 0.00 0.00 179.97 179.56 3fyu h GLY 152 N -0.08 1.10 0.87 2.80 0.00 -1.68 -2.17 103.07 103.90 3fyu h GLY 152 Ca 0.02 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.56 3fyu h GLY 152 CO 0.00 0.72 0.06 -2.08 0.00 0.00 0.00 176.54 175.25 3fyu h VAL 153 N 0.93 1.17 -0.99 4.60 2.07 -1.50 0.13 116.25 122.67 3fyu h VAL 153 Ca 0.17 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.18 3fyu h VAL 153 Cb 0.53 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.44 3fyu h VAL 153 CO 0.03 0.17 0.65 1.88 0.02 0.00 0.00 177.57 180.32 3fyu h TYR 154 N 0.12 1.24 -0.18 1.57 -1.99 -0.68 -0.81 116.97 116.23 3fyu h TYR 154 Ca 0.06 0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.70 3fyu h TYR 154 Cb 0.20 -0.42 -0.01 0.00 2.00 0.00 0.00 36.73 38.50 3fyu h TYR 154 CO -0.01 0.76 -0.39 -0.07 -0.00 0.00 0.00 178.16 178.45 3fyu h LEU 155 N 1.32 0.44 -1.18 3.88 3.38 -1.08 -2.11 115.31 119.96 3fyu h LEU 155 Ca 0.37 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 3fyu h LEU 155 Cb -0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3fyu h LEU 155 CO -0.09 0.79 -0.01 0.44 0.09 0.00 0.00 178.44 179.66 3fyu h ASP 156 N 0.35 0.52 -0.07 -0.43 3.32 0.25 -0.55 116.42 119.80 3fyu h ASP 156 Ca 0.03 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3fyu h ASP 156 Cb 0.85 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 3fyu h ASP 156 CO 0.07 0.60 0.03 0.00 -1.72 0.00 0.00 179.24 178.22 3fyu h ALA 157 N 1.47 0.09 -0.23 3.45 0.00 -0.65 0.14 119.26 123.53 3fyu h ALA 157 Ca 0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3fyu h ALA 157 Cb 0.36 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3fyu h ALA 157 CO 0.01 -0.33 0.14 0.28 0.00 0.00 0.00 179.25 179.35 3fyu h VAL 158 N -0.03 1.09 -0.58 0.00 2.07 -1.04 -2.54 116.25 115.22 3fyu h VAL 158 Ca 0.02 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3fyu h VAL 158 Cb 0.15 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3fyu h VAL 158 CO -0.00 0.09 0.31 -0.09 0.02 0.00 0.00 177.57 177.89 3fyu h ARG 159 N 0.29 0.80 -0.95 1.57 9.65 -0.94 -1.23 114.38 123.55 3fyu h ARG 159 Ca 0.08 -0.08 0.06 0.00 -1.10 0.00 0.00 59.98 58.94 3fyu h ARG 159 Cb 0.02 -0.16 -0.06 0.00 -1.39 0.00 0.00 29.97 28.37 3fyu h ARG 159 CO -0.02 0.60 0.61 0.00 2.80 0.00 0.00 179.97 183.96 3fyu h ALA 160 N 1.54 1.32 -0.37 2.80 0.00 -0.30 -0.02 119.26 124.21 3fyu h ALA 160 Ca 0.21 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 3fyu h ALA 160 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3fyu h ALA 160 CO -0.03 0.40 -0.27 -0.07 0.00 0.00 0.00 179.25 179.27 3fyu h LEU 161 N 1.12 0.80 -0.88 0.00 3.38 -0.97 -1.01 115.31 117.75 3fyu h LEU 161 Ca 0.41 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 3fyu h LEU 161 Cb 0.15 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3fyu h LEU 161 CO -0.17 1.03 -0.39 -0.33 0.09 0.00 0.00 178.44 178.67 3fyu h GLU 162 N 0.67 0.34 0.02 1.13 5.08 -0.62 -1.35 114.58 119.85 3fyu h GLU 162 Ca 0.08 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3fyu h GLU 162 Cb 0.80 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3fyu h GLU 162 CO 0.07 0.68 -0.01 0.28 -1.00 0.00 0.00 179.01 179.03 3fyu h VAL 163 N 0.28 1.47 -0.26 3.13 2.07 -0.86 -2.98 116.25 119.11 3fyu h VAL 163 Ca 0.03 -1.59 0.03 0.00 0.82 0.00 0.00 66.70 65.99 3fyu h VAL 163 Cb 0.82 2.52 -0.03 0.00 -1.52 0.00 0.00 31.29 33.08 3fyu h VAL 163 CO 0.07 0.40 0.06 0.40 0.02 0.00 0.00 177.57 178.52 3fyu h ILE 164 N -0.72 0.89 -0.18 4.57 1.08 -1.15 -2.08 117.51 119.91 3fyu h ILE 164 Ca -0.00 -0.06 0.01 0.00 -0.39 0.00 0.00 64.86 64.42 3fyu h ILE 164 Cb 0.68 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 35.14 3fyu h ILE 164 CO 0.00 0.03 0.12 -0.61 -0.69 0.00 0.00 178.15 177.01 3fyu h GLN 165 N 0.16 0.20 0.00 2.37 4.15 -1.36 -1.33 115.11 119.31 3fyu h GLN 165 Ca 0.12 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3fyu h GLN 165 Cb 0.11 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.76 3fyu h GLN 165 CO -0.15 0.13 0.00 0.66 -1.93 0.00 0.00 178.83 177.55 3fyu h SER 166 N 0.21 0.00 -3.34 -0.69 4.64 -1.21 -3.42 113.55 109.74 3fyu h SER 166 Ca 0.07 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.87 3fyu h SER 166 Cb 0.03 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.17 3fyu h SER 166 CO -0.01 0.00 0.71 -0.36 -0.87 0.00 0.00 176.83 176.29 3fyu s PHE 167 N -3.31 3.16 0.17 4.77 0.08 -0.50 -4.94 117.98 117.41 3fyu s PHE 167 Ca 0.05 1.11 -0.13 0.00 0.12 0.00 0.00 56.93 58.07 3fyu s PHE 167 Cb 0.10 -3.70 0.06 0.00 -0.57 0.00 0.00 43.02 38.90 3fyu s PHE 167 CO 0.45 -2.27 1.76 -1.00 -0.10 0.00 0.00 175.22 174.06 3fyu h PRO 168 N 5.39 0.76 0.00 0.24 0.13 -1.88 -2.34 132.00 134.31 3fyu h PRO 168 Ca -0.45 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3fyu h PRO 168 Cb 1.21 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3fyu h PRO 168 CO 0.79 0.61 0.00 -0.85 -0.23 0.00 0.00 178.00 178.31 3fyu n GLU 169 N -4.60 0.55 -4.60 0.86 0.00 -1.26 -4.68 120.64 106.92 3fyu n GLU 169 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.85 3fyu n GLU 169 Cb 0.10 -1.29 -0.13 0.00 0.00 0.00 0.00 31.44 30.12 3fyu n GLU 169 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 3fyu s VAL 170 N -2.00 3.49 -0.85 3.84 1.01 -0.88 -0.40 120.40 124.61 3fyu s VAL 170 Ca 0.15 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.39 3fyu s VAL 170 Cb 0.07 -2.49 0.06 0.00 0.00 0.00 0.00 36.38 34.02 3fyu s VAL 170 CO 0.12 0.52 1.26 -0.62 0.00 0.00 0.00 175.10 176.37 3fyu s ASP 171 N 0.25 6.35 0.63 3.32 -1.08 0.08 -4.78 116.67 121.44 3fyu s ASP 171 Ca -0.06 -1.14 0.22 0.00 -0.52 0.00 0.00 52.55 51.06 3fyu s ASP 171 Cb -0.15 -2.51 1.05 0.00 -1.46 0.00 0.00 42.92 39.85 3fyu s ASP 171 CO 0.04 -1.53 1.55 1.05 0.52 0.00 0.00 175.17 176.80 3fyu h GLU 172 N 9.68 0.00 -0.01 4.34 4.11 -1.87 0.26 114.58 131.09 3fyu h GLU 172 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.38 3fyu h GLU 172 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3fyu h GLU 172 CO 1.29 0.00 -0.12 0.72 0.07 0.00 0.00 179.01 180.97 3fyu n HIS 173 N -3.14 0.00 -2.86 2.06 8.25 -1.26 -4.15 115.22 114.12 3fyu n HIS 173 Ca 0.08 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.35 3fyu n HIS 173 Cb 0.91 -0.11 -0.01 0.00 1.12 0.00 0.00 29.99 31.90 3fyu n HIS 173 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3fyu n ARG 174 N -0.61 1.98 -4.12 -0.41 1.74 0.90 -4.82 116.66 111.33 3fyu n ARG 174 Ca 0.16 -3.89 -0.35 0.00 -0.77 0.00 0.00 57.85 53.00 3fyu n ARG 174 Cb 0.30 -1.80 -0.12 0.00 -1.02 0.00 0.00 32.46 29.82 3fyu n ARG 174 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3fyu s ILE 175 N -3.65 4.17 0.12 0.55 1.01 -1.26 -0.16 121.20 121.99 3fyu s ILE 175 Ca 0.40 -0.24 0.09 0.00 0.00 0.00 0.00 60.65 60.90 3fyu s ILE 175 Cb 0.37 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 3fyu s ILE 175 CO -0.08 0.44 -0.19 -0.83 0.00 0.00 0.00 174.94 174.28 3fyu s GLY 176 N 0.74 1.68 -0.17 6.18 0.00 0.20 0.39 107.32 116.33 3fyu s GLY 176 Ca 0.01 -1.38 -0.00 0.00 0.00 0.00 0.00 44.72 43.34 3fyu s GLY 176 CO 0.02 -1.37 -0.14 -1.34 0.00 0.00 0.00 173.10 170.27 3fyu s VAL 177 N -1.16 2.69 0.15 1.40 -7.23 -0.92 -0.67 120.40 114.65 3fyu s VAL 177 Ca 0.18 -0.75 0.02 0.00 -1.81 0.00 0.00 61.98 59.62 3fyu s VAL 177 Cb -0.10 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 3fyu s VAL 177 CO 0.10 0.50 -0.03 0.27 -0.31 0.00 0.00 175.10 175.63 3fyu s ILE 178 N 0.99 0.73 0.00 -0.62 -4.36 -0.88 -1.42 121.20 115.65 3fyu s ILE 178 Ca -0.02 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3fyu s ILE 178 Cb -0.15 -1.96 0.00 0.00 1.25 0.00 0.00 42.46 41.60 3fyu s ILE 178 CO -0.03 -0.62 0.00 0.61 0.24 0.00 0.00 174.94 175.14 3fyu n GLY 179 N -0.18 2.11 3.42 6.27 0.00 -0.92 -0.93 105.19 114.97 3fyu n GLY 179 Ca -0.09 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 44.75 3fyu n GLY 179 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fyu s GLY 180 N 0.00 1.46 0.00 -0.02 0.00 -1.24 -1.19 107.32 106.33 3fyu s GLY 180 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.71 3fyu s GLY 180 CO 0.00 -0.78 0.00 -1.26 0.00 0.00 0.00 173.10 171.06 3fyu n SER 181 N 2.42 0.00 -0.19 1.64 2.88 0.18 -0.39 113.62 120.16 3fyu n SER 181 Ca -0.17 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.36 3fyu n SER 181 Cb 0.52 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.07 3fyu n SER 181 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 3fyu h GLN 182 N 0.00 0.35 -0.87 -1.46 4.15 -1.84 0.19 115.11 115.62 3fyu h GLN 182 Ca 0.00 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.46 3fyu h GLN 182 Cb 0.00 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.56 3fyu h GLN 182 CO 0.00 0.23 0.57 0.78 -1.93 0.00 0.00 178.83 178.48 3fyu h GLY 183 N 0.36 1.26 1.36 2.39 0.00 -0.42 0.50 103.07 108.52 3fyu h GLY 183 Ca 0.28 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 47.10 3fyu h GLY 183 CO -0.30 0.30 -0.23 -1.33 0.00 0.00 0.00 176.54 174.98 3fyu h GLY 184 N 1.00 0.79 1.16 4.60 0.00 -0.61 -1.46 103.07 108.55 3fyu h GLY 184 Ca 0.37 -0.68 -0.12 0.00 0.00 0.00 0.00 47.33 46.90 3fyu h GLY 184 CO -0.13 0.62 -0.18 0.00 0.00 0.00 0.00 176.54 176.84 3fyu h ALA 185 N 1.10 0.76 -0.69 3.60 0.00 0.45 -1.80 119.26 122.68 3fyu h ALA 185 Ca 0.09 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 3fyu h ALA 185 Cb 0.73 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3fyu h ALA 185 CO 0.06 0.67 0.17 -0.07 0.00 0.00 0.00 179.25 180.07 3fyu h LEU 186 N 0.84 1.05 0.13 0.00 3.38 -0.74 0.26 115.31 120.24 3fyu h LEU 186 Ca 0.12 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3fyu h LEU 186 Cb 0.74 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3fyu h LEU 186 CO 0.06 1.01 -0.08 0.00 0.09 0.00 0.00 178.44 179.53 3fyu h ALA 187 N 1.08 -0.19 -0.32 1.53 0.00 -1.07 0.30 119.26 120.59 3fyu h ALA 187 Ca 0.22 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3fyu h ALA 187 Cb 0.37 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3fyu h ALA 187 CO 0.00 -0.61 0.14 0.82 0.00 0.00 0.00 179.25 179.61 3fyu h ILE 188 N -0.20 1.17 -0.77 0.00 2.04 -1.12 -0.83 117.51 117.80 3fyu h ILE 188 Ca -0.01 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.37 3fyu h ILE 188 Cb 0.16 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 3fyu h ILE 188 CO 0.02 0.18 0.49 0.00 0.00 0.00 0.00 178.15 178.84 3fyu h ALA 189 N 0.99 1.00 -0.23 1.87 0.00 -0.27 -0.79 119.26 121.83 3fyu h ALA 189 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3fyu h ALA 189 Cb 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3fyu h ALA 189 CO -0.01 0.32 0.08 0.00 0.00 0.00 0.00 179.25 179.64 3fyu h ALA 190 N 1.32 0.30 0.00 0.00 0.00 -0.16 -1.22 119.26 119.50 3fyu h ALA 190 Ca 0.30 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3fyu h ALA 190 Cb -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3fyu h ALA 190 CO -0.10 -0.09 -0.12 0.00 0.00 0.00 0.00 179.25 178.94 3fyu h ALA 191 N 0.92 1.49 0.01 0.00 0.00 -0.79 0.20 119.26 121.10 3fyu h ALA 191 Ca 0.08 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 3fyu h ALA 191 Cb 0.21 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3fyu h ALA 191 CO -0.00 0.15 -1.03 0.00 0.00 0.00 0.00 179.25 178.37 3fyu h ALA 192 N 1.88 0.33 0.00 0.00 0.00 -0.72 -3.30 119.26 117.44 3fyu h ALA 192 Ca -0.00 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.00 3fyu h ALA 192 Cb 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3fyu h ALA 192 CO 0.02 1.23 -0.83 1.28 0.00 0.00 0.00 179.25 180.94 3fyu n LEU 193 N -3.36 0.83 -3.86 0.00 4.77 -0.50 -4.72 117.00 110.15 3fyu n LEU 193 Ca -0.01 -0.33 -0.12 0.00 -0.03 0.00 0.00 56.01 55.53 3fyu n LEU 193 Cb 0.95 -0.09 -0.12 0.00 -2.33 0.00 0.00 43.42 41.83 3fyu n LEU 193 CO 0.48 0.21 -0.25 -0.55 -1.33 0.00 0.00 177.39 175.94 3fyu s SER 194 N -3.00 -0.03 -0.13 -1.43 0.15 0.66 -5.02 113.70 104.89 3fyu s SER 194 Ca 0.09 0.02 0.17 0.00 0.70 0.00 0.00 55.95 56.93 3fyu s SER 194 Cb 0.17 0.19 0.71 0.00 -1.71 0.00 0.00 66.02 65.37 3fyu s SER 194 CO 0.81 -0.15 1.62 -0.90 1.20 0.00 0.00 173.24 175.83 3fyu n ASP 195 N 2.48 4.79 -0.06 5.45 3.85 -1.26 -4.35 116.55 127.44 3fyu n ASP 195 Ca -0.16 -2.56 -0.14 0.00 -0.71 0.00 0.00 54.79 51.23 3fyu n ASP 195 Cb 0.58 -0.58 -0.07 0.00 -1.35 0.00 0.00 41.12 39.70 3fyu n ASP 195 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 3fyu h ILE 196 N 3.80 1.34 -3.92 2.12 2.04 -1.91 -3.44 117.51 117.53 3fyu h ILE 196 Ca 0.00 -1.46 -0.53 0.00 1.00 0.00 0.00 64.86 63.87 3fyu h ILE 196 Cb 1.51 1.87 0.08 0.00 -0.74 0.00 0.00 36.82 39.55 3fyu h ILE 196 CO 0.27 0.44 0.68 -2.84 0.00 0.00 0.00 178.15 176.70 3fyu s PRO 197 N -4.18 4.17 -0.16 2.37 0.02 -1.26 -4.64 135.00 131.32 3fyu s PRO 197 Ca -0.13 2.33 -0.11 0.00 0.02 0.00 0.00 61.00 63.10 3fyu s PRO 197 Cb 0.06 -2.96 -0.23 0.00 0.02 0.00 0.00 34.50 31.39 3fyu s PRO 197 CO 0.79 -0.39 0.26 1.17 -0.33 0.00 0.00 177.00 178.50 3fyu n LYS 198 N 0.51 0.68 -4.26 5.54 4.81 0.16 -4.87 118.16 120.73 3fyu n LYS 198 Ca 0.01 0.36 -0.15 0.00 -0.87 0.00 0.00 58.31 57.67 3fyu n LYS 198 Cb 0.41 -1.70 -0.10 0.00 0.02 0.00 0.00 35.03 33.66 3fyu n LYS 198 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 3fyu s VAL 199 N -2.49 1.00 -0.04 3.15 -7.23 -1.24 -3.72 120.40 109.83 3fyu s VAL 199 Ca -0.26 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 57.90 3fyu s VAL 199 Cb 0.07 -2.03 0.01 0.00 0.56 0.00 0.00 36.38 34.99 3fyu s VAL 199 CO 0.69 -0.59 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.13 3fyu s VAL 200 N -3.44 0.70 -0.19 1.32 1.01 -0.43 -2.16 120.40 117.21 3fyu s VAL 200 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.93 3fyu s VAL 200 Cb 0.04 -0.67 0.04 0.00 0.00 0.00 0.00 36.38 35.80 3fyu s VAL 200 CO 0.03 0.25 -0.07 -0.69 0.00 0.00 0.00 175.10 174.61 3fyu s VAL 201 N 0.59 1.40 -0.18 2.92 1.01 -0.51 -0.19 120.40 125.44 3fyu s VAL 201 Ca -0.09 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.02 3fyu s VAL 201 Cb -0.12 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 34.75 3fyu s VAL 201 CO 0.01 0.11 -0.12 0.00 0.00 0.00 0.00 175.10 175.10 3fyu s ALA 202 N 1.50 1.98 -0.17 5.51 0.00 0.29 -2.16 121.76 128.70 3fyu s ALA 202 Ca -0.01 -1.10 -0.24 0.00 0.00 0.00 0.00 51.96 50.61 3fyu s ALA 202 Cb -0.16 -1.19 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 3fyu s ALA 202 CO -0.08 -0.63 0.79 -0.51 0.00 0.00 0.00 175.76 175.33 3fyu s ASP 203 N 1.42 6.91 -0.16 0.00 1.11 -0.33 -2.33 116.67 123.29 3fyu s ASP 203 Ca 0.01 1.11 -0.00 0.00 0.18 0.00 0.00 52.55 53.85 3fyu s ASP 203 Cb -0.15 -2.43 0.00 0.00 1.07 0.00 0.00 42.92 41.41 3fyu s ASP 203 CO -0.09 -0.36 0.11 0.00 1.18 0.00 0.00 175.17 176.01 3fyu n TYR 204 N 5.11 -0.37 -1.62 4.23 0.18 0.26 0.50 117.16 125.46 3fyu n TYR 204 Ca 0.03 0.14 -0.43 0.00 1.88 0.00 0.00 57.90 59.52 3fyu n TYR 204 Cb 0.49 -0.51 -0.01 0.00 -0.38 0.00 0.00 39.34 38.93 3fyu n TYR 204 CO 0.00 0.00 0.00 -0.35 -2.08 0.00 0.00 176.86 174.43 3fyu n PRO 205 N -0.96 1.58 -0.96 -3.48 -0.04 -1.26 -2.97 135.00 126.91 3fyu n PRO 205 Ca -0.06 0.56 -0.02 0.00 -0.04 0.00 0.00 63.50 63.94 3fyu n PRO 205 Cb 0.13 -2.02 0.01 0.00 -0.04 0.00 0.00 33.50 31.57 3fyu n PRO 205 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 3fyu n TYR 206 N 0.12 -3.15 -4.03 0.54 9.36 -0.44 -4.65 117.16 114.91 3fyu n TYR 206 Ca 0.08 -0.15 -0.30 0.00 3.32 0.00 0.00 57.90 60.84 3fyu n TYR 206 Cb 0.35 -0.05 -0.01 0.00 -0.63 0.00 0.00 39.34 38.99 3fyu n TYR 206 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3fyu n LEU 207 N 0.00 -2.15 -4.03 2.98 4.77 -1.26 -4.52 117.00 112.79 3fyu n LEU 207 Ca 0.01 -0.95 -0.23 0.00 -0.03 0.00 0.00 56.01 54.81 3fyu n LEU 207 Cb 0.05 -2.27 -0.16 0.00 -2.33 0.00 0.00 43.42 38.71 3fyu n LEU 207 CO 0.03 0.39 -0.46 -0.55 -1.33 0.00 0.00 177.39 175.47 3fyu s SER 208 N -3.75 1.56 -1.29 -1.43 0.15 -1.26 -1.50 113.70 106.17 3fyu s SER 208 Ca 0.41 -0.25 -0.07 0.00 0.70 0.00 0.00 55.95 56.75 3fyu s SER 208 Cb -0.22 -0.52 -0.00 0.00 -1.71 0.00 0.00 66.02 63.56 3fyu s SER 208 CO 0.89 0.07 0.61 -3.20 1.20 0.00 0.00 173.24 172.81 3fyu n ASN 209 N 3.44 -2.19 -0.27 5.45 5.15 -1.26 -4.65 115.26 120.92 3fyu n ASN 209 Ca -0.20 -0.96 0.02 0.00 -0.60 0.00 0.00 54.58 52.83 3fyu n ASN 209 Cb 0.53 -3.41 0.09 0.00 -0.53 0.00 0.00 39.78 36.46 3fyu n ASN 209 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 3fyu h PHE 210 N -1.85 -0.44 -0.25 1.20 0.04 -1.95 -0.71 116.94 112.97 3fyu h PHE 210 Ca -0.64 0.07 0.07 0.00 2.80 0.00 0.00 57.97 60.28 3fyu h PHE 210 Cb 1.37 0.32 -0.01 0.00 2.20 0.00 0.00 35.95 39.82 3fyu h PHE 210 CO 0.43 -0.34 0.24 0.93 -0.60 0.00 0.00 178.31 178.97 3fyu h GLU 211 N -0.01 0.00 0.04 1.51 5.08 -1.97 -1.69 114.58 117.55 3fyu h GLU 211 Ca 0.37 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.37 3fyu h GLU 211 Cb 0.57 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 3fyu h GLU 211 CO -0.81 0.00 -2.15 -2.13 -1.00 0.00 0.00 179.01 172.92 3fyu n ARG 212 N -3.98 0.69 -0.15 2.33 0.63 -0.55 -4.33 116.66 111.30 3fyu n ARG 212 Ca 0.03 0.19 -0.03 0.00 -0.92 0.00 0.00 57.85 57.13 3fyu n ARG 212 Cb 0.38 -1.64 0.05 0.00 0.45 0.00 0.00 32.46 31.71 3fyu n ARG 212 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3fyu h ALA 213 N 0.38 0.44 0.00 5.13 0.00 -0.30 0.78 119.26 125.69 3fyu h ALA 213 Ca -0.47 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3fyu h ALA 213 Cb 2.03 0.27 0.00 0.00 0.00 0.00 0.00 17.79 20.08 3fyu h ALA 213 CO 0.02 -0.40 0.00 -0.39 0.00 0.00 0.00 179.25 178.49 3fyu h VAL 214 N 0.09 0.00 0.00 0.00 -1.51 -1.58 0.33 116.25 113.58 3fyu h VAL 214 Ca 0.24 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.61 3fyu h VAL 214 Cb 0.37 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 3fyu h VAL 214 CO -0.42 0.00 -1.39 0.47 -1.23 0.00 0.00 177.57 175.00 3fyu n ASP 215 N -2.63 0.63 -0.04 4.19 8.00 0.13 -4.64 116.55 122.19 3fyu n ASP 215 Ca -0.01 -0.58 -0.05 0.00 0.71 0.00 0.00 54.79 54.87 3fyu n ASP 215 Cb 0.11 1.40 -0.04 0.00 -0.02 0.00 0.00 41.12 42.57 3fyu n ASP 215 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3fyu n VAL 216 N -1.80 0.43 -1.63 2.53 0.31 -0.40 -5.03 118.33 112.75 3fyu n VAL 216 Ca 0.01 -0.20 -0.40 0.00 -0.01 0.00 0.00 64.34 63.73 3fyu n VAL 216 Cb 0.42 -0.80 0.02 0.00 -0.91 0.00 0.00 33.84 32.57 3fyu n VAL 216 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3fyu n ALA 217 N -2.54 0.36 0.08 3.52 0.00 0.11 -4.91 120.51 117.13 3fyu n ALA 217 Ca -0.12 0.16 0.01 0.00 0.00 0.00 0.00 53.44 53.49 3fyu n ALA 217 Cb 0.66 -2.12 0.01 0.00 0.00 0.00 0.00 19.45 18.00 3fyu n ALA 217 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3fyu n LEU 218 N 0.07 1.07 -4.17 0.00 4.77 -0.94 -4.97 117.00 112.83 3fyu n LEU 218 Ca 0.10 -0.95 -0.12 0.00 -0.03 0.00 0.00 56.01 55.01 3fyu n LEU 218 Cb 0.42 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.42 3fyu n LEU 218 CO 0.55 0.25 -0.15 -1.61 -1.33 0.00 0.00 177.39 175.09 3fyu s GLU 219 N -0.26 1.32 0.96 3.23 2.02 -1.22 -5.03 118.70 119.72 3fyu s GLU 219 Ca 0.02 -1.60 -0.11 0.00 0.02 0.00 0.00 54.97 53.30 3fyu s GLU 219 Cb 0.02 0.31 0.17 0.00 0.10 0.00 0.00 34.13 34.73 3fyu s GLU 219 CO 0.03 -0.46 1.09 -0.65 0.02 0.00 0.00 175.26 175.29 3fyu s GLN 220 N -4.05 0.69 0.00 1.61 -1.52 -1.26 -4.03 119.66 111.09 3fyu s GLN 220 Ca 0.36 1.10 0.20 0.00 -1.95 0.00 0.00 55.36 55.08 3fyu s GLN 220 Cb 0.05 -1.72 0.43 0.00 -0.22 0.00 0.00 33.01 31.55 3fyu s GLN 220 CO 0.13 -2.71 1.37 -0.35 -0.25 0.00 0.00 175.29 173.47 3fyu n PRO 221 N -4.25 2.46 -0.33 2.91 -0.04 -1.26 -4.73 135.00 129.77 3fyu n PRO 221 Ca 0.08 -2.26 -0.01 0.00 -0.04 0.00 0.00 63.50 61.26 3fyu n PRO 221 Cb 0.54 -1.47 0.15 0.00 -0.04 0.00 0.00 33.50 32.67 3fyu n PRO 221 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3fyu h TYR 222 N 3.93 1.17 0.00 0.54 0.05 -1.85 -1.56 116.97 119.24 3fyu h TYR 222 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3fyu h TYR 222 Cb 0.92 -0.39 0.00 0.00 1.01 0.00 0.00 36.73 38.26 3fyu h TYR 222 CO 0.28 0.75 0.00 1.28 -1.05 0.00 0.00 178.16 179.42 3fyu n LEU 223 N -4.39 0.00 0.14 3.88 4.77 -1.26 -1.23 117.00 118.92 3fyu n LEU 223 Ca 0.11 0.29 0.02 0.00 -0.03 0.00 0.00 56.01 56.40 3fyu n LEU 223 Cb 0.02 -0.29 0.37 0.00 -2.33 0.00 0.00 43.42 41.20 3fyu n LEU 223 CO 0.37 -0.27 0.81 -0.33 -1.33 0.00 0.00 177.39 176.64 3fyu h GLU 224 N 0.00 0.15 -0.41 3.23 5.08 -1.64 -0.29 114.58 120.70 3fyu h GLU 224 Ca 0.00 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 3fyu h GLU 224 Cb 0.01 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3fyu h GLU 224 CO 0.00 0.39 -0.06 0.82 -1.00 0.00 0.00 179.01 179.15 3fyu h ILE 225 N 0.14 1.27 -0.39 3.13 2.04 -1.37 -0.86 117.51 121.46 3fyu h ILE 225 Ca 0.02 -1.13 -0.00 0.00 1.00 0.00 0.00 64.86 64.75 3fyu h ILE 225 Cb 0.50 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3fyu h ILE 225 CO 0.03 0.38 0.24 0.78 0.00 0.00 0.00 178.15 179.59 3fyu h ASN 226 N 0.58 0.47 -0.56 1.72 4.21 -1.49 -1.48 115.58 119.03 3fyu h ASN 226 Ca 0.11 -0.04 0.03 0.00 1.21 0.00 0.00 56.30 57.61 3fyu h ASN 226 Cb 0.57 -0.12 -0.03 0.00 -1.12 0.00 0.00 38.32 37.62 3fyu h ASN 226 CO 0.03 0.37 0.37 0.28 -1.29 0.00 0.00 177.43 177.19 3fyu h SER 227 N 0.52 0.55 -0.08 5.81 0.02 -0.86 -0.85 113.55 118.66 3fyu h SER 227 Ca 0.14 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3fyu h SER 227 Cb -0.01 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.39 3fyu h SER 227 CO -0.03 0.38 0.02 0.22 -1.14 0.00 0.00 176.83 176.29 3fyu h TYR 228 N 0.64 0.14 -0.07 3.45 3.20 -0.24 -2.56 116.97 121.52 3fyu h TYR 228 Ca 0.22 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.01 3fyu h TYR 228 Cb 0.09 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3fyu h TYR 228 CO -0.00 0.31 -0.27 0.74 -1.64 0.00 0.00 178.16 177.29 3fyu h PHE 229 N -0.08 0.13 -0.82 -3.82 0.04 -0.69 -1.20 116.94 110.51 3fyu h PHE 229 Ca 0.03 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 3fyu h PHE 229 Cb 0.24 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 3fyu h PHE 229 CO 0.00 0.39 0.43 0.00 -0.60 0.00 0.00 178.31 178.53 3fyu h ARG 230 N 0.11 1.15 0.00 1.51 3.08 -0.98 -2.50 114.38 116.76 3fyu h ARG 230 Ca 0.02 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.92 3fyu h ARG 230 Cb 0.55 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3fyu h ARG 230 CO 0.04 0.86 -0.19 0.54 -1.07 0.00 0.00 179.97 180.15 3fyu n ARG 231 N -4.33 0.03 -3.44 0.04 1.74 -0.77 -4.35 116.66 105.58 3fyu n ARG 231 Ca 0.08 0.02 -0.28 0.00 -0.77 0.00 0.00 57.85 56.90 3fyu n ARG 231 Cb 0.11 -1.52 -0.11 0.00 -1.02 0.00 0.00 32.46 29.92 3fyu n ARG 231 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3fyu s ASN 232 N -3.13 2.11 0.43 0.55 -0.87 -0.53 -4.99 114.94 108.50 3fyu s ASN 232 Ca 0.13 -2.77 0.30 0.00 -1.57 0.00 0.00 52.86 48.94 3fyu s ASN 232 Cb 0.18 -0.47 1.44 0.00 -0.02 0.00 0.00 41.25 42.38 3fyu s ASN 232 CO 0.60 -0.22 1.90 0.77 -2.57 0.00 0.00 177.10 177.58 3fyu h SER 233 N 6.14 0.00 -1.24 -1.22 4.64 -1.74 -3.42 113.55 116.71 3fyu h SER 233 Ca 0.18 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.82 3fyu h SER 233 Cb 0.93 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 3fyu h SER 233 CO 0.35 0.00 1.28 -0.67 -0.87 0.00 0.00 176.83 176.91 3fyu n ASP 234 N -2.61 2.28 -0.31 4.97 -0.08 -1.26 -4.81 116.55 114.73 3fyu n ASP 234 Ca -0.00 0.62 0.12 0.00 -1.51 0.00 0.00 54.79 54.01 3fyu n ASP 234 Cb 0.16 -1.24 0.29 0.00 2.34 0.00 0.00 41.12 42.67 3fyu n ASP 234 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3fyu h PRO 235 N 10.89 0.50 0.00 -0.67 0.11 -1.99 0.37 132.00 141.21 3fyu h PRO 235 Ca -0.33 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3fyu h PRO 235 Cb 1.32 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3fyu h PRO 235 CO 1.00 0.33 -0.05 0.87 -0.21 0.00 0.00 178.00 179.94 3fyu h LYS 236 N 0.52 0.00 -0.49 1.05 1.57 -1.96 -1.56 116.57 115.69 3fyu h LYS 236 Ca 0.54 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 59.19 3fyu h LYS 236 Cb 0.93 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 3fyu h LYS 236 CO -0.46 0.05 -0.21 0.28 -0.57 0.00 0.00 179.45 178.55 3fyu h VAL 237 N 0.00 1.27 -0.22 0.50 2.07 -0.59 -0.83 116.25 118.45 3fyu h VAL 237 Ca -0.00 -1.37 -0.03 0.00 0.82 0.00 0.00 66.70 66.11 3fyu h VAL 237 Cb 0.15 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3fyu h VAL 237 CO 0.01 0.48 0.00 -0.08 0.02 0.00 0.00 177.57 178.00 3fyu h GLU 238 N 0.86 0.39 -0.52 1.57 4.81 -1.22 0.25 114.58 120.72 3fyu h GLU 238 Ca 0.11 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3fyu h GLU 238 Cb 0.79 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.11 3fyu h GLU 238 CO 0.07 0.57 0.34 0.93 -0.73 0.00 0.00 179.01 180.18 3fyu h GLU 239 N 0.16 0.67 -0.20 1.92 5.08 -1.38 -1.03 114.58 119.79 3fyu h GLU 239 Ca 0.06 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3fyu h GLU 239 Cb 0.39 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3fyu h GLU 239 CO 0.01 0.44 0.06 -0.22 -1.00 0.00 0.00 179.01 178.31 3fyu h LYS 240 N 0.69 0.31 -0.33 2.33 1.63 -1.02 -1.50 116.57 118.68 3fyu h LYS 240 Ca 0.19 -0.07 0.06 0.00 -0.85 0.00 0.00 60.65 59.98 3fyu h LYS 240 Cb -0.06 -0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.47 3fyu h LYS 240 CO -0.05 0.41 0.02 0.00 -3.45 0.00 0.00 179.45 176.37 3fyu h ALA 241 N 0.89 0.31 0.00 5.00 0.00 -0.14 0.17 119.26 125.49 3fyu h ALA 241 Ca 0.07 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 3fyu h ALA 241 Cb 0.22 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3fyu h ALA 241 CO -0.00 -0.39 -0.29 0.74 0.00 0.00 0.00 179.25 179.31 3fyu h PHE 242 N 0.12 0.00 -0.31 0.00 -1.00 -1.12 -1.12 116.94 113.51 3fyu h PHE 242 Ca 0.16 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.88 3fyu h PHE 242 Cb 0.21 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 3fyu h PHE 242 CO -0.22 0.29 -0.02 1.49 -1.61 0.00 0.00 178.31 178.23 3fyu h GLU 243 N 0.00 0.56 0.13 1.51 4.81 -0.13 -1.95 114.58 119.50 3fyu h GLU 243 Ca -0.00 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.03 3fyu h GLU 243 Cb 0.58 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3fyu h GLU 243 CO 0.04 0.71 -0.06 1.15 -0.73 0.00 0.00 179.01 180.12 3fyu h THR 244 N 0.34 0.90 -0.48 0.32 2.02 -0.51 -2.91 112.91 112.59 3fyu h THR 244 Ca 0.08 -0.11 0.11 0.00 0.77 0.00 0.00 66.41 67.26 3fyu h THR 244 Cb 0.48 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 3fyu h THR 244 CO 0.02 0.03 0.33 -0.07 0.37 0.00 0.00 175.52 176.20 3fyu h LEU 245 N -0.22 0.16 -1.68 2.58 3.38 -1.14 -2.24 115.31 116.15 3fyu h LEU 245 Ca -0.02 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.99 3fyu h LEU 245 Cb 0.17 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 3fyu h LEU 245 CO 0.03 0.10 0.27 0.77 0.09 0.00 0.00 178.44 179.69 3fyu h SER 246 N 0.18 0.36 0.57 -0.43 4.64 -1.14 -0.43 113.55 117.30 3fyu h SER 246 Ca 0.22 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3fyu h SER 246 Cb 0.65 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3fyu h SER 246 CO -0.04 0.25 0.00 -1.22 -0.87 0.00 0.00 176.83 174.96 3fyu n TYR 247 N -4.48 0.75 0.06 4.77 4.01 -0.84 -2.58 117.16 118.84 3fyu n TYR 247 Ca 0.04 0.31 0.01 0.00 -0.16 0.00 0.00 57.90 58.10 3fyu n TYR 247 Cb 0.15 -1.00 0.00 0.00 -0.31 0.00 0.00 39.34 38.18 3fyu n TYR 247 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 3fyu n PHE 248 N -2.20 0.00 -2.18 -0.72 3.72 -0.30 -4.97 117.46 110.80 3fyu n PHE 248 Ca 0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.99 3fyu n PHE 248 Cb 0.19 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.70 3fyu n PHE 248 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3fyu s ASP 249 N -0.34 6.81 0.55 4.37 -1.08 -0.42 -4.89 116.67 121.67 3fyu s ASP 249 Ca 0.01 2.15 0.28 0.00 -0.52 0.00 0.00 52.55 54.47 3fyu s ASP 249 Cb 0.01 -2.56 1.45 0.00 -1.46 0.00 0.00 42.92 40.36 3fyu s ASP 249 CO 0.02 -0.75 1.96 -0.07 0.52 0.00 0.00 175.17 176.85 3fyu h LEU 250 N 8.53 0.00 -0.73 -1.34 3.38 -1.58 0.18 115.31 123.75 3fyu h LEU 250 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3fyu h LEU 250 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3fyu h LEU 250 CO 0.91 0.00 0.00 2.30 0.09 0.00 0.00 178.44 181.74 3fyu n ILE 251 N -4.18 0.86 -0.06 1.22 -5.35 -1.26 0.43 119.36 111.02 3fyu n ILE 251 Ca 0.11 0.28 -0.01 0.00 -0.27 0.00 0.00 62.75 62.86 3fyu n ILE 251 Cb 0.68 -1.21 -0.16 0.00 -1.74 0.00 0.00 39.64 37.21 3fyu n ILE 251 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3fyu n ASN 252 N -2.20 0.17 -0.03 7.28 3.02 0.59 -4.48 115.26 119.61 3fyu n ASN 252 Ca 0.02 0.00 -0.06 0.00 -0.03 0.00 0.00 54.58 54.51 3fyu n ASN 252 Cb 0.21 1.42 -0.13 0.00 -0.61 0.00 0.00 39.78 40.67 3fyu n ASN 252 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3fyu n LEU 253 N -2.51 0.65 -0.28 3.41 4.77 -0.94 -4.38 117.00 117.73 3fyu n LEU 253 Ca -0.19 0.30 0.08 0.00 -0.03 0.00 0.00 56.01 56.17 3fyu n LEU 253 Cb 0.88 0.21 0.23 0.00 -2.33 0.00 0.00 43.42 42.41 3fyu n LEU 253 CO 0.43 0.34 1.02 0.00 -1.33 0.00 0.00 177.39 177.85 3fyu h ALA 254 N 1.14 1.19 0.00 -1.18 0.00 -0.25 -0.56 119.26 119.60 3fyu h ALA 254 Ca -0.30 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3fyu h ALA 254 Cb 1.93 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.83 3fyu h ALA 254 CO 0.06 -0.25 0.20 0.78 0.00 0.00 0.00 179.25 180.04 3fyu h GLY 255 N 0.43 0.00 0.96 0.00 0.00 -1.72 -0.39 103.07 102.34 3fyu h GLY 255 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 3fyu h GLY 255 CO -0.46 0.00 -0.87 0.79 0.00 0.00 0.00 176.54 176.00 3fyu n TRP 256 N -2.42 0.63 -2.04 5.60 8.01 -0.22 -4.75 117.44 122.25 3fyu n TRP 256 Ca -0.02 0.18 -0.42 0.00 -1.31 0.00 0.00 57.50 55.94 3fyu n TRP 256 Cb 0.24 -0.71 -0.03 0.00 -2.01 0.00 0.00 31.31 28.80 3fyu n TRP 256 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 3fyu s VAL 257 N -3.25 3.29 -0.25 -0.99 1.01 -0.16 -4.68 120.40 115.37 3fyu s VAL 257 Ca 0.03 0.72 0.05 0.00 0.00 0.00 0.00 61.98 62.78 3fyu s VAL 257 Cb 0.12 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 3fyu s VAL 257 CO 0.77 -0.00 0.22 0.29 0.00 0.00 0.00 175.10 176.38 3fyu n LYS 258 N 5.47 5.17 -2.88 2.72 4.76 -1.26 -4.47 118.16 127.66 3fyu n LYS 258 Ca 0.15 -0.03 -0.33 0.00 -2.87 0.00 0.00 58.31 55.23 3fyu n LYS 258 Cb 0.42 -0.74 -0.06 0.00 -1.84 0.00 0.00 35.03 32.80 3fyu n LYS 258 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3fyu s GLN 259 N -1.42 4.13 0.18 1.97 1.11 -1.26 -4.70 119.66 119.68 3fyu s GLN 259 Ca 0.02 0.96 -0.32 0.00 0.01 0.00 0.00 55.36 56.03 3fyu s GLN 259 Cb 0.04 -2.25 -0.12 0.00 -1.01 0.00 0.00 33.01 29.67 3fyu s GLN 259 CO 0.19 0.01 1.76 -2.30 0.01 0.00 0.00 175.29 174.96 3fyu n PRO 260 N -0.64 2.78 -5.23 2.91 -0.02 -1.24 -4.51 135.00 129.05 3fyu n PRO 260 Ca 0.06 1.00 -0.31 0.00 -2.02 0.00 0.00 63.50 62.23 3fyu n PRO 260 Cb 0.54 -2.87 -0.16 0.00 -0.02 0.00 0.00 33.50 31.00 3fyu n PRO 260 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3fyu s THR 261 N 1.69 2.23 -0.14 3.45 2.01 0.91 -1.32 115.64 124.47 3fyu s THR 261 Ca 0.77 -1.03 0.02 0.00 0.31 0.00 0.00 61.69 61.76 3fyu s THR 261 Cb -0.50 -1.80 0.02 0.00 0.01 0.00 0.00 72.50 70.23 3fyu s THR 261 CO 0.34 0.58 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.45 3fyu s LEU 262 N -0.53 1.93 0.14 4.42 2.96 0.73 -1.58 118.68 126.75 3fyu s LEU 262 Ca 0.07 -0.54 0.07 0.00 -0.22 0.00 0.00 54.13 53.51 3fyu s LEU 262 Cb -0.11 -1.31 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 3fyu s LEU 262 CO 0.00 0.02 -0.17 -0.04 -1.32 0.00 0.00 176.35 174.85 3fyu s MET 263 N 1.08 1.16 0.16 1.98 -1.94 -0.04 -0.55 119.30 121.16 3fyu s MET 263 Ca -0.02 -1.32 0.06 0.00 -1.71 0.00 0.00 55.69 52.70 3fyu s MET 263 Cb -0.14 -1.17 -0.04 0.00 2.01 0.00 0.00 34.83 35.49 3fyu s MET 263 CO -0.06 0.24 -0.13 0.00 -0.01 0.00 0.00 175.02 175.06 3fyu s ALA 264 N -2.01 1.69 -0.29 3.03 0.00 -0.98 0.10 121.76 123.31 3fyu s ALA 264 Ca 0.12 -1.48 -0.15 0.00 0.00 0.00 0.00 51.96 50.45 3fyu s ALA 264 Cb -0.06 -0.05 0.10 0.00 0.00 0.00 0.00 23.12 23.11 3fyu s ALA 264 CO 0.05 0.05 0.76 -1.50 0.00 0.00 0.00 175.76 175.11 3fyu s ILE 265 N -2.72 -0.16 -0.09 0.00 1.10 -0.16 -0.57 121.20 118.59 3fyu s ILE 265 Ca 0.16 0.00 -0.15 0.00 -0.51 0.00 0.00 60.65 60.14 3fyu s ILE 265 Cb -0.02 -1.00 -0.05 0.00 0.15 0.00 0.00 42.46 41.55 3fyu s ILE 265 CO 0.04 0.00 0.39 -0.83 -2.11 0.00 0.00 174.94 172.43 3fyu s GLY 266 N 1.79 2.36 0.17 1.50 0.00 -1.26 -1.03 107.32 110.85 3fyu s GLY 266 Ca -0.09 -0.29 0.20 0.00 0.00 0.00 0.00 44.72 44.54 3fyu s GLY 266 CO -0.19 0.44 1.61 1.04 0.00 0.00 0.00 173.10 176.01 3fyu n LEU 267 N 3.01 0.43 -0.96 0.66 4.77 -0.49 -2.29 117.00 122.13 3fyu n LEU 267 Ca -0.11 0.61 0.07 0.00 -0.03 0.00 0.00 56.01 56.55 3fyu n LEU 267 Cb 0.52 -0.56 0.26 0.00 -2.33 0.00 0.00 43.42 41.31 3fyu n LEU 267 CO 0.40 -0.48 0.72 2.30 -1.33 0.00 0.00 177.39 179.00 3fyu n ILE 268 N -1.98 2.34 -2.24 -0.08 -5.35 -0.86 -4.51 119.36 106.68 3fyu n ILE 268 Ca 0.02 -1.96 -0.43 0.00 -0.27 0.00 0.00 62.75 60.12 3fyu n ILE 268 Cb 0.20 -0.27 -0.02 0.00 -1.74 0.00 0.00 39.64 37.80 3fyu n ILE 268 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3fyu s ASP 269 N -1.96 6.66 0.01 7.28 -1.08 -0.97 -4.59 116.67 122.02 3fyu s ASP 269 Ca 0.43 1.69 0.22 0.00 -0.52 0.00 0.00 52.55 54.36 3fyu s ASP 269 Cb 0.35 -2.54 -0.13 0.00 -1.46 0.00 0.00 42.92 39.14 3fyu s ASP 269 CO 0.08 -1.01 0.88 0.29 0.52 0.00 0.00 175.17 175.93 3fyu n LYS 270 N 7.18 0.21 -0.06 4.34 5.02 -1.26 -3.74 118.16 129.84 3fyu n LYS 270 Ca 0.16 -0.04 -0.19 0.00 -2.02 0.00 0.00 58.31 56.22 3fyu n LYS 270 Cb 0.45 -1.53 -0.13 0.00 -0.02 0.00 0.00 35.03 33.80 3fyu n LYS 270 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3fyu h ILE 271 N 0.00 1.30 -3.18 -0.18 2.04 -1.86 -2.48 117.51 113.15 3fyu h ILE 271 Ca 0.00 -2.31 -0.63 0.00 1.00 0.00 0.00 64.86 62.92 3fyu h ILE 271 Cb 0.66 2.82 -0.41 0.00 -0.74 0.00 0.00 36.82 39.15 3fyu h ILE 271 CO 0.00 0.53 -0.65 0.42 0.00 0.00 0.00 178.15 178.45 3fyu s THR 272 N -2.34 2.35 0.17 -0.27 -4.23 -1.26 -4.74 115.64 105.32 3fyu s THR 272 Ca -0.22 -3.42 -0.32 0.00 -1.18 0.00 0.00 61.69 56.55 3fyu s THR 272 Cb 0.02 -2.61 -0.16 0.00 1.34 0.00 0.00 72.50 71.09 3fyu s THR 272 CO 0.68 -0.89 0.98 -2.65 -0.54 0.00 0.00 174.62 172.19 3fyu n PRO 273 N 2.86 0.74 -0.35 3.99 -0.02 -1.25 -4.73 135.00 136.25 3fyu n PRO 273 Ca 0.11 0.26 0.22 0.00 -2.02 0.00 0.00 63.50 62.08 3fyu n PRO 273 Cb 0.34 -1.63 0.46 0.00 -0.02 0.00 0.00 33.50 32.66 3fyu n PRO 273 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3fyu h PRO 274 N 2.57 0.41 -0.66 0.52 0.11 -1.81 0.64 132.00 133.78 3fyu h PRO 274 Ca -0.40 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 3fyu h PRO 274 Cb 1.38 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 3fyu h PRO 274 CO 0.65 0.27 0.30 0.66 -0.21 0.00 0.00 178.00 179.67 3fyu h SER 275 N 0.42 0.86 -0.02 -2.05 4.64 -1.94 0.22 113.55 115.69 3fyu h SER 275 Ca 0.67 -0.10 -0.15 0.00 -0.47 0.00 0.00 61.79 61.74 3fyu h SER 275 Cb 1.54 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 3fyu h SER 275 CO -0.46 0.75 -0.51 0.71 -0.87 0.00 0.00 176.83 176.45 3fyu h THR 276 N 0.95 1.31 -0.14 2.95 1.35 -1.20 -0.40 112.91 117.73 3fyu h THR 276 Ca 0.23 -1.73 -0.13 0.00 -0.55 0.00 0.00 66.41 64.23 3fyu h THR 276 Cb 0.13 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3fyu h THR 276 CO -0.03 0.54 -0.43 0.58 -0.25 0.00 0.00 175.52 175.93 3fyu h VAL 277 N 0.46 1.35 -0.34 6.82 2.07 -1.03 -2.75 116.25 122.84 3fyu h VAL 277 Ca 0.02 -1.71 -0.02 0.00 0.82 0.00 0.00 66.70 65.80 3fyu h VAL 277 Cb 1.05 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 3fyu h VAL 277 CO 0.10 0.52 0.12 -0.26 0.02 0.00 0.00 177.57 178.06 3fyu h PHE 278 N 0.17 0.47 -0.86 1.57 -1.00 -0.54 -0.90 116.94 115.86 3fyu h PHE 278 Ca -0.01 -0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 3fyu h PHE 278 Cb 1.05 -0.15 -0.04 0.00 3.61 0.00 0.00 35.95 40.42 3fyu h PHE 278 CO 0.10 0.39 0.49 0.00 -1.61 0.00 0.00 178.31 177.68 3fyu h ALA 279 N 1.66 1.25 -0.13 2.45 0.00 -0.91 0.15 119.26 123.73 3fyu h ALA 279 Ca 0.12 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3fyu h ALA 279 Cb 0.13 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.58 3fyu h ALA 279 CO -0.01 0.62 -0.48 0.00 0.00 0.00 0.00 179.25 179.38 3fyu h ALA 280 N 1.35 0.23 -0.45 0.00 0.00 -1.05 -3.07 119.26 116.27 3fyu h ALA 280 Ca 0.30 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3fyu h ALA 280 Cb -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3fyu h ALA 280 CO -0.05 0.40 0.27 -0.92 0.00 0.00 0.00 179.25 178.94 3fyu h TYR 281 N 0.18 0.59 0.00 0.00 3.20 -0.83 -2.56 116.97 117.56 3fyu h TYR 281 Ca -0.02 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 3fyu h TYR 281 Cb 1.11 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.19 3fyu h TYR 281 CO 0.11 0.42 0.00 0.09 -1.64 0.00 0.00 178.16 177.14 3fyu n ASN 282 N -4.73 0.29 -0.59 -2.11 3.02 0.48 -1.95 115.26 109.68 3fyu n ASN 282 Ca 0.01 0.57 0.13 0.00 -0.03 0.00 0.00 54.58 55.26 3fyu n ASN 282 Cb 0.06 -0.63 0.28 0.00 -0.61 0.00 0.00 39.78 38.88 3fyu n ASN 282 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3fyu n HIS 283 N -1.82 0.00 -3.01 3.10 8.25 -0.97 -4.89 115.22 115.88 3fyu n HIS 283 Ca 0.03 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.14 3fyu n HIS 283 Cb 0.21 -0.02 -0.06 0.00 1.12 0.00 0.00 29.99 31.23 3fyu n HIS 283 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3fyu s LEU 284 N -2.16 4.26 -0.46 2.41 1.43 -0.82 -2.76 118.68 120.58 3fyu s LEU 284 Ca 0.29 1.52 0.04 0.00 -1.03 0.00 0.00 54.13 54.96 3fyu s LEU 284 Cb 0.20 -3.85 0.17 0.00 0.03 0.00 0.00 46.19 42.75 3fyu s LEU 284 CO 0.39 -0.06 0.38 -0.62 0.23 0.00 0.00 176.35 176.67 3fyu n GLU 285 N 0.40 0.48 -3.83 1.70 1.02 -1.26 -4.99 120.64 114.16 3fyu n GLU 285 Ca 0.00 -3.39 -0.06 0.00 -0.02 0.00 0.00 57.16 53.69 3fyu n GLU 285 Cb 0.51 -1.75 0.01 0.00 -0.02 0.00 0.00 31.44 30.19 3fyu n GLU 285 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3fyu s THR 286 N -0.25 0.00 -0.29 2.62 -1.32 -1.26 -4.78 115.64 110.36 3fyu s THR 286 Ca 0.32 -0.85 -0.29 0.00 -1.21 0.00 0.00 61.69 59.66 3fyu s THR 286 Cb 0.03 -2.59 -0.02 0.00 -1.51 0.00 0.00 72.50 68.41 3fyu s THR 286 CO -0.19 0.00 1.75 -1.81 -2.21 0.00 0.00 174.62 172.16 3fyu s ASP 287 N -3.11 6.04 0.14 8.08 1.01 -1.26 -4.90 116.67 122.67 3fyu s ASP 287 Ca 0.16 1.43 0.03 0.00 0.71 0.00 0.00 52.55 54.88 3fyu s ASP 287 Cb -0.04 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3fyu s ASP 287 CO 0.08 -1.56 -0.06 -1.59 0.21 0.00 0.00 175.17 172.25 3fyu s LYS 288 N 5.35 1.00 -0.21 8.23 -2.85 -1.26 -0.06 119.74 129.94 3fyu s LYS 288 Ca 0.78 -1.44 -0.11 0.00 -1.00 0.00 0.00 55.97 54.20 3fyu s LYS 288 Cb -0.24 -0.38 0.07 0.00 -2.06 0.00 0.00 37.83 35.22 3fyu s LYS 288 CO 0.33 -0.02 0.51 0.34 0.10 0.00 0.00 175.35 176.60 3fyu s ASP 289 N -3.13 -0.66 -0.25 0.03 2.15 -0.62 -4.96 116.67 109.24 3fyu s ASP 289 Ca 0.17 1.12 -0.04 0.00 0.43 0.00 0.00 52.55 54.23 3fyu s ASP 289 Cb 0.05 1.04 0.01 0.00 -0.30 0.00 0.00 42.92 43.72 3fyu s ASP 289 CO -0.00 -0.21 -0.02 -0.22 -0.17 0.00 0.00 175.17 174.55 3fyu s LEU 290 N 1.59 3.27 -0.17 -1.34 2.96 -1.26 -0.86 118.68 122.86 3fyu s LEU 290 Ca -0.09 -0.68 -0.23 0.00 -0.22 0.00 0.00 54.13 52.91 3fyu s LEU 290 Cb -0.08 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 3fyu s LEU 290 CO -0.15 -0.11 0.71 -0.54 -1.32 0.00 0.00 176.35 174.94 3fyu s LYS 291 N 1.42 4.26 -0.21 1.98 -0.14 0.29 -4.97 119.74 122.38 3fyu s LYS 291 Ca 0.03 0.79 -0.05 0.00 -1.36 0.00 0.00 55.97 55.37 3fyu s LYS 291 Cb -0.16 -3.56 -0.02 0.00 -1.68 0.00 0.00 37.83 32.40 3fyu s LYS 291 CO -0.02 -0.24 0.01 0.08 -0.76 0.00 0.00 175.35 174.41 3fyu s VAL 292 N 1.90 4.01 -0.34 3.17 1.01 -1.26 -0.99 120.40 127.90 3fyu s VAL 292 Ca 0.33 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.06 3fyu s VAL 292 Cb -0.16 -2.82 0.10 0.00 0.00 0.00 0.00 36.38 33.50 3fyu s VAL 292 CO 0.12 0.42 0.05 -0.31 0.00 0.00 0.00 175.10 175.38 3fyu s TYR 293 N 1.05 3.66 0.24 5.22 2.02 -0.20 -4.99 117.35 124.35 3fyu s TYR 293 Ca 0.02 -2.95 -0.06 0.00 -0.37 0.00 0.00 57.07 53.72 3fyu s TYR 293 Cb -0.14 -2.87 0.42 0.00 -0.40 0.00 0.00 41.96 38.97 3fyu s TYR 293 CO 0.02 -0.94 1.71 -0.09 -1.57 0.00 0.00 175.55 174.68 3fyu h ARG 294 N 7.62 0.36 -0.49 -0.62 9.65 -1.95 -1.24 114.38 127.72 3fyu h ARG 294 Ca -0.05 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 3fyu h ARG 294 Cb 1.02 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.52 3fyu h ARG 294 CO 0.52 0.24 0.00 0.66 2.80 0.00 0.00 179.97 184.18 3fyu n TYR 295 N -5.06 0.69 -4.46 2.20 4.01 -1.26 -4.02 117.16 109.27 3fyu n TYR 295 Ca 0.13 -0.31 -0.24 0.00 -0.16 0.00 0.00 57.90 57.32 3fyu n TYR 295 Cb 0.40 -0.06 -0.10 0.00 -0.31 0.00 0.00 39.34 39.27 3fyu n TYR 295 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3fyu s PHE 296 N -1.53 2.27 0.00 -0.72 0.40 -1.08 -4.96 117.98 112.35 3fyu s PHE 296 Ca 0.29 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.28 3fyu s PHE 296 Cb 0.17 -1.00 0.00 0.00 0.51 0.00 0.00 43.02 42.69 3fyu s PHE 296 CO 0.18 0.68 0.00 0.41 0.70 0.00 0.00 175.22 177.19 3fyu n GLY 297 N -0.49 5.06 3.39 4.36 0.00 -1.26 -2.02 105.19 114.23 3fyu n GLY 297 Ca -0.06 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 3fyu n GLY 297 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3fyu n HIS 298 N 0.00 4.44 -3.84 1.61 -0.00 -1.26 -4.35 115.22 111.82 3fyu n HIS 298 Ca 0.00 -2.90 -0.09 0.00 0.46 0.00 0.00 57.72 55.19 3fyu n HIS 298 Cb 0.00 -2.58 0.01 0.00 -0.12 0.00 0.00 29.99 27.30 3fyu n HIS 298 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 3fyu s GLU 299 N 3.76 2.14 0.05 1.57 -1.05 -1.26 -5.07 118.70 118.84 3fyu s GLU 299 Ca 0.52 -1.41 -0.31 0.00 -0.15 0.00 0.00 54.97 53.62 3fyu s GLU 299 Cb 0.06 0.61 -0.07 0.00 -0.44 0.00 0.00 34.13 34.29 3fyu s GLU 299 CO 0.04 -0.99 1.40 0.12 0.95 0.00 0.00 175.26 176.78 3fyu s PHE 300 N -2.60 3.01 -0.41 4.83 5.36 -1.26 -4.98 117.98 121.92 3fyu s PHE 300 Ca 0.16 0.87 -0.04 0.00 -0.96 0.00 0.00 56.93 56.97 3fyu s PHE 300 Cb -0.05 -3.67 0.11 0.00 -0.34 0.00 0.00 43.02 39.07 3fyu s PHE 300 CO 0.12 -2.43 0.22 0.42 -1.46 0.00 0.00 175.22 172.08 3fyu s ILE 301 N 1.85 3.40 0.23 3.12 1.01 -1.26 -5.00 121.20 124.56 3fyu s ILE 301 Ca 0.64 -1.99 -0.16 0.00 0.00 0.00 0.00 60.65 59.14 3fyu s ILE 301 Cb -0.34 -3.31 0.25 0.00 0.01 0.00 0.00 42.46 39.08 3fyu s ILE 301 CO 0.28 -0.68 1.57 -0.65 0.00 0.00 0.00 174.94 175.46 3fyu h PRO 302 N 8.10 -0.04 -0.99 2.79 0.11 -2.01 0.14 132.00 140.10 3fyu h PRO 302 Ca -0.14 0.00 0.17 0.00 0.11 0.00 0.00 66.00 66.14 3fyu h PRO 302 Cb 1.05 0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.07 3fyu h PRO 302 CO 0.71 -0.03 0.60 0.00 -0.21 0.00 0.00 178.00 179.07 3fyu h ALA 303 N 1.43 1.59 0.00 -0.75 0.00 -2.02 -0.41 119.26 119.11 3fyu h ALA 303 Ca 0.34 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.26 3fyu h ALA 303 Cb 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3fyu h ALA 303 CO -0.88 0.03 -0.24 0.35 0.00 0.00 0.00 179.25 178.51 3fyu h PHE 304 N 0.82 0.00 -0.68 0.00 3.57 -1.17 -2.87 116.94 116.60 3fyu h PHE 304 Ca 0.55 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.98 3fyu h PHE 304 Cb 0.76 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 3fyu h PHE 304 CO -0.01 0.24 0.16 0.37 -2.23 0.00 0.00 178.31 176.84 3fyu h GLN 305 N 0.00 1.09 -0.35 1.11 5.75 -0.60 0.24 115.11 122.35 3fyu h GLN 305 Ca -0.00 -0.26 -0.02 0.00 -0.15 0.00 0.00 58.65 58.22 3fyu h GLN 305 Cb 0.83 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 3fyu h GLN 305 CO 0.03 0.97 0.16 1.15 -2.65 0.00 0.00 178.83 178.49 3fyu h THR 306 N 1.02 1.17 -0.23 2.39 2.02 -1.41 0.12 112.91 117.99 3fyu h THR 306 Ca 0.21 -0.51 0.02 0.00 0.77 0.00 0.00 66.41 66.90 3fyu h THR 306 Cb 0.37 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3fyu h THR 306 CO 0.00 0.19 0.10 -0.33 0.37 0.00 0.00 175.52 175.85 3fyu h GLU 307 N 0.43 0.21 0.16 6.66 4.39 -1.24 -0.31 114.58 124.89 3fyu h GLU 307 Ca 0.12 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 3fyu h GLU 307 Cb 0.15 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3fyu h GLU 307 CO -0.01 0.14 -0.10 -0.22 -1.16 0.00 0.00 179.01 177.66 3fyu h LYS 308 N 0.22 -0.24 -0.79 2.33 3.64 -0.24 0.16 116.57 121.65 3fyu h LYS 308 Ca 0.09 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3fyu h LYS 308 Cb 0.04 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 3fyu h LYS 308 CO -0.08 -0.16 0.44 -0.07 -2.27 0.00 0.00 179.45 177.31 3fyu h LEU 309 N -0.25 0.98 -0.09 5.20 3.38 -0.64 0.61 115.31 124.50 3fyu h LEU 309 Ca -0.01 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3fyu h LEU 309 Cb 0.21 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3fyu h LEU 309 CO 0.02 0.79 0.04 -1.28 0.09 0.00 0.00 178.44 178.10 3fyu h SER 310 N 1.09 0.12 -0.17 -0.43 0.87 -0.82 0.45 113.55 114.67 3fyu h SER 310 Ca 0.28 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 3fyu h SER 310 Cb 0.03 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 3fyu h SER 310 CO -0.05 0.23 0.10 0.15 -0.53 0.00 0.00 176.83 176.74 3fyu h PHE 311 N 0.01 0.20 -0.43 2.24 3.04 -0.36 0.15 116.94 121.79 3fyu h PHE 311 Ca 0.03 0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.91 3fyu h PHE 311 Cb 0.15 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 38.57 3fyu h PHE 311 CO -0.02 0.12 -0.04 -0.07 -2.02 0.00 0.00 178.31 176.28 3fyu h LEU 312 N 0.22 0.69 -0.41 0.59 3.38 -0.80 -1.62 115.31 117.36 3fyu h LEU 312 Ca 0.06 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 3fyu h LEU 312 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3fyu h LEU 312 CO -0.02 0.78 0.05 -0.61 0.09 0.00 0.00 178.44 178.73 3fyu h GLN 313 N 0.66 0.68 -0.51 1.13 4.15 -0.55 0.24 115.11 120.92 3fyu h GLN 313 Ca 0.13 -0.19 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 3fyu h GLN 313 Cb 0.47 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 3fyu h GLN 313 CO 0.02 0.74 0.22 -0.22 -1.93 0.00 0.00 178.83 177.66 3fyu h LYS 314 N 0.53 0.76 0.00 1.69 3.64 -0.66 -1.83 116.57 120.70 3fyu h LYS 314 Ca 0.12 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3fyu h LYS 314 Cb 0.40 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 3fyu h LYS 314 CO 0.01 0.65 -1.08 0.72 -2.27 0.00 0.00 179.45 177.48 3fyu n HIS 315 N -4.56 0.69 -0.02 1.91 8.25 -0.64 -4.64 115.22 116.21 3fyu n HIS 315 Ca 0.02 0.20 -0.02 0.00 -0.26 0.00 0.00 57.72 57.66 3fyu n HIS 315 Cb 0.14 -0.78 -0.02 0.00 1.12 0.00 0.00 29.99 30.45 3fyu n HIS 315 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3fyu n LEU 316 N -2.44 1.78 -0.28 2.41 4.77 0.85 -4.97 117.00 119.12 3fyu n LEU 316 Ca 0.00 -0.01 0.15 0.00 -0.03 0.00 0.00 56.01 56.12 3fyu n LEU 316 Cb 0.52 -0.05 0.70 0.00 -2.33 0.00 0.00 43.42 42.26 3fyu n LEU 316 CO 0.40 0.37 0.97 0.18 -1.33 0.00 0.00 177.39 177.98