#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fyu s GLN 2 N 0.00 0.77 0.57 2.12 2.00 -1.26 -5.03 119.66 118.83 3fyu s GLN 2 Ca 0.00 -1.25 -0.18 0.00 -2.00 0.00 0.00 55.36 51.92 3fyu s GLN 2 Cb 0.00 0.25 -0.07 0.00 0.80 0.00 0.00 33.01 33.98 3fyu s GLN 2 CO 0.00 -0.20 0.70 1.28 -0.50 0.00 0.00 175.29 176.57 3fyu n LEU 3 N 0.00 1.88 0.00 3.68 4.32 -1.26 -4.74 117.00 120.88 3fyu n LEU 3 Ca -0.11 0.78 0.00 0.00 -0.02 0.00 0.00 56.01 56.66 3fyu n LEU 3 Cb 0.62 -1.26 0.00 0.00 -1.62 0.00 0.00 43.42 41.17 3fyu n LEU 3 CO 0.28 -2.56 0.00 2.22 -1.22 0.00 0.00 177.39 176.10 3fyu n PHE 4 N -1.64 0.00 -0.20 -1.77 -1.74 -1.26 -5.08 117.46 105.77 3fyu n PHE 4 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.01 3fyu n PHE 4 Cb 0.47 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.47 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 -0.87 -0.05 -4.70 5.98 -0.08 -1.26 -5.00 116.55 110.57 3fyu n ASP 5 Ca 0.00 -0.20 -0.34 0.00 -1.51 0.00 0.00 54.79 52.75 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 3.18 0.85 -2.67 1.43 -1.26 -4.97 118.68 115.23 3fyu s LEU 6 Ca 0.00 2.38 -0.11 0.00 -1.03 0.00 0.00 54.13 55.37 3fyu s LEU 6 Cb 0.00 -4.59 0.10 0.00 0.03 0.00 0.00 46.19 41.73 3fyu s LEU 6 CO 0.00 -2.60 1.13 -0.94 0.23 0.00 0.00 176.35 174.18 3fyu s SER 7 N -2.11 3.60 0.28 2.29 1.04 -1.26 -4.67 113.70 112.88 3fyu s SER 7 Ca 0.74 2.07 -0.02 0.00 0.48 0.00 0.00 55.95 59.22 3fyu s SER 7 Cb -0.29 -2.55 0.44 0.00 0.10 0.00 0.00 66.02 63.71 3fyu s SER 7 CO 0.49 -2.65 1.91 0.25 0.98 0.00 0.00 173.24 174.23 3fyu h LEU 8 N -1.46 1.00 -0.83 2.42 5.85 -1.99 0.18 115.31 120.48 3fyu h LEU 8 Ca -0.44 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.30 3fyu h LEU 8 Cb 1.26 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 3fyu h LEU 8 CO 0.46 0.66 0.54 -0.08 -0.34 0.00 0.00 178.44 179.68 3fyu h GLU 9 N 1.14 1.06 -0.13 1.25 4.81 -2.01 -2.07 114.58 118.62 3fyu h GLU 9 Ca 0.40 -0.06 -0.23 0.00 -0.13 0.00 0.00 59.36 59.34 3fyu h GLU 9 Cb 0.11 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.26 3fyu h GLU 9 CO -0.14 0.70 -0.80 0.93 -0.73 0.00 0.00 179.01 178.97 3fyu h GLU 10 N 1.09 0.78 -0.75 1.92 5.08 -1.60 -3.28 114.58 117.81 3fyu h GLU 10 Ca 0.31 -0.66 0.09 0.00 -1.00 0.00 0.00 59.36 58.11 3fyu h GLU 10 Cb -0.08 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 3fyu h GLU 10 CO -0.08 1.26 0.40 -0.07 -1.00 0.00 0.00 179.01 179.52 3fyu h LEU 11 N 0.50 0.55 -2.31 1.33 3.38 -0.35 0.25 115.31 118.67 3fyu h LEU 11 Ca -0.06 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3fyu h LEU 11 Cb 1.44 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 3fyu h LEU 11 CO 0.16 0.31 -0.04 0.11 0.09 0.00 0.00 178.44 179.08 3fyu h LYS 12 N 0.68 0.00 -0.01 1.13 1.57 -1.44 -2.08 116.57 116.41 3fyu h LYS 12 Ca 0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 3fyu h LYS 12 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3fyu h LYS 12 CO -0.26 0.04 -0.46 1.63 -0.57 0.00 0.00 179.45 179.83 3fyu n LYS 13 N -3.78 1.37 -2.15 3.15 5.02 -0.45 -4.93 118.16 116.38 3fyu n LYS 13 Ca -0.03 -0.82 -0.43 0.00 -2.02 0.00 0.00 58.31 55.01 3fyu n LYS 13 Cb 0.13 -1.39 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 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 -2.28 2.09 -0.40 2.13 5.04 -0.05 -4.91 117.35 118.97 3fyu s TYR 14 Ca 0.15 0.63 0.03 0.00 -2.44 0.00 0.00 57.07 55.45 3fyu s TYR 14 Cb 0.16 -4.16 0.16 0.00 0.35 0.00 0.00 41.96 38.47 3fyu s TYR 14 CO 0.53 -2.58 0.38 0.21 -1.34 0.00 0.00 175.55 172.74 3fyu s LYS 15 N 5.19 0.78 0.51 4.97 2.20 -1.26 -4.11 119.74 128.01 3fyu s LYS 15 Ca 0.71 -1.44 -0.22 0.00 -0.36 0.00 0.00 55.97 54.65 3fyu s LYS 15 Cb -0.20 -1.00 -0.06 0.00 -1.51 0.00 0.00 37.83 35.06 3fyu s LYS 15 CO 0.32 -1.29 1.31 -1.25 -0.36 0.00 0.00 175.35 174.09 3fyu s PRO 16 N 0.77 3.37 0.33 4.03 0.04 -1.26 -4.94 135.00 137.34 3fyu s PRO 16 Ca 0.25 2.13 -0.29 0.00 0.04 0.00 0.00 61.00 63.13 3fyu s PRO 16 Cb -0.08 -2.35 -0.12 0.00 0.04 0.00 0.00 34.50 32.00 3fyu s PRO 16 CO -0.09 -0.97 1.39 1.63 0.04 0.00 0.00 177.00 179.00 3fyu n LYS 17 N -0.78 2.30 -1.68 4.56 5.02 -1.26 -4.91 118.16 121.41 3fyu n LYS 17 Ca 0.09 0.81 -0.37 0.00 -2.02 0.00 0.00 58.31 56.81 3fyu n LYS 17 Cb 0.45 -2.46 0.06 0.00 -0.02 0.00 0.00 35.03 33.06 3fyu n LYS 17 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3fyu n LYS 18 N 0.97 1.08 -0.11 1.97 5.02 -1.26 -4.92 118.16 120.91 3fyu n LYS 18 Ca 0.06 0.42 0.05 0.00 -2.02 0.00 0.00 58.31 56.81 3fyu n LYS 18 Cb 0.36 -2.38 0.10 0.00 -0.02 0.00 0.00 35.03 33.09 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 -1.74 0.71 -1.71 -0.18 -2.24 -1.26 -5.03 114.28 102.84 3fyu n THR 19 Ca 0.14 -0.86 -0.43 0.00 -2.27 0.00 0.00 64.05 60.63 3fyu n THR 19 Cb 0.47 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.37 3fyu n THR 19 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fyu n ALA 20 N 0.40 2.13 -1.65 6.98 0.00 -1.26 -4.86 120.51 122.25 3fyu n ALA 20 Ca 0.08 0.40 -0.30 0.00 0.00 0.00 0.00 53.44 53.63 3fyu n ALA 20 Cb 0.35 -2.42 0.09 0.00 0.00 0.00 0.00 19.45 17.46 3fyu n ALA 20 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3fyu s ARG 21 N 0.33 2.10 0.64 0.00 3.00 -1.26 -4.92 118.95 118.85 3fyu s ARG 21 Ca 0.71 0.51 0.39 0.00 0.00 0.00 0.00 55.73 57.34 3fyu s ARG 21 Cb -0.57 -1.93 2.18 0.00 0.00 0.00 0.00 34.95 34.63 3fyu s ARG 21 CO 0.41 -1.58 2.30 -1.35 0.00 0.00 0.00 175.30 175.09 3fyu h PRO 22 N -1.05 0.00 -0.57 3.54 0.11 -2.04 -1.35 132.00 130.64 3fyu h PRO 22 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.52 3fyu h PRO 22 Cb 1.28 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 3fyu h PRO 22 CO 0.61 0.00 0.12 -0.40 -0.21 0.00 0.00 178.00 178.13 3fyu n ASP 23 N -3.33 4.65 0.06 -2.05 5.75 -1.26 -4.72 116.55 115.65 3fyu n ASP 23 Ca -0.03 -3.16 -0.04 0.00 -0.01 0.00 0.00 54.79 51.54 3fyu n ASP 23 Cb 0.11 -0.68 -0.03 0.00 -1.03 0.00 0.00 41.12 39.49 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 2.64 -0.37 0.00 2.11 3.57 -1.60 0.92 116.94 124.21 3fyu h PHE 24 Ca 0.15 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3fyu h PHE 24 Cb 2.02 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 40.90 3fyu h PHE 24 CO 1.06 -0.16 -0.10 0.66 -2.23 0.00 0.00 178.31 177.53 3fyu h SER 25 N -0.23 0.00 -0.37 0.41 4.64 -1.85 -1.27 113.55 114.89 3fyu h SER 25 Ca -0.01 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.23 3fyu h SER 25 Cb 0.21 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 3fyu h SER 25 CO -0.04 0.10 -0.05 -0.78 -0.87 0.00 0.00 176.83 175.19 3fyu h ASP 26 N 0.00 0.75 -0.51 4.97 3.58 -1.78 0.95 116.42 124.38 3fyu h ASP 26 Ca -0.00 -0.20 -0.04 0.00 0.42 0.00 0.00 57.03 57.21 3fyu h ASP 26 Cb 0.19 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.02 3fyu h ASP 26 CO 0.01 0.85 0.16 0.15 -2.88 0.00 0.00 179.24 177.53 3fyu h PHE 27 N 0.71 0.82 0.00 0.28 3.57 0.38 -1.09 116.94 121.61 3fyu h PHE 27 Ca 0.13 -0.08 -0.13 0.00 3.53 0.00 0.00 57.97 61.41 3fyu h PHE 27 Cb 0.51 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3fyu h PHE 27 CO 0.03 0.71 -0.64 -1.49 -2.23 0.00 0.00 178.31 174.69 3fyu h TRP 28 N 0.69 0.00 -0.16 0.41 4.06 -1.19 -0.07 115.95 119.69 3fyu h TRP 28 Ca 0.16 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.09 3fyu h TRP 28 Cb 0.28 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.43 3fyu h TRP 28 CO 0.02 0.64 -0.00 -0.22 -3.56 0.00 0.00 178.44 175.31 3fyu h LYS 29 N 0.00 0.28 -0.49 0.49 3.64 -0.54 -0.20 116.57 119.75 3fyu h LYS 29 Ca -0.01 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.22 3fyu h LYS 29 Cb 1.18 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 3fyu h LYS 29 CO 0.08 0.51 0.09 0.87 -2.27 0.00 0.00 179.45 178.73 3fyu h LYS 30 N 0.02 0.81 -0.52 1.90 1.57 -1.11 -2.03 116.57 117.22 3fyu h LYS 30 Ca 0.04 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3fyu h LYS 30 Cb 0.39 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 3fyu h LYS 30 CO 0.01 0.80 0.33 0.77 -0.57 0.00 0.00 179.45 180.80 3fyu h SER 31 N 0.68 0.60 -0.21 0.86 0.02 -0.89 -0.98 113.55 113.63 3fyu h SER 31 Ca 0.15 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.02 3fyu h SER 31 Cb 0.38 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3fyu h SER 31 CO 0.01 0.45 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.07 3fyu h LEU 32 N 0.70 0.47 -0.85 5.07 3.38 -0.91 -1.87 115.31 121.31 3fyu h LEU 32 Ca 0.19 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 3fyu h LEU 32 Cb -0.06 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3fyu h LEU 32 CO -0.04 0.55 -0.21 -0.08 0.09 0.00 0.00 178.44 178.75 3fyu h GLU 33 N 0.48 0.63 -0.12 1.13 4.57 -0.59 0.24 114.58 120.92 3fyu h GLU 33 Ca 0.10 -0.23 -0.13 0.00 -1.18 0.00 0.00 59.36 57.92 3fyu h GLU 33 Cb 0.33 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 3fyu h GLU 33 CO 0.01 0.79 -0.52 0.93 -1.18 0.00 0.00 179.01 179.05 3fyu h GLU 34 N 0.56 0.32 -0.03 1.92 5.08 -0.63 -2.57 114.58 119.23 3fyu h GLU 34 Ca 0.09 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3fyu h GLU 34 Cb 0.66 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 3fyu h GLU 34 CO 0.05 0.76 0.00 1.25 -1.00 0.00 0.00 179.01 180.07 3fyu h LEU 35 N 0.25 0.05 -1.86 1.33 5.85 -0.81 -2.78 115.31 117.33 3fyu h LEU 35 Ca 0.01 -0.27 0.21 0.00 0.84 0.00 0.00 57.88 58.67 3fyu h LEU 35 Cb 1.00 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 3fyu h LEU 35 CO 0.08 0.30 0.54 -0.09 -0.34 0.00 0.00 178.44 178.94 3fyu h ARG 36 N -0.21 0.11 0.00 1.25 2.43 -0.80 0.33 114.38 117.49 3fyu h ARG 36 Ca 0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3fyu h ARG 36 Cb 0.28 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3fyu h ARG 36 CO 0.00 0.08 0.00 1.04 -1.51 0.00 0.00 179.97 179.58 3fyu n GLN 37 N -4.37 0.14 -3.69 0.20 6.02 -0.98 -4.52 117.38 110.17 3fyu n GLN 37 Ca 0.16 0.15 -0.38 0.00 -0.01 0.00 0.00 57.00 56.92 3fyu n GLN 37 Cb 0.77 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.41 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 -2.78 4.31 0.22 5.09 1.01 0.11 -5.06 120.40 123.32 3fyu s VAL 38 Ca 0.13 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.19 3fyu s VAL 38 Cb 0.12 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 33.14 3fyu s VAL 38 CO 0.30 0.03 1.63 -1.61 0.00 0.00 0.00 175.10 175.45 3fyu s GLU 39 N 1.55 4.15 0.17 2.72 0.41 -1.26 -4.85 118.70 121.60 3fyu s GLU 39 Ca 0.03 2.52 -0.14 0.00 -0.41 0.00 0.00 54.97 56.98 3fyu s GLU 39 Cb -0.17 -3.08 0.08 0.00 -1.78 0.00 0.00 34.13 29.18 3fyu s GLU 39 CO 0.05 -0.66 1.82 0.00 -0.49 0.00 0.00 175.26 175.97 3fyu h ALA 40 N 6.15 0.65 -6.88 5.21 0.00 -1.94 -3.40 119.26 119.05 3fyu h ALA 40 Ca -0.44 -0.02 -0.58 0.00 0.00 0.00 0.00 54.91 53.87 3fyu h ALA 40 Cb 1.21 -0.16 -0.14 0.00 0.00 0.00 0.00 17.79 18.70 3fyu h ALA 40 CO 0.89 0.03 -0.95 0.39 0.00 0.00 0.00 179.25 179.61 3fyu n GLU 41 N -4.78 -1.56 -1.51 0.00 1.02 -1.26 -0.09 120.64 112.45 3fyu n GLU 41 Ca 0.03 0.19 -0.34 0.00 -0.02 0.00 0.00 57.16 57.03 3fyu n GLU 41 Cb 0.06 -3.77 0.08 0.00 -0.02 0.00 0.00 31.44 27.79 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 -7.11 2.33 0.04 3.49 0.04 -1.26 -4.54 135.00 127.98 3fyu s PRO 42 Ca 0.06 1.60 0.03 0.00 0.04 0.00 0.00 61.00 62.73 3fyu s PRO 42 Cb -0.03 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.62 3fyu s PRO 42 CO 0.96 -1.66 -0.10 0.95 0.04 0.00 0.00 177.00 177.19 3fyu s THR 43 N -2.16 0.78 -0.11 1.26 -4.23 0.01 -4.98 115.64 106.21 3fyu s THR 43 Ca 0.71 -0.94 -0.01 0.00 -1.18 0.00 0.00 61.69 60.28 3fyu s THR 43 Cb -0.25 -0.76 0.03 0.00 1.34 0.00 0.00 72.50 72.85 3fyu s THR 43 CO 0.45 -0.15 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.10 3fyu s LEU 44 N -1.20 1.08 -0.15 4.79 2.96 -1.26 -2.22 118.68 122.67 3fyu s LEU 44 Ca -0.03 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 3fyu s LEU 44 Cb -0.08 -0.77 0.02 0.00 0.50 0.00 0.00 46.19 45.86 3fyu s LEU 44 CO 0.01 -0.14 -0.15 -0.70 -1.32 0.00 0.00 176.35 174.05 3fyu s GLU 45 N 1.76 2.42 0.61 1.98 2.12 -0.84 -4.96 118.70 121.78 3fyu s GLU 45 Ca 0.05 -0.61 -0.19 0.00 0.36 0.00 0.00 54.97 54.58 3fyu s GLU 45 Cb -0.13 -2.19 -0.04 0.00 0.26 0.00 0.00 34.13 32.04 3fyu s GLU 45 CO -0.08 -0.23 1.11 -1.13 -0.54 0.00 0.00 175.26 174.40 3fyu n SER 46 N 4.75 1.40 -3.82 -1.70 3.41 -1.26 -0.16 113.62 116.24 3fyu n SER 46 Ca -0.18 0.83 -0.20 0.00 -0.26 0.00 0.00 58.87 59.06 3fyu n SER 46 Cb 0.50 -1.46 -0.17 0.00 -0.26 0.00 0.00 64.21 62.82 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 -1.44 0.59 0.26 7.33 5.04 0.53 -4.71 117.35 124.94 3fyu s TYR 47 Ca 0.78 -0.13 -0.29 0.00 -2.44 0.00 0.00 57.07 54.99 3fyu s TYR 47 Cb -0.41 -0.65 -0.09 0.00 0.35 0.00 0.00 41.96 41.16 3fyu s TYR 47 CO 0.45 -0.23 1.21 -0.51 -1.34 0.00 0.00 175.55 175.13 3fyu s ASP 48 N 1.40 7.03 -0.18 4.32 1.01 -1.26 -4.16 116.67 124.84 3fyu s ASP 48 Ca -0.04 2.40 -0.14 0.00 0.71 0.00 0.00 52.55 55.48 3fyu s ASP 48 Cb -0.13 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.22 3fyu s ASP 48 CO -0.03 -0.36 0.46 -0.47 0.21 0.00 0.00 175.17 174.98 3fyu s TYR 49 N -0.70 -0.59 -0.71 4.23 6.14 -1.26 -5.07 117.35 119.40 3fyu s TYR 49 Ca 0.50 1.33 -0.22 0.00 0.64 0.00 0.00 57.07 59.32 3fyu s TYR 49 Cb -0.35 0.24 -0.17 0.00 0.42 0.00 0.00 41.96 42.10 3fyu s TYR 49 CO 0.43 -0.30 1.90 -0.35 0.64 0.00 0.00 175.55 177.87 3fyu n PRO 50 N 3.46 1.40 -3.95 4.97 -0.04 -1.26 -4.83 135.00 134.75 3fyu n PRO 50 Ca -0.17 -1.74 -0.09 0.00 -0.04 0.00 0.00 63.50 61.46 3fyu n PRO 50 Cb 0.56 -2.84 -0.10 0.00 -0.04 0.00 0.00 33.50 31.08 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 5.07 0.12 -0.08 0.52 0.11 -1.26 -5.15 120.40 119.72 3fyu s VAL 51 Ca 0.57 -1.02 0.01 0.00 -2.93 0.00 0.00 61.98 58.61 3fyu s VAL 51 Cb 0.14 -0.65 -0.02 0.00 -1.53 0.00 0.00 36.38 34.31 3fyu s VAL 51 CO 0.13 -0.56 -0.11 -0.75 -3.33 0.00 0.00 175.10 170.47 3fyu s LYS 52 N -2.11 2.90 0.00 1.54 2.20 -1.26 -4.59 119.74 118.42 3fyu s LYS 52 Ca -0.09 -0.64 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 3fyu s LYS 52 Cb -0.04 -2.54 0.00 0.00 -1.51 0.00 0.00 37.83 33.73 3fyu s LYS 52 CO -0.03 0.49 0.00 0.41 -0.36 0.00 0.00 175.35 175.86 3fyu n GLY 53 N 2.72 0.75 2.95 5.54 0.00 -1.26 -5.03 105.19 110.86 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 -2.45 0.00 -0.19 1.61 1.01 -1.26 0.53 120.40 119.65 3fyu s VAL 54 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.92 3fyu s VAL 54 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.24 3fyu s VAL 54 CO 0.00 -0.01 -0.02 -0.54 0.00 0.00 0.00 175.10 174.54 3fyu s LYS 55 N 0.02 3.60 0.00 2.72 1.02 -0.16 -4.84 119.74 122.10 3fyu s LYS 55 Ca -0.00 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 55.45 3fyu s LYS 55 Cb -0.01 -3.02 -0.04 0.00 -0.52 0.00 0.00 37.83 34.25 3fyu s LYS 55 CO 0.00 0.05 0.06 0.08 -0.92 0.00 0.00 175.35 174.62 3fyu s VAL 56 N 0.89 4.58 0.09 3.17 1.01 -1.26 -0.56 120.40 128.32 3fyu s VAL 56 Ca 0.00 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 3fyu s VAL 56 Cb -0.14 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 3fyu s VAL 56 CO 0.02 0.33 0.04 -0.31 0.00 0.00 0.00 175.10 175.18 3fyu s TYR 57 N -1.19 0.64 -0.22 5.22 1.51 0.18 -0.35 117.35 123.14 3fyu s TYR 57 Ca 0.23 -1.10 -0.08 0.00 -1.01 0.00 0.00 57.07 55.11 3fyu s TYR 57 Cb -0.12 -0.39 -0.04 0.00 -0.11 0.00 0.00 41.96 41.30 3fyu s TYR 57 CO 0.14 -0.47 0.08 0.50 -1.11 0.00 0.00 175.55 174.69 3fyu s ARG 58 N -3.97 3.82 -0.10 -0.62 6.06 0.77 0.10 118.95 125.01 3fyu s ARG 58 Ca 0.15 -0.41 0.01 0.00 -2.50 0.00 0.00 55.73 52.97 3fyu s ARG 58 Cb 0.07 -3.30 -0.02 0.00 0.06 0.00 0.00 34.95 31.76 3fyu s ARG 58 CO -0.05 0.02 -0.11 -1.17 -2.50 0.00 0.00 175.30 171.50 3fyu s LEU 59 N 1.07 2.90 0.06 -0.88 2.96 0.11 -2.00 118.68 122.91 3fyu s LEU 59 Ca 0.04 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.79 3fyu s LEU 59 Cb -0.14 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 3fyu s LEU 59 CO 0.03 0.26 -0.09 0.42 -1.32 0.00 0.00 176.35 175.65 3fyu s THR 60 N -0.21 0.73 0.13 3.68 -4.23 -0.94 -1.88 115.64 112.91 3fyu s THR 60 Ca 0.02 -1.31 -0.20 0.00 -1.18 0.00 0.00 61.69 59.03 3fyu s THR 60 Cb -0.13 -0.93 0.05 0.00 1.34 0.00 0.00 72.50 72.83 3fyu s THR 60 CO 0.03 -0.43 0.49 -0.72 -0.54 0.00 0.00 174.62 173.45 3fyu s TYR 61 N -1.77 -0.36 0.02 3.99 1.13 -0.19 -0.81 117.35 119.35 3fyu s TYR 61 Ca -0.04 0.13 -0.18 0.00 -1.41 0.00 0.00 57.07 55.57 3fyu s TYR 61 Cb -0.07 0.39 -0.06 0.00 -1.10 0.00 0.00 41.96 41.12 3fyu s TYR 61 CO 0.00 -0.75 0.53 -0.65 -2.51 0.00 0.00 175.55 172.16 3fyu s GLN 62 N -3.62 4.17 0.00 -3.49 -1.52 0.88 -0.50 119.66 115.58 3fyu s GLN 62 Ca 0.01 0.63 0.00 0.00 -1.95 0.00 0.00 55.36 54.05 3fyu s GLN 62 Cb 0.00 -3.28 0.00 0.00 -0.22 0.00 0.00 33.01 29.52 3fyu s GLN 62 CO -0.11 0.54 0.00 0.45 -0.25 0.00 0.00 175.29 175.92 3fyu n SER 63 N 2.17 0.32 -4.09 5.90 2.88 0.01 -4.31 113.62 116.50 3fyu n SER 63 Ca -0.10 -0.58 -0.47 0.00 -1.33 0.00 0.00 58.87 56.38 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 -1.42 0.66 7.35 -1.26 -0.12 117.46 122.51 3fyu n PHE 64 Ca 0.00 0.92 -0.15 0.00 -0.76 0.00 0.00 57.45 57.46 3fyu n PHE 64 Cb 0.00 -1.85 -0.06 0.00 0.35 0.00 0.00 39.48 37.92 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 1.71 1.48 3.13 7.13 0.00 -1.26 -2.52 105.19 114.86 3fyu n GLY 65 Ca 0.17 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.51 -1.96 -3.11 1.61 8.25 0.82 -4.70 115.22 113.61 3fyu n HIS 66 Ca -0.15 0.53 -0.37 0.00 -0.26 0.00 0.00 57.72 57.48 3fyu n HIS 66 Cb 0.51 -4.13 -0.06 0.00 1.12 0.00 0.00 29.99 27.43 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 -2.73 7.08 -0.43 0.41 0.01 -1.05 -4.78 113.70 112.21 3fyu s SER 67 Ca 0.34 1.41 -0.19 0.00 1.31 0.00 0.00 55.95 58.82 3fyu s SER 67 Cb -0.16 -2.42 0.02 0.00 0.21 0.00 0.00 66.02 63.68 3fyu s SER 67 CO 0.42 0.07 0.53 -0.75 0.41 0.00 0.00 173.24 173.92 3fyu s LYS 68 N -1.82 3.17 -0.02 12.44 2.20 -1.26 -0.81 119.74 133.64 3fyu s LYS 68 Ca 0.41 -0.61 -0.12 0.00 -0.36 0.00 0.00 55.97 55.29 3fyu s LYS 68 Cb -0.17 -3.97 -0.05 0.00 -1.51 0.00 0.00 37.83 32.13 3fyu s LYS 68 CO 0.21 -0.93 0.34 0.42 -0.36 0.00 0.00 175.35 175.03 3fyu s ILE 69 N 2.43 5.16 0.40 5.43 -1.09 0.35 -0.92 121.20 132.95 3fyu s ILE 69 Ca 0.16 0.64 0.04 0.00 -2.23 0.00 0.00 60.65 59.27 3fyu s ILE 69 Cb -0.16 -3.63 -0.03 0.00 -1.58 0.00 0.00 42.46 37.07 3fyu s ILE 69 CO 0.16 0.56 0.14 -1.61 -1.23 0.00 0.00 174.94 172.96 3fyu s GLU 70 N -1.14 1.91 0.00 2.79 2.02 -1.26 -1.02 118.70 122.00 3fyu s GLU 70 Ca 0.22 -2.16 0.00 0.00 0.02 0.00 0.00 54.97 53.06 3fyu s GLU 70 Cb -0.15 -0.53 0.00 0.00 0.10 0.00 0.00 34.13 33.55 3fyu s GLU 70 CO 0.11 -0.49 0.00 0.41 0.02 0.00 0.00 175.26 175.32 3fyu n GLY 71 N -0.88 3.18 3.81 -1.39 0.00 -0.79 -1.25 105.19 107.87 3fyu n GLY 71 Ca -0.05 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 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 3.33 -0.16 1.61 0.40 -1.25 -0.71 117.98 119.20 3fyu s PHE 72 Ca 0.00 1.64 -0.01 0.00 -0.60 0.00 0.00 56.93 57.96 3fyu s PHE 72 Cb 0.00 -2.91 0.04 0.00 0.51 0.00 0.00 43.02 40.66 3fyu s PHE 72 CO 0.00 -0.20 -0.02 -0.47 0.70 0.00 0.00 175.22 175.23 3fyu s TYR 73 N -2.02 1.37 -0.10 0.36 5.04 0.12 -1.34 117.35 120.78 3fyu s TYR 73 Ca 0.60 -0.87 -0.01 0.00 -2.44 0.00 0.00 57.07 54.35 3fyu s TYR 73 Cb -0.13 -1.16 -0.03 0.00 0.35 0.00 0.00 41.96 40.99 3fyu s TYR 73 CO 0.17 -0.56 -0.05 0.00 -1.34 0.00 0.00 175.55 173.77 3fyu s ALA 74 N 1.74 3.04 -0.02 3.97 0.00 0.43 0.51 121.76 131.44 3fyu s ALA 74 Ca 0.01 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.16 3fyu s ALA 74 Cb -0.15 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.58 3fyu s ALA 74 CO -0.07 0.46 -0.15 0.08 0.00 0.00 0.00 175.76 176.08 3fyu s VAL 75 N -0.46 1.20 0.32 0.00 1.01 0.27 -0.13 120.40 122.62 3fyu s VAL 75 Ca 0.07 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 3fyu s VAL 75 Cb -0.12 -1.01 -0.11 0.00 0.00 0.00 0.00 36.38 35.14 3fyu s VAL 75 CO 0.02 0.34 1.55 -2.84 0.00 0.00 0.00 175.10 174.17 3fyu s PRO 76 N -0.23 4.12 -1.38 2.72 0.02 -1.26 -0.99 135.00 138.00 3fyu s PRO 76 Ca 0.03 2.57 -0.12 0.00 0.02 0.00 0.00 61.00 63.51 3fyu s PRO 76 Cb -0.07 -3.00 0.09 0.00 0.02 0.00 0.00 34.50 31.54 3fyu s PRO 76 CO -0.00 -0.59 2.10 -3.47 -0.33 0.00 0.00 177.00 174.71 3fyu n ASP 77 N 1.51 4.66 -3.67 2.53 2.03 0.19 -4.76 116.55 119.04 3fyu n ASP 77 Ca 0.05 -2.96 -0.10 0.00 0.52 0.00 0.00 54.79 52.31 3fyu n ASP 77 Cb 0.38 -1.57 -0.02 0.00 -0.72 0.00 0.00 41.12 39.19 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 1.81 1.49 0.32 -0.67 -2.07 -1.26 -4.87 119.66 114.41 3fyu s GLN 78 Ca 0.45 -0.77 -0.29 0.00 -1.82 0.00 0.00 55.36 52.92 3fyu s GLN 78 Cb 0.12 0.58 -0.11 0.00 -1.09 0.00 0.00 33.01 32.51 3fyu s GLN 78 CO -0.05 -0.66 1.53 0.95 -1.32 0.00 0.00 175.29 175.74 3fyu s THR 79 N -3.85 2.15 0.00 3.63 -4.23 -1.26 -5.02 115.64 107.06 3fyu s THR 79 Ca 0.07 0.13 0.00 0.00 -1.18 0.00 0.00 61.69 60.71 3fyu s THR 79 Cb -0.03 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.73 3fyu s THR 79 CO -0.03 0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 3fyu n GLY 80 N 1.53 1.11 3.77 3.99 0.00 -1.26 -4.84 105.19 109.48 3fyu n GLY 80 Ca 0.05 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.87 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 2.09 3.01 0.14 1.61 0.02 -1.26 -5.10 135.00 135.50 3fyu s PRO 81 Ca 0.00 1.57 0.06 0.00 0.02 0.00 0.00 61.00 62.66 3fyu s PRO 81 Cb 0.00 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.52 3fyu s PRO 81 CO 0.00 -1.12 -0.01 -1.01 -0.33 0.00 0.00 177.00 174.53 3fyu s HIS 82 N -1.97 2.88 0.50 6.54 3.76 0.11 -4.73 115.29 122.38 3fyu s HIS 82 Ca 0.71 -0.10 -0.20 0.00 -0.15 0.00 0.00 55.06 55.32 3fyu s HIS 82 Cb -0.24 -1.44 -0.08 0.00 1.11 0.00 0.00 32.58 31.93 3fyu s HIS 82 CO 0.34 0.49 1.04 -1.25 -0.85 0.00 0.00 174.74 174.52 3fyu s PRO 83 N -2.63 3.76 0.28 8.40 0.04 -1.26 -0.84 135.00 142.75 3fyu s PRO 83 Ca 0.26 1.35 0.08 0.00 0.04 0.00 0.00 61.00 62.73 3fyu s PRO 83 Cb -0.10 -2.09 -0.06 0.00 0.04 0.00 0.00 34.50 32.29 3fyu s PRO 83 CO 0.18 -0.47 -0.09 0.00 0.04 0.00 0.00 177.00 176.66 3fyu s ALA 84 N -2.02 2.44 -0.01 8.56 0.00 -0.02 -1.12 121.76 129.59 3fyu s ALA 84 Ca 0.67 -1.90 0.01 0.00 0.00 0.00 0.00 51.96 50.73 3fyu s ALA 84 Cb -0.16 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.04 3fyu s ALA 84 CO 0.21 0.00 -0.02 -0.51 0.00 0.00 0.00 175.76 175.45 3fyu s LEU 85 N -3.46 1.82 -0.31 0.00 1.43 -0.15 -0.74 118.68 117.27 3fyu s LEU 85 Ca 0.29 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 3fyu s LEU 85 Cb 0.02 -0.15 0.04 0.00 0.03 0.00 0.00 46.19 46.13 3fyu s LEU 85 CO 0.12 0.00 0.05 -0.69 0.23 0.00 0.00 176.35 176.06 3fyu s VAL 86 N 0.18 3.40 -0.14 -1.59 1.01 -0.51 -1.33 120.40 121.42 3fyu s VAL 86 Ca -0.01 -1.18 -0.12 0.00 0.00 0.00 0.00 61.98 60.67 3fyu s VAL 86 Cb -0.04 -2.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 3fyu s VAL 86 CO -0.00 -0.09 0.23 -0.60 0.00 0.00 0.00 175.10 174.63 3fyu s ARG 87 N 1.34 4.03 -0.09 2.72 3.52 -0.26 -1.70 118.95 128.51 3fyu s ARG 87 Ca -0.03 0.01 0.01 0.00 -0.13 0.00 0.00 55.73 55.59 3fyu s ARG 87 Cb -0.19 -3.35 -0.02 0.00 -1.56 0.00 0.00 34.95 29.82 3fyu s ARG 87 CO 0.01 0.42 -0.11 -0.06 -0.81 0.00 0.00 175.30 174.75 3fyu s PHE 88 N -0.05 2.83 0.53 5.12 0.40 -0.08 -2.19 117.98 124.54 3fyu s PHE 88 Ca 0.15 -0.30 -0.03 0.00 -0.60 0.00 0.00 56.93 56.14 3fyu s PHE 88 Cb -0.13 -1.76 0.00 0.00 0.51 0.00 0.00 43.02 41.64 3fyu s PHE 88 CO 0.03 0.05 0.80 -3.38 0.70 0.00 0.00 175.22 173.43 3fyu s HIS 89 N -0.24 3.25 0.84 0.36 -3.43 -1.26 -3.65 115.29 111.15 3fyu s HIS 89 Ca 0.02 0.47 -0.12 0.00 -0.80 0.00 0.00 55.06 54.63 3fyu s HIS 89 Cb -0.13 -2.54 0.10 0.00 -1.43 0.00 0.00 32.58 28.57 3fyu s HIS 89 CO 0.03 -0.61 1.12 0.20 -2.00 0.00 0.00 174.74 173.47 3fyu s GLY 90 N -4.26 1.60 -0.10 -1.38 0.00 -1.26 -2.70 107.32 99.22 3fyu s GLY 90 Ca 0.51 -0.35 -0.32 0.00 0.00 0.00 0.00 44.72 44.57 3fyu s GLY 90 CO 0.42 0.13 2.02 2.98 0.00 0.00 0.00 173.10 178.65 3fyu n TYR 91 N -3.56 2.25 -1.69 1.90 9.36 -1.26 -1.61 117.16 122.55 3fyu n TYR 91 Ca 0.07 -0.14 -0.16 0.00 3.32 0.00 0.00 57.90 61.00 3fyu n TYR 91 Cb 0.58 -2.72 -0.05 0.00 -0.63 0.00 0.00 39.34 36.52 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 8.35 -4.23 -1.00 2.98 5.15 -1.26 -4.83 115.26 120.42 3fyu n ASN 92 Ca 0.25 0.32 0.08 0.00 -0.60 0.00 0.00 54.58 54.63 3fyu n ASN 92 Cb 0.36 -3.78 0.27 0.00 -0.53 0.00 0.00 39.78 36.10 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 0.06 3.13 -2.61 5.20 0.00 -0.64 -4.97 120.51 120.69 3fyu n ALA 93 Ca -0.16 -2.31 -0.38 0.00 0.00 0.00 0.00 53.44 50.59 3fyu n ALA 93 Cb 0.54 -0.76 -0.10 0.00 0.00 0.00 0.00 19.45 19.13 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 -1.85 6.09 -0.21 0.00 0.15 -1.26 -4.67 113.70 111.95 3fyu s SER 94 Ca 0.44 0.07 -0.02 0.00 0.70 0.00 0.00 55.95 57.14 3fyu s SER 94 Cb 0.35 -2.13 -0.00 0.00 -1.71 0.00 0.00 66.02 62.53 3fyu s SER 94 CO 0.09 -0.04 -0.09 -0.31 1.20 0.00 0.00 173.24 174.10 3fyu s TYR 95 N 1.61 2.91 -1.47 3.44 1.51 -1.26 -4.64 117.35 119.45 3fyu s TYR 95 Ca 0.09 -1.13 -0.12 0.00 -1.01 0.00 0.00 57.07 54.89 3fyu s TYR 95 Cb -0.15 -2.05 0.08 0.00 -0.11 0.00 0.00 41.96 39.73 3fyu s TYR 95 CO 0.09 -0.62 0.75 -0.25 -1.11 0.00 0.00 175.55 174.42 3fyu n ASP 96 N 4.73 -4.41 -0.83 2.29 10.43 -1.26 -1.05 116.55 126.45 3fyu n ASP 96 Ca -0.19 -0.62 -0.11 0.00 2.57 0.00 0.00 54.79 56.44 3fyu n ASP 96 Cb 0.51 -3.57 -0.05 0.00 1.84 0.00 0.00 41.12 39.85 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 -1.46 1.13 2.40 0.44 0.00 -1.26 -2.89 105.19 103.54 3fyu n GLY 97 Ca 0.01 -0.17 -0.14 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.63 -0.33 0.37 -0.02 0.00 -0.21 -4.68 105.19 99.69 3fyu n GLY 98 Ca -0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 0.81 -0.57 -0.61 2.10 -1.74 -1.94 117.51 115.56 3fyu h ILE 99 Ca -0.33 -0.27 -0.06 0.00 1.08 0.00 0.00 64.86 65.29 3fyu h ILE 99 Cb 1.22 -0.04 -0.03 0.00 -1.09 0.00 0.00 36.82 36.88 3fyu h ILE 99 CO 0.40 0.14 0.13 0.45 -1.08 0.00 0.00 178.15 178.19 3fyu h HIS 100 N 0.78 0.93 -0.02 2.19 3.86 -1.88 -0.54 115.15 120.46 3fyu h HIS 100 Ca 0.50 -0.09 -0.21 0.00 -1.16 0.00 0.00 60.37 59.41 3fyu h HIS 100 Cb 0.73 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.94 3fyu h HIS 100 CO -0.00 0.78 -0.87 -0.44 0.86 0.00 0.00 177.93 178.25 3fyu h ASP 101 N 0.86 0.48 -0.35 2.45 3.32 -1.77 -2.24 116.42 119.16 3fyu h ASP 101 Ca 0.18 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 3fyu h ASP 101 Cb 0.32 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3fyu h ASP 101 CO 0.00 1.15 0.21 0.40 -1.72 0.00 0.00 179.24 179.28 3fyu h ILE 102 N 0.23 1.11 -0.51 0.35 1.08 -1.02 -0.74 117.51 118.00 3fyu h ILE 102 Ca -0.06 -0.25 -0.01 0.00 -0.39 0.00 0.00 64.86 64.16 3fyu h ILE 102 Cb 1.49 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 35.87 3fyu h ILE 102 CO 0.15 0.11 0.30 0.58 -0.69 0.00 0.00 178.15 178.60 3fyu h VAL 103 N 0.45 1.16 -0.66 1.67 2.07 -1.06 -2.05 116.25 117.85 3fyu h VAL 103 Ca 0.12 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3fyu h VAL 103 Cb -0.01 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 3fyu h VAL 103 CO -0.02 0.17 0.38 0.78 0.02 0.00 0.00 177.57 178.90 3fyu h ASN 104 N 0.69 0.79 -0.58 0.57 2.35 -1.01 0.23 115.58 118.62 3fyu h ASN 104 Ca 0.18 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 3fyu h ASN 104 Cb 0.01 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.16 3fyu h ASN 104 CO -0.03 0.62 0.22 -0.50 -1.65 0.00 0.00 177.43 176.09 3fyu h TRP 105 N 0.91 0.92 -0.10 1.19 -0.00 -0.61 -0.75 115.95 117.51 3fyu h TRP 105 Ca 0.24 -0.06 -0.10 0.00 -0.00 0.00 0.00 58.89 58.96 3fyu h TRP 105 Cb -0.01 -0.28 -0.01 0.00 -0.00 0.00 0.00 29.16 28.86 3fyu h TRP 105 CO 0.00 0.72 -0.40 0.00 -0.00 0.00 0.00 178.44 178.77 3fyu h ALA 106 N 1.35 1.13 0.00 1.49 0.00 -0.48 -1.73 119.26 121.03 3fyu h ALA 106 Ca 0.21 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3fyu h ALA 106 Cb 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3fyu h ALA 106 CO -0.01 0.58 -0.20 -0.07 0.00 0.00 0.00 179.25 179.54 3fyu h LEU 107 N 0.19 0.00 -0.06 0.00 3.38 0.21 -0.19 115.31 118.84 3fyu h LEU 107 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3fyu h LEU 107 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3fyu h LEU 107 CO 0.06 0.20 -0.01 1.41 0.09 0.00 0.00 178.44 180.19 3fyu n HIS 108 N -3.44 0.00 0.00 1.13 8.25 -0.41 -4.87 115.22 115.88 3fyu n HIS 108 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3fyu n HIS 108 Cb 0.39 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.37 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 1.14 1.04 3.54 -1.41 0.00 -0.09 -5.05 105.19 104.37 3fyu n GLY 109 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 3.08 -0.41 1.61 2.02 -0.73 -4.31 117.35 116.61 3fyu s TYR 110 Ca 0.00 -0.19 -0.29 0.00 -0.37 0.00 0.00 57.07 56.23 3fyu s TYR 110 Cb 0.00 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.60 3fyu s TYR 110 CO 0.00 0.04 1.51 0.00 -1.57 0.00 0.00 175.55 175.54 3fyu s ALA 111 N 0.25 2.97 -0.07 3.71 0.00 -0.28 -3.09 121.76 125.26 3fyu s ALA 111 Ca -0.01 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.88 3fyu s ALA 111 Cb -0.14 -3.98 -0.02 0.00 0.00 0.00 0.00 23.12 18.99 3fyu s ALA 111 CO 0.02 -2.52 -0.18 0.99 0.00 0.00 0.00 175.76 174.08 3fyu s THR 112 N 5.89 2.73 -0.18 0.00 2.01 0.82 -0.97 115.64 125.93 3fyu s THR 112 Ca 0.65 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.84 3fyu s THR 112 Cb -0.15 -2.07 0.02 0.00 0.01 0.00 0.00 72.50 70.31 3fyu s THR 112 CO 0.32 0.57 -0.17 0.12 -0.69 0.00 0.00 174.62 174.77 3fyu s PHE 113 N -0.29 2.63 -0.84 4.92 5.36 -0.44 -0.43 117.98 128.88 3fyu s PHE 113 Ca 0.02 -1.58 -0.16 0.00 -0.96 0.00 0.00 56.93 54.25 3fyu s PHE 113 Cb -0.13 -1.82 0.18 0.00 -0.34 0.00 0.00 43.02 40.91 3fyu s PHE 113 CO 0.03 -0.77 0.89 0.20 -1.46 0.00 0.00 175.22 174.10 3fyu s GLY 114 N 1.34 2.32 0.05 13.12 0.00 -0.45 -1.10 107.32 122.59 3fyu s GLY 114 Ca 0.04 -3.02 -0.31 0.00 0.00 0.00 0.00 44.72 41.43 3fyu s GLY 114 CO -0.12 1.56 1.67 -0.29 0.00 0.00 0.00 173.10 175.92 3fyu s MET 115 N 1.31 4.19 -0.08 2.90 1.75 -0.93 -3.84 119.30 124.60 3fyu s MET 115 Ca 0.23 2.32 -0.25 0.00 -1.25 0.00 0.00 55.69 56.74 3fyu s MET 115 Cb -0.10 -3.67 -0.03 0.00 2.84 0.00 0.00 34.83 33.88 3fyu s MET 115 CO -0.08 -0.76 0.79 -0.51 -0.65 0.00 0.00 175.02 173.81 3fyu s LEU 116 N 2.88 4.29 0.02 4.11 1.43 -0.38 -4.36 118.68 126.66 3fyu s LEU 116 Ca 0.74 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.81 3fyu s LEU 116 Cb -0.39 -3.21 -0.05 0.00 0.03 0.00 0.00 46.19 42.57 3fyu s LEU 116 CO 0.32 -0.22 1.17 -0.69 0.23 0.00 0.00 176.35 177.16 3fyu s VAL 117 N 1.22 4.21 -0.12 -1.59 1.01 -1.26 -4.46 120.40 119.42 3fyu s VAL 117 Ca 0.40 1.57 -0.15 0.00 0.00 0.00 0.00 61.98 63.81 3fyu s VAL 117 Cb -0.18 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 3fyu s VAL 117 CO 0.18 0.08 0.47 0.54 0.00 0.00 0.00 175.10 176.37 3fyu n ARG 118 N 4.33 0.00 -0.28 2.72 1.74 -1.24 -0.15 116.66 123.78 3fyu n ARG 118 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 3fyu n ARG 118 Cb 0.47 -0.48 0.00 0.00 -1.02 0.00 0.00 32.46 31.42 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 1.06 0.42 0.00 -0.13 0.00 -0.95 -4.81 105.19 100.78 3fyu n GLY 119 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 1.61 6.02 0.78 -4.74 117.38 119.05 3fyu n GLN 120 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 57.13 3fyu n GLN 120 Cb 0.00 0.00 0.69 0.00 1.02 0.00 0.00 30.24 31.95 3fyu n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3fyu n GLY 121 N 3.20 -1.35 0.00 1.08 0.00 -1.20 -4.95 105.19 101.97 3fyu n GLY 121 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3fyu n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fyu n GLY 122 N 1.31 -0.78 0.69 -0.02 0.00 -1.25 -4.53 105.19 100.61 3fyu n GLY 122 Ca 0.11 -1.22 0.02 0.00 0.00 0.00 0.00 46.02 44.93 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 1.41 -3.72 -4.86 1.61 7.64 -1.26 -2.24 113.62 112.20 3fyu n SER 123 Ca 0.00 0.79 -0.36 0.00 1.01 0.00 0.00 58.87 60.31 3fyu n SER 123 Cb 0.00 -1.90 -0.06 0.00 -1.01 0.00 0.00 64.21 61.24 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 -4.31 3.76 -0.30 1.43 2.12 -0.10 -2.36 118.70 118.95 3fyu s GLU 124 Ca 0.00 0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.56 3fyu s GLU 124 Cb 0.00 -3.12 0.09 0.00 0.26 0.00 0.00 34.13 31.36 3fyu s GLU 124 CO 0.00 0.65 0.02 0.34 -0.54 0.00 0.00 175.26 175.73 3fyu s ASP 125 N -1.39 4.35 0.10 -1.70 -1.08 -1.26 -4.25 116.67 111.44 3fyu s ASP 125 Ca 0.26 -1.72 0.27 0.00 -0.52 0.00 0.00 52.55 50.84 3fyu s ASP 125 Cb -0.15 -1.35 0.86 0.00 -1.46 0.00 0.00 42.92 40.83 3fyu s ASP 125 CO 0.14 -0.33 1.73 0.35 0.52 0.00 0.00 175.17 177.58 3fyu n THR 126 N 4.50 0.28 -1.86 1.71 -2.24 -1.26 -4.86 114.28 110.56 3fyu n THR 126 Ca -0.03 -0.15 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 3fyu n THR 126 Cb 0.42 -0.40 -0.03 0.00 -2.10 0.00 0.00 70.33 68.23 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 -3.77 6.51 0.66 3.42 1.04 -1.26 -4.96 113.70 115.34 3fyu s SER 127 Ca 0.11 2.73 -0.14 0.00 0.48 0.00 0.00 55.95 59.13 3fyu s SER 127 Cb 0.15 -2.60 -0.00 0.00 0.10 0.00 0.00 66.02 63.67 3fyu s SER 127 CO 0.60 -0.87 1.09 -0.69 0.98 0.00 0.00 173.24 174.35 3fyu s VAL 128 N 0.99 3.41 -0.49 5.02 1.01 -1.26 -5.01 120.40 124.08 3fyu s VAL 128 Ca 0.70 0.62 -0.18 0.00 0.00 0.00 0.00 61.98 63.12 3fyu s VAL 128 Cb -0.46 -3.15 0.06 0.00 0.00 0.00 0.00 36.38 32.83 3fyu s VAL 128 CO 0.33 -0.44 0.55 -0.89 0.00 0.00 0.00 175.10 174.66 3fyu s THR 129 N -2.47 4.98 0.23 3.92 2.01 -1.26 -4.85 115.64 118.19 3fyu s THR 129 Ca 0.65 -0.57 -0.06 0.00 0.31 0.00 0.00 61.69 62.02 3fyu s THR 129 Cb -0.19 -4.23 0.19 0.00 0.01 0.00 0.00 72.50 68.29 3fyu s THR 129 CO 0.43 -0.70 1.82 -0.65 -0.69 0.00 0.00 174.62 174.83 3fyu h PRO 130 N 8.91 0.77 0.00 4.92 0.11 -1.94 -3.47 132.00 141.29 3fyu h PRO 130 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3fyu h PRO 130 Cb 1.10 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3fyu h PRO 130 CO 0.92 0.51 0.00 0.41 -0.21 0.00 0.00 178.00 179.63 3fyu n GLY 131 N -1.31 2.16 3.74 -0.55 0.00 -1.26 -5.11 105.19 102.86 3fyu n GLY 131 Ca 0.11 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.49 2.82 0.19 -0.02 0.00 -1.26 -4.81 107.32 103.74 3fyu s GLY 132 Ca 0.00 1.14 -0.23 0.00 0.00 0.00 0.00 44.72 45.63 3fyu s GLY 132 CO 0.00 1.56 0.67 -2.38 0.00 0.00 0.00 173.10 172.95 3fyu s HIS 133 N -1.47 -0.40 0.79 1.90 -0.00 -1.26 -4.91 115.29 109.94 3fyu s HIS 133 Ca 0.79 0.12 -0.12 0.00 -0.00 0.00 0.00 55.06 55.85 3fyu s HIS 133 Cb -0.35 0.61 0.07 0.00 -0.00 0.00 0.00 32.58 32.91 3fyu s HIS 133 CO 0.38 -0.96 1.12 0.00 -0.00 0.00 0.00 174.74 175.28 3fyu s ALA 134 N -3.76 2.06 -0.08 -1.38 0.00 -1.26 -4.89 121.76 112.46 3fyu s ALA 134 Ca 0.05 0.47 -0.34 0.00 0.00 0.00 0.00 51.96 52.13 3fyu s ALA 134 Cb -0.03 -3.35 -0.12 0.00 0.00 0.00 0.00 23.12 19.63 3fyu s ALA 134 CO -0.06 -1.97 1.88 -0.11 0.00 0.00 0.00 175.76 175.50 3fyu n LEU 135 N -3.45 3.46 0.00 0.00 0.00 -1.26 -4.70 117.00 111.04 3fyu n LEU 135 Ca 0.10 0.97 0.00 0.00 0.00 0.00 0.00 56.01 57.09 3fyu n LEU 135 Cb 0.52 -1.38 0.00 0.00 0.00 0.00 0.00 43.42 42.57 3fyu n LEU 135 CO 0.51 -0.05 0.00 0.61 0.00 0.00 0.00 177.39 178.45 3fyu n GLY 136 N 4.38 0.63 0.06 -3.96 0.00 -1.26 -4.86 105.19 100.18 3fyu n GLY 136 Ca 0.22 -2.26 0.05 0.00 0.00 0.00 0.00 46.02 44.04 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 0.12 0.34 -0.31 1.61 8.01 -1.26 -4.50 117.44 121.44 3fyu n TRP 137 Ca 0.00 0.11 0.29 0.00 -1.31 0.00 0.00 57.50 56.59 3fyu n TRP 137 Cb 0.00 -0.78 0.64 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 0.18 -0.15 -0.99 2.86 -1.90 -2.28 114.93 112.64 3fyu h MET 138 Ca -0.13 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 3fyu h MET 138 Cb 1.33 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.95 3fyu h MET 138 CO 0.01 0.12 0.00 0.25 1.06 0.00 0.00 176.91 178.35 3fyu n THR 139 N -4.40 0.74 -1.86 2.22 -2.24 -1.26 -4.90 114.28 102.58 3fyu n THR 139 Ca 0.25 -0.87 -0.42 0.00 -2.27 0.00 0.00 64.05 60.74 3fyu n THR 139 Cb 1.06 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.92 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 -0.88 4.17 -1.54 -0.78 2.20 -0.86 -2.01 119.74 120.04 3fyu s LYS 140 Ca 0.12 2.39 0.00 0.00 -0.36 0.00 0.00 55.97 58.11 3fyu s LYS 140 Cb 0.07 -3.94 0.00 0.00 -1.51 0.00 0.00 37.83 32.44 3fyu s LYS 140 CO 0.09 -0.86 0.00 0.41 -0.36 0.00 0.00 175.35 174.63 3fyu n GLY 141 N 4.25 0.78 0.05 5.54 0.00 -1.26 -1.65 105.19 112.90 3fyu n GLY 141 Ca 0.18 -0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.18 1.18 1.68 -0.61 3.06 -0.85 -2.04 119.36 118.60 3fyu n ILE 142 Ca -0.17 0.35 0.05 0.00 -2.50 0.00 0.00 62.75 60.48 3fyu n ILE 142 Cb 0.57 -1.23 0.25 0.00 0.54 0.00 0.00 39.64 39.78 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 -1.75 0.59 -3.64 9.51 4.77 -1.26 -4.29 117.00 120.93 3fyu n LEU 143 Ca 0.02 -0.27 -0.08 0.00 -0.03 0.00 0.00 56.01 55.65 3fyu n LEU 143 Cb 0.13 -0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.09 3fyu n LEU 143 CO 0.12 0.14 0.54 -0.55 -1.33 0.00 0.00 177.39 176.31 3fyu s SER 144 N -1.26 -0.68 0.57 -1.43 0.15 -1.15 -4.92 113.70 104.99 3fyu s SER 144 Ca 0.17 1.16 0.27 0.00 0.70 0.00 0.00 55.95 58.26 3fyu s SER 144 Cb 0.09 1.24 1.67 0.00 -1.71 0.00 0.00 66.02 67.31 3fyu s SER 144 CO 0.13 -0.19 2.22 0.07 1.20 0.00 0.00 173.24 176.67 3fyu h LYS 145 N 5.70 0.00 -0.01 5.44 2.10 -1.86 -0.23 116.57 127.71 3fyu h LYS 145 Ca -0.29 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.19 3fyu h LYS 145 Cb 1.19 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 3fyu h LYS 145 CO 0.14 0.02 -0.78 -0.44 -2.00 0.00 0.00 179.45 176.38 3fyu h ASP 146 N 0.00 0.15 0.16 7.07 3.32 -1.95 -3.29 116.42 121.87 3fyu h ASP 146 Ca -0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 3fyu h ASP 146 Cb 0.04 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3fyu h ASP 146 CO 0.00 0.87 -1.16 0.35 -1.72 0.00 0.00 179.24 177.59 3fyu n THR 147 N -3.69 0.05 -1.69 0.35 -2.24 -0.73 -4.96 114.28 101.37 3fyu n THR 147 Ca -0.02 -0.16 -0.44 0.00 -2.27 0.00 0.00 64.05 61.15 3fyu n THR 147 Cb 0.74 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 69.48 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 -1.77 2.46 -0.35 4.78 9.36 -0.18 -4.39 117.16 127.08 3fyu n TYR 148 Ca 0.02 0.22 0.02 0.00 3.32 0.00 0.00 57.90 61.48 3fyu n TYR 148 Cb 0.40 -2.58 0.08 0.00 -0.63 0.00 0.00 39.34 36.62 3fyu n TYR 148 CO 0.00 0.00 0.00 0.98 0.22 0.00 0.00 176.86 178.06 3fyu n TYR 149 N 3.30 0.17 0.54 2.98 9.36 -0.66 -0.60 117.16 132.25 3fyu n TYR 149 Ca 0.15 1.14 0.07 0.00 3.32 0.00 0.00 57.90 62.58 3fyu n TYR 149 Cb 0.32 -0.94 0.33 0.00 -0.63 0.00 0.00 39.34 38.42 3fyu n TYR 149 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3fyu n TYR 150 N -5.44 0.00 0.06 2.98 4.01 -1.26 -2.91 117.16 114.60 3fyu n TYR 150 Ca 0.12 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.73 3fyu n TYR 150 Cb 0.42 -0.49 -0.08 0.00 -0.31 0.00 0.00 39.34 38.88 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 -0.08 -0.39 -0.72 2.43 -1.17 0.16 114.38 114.61 3fyu h ARG 151 Ca 0.00 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3fyu h ARG 151 Cb 0.26 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 3fyu h ARG 151 CO 0.00 0.06 0.16 0.78 -1.51 0.00 0.00 179.97 179.46 3fyu h GLY 152 N -0.20 0.62 0.65 2.80 0.00 -1.67 -2.50 103.07 102.78 3fyu h GLY 152 Ca -0.01 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.01 3fyu h GLY 152 CO 0.01 0.31 -0.14 -2.08 0.00 0.00 0.00 176.54 174.64 3fyu h VAL 153 N 0.49 0.64 -0.78 4.60 2.07 -1.46 0.15 116.25 121.96 3fyu h VAL 153 Ca 0.13 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.73 3fyu h VAL 153 Cb 0.17 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 3fyu h VAL 153 CO -0.01 0.00 0.45 1.88 0.02 0.00 0.00 177.57 179.90 3fyu h TYR 154 N -0.24 0.82 -0.34 1.57 -1.99 -0.63 -0.81 116.97 115.34 3fyu h TYR 154 Ca 0.05 0.03 -0.11 0.00 2.00 0.00 0.00 58.73 60.70 3fyu h TYR 154 Cb 0.30 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.77 3fyu h TYR 154 CO -0.20 0.36 -0.24 -0.07 -0.00 0.00 0.00 178.16 178.02 3fyu h LEU 155 N 0.78 0.68 -1.02 3.88 3.38 -0.99 -1.73 115.31 120.28 3fyu h LEU 155 Ca 0.36 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3fyu h LEU 155 Cb 0.28 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 3fyu h LEU 155 CO -0.22 0.90 0.45 0.44 0.09 0.00 0.00 178.44 180.10 3fyu h ASP 156 N 0.59 1.01 -0.52 -0.43 3.32 0.46 0.84 116.42 121.69 3fyu h ASP 156 Ca 0.08 -0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 3fyu h ASP 156 Cb 0.72 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 3fyu h ASP 156 CO 0.05 0.81 0.22 0.00 -1.72 0.00 0.00 179.24 178.60 3fyu h ALA 157 N 1.36 0.67 -0.22 3.45 0.00 -0.64 0.13 119.26 124.00 3fyu h ALA 157 Ca 0.29 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3fyu h ALA 157 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3fyu h ALA 157 CO -0.05 0.27 -0.02 0.28 0.00 0.00 0.00 179.25 179.74 3fyu h VAL 158 N 0.69 1.26 -0.64 0.00 2.07 -0.79 -2.81 116.25 116.04 3fyu h VAL 158 Ca 0.17 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.79 3fyu h VAL 158 Cb 0.18 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3fyu h VAL 158 CO -0.02 0.29 0.42 -0.09 0.02 0.00 0.00 177.57 178.19 3fyu h ARG 159 N 0.16 0.73 -0.91 1.57 9.65 -0.63 -1.58 114.38 123.37 3fyu h ARG 159 Ca 0.06 -0.04 0.03 0.00 -1.10 0.00 0.00 59.98 58.92 3fyu h ARG 159 Cb 0.44 -0.16 -0.05 0.00 -1.39 0.00 0.00 29.97 28.80 3fyu h ARG 159 CO 0.01 0.48 0.60 0.00 2.80 0.00 0.00 179.97 183.86 3fyu h ALA 160 N 1.63 1.19 -0.50 2.80 0.00 -0.49 0.40 119.26 124.29 3fyu h ALA 160 Ca 0.26 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3fyu h ALA 160 Cb 0.08 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3fyu h ALA 160 CO -0.07 0.49 -0.15 -0.07 0.00 0.00 0.00 179.25 179.45 3fyu h LEU 161 N 1.18 1.00 -0.61 0.00 3.38 -1.10 -1.29 115.31 117.86 3fyu h LEU 161 Ca 0.36 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3fyu h LEU 161 Cb -0.04 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 3fyu h LEU 161 CO -0.10 1.14 0.18 -0.33 0.09 0.00 0.00 178.44 179.42 3fyu h GLU 162 N 0.84 0.95 0.07 1.13 5.08 -0.60 -1.56 114.58 120.49 3fyu h GLU 162 Ca 0.12 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3fyu h GLU 162 Cb 0.72 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3fyu h GLU 162 CO 0.06 0.85 -0.03 0.28 -1.00 0.00 0.00 179.01 179.16 3fyu h VAL 163 N 0.87 1.11 -0.24 3.13 2.07 -0.82 -2.74 116.25 119.63 3fyu h VAL 163 Ca 0.20 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3fyu h VAL 163 Cb 0.30 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 3fyu h VAL 163 CO -0.01 0.16 0.06 0.40 0.02 0.00 0.00 177.57 178.20 3fyu h ILE 164 N -0.38 0.90 0.00 4.57 1.08 -1.18 -2.00 117.51 120.50 3fyu h ILE 164 Ca -0.01 -0.05 -0.01 0.00 -0.39 0.00 0.00 64.86 64.40 3fyu h ILE 164 Cb 0.33 0.74 -0.00 0.00 -3.07 0.00 0.00 36.82 34.82 3fyu h ILE 164 CO 0.02 0.03 -0.04 0.06 -0.69 0.00 0.00 178.15 177.52 3fyu h GLN 165 N 0.15 0.00 0.00 2.37 3.07 -1.31 -1.18 115.11 118.21 3fyu h GLN 165 Ca 0.11 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.79 3fyu h GLN 165 Cb 0.10 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.65 3fyu h GLN 165 CO -0.13 0.04 -0.26 0.66 0.09 0.00 0.00 178.83 179.22 3fyu h SER 166 N 0.00 0.00 -2.94 0.06 4.64 -1.04 -3.42 113.55 110.84 3fyu h SER 166 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 3fyu h SER 166 Cb 0.19 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.35 3fyu h SER 166 CO 0.01 0.26 0.93 -0.36 -0.87 0.00 0.00 176.83 176.80 3fyu s PHE 167 N -3.38 2.90 0.39 4.77 0.08 -0.45 -4.90 117.98 117.40 3fyu s PHE 167 Ca 0.03 0.58 0.18 0.00 0.12 0.00 0.00 56.93 57.83 3fyu s PHE 167 Cb 0.09 -4.05 1.01 0.00 -0.57 0.00 0.00 43.02 39.49 3fyu s PHE 167 CO 0.67 -3.81 1.94 -1.00 -0.10 0.00 0.00 175.22 172.92 3fyu h PRO 168 N 6.12 0.00 -0.01 0.24 0.13 -1.87 -2.33 132.00 134.27 3fyu h PRO 168 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3fyu h PRO 168 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3fyu h PRO 168 CO 0.89 0.24 0.00 -0.85 -0.23 0.00 0.00 178.00 178.05 3fyu n GLU 169 N -4.01 1.18 -4.29 0.86 0.00 -1.26 -4.73 120.64 108.40 3fyu n GLU 169 Ca -0.02 -0.27 -0.34 0.00 0.00 0.00 0.00 57.16 56.53 3fyu n GLU 169 Cb 0.31 -1.47 -0.11 0.00 0.00 0.00 0.00 31.44 30.17 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 -1.99 4.18 -0.72 3.84 1.01 -0.88 0.07 120.40 125.90 3fyu s VAL 170 Ca 0.43 -0.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.90 3fyu s VAL 170 Cb 0.21 -2.84 0.04 0.00 0.00 0.00 0.00 36.38 33.79 3fyu s VAL 170 CO 0.34 0.49 1.18 -0.62 0.00 0.00 0.00 175.10 176.50 3fyu s ASP 171 N 0.25 6.18 0.65 3.32 -1.08 -0.02 -4.78 116.67 121.19 3fyu s ASP 171 Ca -0.01 -0.67 0.28 0.00 -0.52 0.00 0.00 52.55 51.63 3fyu s ASP 171 Cb -0.13 -2.51 1.51 0.00 -1.46 0.00 0.00 42.92 40.32 3fyu s ASP 171 CO 0.02 -1.69 1.87 1.05 0.52 0.00 0.00 175.17 176.93 3fyu h GLU 172 N 9.86 0.00 -0.02 4.34 9.09 -1.88 0.41 114.58 136.38 3fyu h GLU 172 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.15 3fyu h GLU 172 Cb 1.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.16 3fyu h GLU 172 CO 1.25 0.00 0.00 0.72 0.05 0.00 0.00 179.01 181.03 3fyu n HIS 173 N -3.08 0.01 -2.89 2.06 8.25 -1.26 -4.23 115.22 114.08 3fyu n HIS 173 Ca 0.01 -0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.27 3fyu n HIS 173 Cb 0.48 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 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 0.18 1.90 -4.51 -0.41 1.74 0.14 -4.84 116.66 110.86 3fyu n ARG 174 Ca 0.19 -3.85 -0.33 0.00 -0.77 0.00 0.00 57.85 53.08 3fyu n ARG 174 Cb 0.35 -1.79 -0.13 0.00 -1.02 0.00 0.00 32.46 29.87 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 -3.54 3.64 0.13 0.55 1.01 -1.26 -0.84 121.20 120.90 3fyu s ILE 175 Ca 0.40 -0.45 0.10 0.00 0.00 0.00 0.00 60.65 60.71 3fyu s ILE 175 Cb 0.37 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 3fyu s ILE 175 CO -0.08 0.50 -0.25 -0.83 0.00 0.00 0.00 174.94 174.28 3fyu s GLY 176 N 0.37 1.53 -0.14 6.18 0.00 0.08 0.83 107.32 116.17 3fyu s GLY 176 Ca -0.06 -1.45 -0.00 0.00 0.00 0.00 0.00 44.72 43.21 3fyu s GLY 176 CO 0.04 -1.44 -0.13 -1.34 0.00 0.00 0.00 173.10 170.22 3fyu s VAL 177 N -1.18 2.95 0.13 1.40 -7.23 -0.86 -1.42 120.40 114.19 3fyu s VAL 177 Ca 0.14 -0.69 0.02 0.00 -1.81 0.00 0.00 61.98 59.64 3fyu s VAL 177 Cb -0.10 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.56 3fyu s VAL 177 CO 0.06 0.52 -0.05 0.27 -0.31 0.00 0.00 175.10 175.59 3fyu s ILE 178 N 0.50 0.80 0.00 -0.62 -4.36 -0.69 -1.39 121.20 115.43 3fyu s ILE 178 Ca -0.09 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 58.32 3fyu s ILE 178 Cb -0.16 -1.87 0.00 0.00 1.25 0.00 0.00 42.46 41.69 3fyu s ILE 178 CO 0.04 -0.71 0.00 0.61 0.24 0.00 0.00 174.94 175.12 3fyu n GLY 179 N -0.14 1.75 0.53 6.27 0.00 -1.00 -0.90 105.19 111.70 3fyu n GLY 179 Ca -0.10 -0.76 0.09 0.00 0.00 0.00 0.00 46.02 45.25 3fyu n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fyu n GLY 180 N -0.45 4.42 0.00 -0.02 0.00 -1.24 -1.28 105.19 106.62 3fyu n GLY 180 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3fyu n GLY 180 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3fyu n GLN 182 N -0.92 0.00 -0.13 1.61 7.27 -1.26 -3.11 117.38 120.83 3fyu n GLN 182 Ca 0.19 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.24 3fyu n GLN 182 Cb 0.78 0.00 0.21 0.00 2.41 0.00 0.00 30.24 33.64 3fyu n GLN 182 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 3fyu h GLY 183 N 0.00 0.89 1.66 1.69 0.00 -1.69 -0.54 103.07 105.08 3fyu h GLY 183 Ca 0.00 -0.48 -0.13 0.00 0.00 0.00 0.00 47.33 46.72 3fyu h GLY 183 CO 0.00 0.45 -0.45 -1.33 0.00 0.00 0.00 176.54 175.21 3fyu h GLY 184 N 0.96 0.40 0.97 4.60 0.00 -1.41 -1.15 103.07 107.44 3fyu h GLY 184 Ca 0.19 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 3fyu h GLY 184 CO -0.01 0.38 -0.13 0.00 0.00 0.00 0.00 176.54 176.78 3fyu h ALA 185 N 1.22 0.52 -0.66 3.60 0.00 -1.64 -1.25 119.26 121.05 3fyu h ALA 185 Ca 0.02 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 3fyu h ALA 185 Cb 0.92 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 3fyu h ALA 185 CO 0.08 0.41 0.09 -0.07 0.00 0.00 0.00 179.25 179.76 3fyu h LEU 186 N 0.55 1.06 0.17 0.00 3.38 -0.95 0.13 115.31 119.64 3fyu h LEU 186 Ca 0.09 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3fyu h LEU 186 Cb 0.66 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3fyu h LEU 186 CO 0.04 1.06 -0.22 0.00 0.09 0.00 0.00 178.44 179.42 3fyu h ALA 187 N 1.04 -0.42 -0.78 1.53 0.00 -0.99 0.27 119.26 119.92 3fyu h ALA 187 Ca 0.20 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3fyu h ALA 187 Cb 0.46 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 3fyu h ALA 187 CO 0.02 -0.77 0.41 0.82 0.00 0.00 0.00 179.25 179.72 3fyu h ILE 188 N -0.45 1.24 -0.59 0.00 2.04 -1.02 -1.66 117.51 117.06 3fyu h ILE 188 Ca 0.01 -0.62 -0.07 0.00 1.00 0.00 0.00 64.86 65.18 3fyu h ILE 188 Cb 0.44 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3fyu h ILE 188 CO -0.09 0.27 0.07 0.00 0.00 0.00 0.00 178.15 178.41 3fyu h ALA 189 N 1.21 1.01 -0.53 1.87 0.00 -0.41 -1.77 119.26 120.64 3fyu h ALA 189 Ca 0.27 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3fyu h ALA 189 Cb 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3fyu h ALA 189 CO -0.04 0.62 0.08 0.00 0.00 0.00 0.00 179.25 179.92 3fyu h ALA 190 N 1.16 0.71 0.00 0.00 0.00 -0.05 -1.43 119.26 119.65 3fyu h ALA 190 Ca 0.18 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3fyu h ALA 190 Cb 0.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3fyu h ALA 190 CO 0.01 0.45 -0.30 0.00 0.00 0.00 0.00 179.25 179.42 3fyu h ALA 191 N 0.98 1.47 0.01 0.00 0.00 -1.11 0.20 119.26 120.81 3fyu h ALA 191 Ca 0.16 -0.27 -0.20 0.00 0.00 0.00 0.00 54.91 54.60 3fyu h ALA 191 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3fyu h ALA 191 CO 0.01 0.37 -0.89 0.00 0.00 0.00 0.00 179.25 178.75 3fyu h ALA 192 N 1.70 0.51 0.00 0.00 0.00 -0.88 -3.33 119.26 117.26 3fyu h ALA 192 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3fyu h ALA 192 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3fyu h ALA 192 CO 0.04 0.93 -1.44 1.28 0.00 0.00 0.00 179.25 180.06 3fyu n LEU 193 N -3.64 0.43 -4.02 0.00 4.77 -0.58 -4.75 117.00 109.21 3fyu n LEU 193 Ca -0.03 0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.79 3fyu n LEU 193 Cb 0.82 -0.04 -0.14 0.00 -2.33 0.00 0.00 43.42 41.72 3fyu n LEU 193 CO 0.48 -0.01 -0.43 -0.55 -1.33 0.00 0.00 177.39 175.55 3fyu s SER 194 N -4.42 1.02 0.00 -1.43 0.15 0.67 -5.01 113.70 104.67 3fyu s SER 194 Ca -0.02 -0.20 0.20 0.00 0.70 0.00 0.00 55.95 56.63 3fyu s SER 194 Cb 0.13 -0.10 0.53 0.00 -1.71 0.00 0.00 66.02 64.88 3fyu s SER 194 CO 0.85 0.08 1.44 -0.90 1.20 0.00 0.00 173.24 175.91 3fyu n ASP 195 N 2.70 2.88 -0.02 5.45 3.85 -1.26 -4.32 116.55 125.83 3fyu n ASP 195 Ca -0.14 -1.93 -0.11 0.00 -0.71 0.00 0.00 54.79 51.89 3fyu n ASP 195 Cb 0.57 -0.27 -0.06 0.00 -1.35 0.00 0.00 41.12 40.01 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 3.49 1.11 -3.91 2.12 2.04 -1.92 -3.43 117.51 117.01 3fyu h ILE 196 Ca 0.00 -0.33 -0.55 0.00 1.00 0.00 0.00 64.86 64.99 3fyu h ILE 196 Cb 0.78 1.12 0.12 0.00 -0.74 0.00 0.00 36.82 38.10 3fyu h ILE 196 CO 0.00 0.10 0.70 -2.65 0.00 0.00 0.00 178.15 176.30 3fyu n PRO 197 N -4.94 2.32 -0.08 2.37 -0.02 -1.26 -4.68 135.00 128.71 3fyu n PRO 197 Ca -0.05 0.82 -0.23 0.00 -2.02 0.00 0.00 63.50 62.02 3fyu n PRO 197 Cb 0.09 -2.62 -0.12 0.00 -0.02 0.00 0.00 33.50 30.83 3fyu n PRO 197 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3fyu n LYS 198 N -0.02 0.64 -4.27 -0.52 4.81 0.24 -4.90 118.16 114.14 3fyu n LYS 198 Ca 0.04 0.38 -0.15 0.00 -0.87 0.00 0.00 58.31 57.72 3fyu n LYS 198 Cb 0.41 -1.67 -0.10 0.00 0.02 0.00 0.00 35.03 33.69 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 -2.47 0.99 -0.03 3.15 -7.23 -1.23 -3.72 120.40 109.86 3fyu s VAL 199 Ca -0.29 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 57.87 3fyu s VAL 199 Cb 0.08 -2.08 0.01 0.00 0.56 0.00 0.00 36.38 34.95 3fyu s VAL 199 CO 0.63 -0.54 -0.06 -0.69 -0.31 0.00 0.00 175.10 174.13 3fyu s VAL 200 N -3.45 0.58 -0.13 1.32 1.01 0.05 -2.04 120.40 117.74 3fyu s VAL 200 Ca 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 3fyu s VAL 200 Cb 0.05 -0.56 0.02 0.00 0.00 0.00 0.00 36.38 35.89 3fyu s VAL 200 CO 0.04 0.21 -0.11 -0.69 0.00 0.00 0.00 175.10 174.55 3fyu s VAL 201 N 0.48 1.28 -0.11 2.92 1.01 -0.49 -0.40 120.40 125.08 3fyu s VAL 201 Ca -0.07 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.46 3fyu s VAL 201 Cb -0.10 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.06 3fyu s VAL 201 CO 0.00 0.41 -0.09 0.00 0.00 0.00 0.00 175.10 175.42 3fyu s ALA 202 N 1.61 1.38 -0.25 5.51 0.00 0.30 -2.39 121.76 127.92 3fyu s ALA 202 Ca 0.05 -0.57 -0.19 0.00 0.00 0.00 0.00 51.96 51.24 3fyu s ALA 202 Cb -0.13 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.08 3fyu s ALA 202 CO -0.09 -0.36 0.58 -0.51 0.00 0.00 0.00 175.76 175.38 3fyu s ASP 203 N 1.57 6.53 -0.44 0.00 1.11 -0.40 -2.31 116.67 122.73 3fyu s ASP 203 Ca 0.03 0.65 -0.07 0.00 0.18 0.00 0.00 52.55 53.34 3fyu s ASP 203 Cb -0.13 -2.31 0.01 0.00 1.07 0.00 0.00 42.92 41.56 3fyu s ASP 203 CO -0.07 -0.32 0.28 0.00 1.18 0.00 0.00 175.17 176.24 3fyu n TYR 204 N 5.53 -0.78 -1.59 4.23 0.18 0.11 -4.48 117.16 120.37 3fyu n TYR 204 Ca -0.02 0.22 -0.46 0.00 1.88 0.00 0.00 57.90 59.52 3fyu n TYR 204 Cb 0.49 -1.22 -0.02 0.00 -0.38 0.00 0.00 39.34 38.20 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 -2.02 1.31 -0.86 -3.48 -0.04 -1.26 -4.75 135.00 123.90 3fyu n PRO 205 Ca -0.11 0.46 -0.02 0.00 -0.04 0.00 0.00 63.50 63.79 3fyu n PRO 205 Cb 0.29 -1.88 0.01 0.00 -0.04 0.00 0.00 33.50 31.88 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 0.74 -3.30 -4.00 0.54 9.36 -1.26 -4.66 117.16 114.59 3fyu n TYR 206 Ca 0.12 -0.19 -0.27 0.00 3.32 0.00 0.00 57.90 60.88 3fyu n TYR 206 Cb 0.29 -0.08 -0.02 0.00 -0.63 0.00 0.00 39.34 38.90 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 -2.14 -3.88 2.98 4.77 -1.26 -4.58 117.00 112.88 3fyu n LEU 207 Ca 0.02 -1.01 -0.20 0.00 -0.03 0.00 0.00 56.01 54.79 3fyu n LEU 207 Cb 0.06 -2.20 -0.16 0.00 -2.33 0.00 0.00 43.42 38.79 3fyu n LEU 207 CO 0.04 0.42 -0.41 -0.55 -1.33 0.00 0.00 177.39 175.56 3fyu s SER 208 N -4.22 0.97 -1.19 -1.43 0.15 -1.26 -1.29 113.70 105.43 3fyu s SER 208 Ca 0.11 -0.12 -0.07 0.00 0.70 0.00 0.00 55.95 56.57 3fyu s SER 208 Cb -0.06 -0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 63.79 3fyu s SER 208 CO 0.89 -0.06 0.80 -3.20 1.20 0.00 0.00 173.24 172.87 3fyu n ASN 209 N 4.11 -3.62 -0.24 5.45 5.15 -1.26 -4.62 115.26 120.24 3fyu n ASN 209 Ca -0.24 -0.83 0.03 0.00 -0.60 0.00 0.00 54.58 52.94 3fyu n ASN 209 Cb 0.51 -4.23 0.13 0.00 -0.53 0.00 0.00 39.78 35.66 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 -1.69 -0.08 -0.16 1.20 0.04 -1.95 0.35 116.94 114.65 3fyu h PHE 210 Ca -0.62 0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.24 3fyu h PHE 210 Cb 1.35 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 39.64 3fyu h PHE 210 CO 0.39 -0.22 0.14 0.93 -0.60 0.00 0.00 178.31 178.95 3fyu h GLU 211 N 0.10 0.00 0.07 1.51 5.08 -1.97 -1.91 114.58 117.45 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 0.63 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.84 3fyu h GLU 211 CO -0.62 0.00 -2.10 -2.13 -1.00 0.00 0.00 179.01 173.15 3fyu n ARG 212 N -4.13 0.71 -0.24 2.33 0.63 -0.34 -4.30 116.66 111.31 3fyu n ARG 212 Ca 0.01 0.22 0.03 0.00 -0.92 0.00 0.00 57.85 57.19 3fyu n ARG 212 Cb 0.26 -1.66 0.16 0.00 0.45 0.00 0.00 32.46 31.67 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 0.27 0.96 0.00 5.13 0.00 -0.43 0.82 119.26 126.01 3fyu h ALA 213 Ca -0.45 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3fyu h ALA 213 Cb 2.02 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.87 3fyu h ALA 213 CO 0.04 -0.18 0.00 1.33 0.00 0.00 0.00 179.25 180.44 3fyu n VAL 214 N -4.98 1.11 0.49 0.00 0.24 -0.77 -0.60 118.33 113.82 3fyu n VAL 214 Ca 0.12 0.37 0.07 0.00 -2.04 0.00 0.00 64.34 62.87 3fyu n VAL 214 Cb 0.35 -1.27 -0.09 0.00 -1.47 0.00 0.00 33.84 31.35 3fyu n VAL 214 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3fyu n ASP 215 N -1.90 0.93 -0.04 -1.34 8.00 0.16 -4.69 116.55 117.67 3fyu n ASP 215 Ca 0.02 -0.60 -0.06 0.00 0.71 0.00 0.00 54.79 54.86 3fyu n ASP 215 Cb 0.14 1.20 -0.05 0.00 -0.02 0.00 0.00 41.12 42.39 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 -1.55 0.54 -1.69 2.53 0.31 -0.49 -5.03 118.33 112.96 3fyu n VAL 216 Ca 0.01 -0.25 -0.40 0.00 -0.01 0.00 0.00 64.34 63.69 3fyu n VAL 216 Cb 0.28 -0.83 0.02 0.00 -0.91 0.00 0.00 33.84 32.40 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 -2.60 1.16 0.10 3.52 0.00 0.23 -4.93 120.51 118.00 3fyu n ALA 217 Ca -0.15 0.22 0.01 0.00 0.00 0.00 0.00 53.44 53.52 3fyu n ALA 217 Cb 0.71 -2.25 0.01 0.00 0.00 0.00 0.00 19.45 17.92 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 -0.01 1.25 -4.25 0.00 4.77 -0.96 -4.96 117.00 112.84 3fyu n LEU 218 Ca 0.08 -1.05 -0.17 0.00 -0.03 0.00 0.00 56.01 54.84 3fyu n LEU 218 Cb 0.41 -0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.41 3fyu n LEU 218 CO 0.57 0.29 -0.16 -1.61 -1.33 0.00 0.00 177.39 175.16 3fyu s GLU 219 N -0.24 1.55 0.89 3.23 0.41 -1.19 -5.03 118.70 118.32 3fyu s GLU 219 Ca 0.03 -1.87 -0.12 0.00 -0.41 0.00 0.00 54.97 52.60 3fyu s GLU 219 Cb 0.02 0.31 0.13 0.00 -1.78 0.00 0.00 34.13 32.80 3fyu s GLU 219 CO 0.03 -0.55 1.10 -0.65 -0.49 0.00 0.00 175.26 174.69 3fyu s GLN 220 N -3.71 1.31 0.00 1.61 -1.52 -1.26 -4.02 119.66 112.07 3fyu s GLN 220 Ca 0.40 0.67 0.23 0.00 -1.95 0.00 0.00 55.36 54.71 3fyu s GLN 220 Cb 0.04 -1.83 0.26 0.00 -0.22 0.00 0.00 33.01 31.27 3fyu s GLN 220 CO 0.22 -2.17 1.29 -0.35 -0.25 0.00 0.00 175.29 174.02 3fyu n PRO 221 N -3.81 2.31 -0.33 2.91 -0.05 -1.26 -4.71 135.00 130.06 3fyu n PRO 221 Ca 0.07 -2.02 -0.01 0.00 -0.05 0.00 0.00 63.50 61.49 3fyu n PRO 221 Cb 0.56 -1.46 0.12 0.00 -0.05 0.00 0.00 33.50 32.67 3fyu n PRO 221 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 175.50 177.33 3fyu h TYR 222 N 4.50 1.09 0.00 0.54 0.05 -1.85 -1.25 116.97 120.05 3fyu h TYR 222 Ca 0.00 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 3fyu h TYR 222 Cb 0.97 -0.36 0.00 0.00 1.01 0.00 0.00 36.73 38.35 3fyu h TYR 222 CO 0.08 0.62 0.00 1.28 -1.05 0.00 0.00 178.16 179.10 3fyu n LEU 223 N -4.52 0.02 0.02 3.88 4.77 -1.26 -0.89 117.00 119.02 3fyu n LEU 223 Ca 0.12 0.51 0.03 0.00 -0.03 0.00 0.00 56.01 56.64 3fyu n LEU 223 Cb 0.10 -0.51 0.41 0.00 -2.33 0.00 0.00 43.42 41.09 3fyu n LEU 223 CO 0.34 -0.51 1.10 -0.33 -1.33 0.00 0.00 177.39 176.66 3fyu h GLU 224 N 0.00 0.49 -0.38 3.23 5.08 -1.58 0.81 114.58 122.23 3fyu h GLU 224 Ca 0.00 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3fyu h GLU 224 Cb 0.00 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3fyu h GLU 224 CO 0.00 0.37 0.15 0.82 -1.00 0.00 0.00 179.01 179.35 3fyu h ILE 225 N 0.50 1.20 -0.59 3.13 2.04 -1.20 0.25 117.51 122.83 3fyu h ILE 225 Ca 0.13 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3fyu h ILE 225 Cb 0.03 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 3fyu h ILE 225 CO -0.02 0.22 0.36 0.78 0.00 0.00 0.00 178.15 179.49 3fyu h ASN 226 N 0.48 0.58 -0.47 1.72 4.21 -1.29 -1.28 115.58 119.53 3fyu h ASN 226 Ca 0.13 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.62 3fyu h ASN 226 Cb 0.20 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.25 3fyu h ASN 226 CO -0.01 0.41 0.21 0.28 -1.29 0.00 0.00 177.43 177.03 3fyu h SER 227 N 0.71 0.66 -0.25 5.81 0.02 -0.46 -1.62 113.55 118.42 3fyu h SER 227 Ca 0.24 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 3fyu h SER 227 Cb 0.03 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3fyu h SER 227 CO -0.10 0.59 0.08 0.22 -1.14 0.00 0.00 176.83 176.48 3fyu h TYR 228 N 0.72 0.39 0.00 3.45 3.20 0.14 -2.67 116.97 122.20 3fyu h TYR 228 Ca 0.18 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.95 3fyu h TYR 228 Cb 0.13 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 3fyu h TYR 228 CO 0.01 0.43 -0.30 0.74 -1.64 0.00 0.00 178.16 177.40 3fyu h PHE 229 N 0.24 0.00 -0.09 -3.82 0.04 -0.90 -1.45 116.94 110.97 3fyu h PHE 229 Ca 0.08 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 3fyu h PHE 229 Cb 0.22 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 3fyu h PHE 229 CO 0.00 0.30 -0.19 0.00 -0.60 0.00 0.00 178.31 177.82 3fyu h ARG 230 N 0.00 0.14 0.00 1.51 3.08 -1.02 -2.66 114.38 115.44 3fyu h ARG 230 Ca -0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3fyu h ARG 230 Cb 0.55 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3fyu h ARG 230 CO 0.04 0.33 -0.63 0.54 -1.07 0.00 0.00 179.97 179.19 3fyu n ARG 231 N -4.25 0.16 -3.49 0.04 1.74 -0.65 -4.51 116.66 105.70 3fyu n ARG 231 Ca -0.01 0.03 -0.28 0.00 -0.77 0.00 0.00 57.85 56.82 3fyu n ARG 231 Cb 0.29 -1.59 -0.11 0.00 -1.02 0.00 0.00 32.46 30.03 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 -3.63 2.56 0.26 0.55 -0.87 -0.64 -5.00 114.94 108.18 3fyu s ASN 232 Ca 0.08 -2.64 0.22 0.00 -1.57 0.00 0.00 52.86 48.95 3fyu s ASN 232 Cb 0.15 -0.54 1.01 0.00 -0.02 0.00 0.00 41.25 41.85 3fyu s ASN 232 CO 0.72 -0.24 1.68 -1.54 -2.57 0.00 0.00 177.10 175.15 3fyu n SER 233 N 3.45 0.61 -4.67 -1.22 3.41 -1.20 -4.63 113.62 109.36 3fyu n SER 233 Ca 0.19 0.69 -0.51 0.00 -0.26 0.00 0.00 58.87 58.97 3fyu n SER 233 Cb 0.41 -0.80 -0.06 0.00 -0.26 0.00 0.00 64.21 63.50 3fyu n SER 233 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3fyu n ASP 234 N -2.21 3.08 -0.35 4.04 -0.08 -1.26 -4.84 116.55 114.93 3fyu n ASP 234 Ca 0.01 0.95 0.07 0.00 -1.51 0.00 0.00 54.79 54.31 3fyu n ASP 234 Cb 0.17 -1.30 0.25 0.00 2.34 0.00 0.00 41.12 42.57 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 9.04 0.96 0.00 -0.67 0.11 -2.00 -0.16 132.00 139.28 3fyu h PRO 235 Ca -0.46 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 3fyu h PRO 235 Cb 1.29 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3fyu h PRO 235 CO 0.96 0.63 -0.11 0.87 -0.21 0.00 0.00 178.00 180.14 3fyu h LYS 236 N 0.99 0.00 -0.47 1.05 1.57 -1.97 -1.87 116.57 115.87 3fyu h LYS 236 Ca 0.48 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 59.18 3fyu h LYS 236 Cb 0.47 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 3fyu h LYS 236 CO -0.25 0.11 -0.02 0.28 -0.57 0.00 0.00 179.45 179.00 3fyu h VAL 237 N 0.00 1.25 -0.28 0.50 2.07 -1.36 -0.16 116.25 118.26 3fyu h VAL 237 Ca -0.00 -1.04 -0.10 0.00 0.82 0.00 0.00 66.70 66.38 3fyu h VAL 237 Cb 0.20 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3fyu h VAL 237 CO 0.01 0.36 -0.23 -0.08 0.02 0.00 0.00 177.57 177.66 3fyu h GLU 238 N 0.73 0.65 -0.00 1.57 4.81 -1.28 0.56 114.58 121.62 3fyu h GLU 238 Ca 0.14 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 3fyu h GLU 238 Cb 0.48 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 3fyu h GLU 238 CO 0.02 0.93 0.00 0.93 -0.73 0.00 0.00 179.01 180.16 3fyu h GLU 239 N 0.39 0.00 -0.08 1.92 5.08 -1.19 -2.09 114.58 118.62 3fyu h GLU 239 Ca 0.05 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.44 3fyu h GLU 239 Cb 0.78 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 3fyu h GLU 239 CO 0.06 0.01 -0.11 -0.22 -1.00 0.00 0.00 179.01 177.76 3fyu h LYS 240 N -0.01 -0.14 -0.27 2.33 1.63 -0.97 -0.48 116.57 118.68 3fyu h LYS 240 Ca 0.00 0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 3fyu h LYS 240 Cb 0.01 0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.61 3fyu h LYS 240 CO -0.00 -0.09 -0.14 0.00 -3.45 0.00 0.00 179.45 175.76 3fyu h ALA 241 N 0.90 0.06 0.00 5.00 0.00 -0.67 0.20 119.26 124.76 3fyu h ALA 241 Ca 0.07 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3fyu h ALA 241 Cb 0.24 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3fyu h ALA 241 CO -0.17 -0.55 -0.27 0.74 0.00 0.00 0.00 179.25 179.00 3fyu h PHE 242 N -0.11 0.00 -0.34 0.00 -1.00 -1.22 0.90 116.94 115.17 3fyu h PHE 242 Ca 0.14 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.87 3fyu h PHE 242 Cb 0.33 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 3fyu h PHE 242 CO -0.33 0.27 0.02 1.49 -1.61 0.00 0.00 178.31 178.16 3fyu h GLU 243 N 0.00 0.58 0.14 1.51 4.81 0.53 -2.03 114.58 120.12 3fyu h GLU 243 Ca -0.00 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 3fyu h GLU 243 Cb 0.53 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.85 3fyu h GLU 243 CO 0.04 0.69 -0.07 1.15 -0.73 0.00 0.00 179.01 180.09 3fyu h THR 244 N 0.40 0.95 -0.55 0.32 2.02 0.21 -3.05 112.91 113.20 3fyu h THR 244 Ca 0.10 -0.36 0.12 0.00 0.77 0.00 0.00 66.41 67.04 3fyu h THR 244 Cb 0.41 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 3fyu h THR 244 CO 0.01 0.09 0.38 -0.07 0.37 0.00 0.00 175.52 176.30 3fyu h LEU 245 N -0.35 0.21 -1.89 2.58 3.38 -0.79 -2.26 115.31 116.19 3fyu h LEU 245 Ca -0.02 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.00 3fyu h LEU 245 Cb 0.28 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3fyu h LEU 245 CO 0.03 0.12 0.18 0.77 0.09 0.00 0.00 178.44 179.63 3fyu h SER 246 N 0.23 0.12 0.69 -0.43 4.64 -1.25 0.10 113.55 117.65 3fyu h SER 246 Ca 0.26 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3fyu h SER 246 Cb 0.72 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 3fyu h SER 246 CO -0.05 0.08 0.00 -1.22 -0.87 0.00 0.00 176.83 174.77 3fyu n TYR 247 N -4.49 0.47 -0.05 4.77 4.01 -0.85 -2.92 117.16 118.11 3fyu n TYR 247 Ca 0.02 0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.94 3fyu n TYR 247 Cb 0.23 -0.79 0.00 0.00 -0.31 0.00 0.00 39.34 38.47 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 -1.92 0.00 -2.35 -0.72 3.72 -0.09 -4.99 117.46 111.11 3fyu n PHE 248 Ca 0.03 -0.03 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 3fyu n PHE 248 Cb 0.22 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.73 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 -0.05 6.97 0.53 4.37 -1.08 -0.50 -4.89 116.67 122.02 3fyu s ASP 249 Ca 0.00 1.99 0.26 0.00 -0.52 0.00 0.00 52.55 54.28 3fyu s ASP 249 Cb 0.00 -2.56 1.41 0.00 -1.46 0.00 0.00 42.92 40.31 3fyu s ASP 249 CO 0.00 -0.62 1.98 -0.07 0.52 0.00 0.00 175.17 176.99 3fyu h LEU 250 N 7.94 0.00 -1.28 -1.34 3.38 -1.50 0.89 115.31 123.40 3fyu h LEU 250 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 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 0.88 0.00 0.00 0.16 0.09 0.00 0.00 178.44 179.57 3fyu h ILE 251 N 0.00 0.00 0.00 1.22 3.07 -1.88 0.35 117.51 120.27 3fyu h ILE 251 Ca 0.27 -0.21 0.00 0.00 1.55 0.00 0.00 64.86 66.47 3fyu h ILE 251 Cb 1.08 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 38.60 3fyu h ILE 251 CO -0.00 0.00 -1.80 0.59 -1.05 0.00 0.00 178.15 175.89 3fyu n ASN 252 N -2.51 0.29 -0.07 2.16 3.02 0.28 -4.45 115.26 113.98 3fyu n ASN 252 Ca 0.00 -0.17 -0.12 0.00 -0.03 0.00 0.00 54.58 54.26 3fyu n ASN 252 Cb 0.18 1.80 -0.14 0.00 -0.61 0.00 0.00 39.78 41.01 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 -2.11 1.10 -0.32 3.41 4.77 -0.79 -4.45 117.00 118.62 3fyu n LEU 253 Ca -0.03 0.11 0.19 0.00 -0.03 0.00 0.00 56.01 56.26 3fyu n LEU 253 Cb 0.51 -0.04 0.39 0.00 -2.33 0.00 0.00 43.42 41.95 3fyu n LEU 253 CO 0.44 0.59 1.00 0.00 -1.33 0.00 0.00 177.39 178.10 3fyu h ALA 254 N 0.70 1.61 -0.03 -1.18 0.00 -0.55 0.17 119.26 119.98 3fyu h ALA 254 Ca -0.47 0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.68 3fyu h ALA 254 Cb 2.10 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 20.18 3fyu h ALA 254 CO 0.03 -0.57 0.14 0.78 0.00 0.00 0.00 179.25 179.62 3fyu h GLY 255 N 0.20 0.00 1.15 0.00 0.00 -1.77 -0.83 103.07 101.83 3fyu h GLY 255 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.99 3fyu h GLY 255 CO -0.68 0.00 -0.48 0.79 0.00 0.00 0.00 176.54 176.16 3fyu n TRP 256 N -3.15 0.15 -2.32 5.60 8.01 0.05 -4.76 117.44 121.03 3fyu n TRP 256 Ca -0.02 0.04 -0.42 0.00 -1.31 0.00 0.00 57.50 55.79 3fyu n TRP 256 Cb 0.21 -0.39 -0.03 0.00 -2.01 0.00 0.00 31.31 29.09 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 -3.05 3.98 -0.39 -0.99 1.01 -0.32 -4.67 120.40 115.98 3fyu s VAL 257 Ca 0.10 1.30 0.06 0.00 0.00 0.00 0.00 61.98 63.44 3fyu s VAL 257 Cb 0.17 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 3fyu s VAL 257 CO 0.69 -0.04 0.35 0.29 0.00 0.00 0.00 175.10 176.39 3fyu n LYS 258 N 5.75 3.95 -3.03 2.72 4.76 -1.26 -4.46 118.16 126.59 3fyu n LYS 258 Ca 0.13 -0.20 -0.33 0.00 -2.87 0.00 0.00 58.31 55.04 3fyu n LYS 258 Cb 0.45 -0.85 -0.06 0.00 -1.84 0.00 0.00 35.03 32.72 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 -1.31 4.10 0.19 1.97 1.11 -1.26 -4.64 119.66 119.82 3fyu s GLN 259 Ca 0.03 0.83 -0.33 0.00 0.01 0.00 0.00 55.36 55.91 3fyu s GLN 259 Cb 0.05 -2.40 -0.13 0.00 -1.01 0.00 0.00 33.01 29.52 3fyu s GLN 259 CO 0.20 0.12 1.59 -2.30 0.01 0.00 0.00 175.29 174.91 3fyu n PRO 260 N -0.35 2.32 -4.72 2.91 -0.02 -1.24 -4.46 135.00 129.42 3fyu n PRO 260 Ca 0.04 0.83 -0.25 0.00 -2.02 0.00 0.00 63.50 62.11 3fyu n PRO 260 Cb 0.53 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.25 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 0.75 1.28 -0.16 3.45 2.01 0.12 -0.77 115.64 122.31 3fyu s THR 261 Ca 0.75 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 62.14 3fyu s THR 261 Cb -0.62 -1.11 0.01 0.00 0.01 0.00 0.00 72.50 70.79 3fyu s THR 261 CO 0.39 0.37 -0.20 -0.22 -0.69 0.00 0.00 174.62 174.27 3fyu s LEU 262 N 0.12 2.17 0.28 4.42 2.96 0.46 -1.57 118.68 127.52 3fyu s LEU 262 Ca -0.05 -0.61 0.09 0.00 -0.22 0.00 0.00 54.13 53.34 3fyu s LEU 262 Cb -0.11 -1.48 -0.06 0.00 0.50 0.00 0.00 46.19 45.05 3fyu s LEU 262 CO 0.02 0.04 -0.12 -0.04 -1.32 0.00 0.00 176.35 174.94 3fyu s MET 263 N 1.03 1.61 0.03 1.98 -1.94 -0.36 -0.54 119.30 121.11 3fyu s MET 263 Ca -0.02 -1.79 -0.00 0.00 -1.71 0.00 0.00 55.69 52.18 3fyu s MET 263 Cb -0.14 -1.43 -0.03 0.00 2.01 0.00 0.00 34.83 35.24 3fyu s MET 263 CO -0.06 0.16 -0.03 0.00 -0.01 0.00 0.00 175.02 175.07 3fyu s ALA 264 N -2.79 0.25 -0.22 3.03 0.00 -0.98 -0.47 121.76 120.59 3fyu s ALA 264 Ca 0.29 -0.76 -0.15 0.00 0.00 0.00 0.00 51.96 51.34 3fyu s ALA 264 Cb 0.01 0.17 0.06 0.00 0.00 0.00 0.00 23.12 23.36 3fyu s ALA 264 CO 0.13 -0.20 0.55 -1.50 0.00 0.00 0.00 175.76 174.74 3fyu s ILE 265 N -2.07 -0.01 -0.09 0.00 1.10 -0.63 0.04 121.20 119.55 3fyu s ILE 265 Ca -0.10 0.03 -0.12 0.00 -0.51 0.00 0.00 60.65 59.95 3fyu s ILE 265 Cb -0.06 -0.79 -0.05 0.00 0.15 0.00 0.00 42.46 41.72 3fyu s ILE 265 CO -0.03 0.01 0.28 -0.83 -2.11 0.00 0.00 174.94 172.26 3fyu s GLY 266 N 1.04 2.29 0.17 1.50 0.00 -1.26 -1.03 107.32 110.04 3fyu s GLY 266 Ca -0.06 -0.43 0.22 0.00 0.00 0.00 0.00 44.72 44.45 3fyu s GLY 266 CO -0.10 0.06 1.69 1.04 0.00 0.00 0.00 173.10 175.80 3fyu n LEU 267 N 2.43 0.49 -1.02 0.66 4.77 -0.49 -2.71 117.00 121.13 3fyu n LEU 267 Ca -0.15 0.60 0.05 0.00 -0.03 0.00 0.00 56.01 56.48 3fyu n LEU 267 Cb 0.53 -0.51 0.25 0.00 -2.33 0.00 0.00 43.42 41.37 3fyu n LEU 267 CO 0.36 -0.37 0.73 2.30 -1.33 0.00 0.00 177.39 179.08 3fyu n ILE 268 N -2.02 2.39 -2.30 -0.08 -5.35 -0.97 -4.47 119.36 106.56 3fyu n ILE 268 Ca 0.03 -2.01 -0.43 0.00 -0.27 0.00 0.00 62.75 60.08 3fyu n ILE 268 Cb 0.26 -0.28 -0.02 0.00 -1.74 0.00 0.00 39.64 37.86 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 -1.97 6.67 0.00 7.28 -1.08 -1.10 -4.60 116.67 121.87 3fyu s ASP 269 Ca 0.44 1.56 0.23 0.00 -0.52 0.00 0.00 52.55 54.26 3fyu s ASP 269 Cb 0.36 -2.54 0.09 0.00 -1.46 0.00 0.00 42.92 39.37 3fyu s ASP 269 CO 0.08 -1.02 1.12 0.29 0.52 0.00 0.00 175.17 176.16 3fyu n LYS 270 N 7.18 0.15 -0.10 4.34 5.02 -1.26 -3.77 118.16 129.72 3fyu n LYS 270 Ca 0.16 -0.11 -0.20 0.00 -2.02 0.00 0.00 58.31 56.13 3fyu n LYS 270 Cb 0.45 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.85 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 0.28 1.02 -3.30 -0.18 2.04 -1.88 -2.53 117.51 112.96 3fyu h ILE 271 Ca 0.00 -2.17 -0.65 0.00 1.00 0.00 0.00 64.86 63.05 3fyu h ILE 271 Cb 0.52 2.33 -0.40 0.00 -0.74 0.00 0.00 36.82 38.53 3fyu h ILE 271 CO 0.00 0.35 -0.54 0.42 0.00 0.00 0.00 178.15 178.38 3fyu s THR 272 N -2.33 2.97 0.26 -0.27 -4.23 -1.26 -4.73 115.64 106.04 3fyu s THR 272 Ca -0.27 -3.65 -0.29 0.00 -1.18 0.00 0.00 61.69 56.30 3fyu s THR 272 Cb 0.04 -2.98 -0.14 0.00 1.34 0.00 0.00 72.50 70.76 3fyu s THR 272 CO 0.59 -0.90 1.06 -2.65 -0.54 0.00 0.00 174.62 172.18 3fyu n PRO 273 N 2.70 1.33 -0.31 3.99 -0.02 -1.25 -4.76 135.00 136.68 3fyu n PRO 273 Ca 0.12 0.47 0.17 0.00 -2.02 0.00 0.00 63.50 62.23 3fyu n PRO 273 Cb 0.34 -1.88 0.36 0.00 -0.02 0.00 0.00 33.50 32.31 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 2.41 0.26 -0.63 0.52 0.11 -1.81 0.06 132.00 132.94 3fyu h PRO 274 Ca -0.40 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.72 3fyu h PRO 274 Cb 1.34 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.35 3fyu h PRO 274 CO 0.63 0.17 0.38 0.66 -0.21 0.00 0.00 178.00 179.64 3fyu h SER 275 N 0.27 0.61 0.39 -2.05 4.64 -1.93 0.18 113.55 115.66 3fyu h SER 275 Ca 0.62 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.88 3fyu h SER 275 Cb 1.32 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 3fyu h SER 275 CO -0.63 0.42 -0.33 0.71 -0.87 0.00 0.00 176.83 176.14 3fyu h THR 276 N 0.74 1.15 0.24 2.95 1.35 -1.29 0.12 112.91 118.17 3fyu h THR 276 Ca 0.26 -1.15 -0.33 0.00 -0.55 0.00 0.00 66.41 64.63 3fyu h THR 276 Cb 0.04 1.64 0.04 0.00 -1.73 0.00 0.00 68.15 68.14 3fyu h THR 276 CO -0.11 0.32 -1.45 0.58 -0.25 0.00 0.00 175.52 174.61 3fyu h VAL 277 N 0.00 1.30 -0.14 6.82 2.07 -1.05 -3.01 116.25 122.25 3fyu h VAL 277 Ca -0.00 -2.72 -0.07 0.00 0.82 0.00 0.00 66.70 64.72 3fyu h VAL 277 Cb 0.61 3.02 -0.01 0.00 -1.52 0.00 0.00 31.29 33.39 3fyu h VAL 277 CO 0.04 0.81 -0.23 -0.26 0.02 0.00 0.00 177.57 177.95 3fyu h PHE 278 N 0.15 0.27 -0.32 1.57 -1.00 -0.48 -1.15 116.94 115.97 3fyu h PHE 278 Ca -0.24 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.49 3fyu h PHE 278 Cb 2.15 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 41.62 3fyu h PHE 278 CO 0.12 0.47 0.20 0.00 -1.61 0.00 0.00 178.31 177.50 3fyu h ALA 279 N 1.54 0.40 -0.31 2.45 0.00 -0.98 0.47 119.26 122.84 3fyu h ALA 279 Ca 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3fyu h ALA 279 Cb 0.54 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3fyu h ALA 279 CO 0.04 -0.12 0.04 0.00 0.00 0.00 0.00 179.25 179.21 3fyu h ALA 280 N 1.10 0.41 -0.61 0.00 0.00 -1.31 -2.72 119.26 116.12 3fyu h ALA 280 Ca 0.12 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3fyu h ALA 280 Cb -0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3fyu h ALA 280 CO -0.02 0.11 0.40 -0.92 0.00 0.00 0.00 179.25 178.82 3fyu h TYR 281 N 0.33 0.76 0.00 0.00 3.20 -0.86 -2.18 116.97 118.22 3fyu h TYR 281 Ca 0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3fyu h TYR 281 Cb 0.37 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.38 3fyu h TYR 281 CO 0.03 0.47 0.00 0.09 -1.64 0.00 0.00 178.16 177.10 3fyu n ASN 282 N -4.67 0.00 -0.42 -2.11 3.02 0.16 -1.96 115.26 109.28 3fyu n ASN 282 Ca 0.05 0.38 0.11 0.00 -0.03 0.00 0.00 54.58 55.09 3fyu n ASN 282 Cb 0.03 -0.44 0.06 0.00 -0.61 0.00 0.00 39.78 38.82 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 -1.44 0.00 -2.79 3.10 8.25 -0.83 -4.90 115.22 116.61 3fyu n HIS 283 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 3fyu n HIS 283 Cb 0.16 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 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 -2.52 4.34 -0.61 2.41 1.43 -0.83 -3.24 118.68 119.66 3fyu s LEU 284 Ca 0.19 1.52 0.04 0.00 -1.03 0.00 0.00 54.13 54.85 3fyu s LEU 284 Cb 0.18 -3.44 0.15 0.00 0.03 0.00 0.00 46.19 43.11 3fyu s LEU 284 CO 0.58 -0.25 0.39 -1.61 0.23 0.00 0.00 176.35 175.69 3fyu s GLU 285 N 1.13 2.16 0.15 1.70 2.02 -1.26 -5.02 118.70 119.58 3fyu s GLU 285 Ca 0.48 -2.97 -0.24 0.00 0.02 0.00 0.00 54.97 52.26 3fyu s GLU 285 Cb -0.20 -3.25 0.08 0.00 0.10 0.00 0.00 34.13 30.86 3fyu s GLU 285 CO 0.24 -1.22 1.05 -0.08 0.02 0.00 0.00 175.26 175.27 3fyu s THR 286 N -0.88 0.00 -0.19 3.63 -1.32 -1.26 -4.76 115.64 110.85 3fyu s THR 286 Ca 0.22 -0.56 -0.29 0.00 -1.21 0.00 0.00 61.69 59.85 3fyu s THR 286 Cb -0.13 -2.52 -0.05 0.00 -1.51 0.00 0.00 72.50 68.29 3fyu s THR 286 CO -0.10 0.00 2.04 -0.62 -2.21 0.00 0.00 174.62 173.73 3fyu s ASP 287 N -3.23 5.80 0.20 8.08 -1.08 -1.26 -4.90 116.67 120.28 3fyu s ASP 287 Ca 0.18 1.90 -0.04 0.00 -0.52 0.00 0.00 52.55 54.07 3fyu s ASP 287 Cb -0.01 -2.52 -0.03 0.00 -1.46 0.00 0.00 42.92 38.90 3fyu s ASP 287 CO 0.03 -1.68 0.21 -1.59 0.52 0.00 0.00 175.17 172.66 3fyu s LYS 288 N 5.72 1.25 -0.28 4.34 -2.85 -1.26 0.11 119.74 126.77 3fyu s LYS 288 Ca 0.92 -1.49 -0.19 0.00 -1.00 0.00 0.00 55.97 54.20 3fyu s LYS 288 Cb -0.32 0.32 0.11 0.00 -2.06 0.00 0.00 37.83 35.88 3fyu s LYS 288 CO 0.35 -0.44 0.85 0.34 0.10 0.00 0.00 175.35 176.55 3fyu s ASP 289 N -3.10 -0.69 -0.26 0.03 2.15 -0.61 -4.95 116.67 109.25 3fyu s ASP 289 Ca 0.32 1.17 -0.01 0.00 0.43 0.00 0.00 52.55 54.46 3fyu s ASP 289 Cb 0.05 1.25 0.03 0.00 -0.30 0.00 0.00 42.92 43.95 3fyu s ASP 289 CO 0.09 -0.19 -0.05 -0.22 -0.17 0.00 0.00 175.17 174.63 3fyu s LEU 290 N 1.06 3.33 -0.28 -1.34 2.96 -1.26 -1.23 118.68 121.92 3fyu s LEU 290 Ca -0.05 -0.98 -0.24 0.00 -0.22 0.00 0.00 54.13 52.64 3fyu s LEU 290 Cb -0.05 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.98 3fyu s LEU 290 CO -0.12 -0.16 0.81 -0.54 -1.32 0.00 0.00 176.35 175.02 3fyu s LYS 291 N 1.30 4.06 -0.19 1.98 -0.14 0.38 -4.96 119.74 122.16 3fyu s LYS 291 Ca -0.01 0.75 -0.09 0.00 -1.36 0.00 0.00 55.97 55.25 3fyu s LYS 291 Cb -0.17 -3.69 -0.05 0.00 -1.68 0.00 0.00 37.83 32.24 3fyu s LYS 291 CO -0.04 -0.62 0.11 0.08 -0.76 0.00 0.00 175.35 174.13 3fyu s VAL 292 N 2.93 5.25 -0.29 3.17 1.01 -1.26 -1.60 120.40 129.61 3fyu s VAL 292 Ca 0.34 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.48 3fyu s VAL 292 Cb -0.14 -3.39 0.08 0.00 0.00 0.00 0.00 36.38 32.93 3fyu s VAL 292 CO 0.10 0.45 -0.02 -0.31 0.00 0.00 0.00 175.10 175.32 3fyu s TYR 293 N 0.30 3.23 0.22 5.22 2.02 -0.19 -4.98 117.35 123.16 3fyu s TYR 293 Ca 0.07 -2.47 -0.08 0.00 -0.37 0.00 0.00 57.07 54.22 3fyu s TYR 293 Cb -0.11 -2.25 0.31 0.00 -0.40 0.00 0.00 41.96 39.50 3fyu s TYR 293 CO -0.01 -0.89 1.76 -0.09 -1.57 0.00 0.00 175.55 174.75 3fyu h ARG 294 N 7.76 0.50 -0.57 -0.62 9.65 -1.95 -1.28 114.38 127.85 3fyu h ARG 294 Ca -0.13 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 3fyu h ARG 294 Cb 1.04 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 3fyu h ARG 294 CO 0.48 0.33 0.00 0.66 2.80 0.00 0.00 179.97 184.24 3fyu n TYR 295 N -4.92 0.92 -4.47 2.20 4.01 -1.26 -4.01 117.16 109.63 3fyu n TYR 295 Ca 0.10 -0.39 -0.24 0.00 -0.16 0.00 0.00 57.90 57.21 3fyu n TYR 295 Cb 0.27 -0.12 -0.10 0.00 -0.31 0.00 0.00 39.34 39.08 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 -1.59 2.27 0.00 -0.72 0.40 -1.17 -4.93 117.98 112.24 3fyu s PHE 296 Ca 0.35 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 3fyu s PHE 296 Cb 0.21 -1.02 0.00 0.00 0.51 0.00 0.00 43.02 42.72 3fyu s PHE 296 CO 0.20 0.69 0.00 0.41 0.70 0.00 0.00 175.22 177.22 3fyu n GLY 297 N -0.63 4.72 3.52 4.36 0.00 -1.26 -2.29 105.19 113.62 3fyu n GLY 297 Ca -0.05 -1.24 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 3fyu n GLY 297 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fyu s HIS 298 N 3.80 3.12 0.32 1.61 2.46 -1.26 -4.38 115.29 120.95 3fyu s HIS 298 Ca 0.00 -1.84 -0.18 0.00 0.47 0.00 0.00 55.06 53.51 3fyu s HIS 298 Cb 0.00 -4.54 0.06 0.00 -0.13 0.00 0.00 32.58 27.97 3fyu s HIS 298 CO 0.00 -1.62 0.86 -1.83 -2.47 0.00 0.00 174.74 169.69 3fyu s GLU 299 N 2.99 1.93 0.11 2.88 -1.05 -1.26 -5.06 118.70 119.25 3fyu s GLU 299 Ca 0.48 -1.24 -0.31 0.00 -0.15 0.00 0.00 54.97 53.76 3fyu s GLU 299 Cb 0.01 0.55 -0.08 0.00 -0.44 0.00 0.00 34.13 34.16 3fyu s GLU 299 CO 0.04 -0.91 1.43 0.12 0.95 0.00 0.00 175.26 176.89 3fyu s PHE 300 N -2.33 3.16 -0.36 4.83 5.36 -1.26 -4.98 117.98 122.39 3fyu s PHE 300 Ca 0.17 0.87 -0.02 0.00 -0.96 0.00 0.00 56.93 56.99 3fyu s PHE 300 Cb -0.04 -3.73 0.09 0.00 -0.34 0.00 0.00 43.02 38.99 3fyu s PHE 300 CO 0.09 -2.61 0.12 0.42 -1.46 0.00 0.00 175.22 171.78 3fyu s ILE 301 N 1.24 3.07 0.24 3.12 1.01 -1.26 -5.01 121.20 123.61 3fyu s ILE 301 Ca 0.66 -1.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.36 3fyu s ILE 301 Cb -0.38 -3.01 0.26 0.00 0.01 0.00 0.00 42.46 39.34 3fyu s ILE 301 CO 0.30 -0.48 1.64 -0.65 0.00 0.00 0.00 174.94 175.75 3fyu h PRO 302 N 7.98 0.09 -0.77 2.79 0.11 -2.01 0.12 132.00 140.31 3fyu h PRO 302 Ca -0.15 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.01 3fyu h PRO 302 Cb 1.05 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.09 3fyu h PRO 302 CO 0.62 0.06 0.51 0.00 -0.21 0.00 0.00 178.00 178.98 3fyu h ALA 303 N 1.68 1.60 0.00 -0.75 0.00 -2.01 -1.05 119.26 118.73 3fyu h ALA 303 Ca 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 3fyu h ALA 303 Cb 0.66 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3fyu h ALA 303 CO -0.64 0.29 -0.11 0.35 0.00 0.00 0.00 179.25 179.14 3fyu h PHE 304 N 0.88 0.00 -0.38 0.00 3.57 -1.41 -2.86 116.94 116.73 3fyu h PHE 304 Ca 0.32 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 3fyu h PHE 304 Cb 0.16 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3fyu h PHE 304 CO -0.00 0.11 -0.04 0.37 -2.23 0.00 0.00 178.31 176.52 3fyu h GLN 305 N 0.00 0.71 0.04 1.11 5.75 -0.71 0.17 115.11 122.18 3fyu h GLN 305 Ca -0.00 -0.25 -0.00 0.00 -0.15 0.00 0.00 58.65 58.25 3fyu h GLN 305 Cb 0.74 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.24 3fyu h GLN 305 CO 0.01 0.83 -0.02 1.15 -2.65 0.00 0.00 178.83 178.15 3fyu h THR 306 N 0.52 0.96 -0.43 2.39 2.02 -1.42 0.22 112.91 117.16 3fyu h THR 306 Ca 0.10 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.37 3fyu h THR 306 Cb 0.54 0.96 -0.08 0.00 -1.74 0.00 0.00 68.15 67.82 3fyu h THR 306 CO 0.03 0.00 -0.08 -0.33 0.37 0.00 0.00 175.52 175.51 3fyu h GLU 307 N -0.06 0.02 0.34 6.66 4.39 -1.30 0.12 114.58 124.76 3fyu h GLU 307 Ca -0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3fyu h GLU 307 Cb 0.05 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3fyu h GLU 307 CO 0.01 0.02 -0.20 -0.22 -1.16 0.00 0.00 179.01 177.45 3fyu h LYS 308 N 0.03 -0.49 -0.88 2.33 3.64 -0.15 0.16 116.57 121.20 3fyu h LYS 308 Ca 0.21 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 3fyu h LYS 308 Cb 0.32 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 3fyu h LYS 308 CO -0.43 -0.33 0.57 -0.07 -2.27 0.00 0.00 179.45 176.92 3fyu h LEU 309 N -0.51 0.95 -0.50 5.20 3.38 -0.24 -0.76 115.31 122.83 3fyu h LEU 309 Ca -0.04 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 3fyu h LEU 309 Cb 0.42 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3fyu h LEU 309 CO 0.04 0.65 0.01 -1.28 0.09 0.00 0.00 178.44 177.96 3fyu h SER 310 N 1.11 0.86 0.09 -0.43 0.87 -0.54 -0.42 113.55 115.10 3fyu h SER 310 Ca 0.35 -0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3fyu h SER 310 Cb -0.00 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 3fyu h SER 310 CO -0.12 0.95 -0.05 0.15 -0.53 0.00 0.00 176.83 177.24 3fyu h PHE 311 N 0.75 -0.12 -0.65 2.24 3.04 -0.18 -1.54 116.94 120.47 3fyu h PHE 311 Ca 0.14 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.05 3fyu h PHE 311 Cb 0.50 0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.02 3fyu h PHE 311 CO 0.04 0.12 0.24 -0.07 -2.02 0.00 0.00 178.31 176.62 3fyu h LEU 312 N -0.35 0.89 -0.35 0.59 3.38 -1.15 -1.86 115.31 116.46 3fyu h LEU 312 Ca -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3fyu h LEU 312 Cb 0.29 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3fyu h LEU 312 CO 0.02 0.80 0.17 -0.61 0.09 0.00 0.00 178.44 178.92 3fyu h GLN 313 N 0.94 0.51 -0.72 1.13 4.15 -0.97 0.20 115.11 120.35 3fyu h GLN 313 Ca 0.22 -0.07 -0.05 0.00 0.77 0.00 0.00 58.65 59.51 3fyu h GLN 313 Cb 0.21 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 3fyu h GLN 313 CO -0.02 0.46 0.25 -0.22 -1.93 0.00 0.00 178.83 177.36 3fyu h LYS 314 N 0.43 1.10 0.00 1.69 3.64 -0.98 -1.11 116.57 121.34 3fyu h LYS 314 Ca 0.12 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3fyu h LYS 314 Cb 0.11 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3fyu h LYS 314 CO -0.02 0.93 -1.07 0.72 -2.27 0.00 0.00 179.45 177.74 3fyu n HIS 315 N -4.31 0.66 0.08 1.91 8.25 -0.72 -4.69 115.22 116.40 3fyu n HIS 315 Ca 0.06 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 3fyu n HIS 315 Cb 0.21 -0.76 0.00 0.00 1.12 0.00 0.00 29.99 30.56 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 -2.41 0.61 -0.01 2.41 4.77 0.68 -4.93 117.00 118.13 3fyu n LEU 316 Ca 0.00 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 3fyu n LEU 316 Cb 0.51 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.50 3fyu n LEU 316 CO 0.40 -0.73 0.83 0.25 -1.33 0.00 0.00 177.39 176.81 3fyu h LEU 317 N 0.00 -0.18 -1.72 2.23 5.85 -1.30 -3.45 115.31 116.73 3fyu h LEU 317 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3fyu h LEU 317 Cb 0.04 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.18 3fyu h LEU 317 CO 0.00 -0.07 0.00 0.18 -0.34 0.00 0.00 178.44 178.21