#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 1.46 0.41 3.17 2.00 -1.26 -5.02 119.66 120.42 3fyu s GLN 2 Ca 0.00 -1.81 -0.24 0.00 -2.00 0.00 0.00 55.36 51.31 3fyu s GLN 2 Cb 0.00 0.10 -0.11 0.00 0.80 0.00 0.00 33.01 33.80 3fyu s GLN 2 CO 0.00 -0.45 0.96 1.28 -0.50 0.00 0.00 175.29 176.58 3fyu n LEU 3 N -0.46 2.28 0.00 3.68 4.32 -1.26 -4.75 117.00 120.80 3fyu n LEU 3 Ca 0.02 1.03 0.00 0.00 -0.02 0.00 0.00 56.01 57.05 3fyu n LEU 3 Cb 0.65 -1.32 0.00 0.00 -1.62 0.00 0.00 43.42 41.13 3fyu n LEU 3 CO 0.34 -1.63 0.00 2.22 -1.22 0.00 0.00 177.39 177.10 3fyu n PHE 4 N -0.48 0.00 -0.09 -1.77 -1.74 -1.26 -5.09 117.46 107.02 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 0.39 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.39 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 -0.59 -0.02 -4.72 5.98 -0.08 -1.26 -5.01 116.55 110.84 3fyu n ASP 5 Ca 0.00 -0.09 -0.33 0.00 -1.51 0.00 0.00 54.79 52.86 3fyu n ASP 5 Cb 0.00 0.00 0.11 0.00 2.34 0.00 0.00 41.12 43.57 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 3.13 0.68 -2.67 1.43 -1.26 -4.97 118.68 115.02 3fyu s LEU 6 Ca 0.00 2.17 -0.16 0.00 -1.03 0.00 0.00 54.13 55.11 3fyu s LEU 6 Cb 0.00 -4.57 0.01 0.00 0.03 0.00 0.00 46.19 41.66 3fyu s LEU 6 CO 0.00 -2.41 1.18 -0.94 0.23 0.00 0.00 176.35 174.40 3fyu s SER 7 N -2.53 4.69 0.35 2.29 1.04 -1.26 -4.70 113.70 113.58 3fyu s SER 7 Ca 0.69 2.26 0.09 0.00 0.48 0.00 0.00 55.95 59.47 3fyu s SER 7 Cb -0.24 -2.58 0.81 0.00 0.10 0.00 0.00 66.02 64.11 3fyu s SER 7 CO 0.51 -1.92 1.86 0.25 0.98 0.00 0.00 173.24 174.91 3fyu h LEU 8 N 0.08 0.66 -1.12 2.42 5.85 -1.99 0.14 115.31 121.36 3fyu h LEU 8 Ca -0.48 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 3fyu h LEU 8 Cb 1.28 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 3fyu h LEU 8 CO 0.52 0.33 0.26 -0.08 -0.34 0.00 0.00 178.44 179.13 3fyu h GLU 9 N 0.70 0.88 0.09 1.25 4.81 -2.01 -2.57 114.58 117.73 3fyu h GLU 9 Ca 0.46 -0.13 -0.25 0.00 -0.13 0.00 0.00 59.36 59.30 3fyu h GLU 9 Cb 0.74 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 3fyu h GLU 9 CO -0.21 0.71 -1.15 0.93 -0.73 0.00 0.00 179.01 178.56 3fyu h GLU 10 N 0.87 0.25 -0.92 1.92 5.08 -1.18 -3.31 114.58 117.29 3fyu h GLU 10 Ca 0.21 -0.38 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 3fyu h GLU 10 Cb 0.15 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 3fyu h GLU 10 CO -0.02 1.16 0.60 -0.07 -1.00 0.00 0.00 179.01 179.68 3fyu h LEU 11 N 0.08 1.03 -1.84 1.33 3.38 -0.56 -0.49 115.31 118.24 3fyu h LEU 11 Ca -0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3fyu h LEU 11 Cb 1.86 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.36 3fyu h LEU 11 CO 0.18 0.73 -0.05 0.11 0.09 0.00 0.00 178.44 179.50 3fyu h LYS 12 N 1.21 0.04 -0.01 1.13 1.57 -1.55 -2.03 116.57 116.92 3fyu h LYS 12 Ca 0.35 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3fyu h LYS 12 Cb -0.07 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3fyu h LYS 12 CO -0.10 0.09 -0.43 1.63 -0.57 0.00 0.00 179.45 180.08 3fyu n LYS 13 N -4.46 1.19 -2.17 3.15 5.02 -0.71 -4.91 118.16 115.28 3fyu n LYS 13 Ca -0.02 -0.96 -0.43 0.00 -2.02 0.00 0.00 58.31 54.88 3fyu n LYS 13 Cb 0.14 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 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 -2.46 2.09 -0.43 2.13 5.04 -0.28 -4.89 117.35 118.55 3fyu s TYR 14 Ca 0.20 0.64 0.05 0.00 -2.44 0.00 0.00 57.07 55.52 3fyu s TYR 14 Cb 0.18 -4.22 0.18 0.00 0.35 0.00 0.00 41.96 38.45 3fyu s TYR 14 CO 0.56 -2.49 0.43 1.17 -1.34 0.00 0.00 175.55 173.88 3fyu n LYS 15 N 8.27 0.30 -1.66 4.97 4.81 -1.26 -4.09 118.16 129.49 3fyu n LYS 15 Ca 0.20 -2.96 -0.40 0.00 -0.87 0.00 0.00 58.31 54.28 3fyu n LYS 15 Cb 0.47 -1.59 0.03 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 2.70 1.51 -1.72 1.64 -0.04 -1.26 -4.90 135.00 132.94 3fyu n PRO 16 Ca 0.27 0.55 -0.43 0.00 -0.04 0.00 0.00 63.50 63.85 3fyu n PRO 16 Cb 0.50 -2.28 -0.01 0.00 -0.04 0.00 0.00 33.50 31.67 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 -0.33 2.43 -1.66 0.54 4.81 -1.26 -4.91 118.16 117.79 3fyu n LYS 17 Ca 0.09 0.86 -0.38 0.00 -0.87 0.00 0.00 58.31 58.02 3fyu n LYS 17 Cb 0.42 -2.57 0.05 0.00 0.02 0.00 0.00 35.03 32.95 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 1.59 1.08 -0.16 1.64 5.02 -1.26 -4.92 118.16 121.15 3fyu n LYS 18 Ca 0.08 0.41 0.06 0.00 -2.02 0.00 0.00 58.31 56.84 3fyu n LYS 18 Cb 0.36 -2.32 0.15 0.00 -0.02 0.00 0.00 35.03 33.19 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 -1.65 0.83 -1.76 -0.18 -2.24 -1.26 -5.02 114.28 103.01 3fyu n THR 19 Ca 0.14 -0.92 -0.42 0.00 -2.27 0.00 0.00 64.05 60.58 3fyu n THR 19 Cb 0.47 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 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 3.76 0.85 6.98 0.00 -1.26 -4.87 121.76 126.21 3fyu s ALA 20 Ca 0.24 1.41 -0.11 0.00 0.00 0.00 0.00 51.96 53.50 3fyu s ALA 20 Cb 0.13 -3.75 0.10 0.00 0.00 0.00 0.00 23.12 19.60 3fyu s ALA 20 CO 0.17 -1.18 1.09 1.03 0.00 0.00 0.00 175.76 176.87 3fyu s ARG 21 N 2.62 1.67 0.51 0.00 3.00 -1.26 -4.91 118.95 120.58 3fyu s ARG 21 Ca 0.79 0.85 0.22 0.00 0.00 0.00 0.00 55.73 57.59 3fyu s ARG 21 Cb -0.45 -1.85 1.32 0.00 0.00 0.00 0.00 34.95 33.96 3fyu s ARG 21 CO 0.35 -1.96 2.01 -1.35 0.00 0.00 0.00 175.30 174.35 3fyu h PRO 22 N -1.35 0.07 -0.65 3.54 0.11 -2.04 -1.29 132.00 130.40 3fyu h PRO 22 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3fyu h PRO 22 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3fyu h PRO 22 CO 0.55 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 3fyu n ASP 23 N -4.41 4.50 0.02 -2.05 5.75 -1.26 -4.61 116.55 114.48 3fyu n ASP 23 Ca 0.09 -2.46 -0.05 0.00 -0.01 0.00 0.00 54.79 52.36 3fyu n ASP 23 Cb 0.52 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 40.01 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 3.74 -0.55 -0.99 2.11 3.57 -1.58 0.37 116.94 123.62 3fyu h PHE 24 Ca 0.00 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.70 3fyu h PHE 24 Cb 1.41 0.24 -0.10 0.00 2.79 0.00 0.00 35.95 40.29 3fyu h PHE 24 CO 0.74 -0.20 0.61 1.03 -2.23 0.00 0.00 178.31 178.27 3fyu h SER 25 N -0.23 0.73 -0.11 0.41 0.87 -1.83 -1.89 113.55 111.51 3fyu h SER 25 Ca 0.00 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 3fyu h SER 25 Cb 0.25 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3fyu h SER 25 CO -0.12 0.28 0.04 -0.78 -0.53 0.00 0.00 176.83 175.71 3fyu h ASP 26 N 0.72 0.15 -0.94 6.23 3.58 -1.59 -2.01 116.42 122.55 3fyu h ASP 26 Ca 0.55 -0.17 0.11 0.00 0.42 0.00 0.00 57.03 57.94 3fyu h ASP 26 Cb 0.92 -0.04 -0.08 0.00 1.72 0.00 0.00 39.33 41.85 3fyu h ASP 26 CO -0.33 0.28 0.58 0.15 -2.88 0.00 0.00 179.24 177.03 3fyu h PHE 27 N 0.01 1.05 -0.04 0.28 3.57 0.52 -1.30 116.94 121.03 3fyu h PHE 27 Ca 0.04 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.41 3fyu h PHE 27 Cb 0.17 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 3fyu h PHE 27 CO -0.01 0.43 -0.68 -1.49 -2.23 0.00 0.00 178.31 174.33 3fyu h TRP 28 N 0.94 0.25 -0.09 0.41 4.06 -1.31 -0.77 115.95 119.44 3fyu h TRP 28 Ca 0.46 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 61.29 3fyu h TRP 28 Cb 0.42 -0.04 -0.00 0.00 -1.00 0.00 0.00 29.16 28.54 3fyu h TRP 28 CO -0.02 0.81 0.03 -0.22 -3.56 0.00 0.00 178.44 175.47 3fyu h LYS 29 N 0.13 0.14 -0.36 0.49 3.64 -0.55 -0.18 116.57 119.87 3fyu h LYS 29 Ca -0.02 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 3fyu h LYS 29 Cb 1.21 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.00 3fyu h LYS 29 CO 0.10 0.30 -0.13 0.87 -2.27 0.00 0.00 179.45 178.32 3fyu h LYS 30 N -0.05 0.64 -0.40 1.90 1.57 -1.24 -1.24 116.57 117.76 3fyu h LYS 30 Ca 0.03 -0.20 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 3fyu h LYS 30 Cb 0.22 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 3fyu h LYS 30 CO -0.00 0.75 -0.13 0.77 -0.57 0.00 0.00 179.45 180.27 3fyu h SER 31 N 0.59 0.71 0.12 0.86 0.02 -0.93 -0.77 113.55 114.15 3fyu h SER 31 Ca 0.10 -0.22 -0.14 0.00 -0.84 0.00 0.00 61.79 60.70 3fyu h SER 31 Cb 0.56 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3fyu h SER 31 CO 0.03 0.86 -0.50 -0.07 -1.14 0.00 0.00 176.83 176.02 3fyu h LEU 32 N 0.65 0.47 -0.53 5.07 3.38 -0.70 -2.26 115.31 121.39 3fyu h LEU 32 Ca 0.11 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3fyu h LEU 32 Cb 0.60 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3fyu h LEU 32 CO 0.04 0.89 0.07 -0.08 0.09 0.00 0.00 178.44 179.45 3fyu h GLU 33 N 0.34 0.89 0.00 1.13 4.57 -0.70 -0.01 114.58 120.80 3fyu h GLU 33 Ca 0.01 -0.25 -0.06 0.00 -1.18 0.00 0.00 59.36 57.89 3fyu h GLU 33 Cb 1.00 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.48 3fyu h GLU 33 CO 0.09 0.87 -0.29 0.93 -1.18 0.00 0.00 179.01 179.43 3fyu h GLU 34 N 0.77 0.00 -0.13 1.92 5.08 -1.03 -2.15 114.58 119.03 3fyu h GLU 34 Ca 0.16 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3fyu h GLU 34 Cb 0.43 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 3fyu h GLU 34 CO 0.01 0.29 -0.08 1.25 -1.00 0.00 0.00 179.01 179.49 3fyu h LEU 35 N 0.00 0.29 -1.78 1.33 5.85 -0.78 -3.02 115.31 117.21 3fyu h LEU 35 Ca -0.00 -0.43 0.11 0.00 0.84 0.00 0.00 57.88 58.39 3fyu h LEU 35 Cb 0.59 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 3fyu h LEU 35 CO 0.04 0.66 0.36 -0.09 -0.34 0.00 0.00 178.44 179.07 3fyu h ARG 36 N -0.07 0.24 0.00 1.25 2.43 -0.58 -0.27 114.38 117.38 3fyu h ARG 36 Ca 0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3fyu h ARG 36 Cb 0.56 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3fyu h ARG 36 CO 0.02 0.16 0.00 1.04 -1.51 0.00 0.00 179.97 179.68 3fyu n GLN 37 N -4.45 0.58 -3.99 0.20 6.02 -0.85 -4.50 117.38 110.39 3fyu n GLN 37 Ca 0.09 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.74 3fyu n GLN 37 Cb 0.41 -1.41 -0.14 0.00 1.02 0.00 0.00 30.24 30.12 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 2.65 0.18 5.09 1.01 -0.11 -5.09 120.40 122.12 3fyu s VAL 38 Ca 0.23 -1.30 -0.32 0.00 0.00 0.00 0.00 61.98 60.60 3fyu s VAL 38 Cb 0.10 -2.44 -0.11 0.00 0.00 0.00 0.00 36.38 33.94 3fyu s VAL 38 CO 0.18 0.07 1.64 -1.61 0.00 0.00 0.00 175.10 175.38 3fyu s GLU 39 N 1.24 4.18 0.16 2.72 0.41 -1.26 -4.84 118.70 121.30 3fyu s GLU 39 Ca -0.04 2.47 -0.17 0.00 -0.41 0.00 0.00 54.97 56.82 3fyu s GLU 39 Cb -0.18 -3.16 0.09 0.00 -1.78 0.00 0.00 34.13 29.09 3fyu s GLU 39 CO -0.04 -0.68 1.68 0.00 -0.49 0.00 0.00 175.26 175.73 3fyu h ALA 40 N 6.96 0.29 -6.69 5.21 0.00 -1.94 -3.38 119.26 119.70 3fyu h ALA 40 Ca -0.43 0.13 -0.54 0.00 0.00 0.00 0.00 54.91 54.08 3fyu h ALA 40 Cb 1.20 0.25 -0.14 0.00 0.00 0.00 0.00 17.79 19.10 3fyu h ALA 40 CO 0.93 -0.43 -0.88 0.39 0.00 0.00 0.00 179.25 179.26 3fyu n GLU 41 N -5.26 -2.86 -1.35 0.00 1.02 -1.26 0.68 120.64 111.62 3fyu n GLU 41 Ca 0.02 0.34 -0.34 0.00 -0.02 0.00 0.00 57.16 57.16 3fyu n GLU 41 Cb 0.21 -4.61 0.10 0.00 -0.02 0.00 0.00 31.44 27.12 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 -6.82 1.98 -0.00 3.49 0.04 -1.26 -4.55 135.00 127.87 3fyu s PRO 42 Ca 0.29 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.16 3fyu s PRO 42 Cb -0.16 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3fyu s PRO 42 CO 0.92 -1.97 -0.00 0.95 0.04 0.00 0.00 177.00 176.94 3fyu s THR 43 N -1.94 0.02 -0.06 1.26 -4.23 -0.20 -4.97 115.64 105.53 3fyu s THR 43 Ca 0.76 -0.00 0.06 0.00 -1.18 0.00 0.00 61.69 61.32 3fyu s THR 43 Cb -0.31 -0.04 -0.01 0.00 1.34 0.00 0.00 72.50 73.49 3fyu s THR 43 CO 0.47 0.01 -0.25 -0.76 -0.54 0.00 0.00 174.62 173.55 3fyu s LEU 44 N 0.04 2.09 -0.07 4.79 2.01 -1.26 -1.85 118.68 124.43 3fyu s LEU 44 Ca -0.00 -0.50 -0.01 0.00 0.01 0.00 0.00 54.13 53.63 3fyu s LEU 44 Cb -0.01 -1.38 0.03 0.00 0.01 0.00 0.00 46.19 44.84 3fyu s LEU 44 CO -0.00 0.25 -0.01 -0.70 1.01 0.00 0.00 176.35 176.90 3fyu s GLU 45 N -0.20 0.68 0.39 1.70 2.12 -0.54 -4.95 118.70 117.89 3fyu s GLU 45 Ca -0.02 0.06 -0.28 0.00 0.36 0.00 0.00 54.97 55.09 3fyu s GLU 45 Cb -0.13 -0.97 -0.11 0.00 0.26 0.00 0.00 34.13 33.17 3fyu s GLU 45 CO 0.03 -0.27 1.49 -1.13 -0.54 0.00 0.00 175.26 174.84 3fyu n SER 46 N 4.95 3.77 -3.91 -1.70 3.41 -1.26 -0.07 113.62 118.81 3fyu n SER 46 Ca -0.10 1.22 -0.27 0.00 -0.26 0.00 0.00 58.87 59.45 3fyu n SER 46 Cb 0.50 -1.62 -0.17 0.00 -0.26 0.00 0.00 64.21 62.66 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 -1.13 1.53 0.31 7.33 5.04 0.86 -4.78 117.35 126.52 3fyu s TYR 47 Ca 0.54 -0.78 -0.29 0.00 -2.44 0.00 0.00 57.07 54.10 3fyu s TYR 47 Cb -0.47 -1.26 -0.10 0.00 0.35 0.00 0.00 41.96 40.48 3fyu s TYR 47 CO 0.63 -0.53 1.38 -0.51 -1.34 0.00 0.00 175.55 175.19 3fyu s ASP 48 N 1.69 6.65 -0.21 4.32 1.01 -1.26 -4.27 116.67 124.61 3fyu s ASP 48 Ca 0.05 2.76 -0.14 0.00 0.71 0.00 0.00 52.55 55.93 3fyu s ASP 48 Cb -0.13 -2.64 0.06 0.00 1.01 0.00 0.00 42.92 41.22 3fyu s ASP 48 CO -0.08 -0.65 0.52 -0.47 0.21 0.00 0.00 175.17 174.69 3fyu s TYR 49 N -0.78 -0.72 -0.51 4.23 6.14 -1.26 -5.07 117.35 119.38 3fyu s TYR 49 Ca 0.53 1.55 -0.14 0.00 0.64 0.00 0.00 57.07 59.65 3fyu s TYR 49 Cb -0.42 0.35 -0.13 0.00 0.42 0.00 0.00 41.96 42.18 3fyu s TYR 49 CO 0.52 -0.37 1.72 -0.35 0.64 0.00 0.00 175.55 177.71 3fyu n PRO 50 N 3.86 1.09 -3.91 4.97 -0.04 -1.26 -4.79 135.00 134.91 3fyu n PRO 50 Ca -0.20 -1.28 -0.11 0.00 -0.04 0.00 0.00 63.50 61.87 3fyu n PRO 50 Cb 0.57 -2.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.41 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 4.87 0.07 -0.08 0.52 0.11 -1.26 -5.15 120.40 119.48 3fyu s VAL 51 Ca 0.42 -0.55 0.00 0.00 -2.93 0.00 0.00 61.98 58.92 3fyu s VAL 51 Cb 0.10 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.69 3fyu s VAL 51 CO 0.09 -0.30 -0.07 -0.75 -3.33 0.00 0.00 175.10 170.74 3fyu s LYS 52 N -0.93 2.88 0.00 1.54 2.20 -1.26 -4.51 119.74 119.66 3fyu s LYS 52 Ca -0.10 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 3fyu s LYS 52 Cb -0.06 -2.63 0.00 0.00 -1.51 0.00 0.00 37.83 33.63 3fyu s LYS 52 CO -0.00 0.60 0.00 0.41 -0.36 0.00 0.00 175.35 176.00 3fyu n GLY 53 N 2.41 0.72 3.04 5.54 0.00 -1.26 -5.03 105.19 110.62 3fyu n GLY 53 Ca -0.18 0.00 -0.13 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 -2.07 -0.01 -0.19 1.61 1.01 -1.26 -0.36 120.40 119.13 3fyu s VAL 54 Ca 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 61.98 61.94 3fyu s VAL 54 Cb 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3fyu s VAL 54 CO 0.00 0.01 0.05 -0.54 0.00 0.00 0.00 175.10 174.62 3fyu s LYS 55 N 0.29 3.90 -0.08 2.72 -0.14 0.23 -4.84 119.74 121.83 3fyu s LYS 55 Ca -0.02 -0.38 0.01 0.00 -1.36 0.00 0.00 55.97 54.22 3fyu s LYS 55 Cb -0.03 -3.19 -0.03 0.00 -1.68 0.00 0.00 37.83 32.90 3fyu s LYS 55 CO -0.01 0.21 -0.08 0.08 -0.76 0.00 0.00 175.35 174.79 3fyu s VAL 56 N 0.52 3.58 0.11 3.17 1.01 -1.26 -0.13 120.40 127.40 3fyu s VAL 56 Ca 0.02 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3fyu s VAL 56 Cb -0.13 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 3fyu s VAL 56 CO 0.01 0.58 -0.07 -0.31 0.00 0.00 0.00 175.10 175.31 3fyu s TYR 57 N -0.62 0.98 -0.20 5.22 1.51 0.26 -0.10 117.35 124.40 3fyu s TYR 57 Ca 0.09 -0.88 -0.08 0.00 -1.01 0.00 0.00 57.07 55.20 3fyu s TYR 57 Cb -0.12 -0.55 -0.04 0.00 -0.11 0.00 0.00 41.96 41.15 3fyu s TYR 57 CO 0.02 -0.09 0.08 0.50 -1.11 0.00 0.00 175.55 174.94 3fyu s ARG 58 N -3.80 3.93 -0.04 -0.62 3.52 0.90 0.77 118.95 123.60 3fyu s ARG 58 Ca 0.13 -0.36 0.05 0.00 -0.13 0.00 0.00 55.73 55.42 3fyu s ARG 58 Cb 0.05 -3.29 -0.02 0.00 -1.56 0.00 0.00 34.95 30.12 3fyu s ARG 58 CO -0.03 0.15 -0.19 -1.17 -0.81 0.00 0.00 175.30 173.25 3fyu s LEU 59 N 0.72 2.48 0.07 -0.88 2.96 -0.11 -1.47 118.68 122.46 3fyu s LEU 59 Ca 0.04 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 3fyu s LEU 59 Cb -0.13 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 3fyu s LEU 59 CO 0.02 0.33 -0.05 0.42 -1.32 0.00 0.00 176.35 175.74 3fyu s THR 60 N -0.63 0.47 -0.03 3.68 -4.23 -0.77 -2.26 115.64 111.87 3fyu s THR 60 Ca 0.10 -1.75 -0.29 0.00 -1.18 0.00 0.00 61.69 58.57 3fyu s THR 60 Cb -0.11 -1.44 0.10 0.00 1.34 0.00 0.00 72.50 72.39 3fyu s THR 60 CO 0.00 -0.85 0.84 -0.72 -0.54 0.00 0.00 174.62 173.35 3fyu s TYR 61 N -3.40 -0.43 0.10 3.99 1.13 -0.74 -1.03 117.35 116.98 3fyu s TYR 61 Ca 0.06 0.50 -0.22 0.00 -1.41 0.00 0.00 57.07 56.00 3fyu s TYR 61 Cb 0.04 0.50 -0.07 0.00 -1.10 0.00 0.00 41.96 41.33 3fyu s TYR 61 CO -0.06 -0.55 0.68 -0.65 -2.51 0.00 0.00 175.55 172.46 3fyu s GLN 62 N -2.35 4.39 0.00 -3.49 -1.52 0.21 -1.07 119.66 115.84 3fyu s GLN 62 Ca -0.00 0.95 0.00 0.00 -1.95 0.00 0.00 55.36 54.35 3fyu s GLN 62 Cb -0.01 -3.27 -0.00 0.00 -0.22 0.00 0.00 33.01 29.52 3fyu s GLN 62 CO -0.04 0.56 0.00 0.45 -0.25 0.00 0.00 175.29 176.02 3fyu n SER 63 N 1.83 0.28 -3.76 5.90 2.88 -0.25 -4.28 113.62 116.22 3fyu n SER 63 Ca -0.07 -1.01 -0.44 0.00 -1.33 0.00 0.00 58.87 56.02 3fyu n SER 63 Cb 0.50 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.92 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 -0.11 -1.35 0.66 7.35 -1.26 -0.09 117.46 122.67 3fyu n PHE 64 Ca 0.00 0.85 -0.12 0.00 -0.76 0.00 0.00 57.45 57.42 3fyu n PHE 64 Cb 0.00 -1.70 -0.05 0.00 0.35 0.00 0.00 39.48 38.08 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 1.56 1.25 3.37 7.13 0.00 -1.26 -2.70 105.19 114.55 3fyu n GLY 65 Ca 0.16 -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 -2.52 -2.39 -3.22 1.61 8.25 0.87 -4.72 115.22 113.10 3fyu n HIS 66 Ca -0.12 0.77 -0.39 0.00 -0.26 0.00 0.00 57.72 57.72 3fyu n HIS 66 Cb 0.46 -4.60 -0.06 0.00 1.12 0.00 0.00 29.99 26.91 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 -3.02 7.02 -0.57 0.41 0.01 -0.96 -4.80 113.70 111.78 3fyu s SER 67 Ca 0.47 1.21 -0.25 0.00 1.31 0.00 0.00 55.95 58.69 3fyu s SER 67 Cb -0.21 -2.37 0.04 0.00 0.21 0.00 0.00 66.02 63.69 3fyu s SER 67 CO 0.58 0.16 1.00 -0.75 0.41 0.00 0.00 173.24 174.64 3fyu s LYS 68 N -0.52 3.35 0.07 12.44 2.47 -1.26 -1.10 119.74 135.19 3fyu s LYS 68 Ca 0.31 -0.20 -0.14 0.00 -1.56 0.00 0.00 55.97 54.37 3fyu s LYS 68 Cb -0.19 -4.06 -0.06 0.00 -1.46 0.00 0.00 37.83 32.06 3fyu s LYS 68 CO 0.18 -1.56 0.47 0.42 0.16 0.00 0.00 175.35 175.02 3fyu s ILE 69 N 4.19 4.96 0.42 5.43 -1.09 -0.23 -0.68 121.20 134.20 3fyu s ILE 69 Ca 0.32 0.80 0.04 0.00 -2.23 0.00 0.00 60.65 59.59 3fyu s ILE 69 Cb -0.12 -3.73 -0.02 0.00 -1.58 0.00 0.00 42.46 37.01 3fyu s ILE 69 CO 0.20 0.42 0.14 -1.61 -1.23 0.00 0.00 174.94 172.86 3fyu s GLU 70 N -1.51 1.98 0.00 2.79 2.02 -1.26 -1.79 118.70 120.94 3fyu s GLU 70 Ca 0.30 -2.22 0.00 0.00 0.02 0.00 0.00 54.97 53.07 3fyu s GLU 70 Cb -0.16 -0.57 0.00 0.00 0.10 0.00 0.00 34.13 33.50 3fyu s GLU 70 CO 0.17 -0.53 0.00 0.41 0.02 0.00 0.00 175.26 175.33 3fyu n GLY 71 N -0.95 3.25 3.80 -1.39 0.00 -0.96 -0.47 105.19 108.47 3fyu n GLY 71 Ca -0.06 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 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 3.80 -0.21 1.61 0.40 -1.23 -0.93 117.98 119.41 3fyu s PHE 72 Ca 0.00 1.50 0.01 0.00 -0.60 0.00 0.00 56.93 57.84 3fyu s PHE 72 Cb 0.00 -2.68 0.05 0.00 0.51 0.00 0.00 43.02 40.90 3fyu s PHE 72 CO 0.00 0.46 -0.10 -0.47 0.70 0.00 0.00 175.22 175.80 3fyu s TYR 73 N -1.29 2.61 -0.13 0.36 5.04 0.23 -1.21 117.35 122.96 3fyu s TYR 73 Ca 0.38 -1.77 -0.02 0.00 -2.44 0.00 0.00 57.07 53.22 3fyu s TYR 73 Cb -0.20 -1.71 -0.02 0.00 0.35 0.00 0.00 41.96 40.38 3fyu s TYR 73 CO 0.23 -0.78 -0.08 0.00 -1.34 0.00 0.00 175.55 173.58 3fyu s ALA 74 N 1.33 2.85 -0.04 3.97 0.00 0.01 0.90 121.76 130.79 3fyu s ALA 74 Ca -0.03 -0.85 0.05 0.00 0.00 0.00 0.00 51.96 51.13 3fyu s ALA 74 Cb -0.17 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.56 3fyu s ALA 74 CO -0.08 0.28 -0.20 0.08 0.00 0.00 0.00 175.76 175.84 3fyu s VAL 75 N 0.20 1.62 0.20 0.00 1.01 0.81 -0.53 120.40 123.72 3fyu s VAL 75 Ca -0.05 -0.85 -0.33 0.00 0.00 0.00 0.00 61.98 60.76 3fyu s VAL 75 Cb -0.14 -1.37 -0.13 0.00 0.00 0.00 0.00 36.38 34.73 3fyu s VAL 75 CO 0.04 0.46 1.54 -2.65 0.00 0.00 0.00 175.10 174.48 3fyu n PRO 76 N 2.89 2.21 -1.99 2.72 -0.02 -1.26 -0.60 135.00 138.94 3fyu n PRO 76 Ca -0.17 0.79 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 3fyu n PRO 76 Cb 0.53 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 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 2.95 4.60 -3.62 2.55 2.03 0.52 -4.75 116.55 120.82 3fyu n ASP 77 Ca 0.14 -2.96 -0.09 0.00 0.52 0.00 0.00 54.79 52.40 3fyu n ASP 77 Cb 0.31 -1.57 -0.02 0.00 -0.72 0.00 0.00 41.12 39.12 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 1.83 1.45 0.29 -0.67 -2.07 -1.26 -4.84 119.66 114.38 3fyu s GLN 78 Ca 0.44 -0.68 -0.30 0.00 -1.82 0.00 0.00 55.36 53.01 3fyu s GLN 78 Cb 0.12 0.57 -0.11 0.00 -1.09 0.00 0.00 33.01 32.50 3fyu s GLN 78 CO -0.05 -0.65 1.56 0.95 -1.32 0.00 0.00 175.29 175.78 3fyu s THR 79 N -3.75 2.18 0.00 3.63 -4.23 -1.26 -5.02 115.64 107.19 3fyu s THR 79 Ca 0.06 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.72 3fyu s THR 79 Cb -0.03 -3.10 0.00 0.00 1.34 0.00 0.00 72.50 70.71 3fyu s THR 79 CO -0.04 0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 3fyu n GLY 80 N 2.02 1.15 3.77 3.99 0.00 -1.26 -4.88 105.19 109.97 3fyu n GLY 80 Ca 0.07 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.98 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 1.98 2.84 0.16 1.61 0.02 -1.26 -5.11 135.00 135.23 3fyu s PRO 81 Ca 0.00 1.47 0.08 0.00 0.02 0.00 0.00 61.00 62.57 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 -1.23 -0.07 -1.01 -0.33 0.00 0.00 177.00 174.36 3fyu s HIS 82 N -2.19 2.73 0.63 6.54 3.76 0.63 -4.73 115.29 122.66 3fyu s HIS 82 Ca 0.69 -0.18 -0.15 0.00 -0.15 0.00 0.00 55.06 55.27 3fyu s HIS 82 Cb -0.22 -1.35 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 3fyu s HIS 82 CO 0.39 0.49 1.08 -1.25 -0.85 0.00 0.00 174.74 174.60 3fyu s PRO 83 N -2.69 3.02 0.18 8.40 0.04 -1.26 -0.86 135.00 141.84 3fyu s PRO 83 Ca 0.25 1.28 0.07 0.00 0.04 0.00 0.00 61.00 62.63 3fyu s PRO 83 Cb -0.10 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 3fyu s PRO 83 CO 0.16 -1.06 -0.14 0.00 0.04 0.00 0.00 177.00 176.00 3fyu s ALA 84 N -2.45 1.88 -0.02 8.56 0.00 0.11 -1.04 121.76 128.81 3fyu s ALA 84 Ca 0.65 -1.57 0.01 0.00 0.00 0.00 0.00 51.96 51.05 3fyu s ALA 84 Cb -0.18 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.86 3fyu s ALA 84 CO 0.41 0.08 -0.02 -0.51 0.00 0.00 0.00 175.76 175.71 3fyu s LEU 85 N -3.09 1.65 -0.30 0.00 1.43 0.80 0.51 118.68 119.68 3fyu s LEU 85 Ca 0.19 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.20 3fyu s LEU 85 Cb -0.02 -0.22 0.04 0.00 0.03 0.00 0.00 46.19 46.02 3fyu s LEU 85 CO 0.06 -0.01 0.02 -0.69 0.23 0.00 0.00 176.35 175.96 3fyu s VAL 86 N 0.39 3.28 -0.17 -1.59 1.01 0.01 -0.68 120.40 122.66 3fyu s VAL 86 Ca -0.04 -1.17 -0.11 0.00 0.00 0.00 0.00 61.98 60.66 3fyu s VAL 86 Cb -0.07 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 3fyu s VAL 86 CO -0.01 -0.05 0.18 -0.60 0.00 0.00 0.00 175.10 174.63 3fyu s ARG 87 N 1.33 4.09 -0.15 2.72 3.52 0.40 -2.08 118.95 128.78 3fyu s ARG 87 Ca -0.02 -0.11 -0.03 0.00 -0.13 0.00 0.00 55.73 55.44 3fyu s ARG 87 Cb -0.19 -3.38 -0.02 0.00 -1.56 0.00 0.00 34.95 29.80 3fyu s ARG 87 CO -0.00 0.37 -0.06 -0.06 -0.81 0.00 0.00 175.30 174.74 3fyu s PHE 88 N 0.15 2.98 0.69 5.12 0.40 -0.10 -2.63 117.98 124.59 3fyu s PHE 88 Ca 0.12 -0.40 -0.10 0.00 -0.60 0.00 0.00 56.93 55.94 3fyu s PHE 88 Cb -0.12 -1.95 0.02 0.00 0.51 0.00 0.00 43.02 41.49 3fyu s PHE 88 CO 0.01 -0.10 1.05 -3.38 0.70 0.00 0.00 175.22 173.49 3fyu s HIS 89 N 0.43 3.24 0.75 0.36 -3.43 -1.26 -3.70 115.29 111.68 3fyu s HIS 89 Ca -0.05 0.87 -0.12 0.00 -0.80 0.00 0.00 55.06 54.96 3fyu s HIS 89 Cb -0.15 -3.04 0.04 0.00 -1.43 0.00 0.00 32.58 28.01 3fyu s HIS 89 CO 0.03 -1.17 1.10 0.20 -2.00 0.00 0.00 174.74 172.91 3fyu s GLY 90 N -4.38 1.62 -0.23 -1.38 0.00 -1.26 -2.56 107.32 99.14 3fyu s GLY 90 Ca 0.58 -0.33 -0.35 0.00 0.00 0.00 0.00 44.72 44.62 3fyu s GLY 90 CO 0.49 0.08 2.01 2.98 0.00 0.00 0.00 173.10 178.66 3fyu n TYR 91 N -3.19 1.99 -1.14 1.90 9.36 -1.26 -1.11 117.16 123.71 3fyu n TYR 91 Ca 0.07 0.17 -0.09 0.00 3.32 0.00 0.00 57.90 61.37 3fyu n TYR 91 Cb 0.57 -2.59 -0.04 0.00 -0.63 0.00 0.00 39.34 36.65 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 8.13 -4.14 -1.92 2.98 5.15 -1.26 -4.80 115.26 119.40 3fyu n ASN 92 Ca 0.31 0.22 -0.14 0.00 -0.60 0.00 0.00 54.58 54.36 3fyu n ASN 92 Cb 0.26 -3.24 0.22 0.00 -0.53 0.00 0.00 39.78 36.49 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 0.73 4.99 -3.00 5.20 0.00 -0.27 -4.94 120.51 123.21 3fyu n ALA 93 Ca -0.09 -2.77 -0.36 0.00 0.00 0.00 0.00 53.44 50.22 3fyu n ALA 93 Cb 0.44 -1.23 -0.12 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.48 5.21 -0.18 0.00 0.15 -1.26 -4.62 113.70 111.51 3fyu s SER 94 Ca 0.54 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.04 3fyu s SER 94 Cb 0.45 -1.92 0.01 0.00 -1.71 0.00 0.00 66.02 62.85 3fyu s SER 94 CO 0.10 0.02 -0.16 -0.31 1.20 0.00 0.00 173.24 174.08 3fyu s TYR 95 N 1.30 2.80 -1.48 3.44 1.51 -1.26 -4.70 117.35 118.96 3fyu s TYR 95 Ca 0.05 -1.32 -0.11 0.00 -1.01 0.00 0.00 57.07 54.67 3fyu s TYR 95 Cb -0.15 -1.94 0.07 0.00 -0.11 0.00 0.00 41.96 39.84 3fyu s TYR 95 CO 0.03 -0.65 0.82 -0.25 -1.11 0.00 0.00 175.55 174.39 3fyu n ASP 96 N 4.46 -4.80 -0.38 2.29 10.43 -1.26 -1.11 116.55 126.18 3fyu n ASP 96 Ca -0.20 -0.61 -0.05 0.00 2.57 0.00 0.00 54.79 56.50 3fyu n ASP 96 Cb 0.51 -3.86 -0.02 0.00 1.84 0.00 0.00 41.12 39.59 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 0.59 2.62 0.44 0.00 -1.26 -2.67 105.19 103.35 3fyu n GLY 97 Ca 0.01 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.37 -0.50 0.31 -0.02 0.00 -0.26 -4.66 105.19 99.69 3fyu n GLY 98 Ca -0.05 0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.29 0.86 -0.74 -0.61 2.10 -1.72 -2.00 117.51 115.12 3fyu h ILE 99 Ca -0.38 -0.26 -0.00 0.00 1.08 0.00 0.00 64.86 65.29 3fyu h ILE 99 Cb 1.28 0.03 -0.04 0.00 -1.09 0.00 0.00 36.82 37.00 3fyu h ILE 99 CO 0.45 0.14 0.45 0.45 -1.08 0.00 0.00 178.15 178.56 3fyu h HIS 100 N 0.76 0.96 -0.07 2.19 3.86 -1.89 -0.79 115.15 120.18 3fyu h HIS 100 Ca 0.43 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.41 3fyu h HIS 100 Cb 0.46 -0.32 0.01 0.00 1.06 0.00 0.00 27.41 28.62 3fyu h HIS 100 CO -0.06 0.64 -0.87 -0.44 0.86 0.00 0.00 177.93 178.05 3fyu h ASP 101 N 1.02 0.77 0.04 2.45 3.32 -1.84 -2.35 116.42 119.83 3fyu h ASP 101 Ca 0.27 -0.56 0.01 0.00 0.02 0.00 0.00 57.03 56.77 3fyu h ASP 101 Cb -0.05 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 3fyu h ASP 101 CO -0.05 1.35 -0.09 0.40 -1.72 0.00 0.00 179.24 179.12 3fyu h ILE 102 N 0.40 0.77 -0.51 0.35 1.08 -0.90 -0.60 117.51 118.09 3fyu h ILE 102 Ca -0.07 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.45 3fyu h ILE 102 Cb 1.50 0.77 -0.05 0.00 -3.07 0.00 0.00 36.82 35.97 3fyu h ILE 102 CO 0.17 0.00 0.25 0.58 -0.69 0.00 0.00 178.15 178.45 3fyu h VAL 103 N -0.18 0.93 -0.76 1.67 2.07 -1.19 -1.61 116.25 117.18 3fyu h VAL 103 Ca 0.02 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.44 3fyu h VAL 103 Cb 0.20 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 3fyu h VAL 103 CO -0.07 0.09 0.46 0.78 0.02 0.00 0.00 177.57 178.84 3fyu h ASN 104 N 0.48 0.71 -0.73 0.57 2.35 -0.99 0.08 115.58 118.05 3fyu h ASN 104 Ca 0.23 0.02 0.03 0.00 -0.55 0.00 0.00 56.30 56.03 3fyu h ASN 104 Cb 0.16 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.36 3fyu h ASN 104 CO -0.17 0.46 0.48 -0.50 -1.65 0.00 0.00 177.43 176.05 3fyu h TRP 105 N 0.84 0.87 -0.55 1.19 -0.00 -0.20 -0.93 115.95 117.17 3fyu h TRP 105 Ca 0.33 0.02 -0.10 0.00 -0.00 0.00 0.00 58.89 59.14 3fyu h TRP 105 Cb 0.16 -0.29 -0.02 0.00 -0.00 0.00 0.00 29.16 29.01 3fyu h TRP 105 CO -0.05 0.52 -0.06 0.00 -0.00 0.00 0.00 178.44 178.84 3fyu h ALA 106 N 1.57 0.75 0.00 1.49 0.00 -0.31 -1.95 119.26 120.80 3fyu h ALA 106 Ca 0.29 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3fyu h ALA 106 Cb 0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 3fyu h ALA 106 CO -0.08 0.63 -0.04 -0.07 0.00 0.00 0.00 179.25 179.69 3fyu h LEU 107 N 0.89 0.00 -0.28 0.00 3.38 0.20 0.44 115.31 119.93 3fyu h LEU 107 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3fyu h LEU 107 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 3fyu h LEU 107 CO 0.04 0.04 0.00 1.41 0.09 0.00 0.00 178.44 180.02 3fyu n HIS 108 N -3.74 0.01 -0.14 1.13 8.25 -0.58 -4.89 115.22 115.27 3fyu n HIS 108 Ca -0.03 -0.01 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 1.02 0.92 3.31 -1.41 0.00 0.15 -5.07 105.19 104.11 3fyu n GLY 109 Ca 0.21 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 2.76 -0.23 1.61 2.02 -0.85 -4.26 117.35 116.40 3fyu s TYR 110 Ca 0.00 -0.84 -0.29 0.00 -0.37 0.00 0.00 57.07 55.57 3fyu s TYR 110 Cb 0.00 -1.84 -0.02 0.00 -0.40 0.00 0.00 41.96 39.70 3fyu s TYR 110 CO 0.00 -0.34 1.54 0.00 -1.57 0.00 0.00 175.55 175.18 3fyu s ALA 111 N 0.51 3.32 -0.07 3.71 0.00 -0.20 -3.28 121.76 125.74 3fyu s ALA 111 Ca -0.10 0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.31 3fyu s ALA 111 Cb -0.16 -3.82 -0.01 0.00 0.00 0.00 0.00 23.12 19.13 3fyu s ALA 111 CO 0.04 -1.86 -0.24 0.99 0.00 0.00 0.00 175.76 174.69 3fyu s THR 112 N 4.91 2.04 -0.17 0.00 2.01 0.31 -0.14 115.64 124.60 3fyu s THR 112 Ca 0.68 -1.04 -0.00 0.00 0.31 0.00 0.00 61.69 61.63 3fyu s THR 112 Cb -0.23 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.54 3fyu s THR 112 CO 0.27 0.56 -0.14 0.12 -0.69 0.00 0.00 174.62 174.74 3fyu s PHE 113 N 0.05 2.81 -0.83 4.92 5.36 0.15 -0.81 117.98 129.64 3fyu s PHE 113 Ca -0.10 -1.10 -0.12 0.00 -0.96 0.00 0.00 56.93 54.65 3fyu s PHE 113 Cb -0.15 -1.93 0.22 0.00 -0.34 0.00 0.00 43.02 40.81 3fyu s PHE 113 CO 0.06 -0.53 0.76 0.20 -1.46 0.00 0.00 175.22 174.25 3fyu s GLY 114 N 0.98 2.70 0.06 13.12 0.00 -0.35 -0.46 107.32 123.38 3fyu s GLY 114 Ca -0.02 -3.37 -0.31 0.00 0.00 0.00 0.00 44.72 41.02 3fyu s GLY 114 CO -0.02 1.24 1.64 -0.29 0.00 0.00 0.00 173.10 175.67 3fyu s MET 115 N -0.02 4.20 -0.14 2.90 1.75 -1.08 -3.57 119.30 123.34 3fyu s MET 115 Ca 0.19 2.31 -0.24 0.00 -1.25 0.00 0.00 55.69 56.71 3fyu s MET 115 Cb -0.11 -3.60 -0.02 0.00 2.84 0.00 0.00 34.83 33.93 3fyu s MET 115 CO -0.08 -0.73 0.76 -0.51 -0.65 0.00 0.00 175.02 173.81 3fyu s LEU 116 N 2.65 4.21 0.03 4.11 1.43 0.38 -4.37 118.68 127.13 3fyu s LEU 116 Ca 0.73 1.12 -0.30 0.00 -1.03 0.00 0.00 54.13 54.65 3fyu s LEU 116 Cb -0.39 -3.13 -0.06 0.00 0.03 0.00 0.00 46.19 42.63 3fyu s LEU 116 CO 0.32 -0.30 1.39 -0.69 0.23 0.00 0.00 176.35 177.31 3fyu s VAL 117 N 1.73 3.62 -0.11 -1.59 1.01 -1.26 -4.44 120.40 119.36 3fyu s VAL 117 Ca 0.36 1.06 -0.15 0.00 0.00 0.00 0.00 61.98 63.25 3fyu s VAL 117 Cb -0.17 -3.68 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 3fyu s VAL 117 CO 0.14 0.02 0.48 0.54 0.00 0.00 0.00 175.10 176.28 3fyu n ARG 118 N 4.98 0.00 -0.25 2.72 1.74 -1.24 -0.32 116.66 124.29 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 0.43 -0.51 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 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 1.05 0.56 0.00 -0.13 0.00 -1.00 -4.81 105.19 100.85 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 0.20 1.61 6.02 0.56 -4.76 117.38 119.01 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 0.47 0.00 1.02 0.00 0.00 30.24 31.73 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 0.49 -0.60 0.77 4.60 0.00 -1.26 -4.57 105.19 104.63 3fyu n GLY 122 Ca 0.03 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 0.25 -4.14 -4.87 1.61 7.64 -1.26 -2.38 113.62 110.47 3fyu n SER 123 Ca 0.00 0.92 -0.32 0.00 1.01 0.00 0.00 58.87 60.48 3fyu n SER 123 Cb 0.00 -1.98 -0.06 0.00 -1.01 0.00 0.00 64.21 61.17 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 -4.69 3.84 -0.31 1.43 2.12 0.15 -2.40 118.70 118.83 3fyu s GLU 124 Ca 0.00 0.35 -0.00 0.00 0.36 0.00 0.00 54.97 55.68 3fyu s GLU 124 Cb 0.00 -2.64 0.10 0.00 0.26 0.00 0.00 34.13 31.85 3fyu s GLU 124 CO 0.00 0.31 0.09 0.34 -0.54 0.00 0.00 175.26 175.46 3fyu s ASP 125 N -2.30 4.10 0.15 -1.70 -1.08 -1.26 -4.45 116.67 110.14 3fyu s ASP 125 Ca 0.48 -1.69 0.27 0.00 -0.52 0.00 0.00 52.55 51.08 3fyu s ASP 125 Cb -0.11 -0.95 0.93 0.00 -1.46 0.00 0.00 42.92 41.32 3fyu s ASP 125 CO 0.20 -0.41 1.81 0.35 0.52 0.00 0.00 175.17 177.64 3fyu n THR 126 N 4.78 0.46 -1.81 1.71 -2.24 -1.26 -4.85 114.28 111.07 3fyu n THR 126 Ca -0.01 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 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 -4.10 6.43 0.77 3.42 1.04 -1.26 -4.97 113.70 115.02 3fyu s SER 127 Ca 0.11 2.87 -0.11 0.00 0.48 0.00 0.00 55.95 59.30 3fyu s SER 127 Cb 0.14 -2.62 0.05 0.00 0.10 0.00 0.00 66.02 63.69 3fyu s SER 127 CO 0.57 -0.89 1.08 -0.69 0.98 0.00 0.00 173.24 174.29 3fyu s VAL 128 N 0.35 3.40 -0.50 5.02 1.01 -1.26 -5.01 120.40 123.41 3fyu s VAL 128 Ca 0.66 0.45 -0.14 0.00 0.00 0.00 0.00 61.98 62.95 3fyu s VAL 128 Cb -0.47 -3.15 0.11 0.00 0.00 0.00 0.00 36.38 32.86 3fyu s VAL 128 CO 0.42 -0.59 0.43 -0.89 0.00 0.00 0.00 175.10 174.47 3fyu s THR 129 N -3.08 5.00 0.24 3.92 2.01 -1.26 -4.84 115.64 117.63 3fyu s THR 129 Ca 0.60 -1.39 -0.06 0.00 0.31 0.00 0.00 61.69 61.15 3fyu s THR 129 Cb -0.15 -4.13 0.24 0.00 0.01 0.00 0.00 72.50 68.47 3fyu s THR 129 CO 0.55 -0.73 1.67 -0.65 -0.69 0.00 0.00 174.62 174.76 3fyu h PRO 130 N 8.75 0.19 0.00 4.92 0.11 -1.95 -3.47 132.00 140.56 3fyu h PRO 130 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3fyu h PRO 130 Cb 1.10 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3fyu h PRO 130 CO 0.94 0.13 0.00 0.41 -0.21 0.00 0.00 178.00 179.27 3fyu n GLY 131 N -1.37 2.59 3.77 -0.55 0.00 -1.26 -5.11 105.19 103.26 3fyu n GLY 131 Ca 0.13 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.14 2.66 0.25 -0.02 0.00 -1.26 -4.82 107.32 103.99 3fyu s GLY 132 Ca 0.00 0.86 -0.17 0.00 0.00 0.00 0.00 44.72 45.41 3fyu s GLY 132 CO 0.00 1.23 0.59 -2.38 0.00 0.00 0.00 173.10 172.53 3fyu s HIS 133 N -1.73 0.02 0.54 1.90 -0.00 -1.26 -4.89 115.29 109.86 3fyu s HIS 133 Ca 0.73 -0.41 -0.18 0.00 -0.00 0.00 0.00 55.06 55.20 3fyu s HIS 133 Cb -0.25 0.45 -0.06 0.00 -0.00 0.00 0.00 32.58 32.72 3fyu s HIS 133 CO 0.28 -1.07 1.05 0.00 -0.00 0.00 0.00 174.74 175.00 3fyu s ALA 134 N -3.94 2.80 -0.28 -1.38 0.00 -1.26 -4.91 121.76 112.79 3fyu s ALA 134 Ca 0.14 0.53 -0.39 0.00 0.00 0.00 0.00 51.96 52.24 3fyu s ALA 134 Cb -0.03 -3.25 -0.15 0.00 0.00 0.00 0.00 23.12 19.69 3fyu s ALA 134 CO 0.05 -0.56 1.82 -0.11 0.00 0.00 0.00 175.76 176.97 3fyu n LEU 135 N -1.45 2.41 0.00 0.00 0.00 -1.26 -4.65 117.00 112.05 3fyu n LEU 135 Ca 0.09 0.98 0.00 0.00 0.00 0.00 0.00 56.01 57.08 3fyu n LEU 135 Cb 0.53 -1.17 0.00 0.00 0.00 0.00 0.00 43.42 42.78 3fyu n LEU 135 CO 0.43 -0.43 0.00 0.61 0.00 0.00 0.00 177.39 178.00 3fyu n GLY 136 N 4.58 0.78 0.06 -3.96 0.00 -1.26 -4.90 105.19 100.50 3fyu n GLY 136 Ca 0.29 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 44.15 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 0.77 0.08 -0.39 1.61 8.01 -1.26 -4.53 117.44 121.73 3fyu n TRP 137 Ca 0.00 0.02 0.35 0.00 -1.31 0.00 0.00 57.50 56.56 3fyu n TRP 137 Cb 0.00 -0.78 0.68 0.00 -2.01 0.00 0.00 31.31 29.20 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 0.11 -0.10 -0.99 2.86 -1.90 -1.86 114.93 113.05 3fyu h MET 138 Ca -0.27 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 3fyu h MET 138 Cb 1.64 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.27 3fyu h MET 138 CO 0.02 0.07 0.00 0.25 1.06 0.00 0.00 176.91 178.31 3fyu n THR 139 N -4.34 0.44 -1.70 2.22 -2.24 -1.26 -4.88 114.28 102.51 3fyu n THR 139 Ca 0.29 -0.72 -0.42 0.00 -2.27 0.00 0.00 64.05 60.93 3fyu n THR 139 Cb 1.27 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 70.34 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 -0.77 4.04 -1.50 -0.78 2.20 -0.70 -1.43 119.74 120.80 3fyu s LYS 140 Ca 0.11 2.50 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 3fyu s LYS 140 Cb 0.07 -4.17 0.00 0.00 -1.51 0.00 0.00 37.83 32.22 3fyu s LYS 140 CO 0.09 -1.07 0.00 0.41 -0.36 0.00 0.00 175.35 174.43 3fyu n GLY 141 N 4.63 0.73 0.00 5.54 0.00 -1.26 -1.90 105.19 112.92 3fyu n GLY 141 Ca 0.21 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.22 0.86 1.37 -0.61 3.06 -0.51 -2.37 119.36 117.93 3fyu n ILE 142 Ca -0.17 0.22 0.04 0.00 -2.50 0.00 0.00 62.75 60.34 3fyu n ILE 142 Cb 0.57 -1.04 0.15 0.00 0.54 0.00 0.00 39.64 39.85 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 -1.33 1.09 -3.64 9.51 4.77 -1.26 -4.28 117.00 121.87 3fyu n LEU 143 Ca 0.04 -0.54 -0.05 0.00 -0.03 0.00 0.00 56.01 55.44 3fyu n LEU 143 Cb 0.09 -0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 40.98 3fyu n LEU 143 CO 0.08 0.27 0.59 -0.55 -1.33 0.00 0.00 177.39 176.45 3fyu s SER 144 N -1.09 -0.63 0.55 -1.43 0.15 -1.14 -4.93 113.70 105.19 3fyu s SER 144 Ca 0.17 1.03 0.22 0.00 0.70 0.00 0.00 55.95 58.07 3fyu s SER 144 Cb 0.09 1.22 1.47 0.00 -1.71 0.00 0.00 66.02 67.08 3fyu s SER 144 CO 0.12 -0.17 2.15 0.07 1.20 0.00 0.00 173.24 176.61 3fyu h LYS 145 N 5.98 0.00 0.00 5.44 2.10 -1.86 -0.28 116.57 127.95 3fyu h LYS 145 Ca -0.29 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.23 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 0.17 0.00 -0.62 -0.44 -2.00 0.00 0.00 179.45 176.56 3fyu h ASP 146 N 0.00 0.00 0.00 7.07 3.32 -1.95 -3.28 116.42 121.58 3fyu h ASP 146 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3fyu h ASP 146 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3fyu h ASP 146 CO -0.00 0.62 -1.49 0.35 -1.72 0.00 0.00 179.24 177.00 3fyu n THR 147 N -3.64 0.00 -1.64 0.35 -2.24 -0.58 -4.97 114.28 101.56 3fyu n THR 147 Ca -0.01 -0.25 -0.47 0.00 -2.27 0.00 0.00 64.05 61.05 3fyu n THR 147 Cb 0.65 0.50 -0.04 0.00 -2.10 0.00 0.00 70.33 69.34 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 -1.87 1.91 -0.30 4.78 9.36 -0.22 -4.49 117.16 126.32 3fyu n TYR 148 Ca -0.00 0.48 0.08 0.00 3.32 0.00 0.00 57.90 61.78 3fyu n TYR 148 Cb 0.45 -2.42 0.19 0.00 -0.63 0.00 0.00 39.34 36.93 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 4.46 -0.16 0.00 2.98 3.20 -1.64 -1.17 116.97 124.64 3fyu h TYR 149 Ca -0.45 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.49 3fyu h TYR 149 Cb 1.29 0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.77 3fyu h TYR 149 CO 0.58 -0.34 0.00 0.66 -1.64 0.00 0.00 178.16 177.41 3fyu n TYR 150 N -5.45 0.34 -0.02 -3.82 4.01 -1.26 -2.99 117.16 107.96 3fyu n TYR 150 Ca 0.17 0.13 -0.11 0.00 -0.16 0.00 0.00 57.90 57.92 3fyu n TYR 150 Cb 0.57 -0.70 -0.06 0.00 -0.31 0.00 0.00 39.34 38.83 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 0.17 -0.56 -0.72 2.43 -1.52 0.24 114.38 114.42 3fyu h ARG 151 Ca 0.00 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 3fyu h ARG 151 Cb 0.34 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3fyu h ARG 151 CO 0.00 0.29 0.09 0.78 -1.51 0.00 0.00 179.97 179.62 3fyu h GLY 152 N 0.01 1.00 0.89 2.80 0.00 -1.68 -2.13 103.07 103.97 3fyu h GLY 152 Ca 0.04 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 3fyu h GLY 152 CO -0.00 0.62 0.07 -2.08 0.00 0.00 0.00 176.54 175.14 3fyu h VAL 153 N 0.82 1.14 -0.98 4.60 2.07 -1.46 0.97 116.25 123.42 3fyu h VAL 153 Ca 0.17 -0.41 0.04 0.00 0.82 0.00 0.00 66.70 67.31 3fyu h VAL 153 Cb 0.41 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 3fyu h VAL 153 CO 0.01 0.13 0.64 1.88 0.02 0.00 0.00 177.57 180.25 3fyu h TYR 154 N 0.11 1.19 -0.14 1.57 -1.99 -0.49 -0.66 116.97 116.56 3fyu h TYR 154 Ca 0.05 0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.68 3fyu h TYR 154 Cb 0.15 -0.40 -0.01 0.00 2.00 0.00 0.00 36.73 38.47 3fyu h TYR 154 CO -0.02 0.69 -0.47 -0.07 -0.00 0.00 0.00 178.16 178.29 3fyu h LEU 155 N 1.23 0.38 -1.18 3.88 3.38 -1.08 -2.15 115.31 119.78 3fyu h LEU 155 Ca 0.39 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 3fyu h LEU 155 Cb 0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3fyu h LEU 155 CO -0.12 0.80 -0.04 0.44 0.09 0.00 0.00 178.44 179.61 3fyu h ASP 156 N 0.29 0.49 0.08 -0.43 3.32 0.36 -0.46 116.42 120.06 3fyu h ASP 156 Ca 0.02 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3fyu h ASP 156 Cb 0.94 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.37 3fyu h ASP 156 CO 0.08 0.59 -0.04 0.00 -1.72 0.00 0.00 179.24 178.15 3fyu h ALA 157 N 1.47 -0.10 -0.36 3.45 0.00 -0.68 0.95 119.26 123.99 3fyu h ALA 157 Ca 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3fyu h ALA 157 Cb 0.39 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3fyu h ALA 157 CO 0.02 -0.48 0.24 0.28 0.00 0.00 0.00 179.25 179.30 3fyu h VAL 158 N -0.26 1.10 -0.50 0.00 2.07 -1.08 -2.38 116.25 115.20 3fyu h VAL 158 Ca -0.01 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3fyu h VAL 158 Cb 0.22 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 3fyu h VAL 158 CO 0.02 0.09 0.25 -0.09 0.02 0.00 0.00 177.57 177.86 3fyu h ARG 159 N 0.48 0.69 -0.73 1.57 9.65 -0.93 -1.56 114.38 123.56 3fyu h ARG 159 Ca 0.13 -0.07 0.04 0.00 -1.10 0.00 0.00 59.98 58.98 3fyu h ARG 159 Cb -0.05 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 28.34 3fyu h ARG 159 CO -0.03 0.52 0.45 0.00 2.80 0.00 0.00 179.97 183.72 3fyu h ALA 160 N 1.59 0.96 -0.60 2.80 0.00 -0.30 0.14 119.26 123.86 3fyu h ALA 160 Ca 0.18 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3fyu h ALA 160 Cb 0.05 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3fyu h ALA 160 CO -0.03 0.22 0.03 -0.07 0.00 0.00 0.00 179.25 179.40 3fyu h LEU 161 N 0.87 0.98 -0.93 0.00 3.38 -1.02 -0.57 115.31 118.02 3fyu h LEU 161 Ca 0.30 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3fyu h LEU 161 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3fyu h LEU 161 CO -0.13 1.02 -0.26 -0.33 0.09 0.00 0.00 178.44 178.84 3fyu h GLU 162 N 0.94 0.48 -0.04 1.13 5.08 -0.63 -1.20 114.58 120.34 3fyu h GLU 162 Ca 0.18 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 3fyu h GLU 162 Cb 0.50 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3fyu h GLU 162 CO 0.02 0.70 -0.16 0.28 -1.00 0.00 0.00 179.01 178.85 3fyu h VAL 163 N 0.42 1.47 0.05 3.13 2.07 -0.74 -2.97 116.25 119.68 3fyu h VAL 163 Ca 0.06 -1.62 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 3fyu h VAL 163 Cb 0.68 2.42 -0.00 0.00 -1.52 0.00 0.00 31.29 32.87 3fyu h VAL 163 CO 0.05 0.45 -0.03 0.40 0.02 0.00 0.00 177.57 178.46 3fyu h ILE 164 N -0.38 0.94 -0.03 4.57 1.08 -1.03 -2.52 117.51 120.13 3fyu h ILE 164 Ca -0.01 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 3fyu h ILE 164 Cb 0.81 0.94 -0.00 0.00 -3.07 0.00 0.00 36.82 35.50 3fyu h ILE 164 CO 0.03 0.00 0.03 -0.61 -0.69 0.00 0.00 178.15 176.91 3fyu h GLN 165 N -0.07 0.00 0.00 2.37 4.15 -1.33 0.15 115.11 120.38 3fyu h GLN 165 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3fyu h GLN 165 Cb 0.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.75 3fyu h GLN 165 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 178.83 175.77 3fyu n SER 166 N -4.25 0.36 -4.74 -0.69 3.41 -0.96 -4.61 113.62 102.15 3fyu n SER 166 Ca -0.02 0.56 -0.41 0.00 -0.26 0.00 0.00 58.87 58.74 3fyu n SER 166 Cb 0.12 -0.65 -0.03 0.00 -0.26 0.00 0.00 64.21 63.39 3fyu n SER 166 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 3fyu s PHE 167 N -3.11 3.38 0.20 7.33 0.08 0.04 -4.94 117.98 120.96 3fyu s PHE 167 Ca 0.09 1.35 -0.10 0.00 0.12 0.00 0.00 56.93 58.39 3fyu s PHE 167 Cb 0.12 -3.48 0.14 0.00 -0.57 0.00 0.00 43.02 39.23 3fyu s PHE 167 CO 0.44 -1.41 1.83 -1.00 -0.10 0.00 0.00 175.22 174.97 3fyu h PRO 168 N 5.37 1.00 0.00 0.24 0.13 -1.87 -2.32 132.00 134.55 3fyu h PRO 168 Ca -0.44 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 3fyu h PRO 168 Cb 1.21 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.14 3fyu h PRO 168 CO 0.76 0.73 0.00 -0.85 -0.23 0.00 0.00 178.00 178.41 3fyu n GLU 169 N -4.50 0.65 -4.49 0.86 0.00 -1.26 -4.69 120.64 107.21 3fyu n GLU 169 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 57.16 56.89 3fyu n GLU 169 Cb 0.07 -1.37 -0.12 0.00 0.00 0.00 0.00 31.44 30.03 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 3.77 -0.80 3.84 1.01 -0.88 -0.27 120.40 125.08 3fyu s VAL 170 Ca 0.23 -0.41 -0.23 0.00 0.00 0.00 0.00 61.98 61.56 3fyu s VAL 170 Cb 0.10 -2.62 0.06 0.00 0.00 0.00 0.00 36.38 33.92 3fyu s VAL 170 CO 0.18 0.52 1.20 -0.62 0.00 0.00 0.00 175.10 176.37 3fyu s ASP 171 N 0.08 6.31 0.63 3.32 -1.08 -0.04 -4.77 116.67 121.12 3fyu s ASP 171 Ca -0.01 -1.08 0.23 0.00 -0.52 0.00 0.00 52.55 51.17 3fyu s ASP 171 Cb -0.14 -2.49 1.15 0.00 -1.46 0.00 0.00 42.92 39.98 3fyu s ASP 171 CO 0.03 -1.53 1.63 1.05 0.52 0.00 0.00 175.17 176.87 3fyu h GLU 172 N 9.65 0.00 -0.01 4.34 4.11 -1.87 0.11 114.58 130.92 3fyu h GLU 172 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.32 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 1.26 0.00 -0.15 0.72 0.07 0.00 0.00 179.01 180.91 3fyu n HIS 173 N -3.13 0.00 -2.93 2.06 8.25 -1.26 -4.17 115.22 114.04 3fyu n HIS 173 Ca 0.06 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.31 3fyu n HIS 173 Cb 0.79 -0.15 -0.02 0.00 1.12 0.00 0.00 29.99 31.72 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 -0.81 2.06 -4.34 -0.41 1.74 0.40 -4.81 116.66 110.49 3fyu n ARG 174 Ca 0.14 -3.99 -0.34 0.00 -0.77 0.00 0.00 57.85 52.89 3fyu n ARG 174 Cb 0.30 -1.88 -0.12 0.00 -1.02 0.00 0.00 32.46 29.74 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 -3.61 3.81 0.19 0.55 1.01 -1.26 0.05 121.20 121.95 3fyu s ILE 175 Ca 0.42 -0.38 0.10 0.00 0.00 0.00 0.00 60.65 60.79 3fyu s ILE 175 Cb 0.35 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 3fyu s ILE 175 CO -0.10 0.48 -0.17 -0.83 0.00 0.00 0.00 174.94 174.32 3fyu s GLY 176 N 0.55 1.72 -0.15 6.18 0.00 0.18 0.23 107.32 116.04 3fyu s GLY 176 Ca -0.03 -1.56 0.02 0.00 0.00 0.00 0.00 44.72 43.15 3fyu s GLY 176 CO 0.03 -1.59 -0.22 -1.34 0.00 0.00 0.00 173.10 169.98 3fyu s VAL 177 N -1.69 2.06 0.12 1.40 -7.23 -0.90 -0.81 120.40 113.36 3fyu s VAL 177 Ca 0.23 -0.97 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 3fyu s VAL 177 Cb -0.08 -1.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 3fyu s VAL 177 CO 0.12 0.55 -0.04 0.27 -0.31 0.00 0.00 175.10 175.69 3fyu s ILE 178 N 0.92 0.67 0.00 -0.62 -4.36 -0.88 -1.24 121.20 115.67 3fyu s ILE 178 Ca -0.04 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.40 3fyu s ILE 178 Cb -0.15 -1.84 0.00 0.00 1.25 0.00 0.00 42.46 41.72 3fyu s ILE 178 CO -0.04 -0.73 0.00 0.61 0.24 0.00 0.00 174.94 175.02 3fyu n GLY 179 N -0.11 1.79 3.44 6.27 0.00 -0.86 -0.92 105.19 114.80 3fyu n GLY 179 Ca -0.10 -0.86 -0.32 0.00 0.00 0.00 0.00 46.02 44.74 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 1.49 0.00 -0.02 0.00 -1.24 -1.12 107.32 106.42 3fyu s GLY 180 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.69 3fyu s GLY 180 CO 0.00 -0.84 0.00 -1.26 0.00 0.00 0.00 173.10 171.00 3fyu n SER 181 N 2.23 0.00 -0.23 1.64 2.88 0.22 -0.39 113.62 119.97 3fyu n SER 181 Ca -0.17 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.41 3fyu n SER 181 Cb 0.52 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.13 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 0.31 -0.27 -1.46 4.15 -1.84 0.44 115.11 116.43 3fyu h GLN 182 Ca 0.00 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 3fyu h GLN 182 Cb 0.00 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 3fyu h GLN 182 CO 0.00 0.20 0.12 0.78 -1.93 0.00 0.00 178.83 178.01 3fyu h GLY 183 N 0.32 0.39 1.43 2.39 0.00 -0.44 -0.12 103.07 107.04 3fyu h GLY 183 Ca 0.37 -0.17 -0.16 0.00 0.00 0.00 0.00 47.33 47.38 3fyu h GLY 183 CO -0.44 0.16 -0.51 -1.33 0.00 0.00 0.00 176.54 174.42 3fyu h GLY 184 N 0.48 0.67 1.09 4.60 0.00 -0.13 -1.66 103.07 108.12 3fyu h GLY 184 Ca 0.10 -0.75 -0.13 0.00 0.00 0.00 0.00 47.33 46.54 3fyu h GLY 184 CO -0.01 0.67 -0.24 0.00 0.00 0.00 0.00 176.54 176.96 3fyu h ALA 185 N 0.96 0.63 -0.68 3.60 0.00 0.03 -1.90 119.26 121.90 3fyu h ALA 185 Ca 0.02 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 3fyu h ALA 185 Cb 1.06 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3fyu h ALA 185 CO 0.10 0.63 0.21 -0.07 0.00 0.00 0.00 179.25 180.13 3fyu h LEU 186 N 0.79 0.99 -0.15 0.00 3.38 -0.92 0.27 115.31 119.67 3fyu h LEU 186 Ca 0.10 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3fyu h LEU 186 Cb 0.82 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3fyu h LEU 186 CO 0.07 0.93 0.09 0.00 0.09 0.00 0.00 178.44 179.63 3fyu h ALA 187 N 1.09 0.19 -0.32 1.53 0.00 -1.16 0.18 119.26 120.77 3fyu h ALA 187 Ca 0.22 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3fyu h ALA 187 Cb 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3fyu h ALA 187 CO -0.01 -0.31 0.07 0.82 0.00 0.00 0.00 179.25 179.83 3fyu h ILE 188 N 0.18 1.22 -0.73 0.00 2.04 -1.05 -0.96 117.51 118.21 3fyu h ILE 188 Ca 0.05 -0.75 0.00 0.00 1.00 0.00 0.00 64.86 65.16 3fyu h ILE 188 Cb 0.01 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 3fyu h ILE 188 CO -0.01 0.25 0.47 0.00 0.00 0.00 0.00 178.15 178.86 3fyu h ALA 189 N 0.91 0.93 -0.37 1.87 0.00 -0.26 -0.98 119.26 121.36 3fyu h ALA 189 Ca 0.10 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3fyu h ALA 189 Cb 0.31 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3fyu h ALA 189 CO 0.00 0.37 0.12 0.00 0.00 0.00 0.00 179.25 179.74 3fyu h ALA 190 N 1.25 0.49 0.00 0.00 0.00 -0.46 -0.64 119.26 119.89 3fyu h ALA 190 Ca 0.26 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3fyu h ALA 190 Cb -0.08 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3fyu h ALA 190 CO -0.05 0.13 -0.19 0.00 0.00 0.00 0.00 179.25 179.13 3fyu h ALA 191 N 0.96 1.48 0.01 0.00 0.00 -0.81 0.32 119.26 121.22 3fyu h ALA 191 Ca 0.12 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 3fyu h ALA 191 Cb 0.25 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3fyu h ALA 191 CO -0.00 0.24 -0.99 0.00 0.00 0.00 0.00 179.25 178.49 3fyu h ALA 192 N 1.81 0.37 0.00 0.00 0.00 -0.74 -3.30 119.26 117.40 3fyu h ALA 192 Ca -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.03 3fyu h ALA 192 Cb 0.39 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fyu h ALA 192 CO 0.03 1.17 -1.03 1.28 0.00 0.00 0.00 179.25 180.70 3fyu n LEU 193 N -3.42 0.61 -3.96 0.00 4.77 -0.29 -4.73 117.00 109.99 3fyu n LEU 193 Ca -0.01 -0.01 -0.13 0.00 -0.03 0.00 0.00 56.01 55.84 3fyu n LEU 193 Cb 0.92 -0.10 -0.13 0.00 -2.33 0.00 0.00 43.42 41.78 3fyu n LEU 193 CO 0.47 0.03 -0.38 -0.55 -1.33 0.00 0.00 177.39 175.64 3fyu s SER 194 N -3.98 0.40 -0.10 -1.43 0.15 0.11 -5.02 113.70 103.83 3fyu s SER 194 Ca 0.03 -0.24 0.18 0.00 0.70 0.00 0.00 55.95 56.62 3fyu s SER 194 Cb 0.14 0.01 0.68 0.00 -1.71 0.00 0.00 66.02 65.14 3fyu s SER 194 CO 0.80 -0.09 1.59 -0.90 1.20 0.00 0.00 173.24 175.84 3fyu n ASP 195 N 2.40 4.54 -0.07 5.45 3.85 -1.26 -4.37 116.55 127.09 3fyu n ASP 195 Ca -0.17 -2.42 -0.13 0.00 -0.71 0.00 0.00 54.79 51.36 3fyu n ASP 195 Cb 0.57 -0.55 -0.05 0.00 -1.35 0.00 0.00 41.12 39.74 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 3.81 1.32 -3.94 2.12 2.04 -1.91 -3.44 117.51 117.50 3fyu h ILE 196 Ca 0.00 -1.27 -0.53 0.00 1.00 0.00 0.00 64.86 64.06 3fyu h ILE 196 Cb 1.37 1.67 0.09 0.00 -0.74 0.00 0.00 36.82 39.22 3fyu h ILE 196 CO 0.20 0.39 0.67 -2.84 0.00 0.00 0.00 178.15 176.57 3fyu s PRO 197 N -4.46 4.01 -0.18 2.37 0.02 -1.26 -4.66 135.00 130.84 3fyu s PRO 197 Ca -0.13 2.32 -0.12 0.00 0.02 0.00 0.00 61.00 63.08 3fyu s PRO 197 Cb 0.07 -2.84 -0.21 0.00 0.02 0.00 0.00 34.50 31.53 3fyu s PRO 197 CO 0.78 -0.52 0.18 1.17 -0.33 0.00 0.00 177.00 178.28 3fyu n LYS 198 N 0.25 0.66 -4.29 5.54 4.81 0.14 -4.88 118.16 120.39 3fyu n LYS 198 Ca 0.03 0.37 -0.16 0.00 -0.87 0.00 0.00 58.31 57.68 3fyu n LYS 198 Cb 0.42 -1.68 -0.10 0.00 0.02 0.00 0.00 35.03 33.68 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 -2.48 1.12 -0.04 3.15 -7.23 -1.24 -3.74 120.40 109.94 3fyu s VAL 199 Ca -0.28 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 57.86 3fyu s VAL 199 Cb 0.07 -2.07 0.01 0.00 0.56 0.00 0.00 36.38 34.95 3fyu s VAL 199 CO 0.66 -0.55 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.13 3fyu s VAL 200 N -3.37 0.70 -0.20 1.32 1.01 -0.48 -2.11 120.40 117.28 3fyu s VAL 200 Ca 0.22 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.95 3fyu s VAL 200 Cb 0.04 -0.67 0.05 0.00 0.00 0.00 0.00 36.38 35.79 3fyu s VAL 200 CO 0.04 0.25 -0.07 -0.69 0.00 0.00 0.00 175.10 174.63 3fyu s VAL 201 N 0.60 1.44 -0.18 2.92 1.01 -0.38 -0.23 120.40 125.59 3fyu s VAL 201 Ca -0.09 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.96 3fyu s VAL 201 Cb -0.12 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.69 3fyu s VAL 201 CO 0.01 0.09 -0.14 0.00 0.00 0.00 0.00 175.10 175.06 3fyu s ALA 202 N 1.47 2.04 -0.21 5.51 0.00 0.16 -2.03 121.76 128.70 3fyu s ALA 202 Ca -0.02 -1.12 -0.23 0.00 0.00 0.00 0.00 51.96 50.59 3fyu s ALA 202 Cb -0.17 -1.19 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 3fyu s ALA 202 CO -0.08 -0.58 0.76 -0.51 0.00 0.00 0.00 175.76 175.35 3fyu s ASP 203 N 1.40 6.81 -0.24 0.00 1.11 -0.28 -2.33 116.67 123.14 3fyu s ASP 203 Ca 0.02 1.00 -0.01 0.00 0.18 0.00 0.00 52.55 53.74 3fyu s ASP 203 Cb -0.14 -2.41 0.00 0.00 1.07 0.00 0.00 42.92 41.44 3fyu s ASP 203 CO -0.10 -0.40 0.17 0.00 1.18 0.00 0.00 175.17 176.02 3fyu n TYR 204 N 5.46 -0.54 -1.63 4.23 0.18 0.32 0.69 117.16 125.87 3fyu n TYR 204 Ca 0.03 0.21 -0.44 0.00 1.88 0.00 0.00 57.90 59.58 3fyu n TYR 204 Cb 0.49 -0.76 -0.01 0.00 -0.38 0.00 0.00 39.34 38.67 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 -1.19 1.64 -0.93 -3.48 -0.04 -1.26 -2.96 135.00 126.77 3fyu n PRO 205 Ca -0.09 0.57 -0.02 0.00 -0.04 0.00 0.00 63.50 63.93 3fyu n PRO 205 Cb 0.19 -2.03 0.01 0.00 -0.04 0.00 0.00 33.50 31.63 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 0.34 -3.18 -3.97 0.54 9.36 -0.72 -4.65 117.16 114.88 3fyu n TYR 206 Ca 0.08 -0.15 -0.29 0.00 3.32 0.00 0.00 57.90 60.86 3fyu n TYR 206 Cb 0.33 -0.05 0.00 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 -2.35 -4.01 2.98 4.77 -1.26 -4.53 117.00 112.59 3fyu n LEU 207 Ca 0.01 -0.90 -0.22 0.00 -0.03 0.00 0.00 56.01 54.87 3fyu n LEU 207 Cb 0.05 -2.37 -0.16 0.00 -2.33 0.00 0.00 43.42 38.61 3fyu n LEU 207 CO 0.03 0.41 -0.45 -0.55 -1.33 0.00 0.00 177.39 175.50 3fyu s SER 208 N -3.75 1.43 -1.32 -1.43 0.15 -1.26 -1.61 113.70 105.91 3fyu s SER 208 Ca 0.40 -0.23 -0.02 0.00 0.70 0.00 0.00 55.95 56.81 3fyu s SER 208 Cb -0.21 -0.49 -0.00 0.00 -1.71 0.00 0.00 66.02 63.61 3fyu s SER 208 CO 0.87 0.06 0.62 -3.20 1.20 0.00 0.00 173.24 172.78 3fyu n ASN 209 N 3.48 -1.34 -0.31 5.45 5.15 -1.26 -4.64 115.26 121.79 3fyu n ASN 209 Ca -0.20 -0.90 0.06 0.00 -0.60 0.00 0.00 54.58 52.95 3fyu n ASN 209 Cb 0.53 -3.69 0.16 0.00 -0.53 0.00 0.00 39.78 36.25 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 -1.84 -0.31 -0.10 1.20 0.04 -1.95 -0.32 116.94 113.66 3fyu h PHE 210 Ca -0.62 0.07 0.03 0.00 2.80 0.00 0.00 57.97 60.25 3fyu h PHE 210 Cb 1.36 0.28 -0.00 0.00 2.20 0.00 0.00 35.95 39.79 3fyu h PHE 210 CO 0.46 -0.37 0.09 0.93 -0.60 0.00 0.00 178.31 178.82 3fyu h GLU 211 N 0.02 0.00 0.10 1.51 5.08 -1.97 -2.09 114.58 117.24 3fyu h GLU 211 Ca 0.46 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.46 3fyu h GLU 211 Cb 0.78 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 3fyu h GLU 211 CO -0.87 0.00 -2.03 -2.13 -1.00 0.00 0.00 179.01 172.97 3fyu n ARG 212 N -4.17 0.74 -0.22 2.33 0.63 -0.28 -4.33 116.66 111.37 3fyu n ARG 212 Ca -0.01 0.26 0.01 0.00 -0.92 0.00 0.00 57.85 57.19 3fyu n ARG 212 Cb 0.20 -1.68 0.09 0.00 0.45 0.00 0.00 32.46 31.51 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 0.03 0.53 0.00 5.13 0.00 -0.59 0.14 119.26 124.51 3fyu h ALA 213 Ca -0.44 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3fyu h ALA 213 Cb 1.98 0.44 0.00 0.00 0.00 0.00 0.00 17.79 20.21 3fyu h ALA 213 CO 0.05 -0.42 0.00 -0.39 0.00 0.00 0.00 179.25 178.49 3fyu h VAL 214 N 0.05 0.00 0.00 0.00 -1.51 -1.59 0.22 116.25 113.42 3fyu h VAL 214 Ca 0.33 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.68 3fyu h VAL 214 Cb 0.53 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 3fyu h VAL 214 CO -0.63 0.00 -1.41 0.47 -1.23 0.00 0.00 177.57 174.77 3fyu n ASP 215 N -2.48 0.65 -0.04 4.19 8.00 0.38 -4.67 116.55 122.58 3fyu n ASP 215 Ca -0.00 -0.51 -0.05 0.00 0.71 0.00 0.00 54.79 54.94 3fyu n ASP 215 Cb 0.12 1.44 -0.04 0.00 -0.02 0.00 0.00 41.12 42.63 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 -1.82 0.43 -1.62 2.53 0.31 -0.47 -5.03 118.33 112.67 3fyu n VAL 216 Ca 0.00 -0.20 -0.40 0.00 -0.01 0.00 0.00 64.34 63.73 3fyu n VAL 216 Cb 0.41 -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 -2.56 0.29 -0.01 3.52 0.00 0.72 -4.91 120.51 117.56 3fyu n ALA 217 Ca -0.12 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3fyu n ALA 217 Cb 0.66 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 0.21 0.96 -4.18 0.00 4.77 -0.97 -4.96 117.00 112.83 3fyu n LEU 218 Ca 0.10 -0.98 -0.11 0.00 -0.03 0.00 0.00 56.01 54.99 3fyu n LEU 218 Cb 0.41 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 3fyu n LEU 218 CO 0.55 0.24 -0.22 -1.61 -1.33 0.00 0.00 177.39 175.03 3fyu s GLU 219 N -0.03 1.18 0.96 3.23 2.02 -1.21 -5.03 118.70 119.81 3fyu s GLU 219 Ca 0.00 -1.57 -0.11 0.00 0.02 0.00 0.00 54.97 53.31 3fyu s GLU 219 Cb 0.00 0.28 0.17 0.00 0.10 0.00 0.00 34.13 34.68 3fyu s GLU 219 CO 0.00 -0.39 1.10 -0.65 0.02 0.00 0.00 175.26 175.34 3fyu s GLN 220 N -4.13 0.74 0.00 1.61 -1.52 -1.26 -4.01 119.66 111.09 3fyu s GLN 220 Ca 0.35 1.14 0.19 0.00 -1.95 0.00 0.00 55.36 55.10 3fyu s GLN 220 Cb 0.07 -1.72 0.50 0.00 -0.22 0.00 0.00 33.01 31.63 3fyu s GLN 220 CO 0.10 -2.69 1.42 -0.35 -0.25 0.00 0.00 175.29 173.52 3fyu n PRO 221 N -4.23 2.64 -0.31 2.91 -0.04 -1.26 -4.73 135.00 129.97 3fyu n PRO 221 Ca 0.08 -2.40 -0.05 0.00 -0.04 0.00 0.00 63.50 61.10 3fyu n PRO 221 Cb 0.53 -1.47 0.08 0.00 -0.04 0.00 0.00 33.50 32.60 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 3.72 1.20 0.00 0.54 0.05 -1.85 -2.04 116.97 118.59 3fyu h TYR 222 Ca 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.73 3fyu h TYR 222 Cb 0.91 -0.38 0.00 0.00 1.01 0.00 0.00 36.73 38.28 3fyu h TYR 222 CO 0.36 0.86 0.01 1.28 -1.05 0.00 0.00 178.16 179.62 3fyu n LEU 223 N -4.33 0.00 0.05 3.88 4.77 -1.26 -1.28 117.00 118.83 3fyu n LEU 223 Ca 0.08 0.31 -0.00 0.00 -0.03 0.00 0.00 56.01 56.37 3fyu n LEU 223 Cb 0.13 -0.31 0.30 0.00 -2.33 0.00 0.00 43.42 41.21 3fyu n LEU 223 CO 0.39 -0.31 0.86 -0.33 -1.33 0.00 0.00 177.39 176.68 3fyu h GLU 224 N 0.00 0.41 -0.49 3.23 5.08 -1.73 -0.23 114.58 120.84 3fyu h GLU 224 Ca 0.00 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 3fyu h GLU 224 Cb 0.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 3fyu h GLU 224 CO 0.00 0.53 0.11 0.82 -1.00 0.00 0.00 179.01 179.46 3fyu h ILE 225 N 0.38 1.24 -0.47 3.13 2.04 -1.39 -0.48 117.51 121.96 3fyu h ILE 225 Ca 0.07 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 65.06 3fyu h ILE 225 Cb 0.44 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3fyu h ILE 225 CO 0.02 0.31 0.28 0.78 0.00 0.00 0.00 178.15 179.55 3fyu h ASN 226 N 0.68 0.57 -0.51 1.72 4.21 -1.49 -1.24 115.58 119.52 3fyu h ASN 226 Ca 0.15 -0.06 0.01 0.00 1.21 0.00 0.00 56.30 57.61 3fyu h ASN 226 Cb 0.35 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.38 3fyu h ASN 226 CO 0.00 0.47 0.34 0.28 -1.29 0.00 0.00 177.43 177.24 3fyu h SER 227 N 0.63 0.58 0.06 5.81 0.02 -0.74 -1.17 113.55 118.74 3fyu h SER 227 Ca 0.17 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3fyu h SER 227 Cb 0.01 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.40 3fyu h SER 227 CO -0.03 0.42 -0.03 0.22 -1.14 0.00 0.00 176.83 176.27 3fyu h TYR 228 N 0.68 -0.08 0.00 3.45 3.20 -0.18 -2.62 116.97 121.43 3fyu h TYR 228 Ca 0.19 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.02 3fyu h TYR 228 Cb -0.06 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 3fyu h TYR 228 CO -0.00 0.15 -0.20 0.74 -1.64 0.00 0.00 178.16 177.21 3fyu h PHE 229 N -0.29 0.00 -0.69 -3.82 0.04 -0.76 -1.08 116.94 110.34 3fyu h PHE 229 Ca -0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 3fyu h PHE 229 Cb 0.26 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 3fyu h PHE 229 CO -0.00 0.20 0.27 0.00 -0.60 0.00 0.00 178.31 178.17 3fyu h ARG 230 N 0.00 1.04 0.00 1.51 3.08 -1.04 -2.74 114.38 116.23 3fyu h ARG 230 Ca -0.00 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 59.86 3fyu h ARG 230 Cb 0.37 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3fyu h ARG 230 CO 0.03 0.87 -0.07 0.54 -1.07 0.00 0.00 179.97 180.26 3fyu n ARG 231 N -4.37 0.10 -3.45 0.04 1.74 -0.74 -4.32 116.66 105.66 3fyu n ARG 231 Ca 0.05 0.07 -0.28 0.00 -0.77 0.00 0.00 57.85 56.93 3fyu n ARG 231 Cb 0.18 -1.61 -0.11 0.00 -1.02 0.00 0.00 32.46 29.90 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 -3.55 2.15 0.34 0.55 -0.87 -0.49 -4.99 114.94 108.08 3fyu s ASN 232 Ca 0.12 -2.82 0.26 0.00 -1.57 0.00 0.00 52.86 48.85 3fyu s ASN 232 Cb 0.16 -0.51 1.19 0.00 -0.02 0.00 0.00 41.25 42.07 3fyu s ASN 232 CO 0.57 -0.21 1.78 0.77 -2.57 0.00 0.00 177.10 177.44 3fyu h SER 233 N 6.09 0.00 -1.44 -1.22 4.64 -1.73 -3.42 113.55 116.46 3fyu h SER 233 Ca 0.19 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.84 3fyu h SER 233 Cb 0.92 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.01 3fyu h SER 233 CO 0.36 0.00 1.23 -0.67 -0.87 0.00 0.00 176.83 176.89 3fyu n ASP 234 N -2.41 2.54 -0.31 4.97 -0.08 -1.26 -4.82 116.55 115.19 3fyu n ASP 234 Ca 0.01 0.68 0.10 0.00 -1.51 0.00 0.00 54.79 54.07 3fyu n ASP 234 Cb 0.17 -1.27 0.27 0.00 2.34 0.00 0.00 41.12 42.63 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 10.61 0.59 0.00 -0.67 0.11 -1.99 0.35 132.00 141.00 3fyu h PRO 235 Ca -0.37 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3fyu h PRO 235 Cb 1.31 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 3fyu h PRO 235 CO 0.99 0.39 -0.04 0.87 -0.21 0.00 0.00 178.00 180.00 3fyu h LYS 236 N 0.61 0.00 -0.40 1.05 1.57 -1.96 -1.37 116.57 116.07 3fyu h LYS 236 Ca 0.52 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.15 3fyu h LYS 236 Cb 0.82 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 3fyu h LYS 236 CO -0.41 0.04 -0.32 0.28 -0.57 0.00 0.00 179.45 178.47 3fyu h VAL 237 N 0.00 1.27 -0.18 0.50 2.07 -0.64 -0.84 116.25 118.43 3fyu h VAL 237 Ca -0.00 -1.49 -0.04 0.00 0.82 0.00 0.00 66.70 65.99 3fyu h VAL 237 Cb 0.12 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3fyu h VAL 237 CO 0.00 0.50 -0.04 -0.08 0.02 0.00 0.00 177.57 177.97 3fyu h GLU 238 N 0.75 0.35 -0.41 1.57 4.81 -1.18 0.12 114.58 120.59 3fyu h GLU 238 Ca 0.08 -0.13 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3fyu h GLU 238 Cb 0.89 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.22 3fyu h GLU 238 CO 0.08 0.60 0.23 0.93 -0.73 0.00 0.00 179.01 180.12 3fyu h GLU 239 N 0.06 0.45 -0.10 1.92 5.08 -1.41 -1.13 114.58 119.44 3fyu h GLU 239 Ca 0.05 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3fyu h GLU 239 Cb 0.47 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 3fyu h GLU 239 CO 0.02 0.29 0.05 -0.22 -1.00 0.00 0.00 179.01 178.15 3fyu h LYS 240 N 0.46 0.14 -0.22 2.33 1.63 -1.07 -1.37 116.57 118.48 3fyu h LYS 240 Ca 0.17 -0.02 0.05 0.00 -0.85 0.00 0.00 60.65 60.00 3fyu h LYS 240 Cb 0.03 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.58 3fyu h LYS 240 CO -0.09 0.19 -0.15 0.00 -3.45 0.00 0.00 179.45 175.95 3fyu h ALA 241 N 0.94 0.01 0.00 5.00 0.00 -0.38 0.27 119.26 125.10 3fyu h ALA 241 Ca 0.04 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3fyu h ALA 241 Cb 0.09 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3fyu h ALA 241 CO -0.01 -0.57 -0.20 0.74 0.00 0.00 0.00 179.25 179.21 3fyu h PHE 242 N -0.15 0.00 -0.26 0.00 -1.00 -1.13 -0.98 116.94 113.42 3fyu h PHE 242 Ca 0.13 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.85 3fyu h PHE 242 Cb 0.34 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.89 3fyu h PHE 242 CO -0.31 0.20 -0.05 1.49 -1.61 0.00 0.00 178.31 178.04 3fyu h GLU 243 N 0.00 0.49 0.16 1.51 4.81 -0.02 -2.13 114.58 119.40 3fyu h GLU 243 Ca -0.00 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 3fyu h GLU 243 Cb 0.44 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.79 3fyu h GLU 243 CO 0.03 0.69 -0.08 1.15 -0.73 0.00 0.00 179.01 180.07 3fyu h THR 244 N 0.24 0.85 -0.50 0.32 2.02 -0.30 -2.88 112.91 112.66 3fyu h THR 244 Ca 0.07 -0.06 0.11 0.00 0.77 0.00 0.00 66.41 67.30 3fyu h THR 244 Cb 0.50 0.89 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 3fyu h THR 244 CO 0.02 0.01 0.34 -0.07 0.37 0.00 0.00 175.52 176.20 3fyu h LEU 245 N -0.24 0.16 -1.61 2.58 3.38 -1.16 -2.06 115.31 116.36 3fyu h LEU 245 Ca -0.02 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.99 3fyu h LEU 245 Cb 0.19 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3fyu h LEU 245 CO 0.04 0.10 0.32 0.77 0.09 0.00 0.00 178.44 179.76 3fyu h SER 246 N 0.18 0.44 0.52 -0.43 4.64 -1.15 -0.28 113.55 117.47 3fyu h SER 246 Ca 0.23 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3fyu h SER 246 Cb 0.68 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 3fyu h SER 246 CO -0.04 0.30 0.00 -1.22 -0.87 0.00 0.00 176.83 175.00 3fyu n TYR 247 N -4.48 0.30 -0.05 4.77 4.01 -0.77 -2.72 117.16 118.23 3fyu n TYR 247 Ca 0.06 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 3fyu n TYR 247 Cb 0.17 -0.70 0.00 0.00 -0.31 0.00 0.00 39.34 38.51 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 -1.78 0.00 -2.15 -0.72 3.72 -0.25 -4.98 117.46 111.29 3fyu n PHE 248 Ca 0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 3fyu n PHE 248 Cb 0.17 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 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 -0.26 6.79 0.57 4.37 -1.08 -0.42 -4.89 116.67 121.75 3fyu s ASP 249 Ca 0.00 2.17 0.28 0.00 -0.52 0.00 0.00 52.55 54.47 3fyu s ASP 249 Cb 0.00 -2.56 1.49 0.00 -1.46 0.00 0.00 42.92 40.40 3fyu s ASP 249 CO 0.00 -0.78 1.98 -0.07 0.52 0.00 0.00 175.17 176.82 3fyu h LEU 250 N 8.76 0.00 -0.64 -1.34 3.38 -1.61 0.19 115.31 124.04 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 0.92 0.00 0.00 2.30 0.09 0.00 0.00 178.44 181.75 3fyu n ILE 251 N -3.99 0.86 -0.04 1.22 -5.35 -1.26 0.06 119.36 110.85 3fyu n ILE 251 Ca 0.08 0.25 0.04 0.00 -0.27 0.00 0.00 62.75 62.84 3fyu n ILE 251 Cb 0.58 -1.16 -0.16 0.00 -1.74 0.00 0.00 39.64 37.16 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 -2.16 0.28 -0.05 7.28 3.02 0.64 -4.47 115.26 119.80 3fyu n ASN 252 Ca 0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.48 3fyu n ASN 252 Cb 0.22 1.61 -0.15 0.00 -0.61 0.00 0.00 39.78 40.85 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 -2.39 0.57 -0.27 3.41 4.77 -0.98 -4.44 117.00 117.67 3fyu n LEU 253 Ca -0.13 0.26 0.08 0.00 -0.03 0.00 0.00 56.01 56.18 3fyu n LEU 253 Cb 0.74 0.28 0.21 0.00 -2.33 0.00 0.00 43.42 42.33 3fyu n LEU 253 CO 0.42 0.43 0.96 0.00 -1.33 0.00 0.00 177.39 177.88 3fyu h ALA 254 N 0.99 1.07 0.00 -1.18 0.00 -0.60 -0.04 119.26 119.51 3fyu h ALA 254 Ca -0.39 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3fyu h ALA 254 Cb 2.10 0.21 0.00 0.00 0.00 0.00 0.00 17.79 20.11 3fyu h ALA 254 CO 0.06 -0.34 0.19 0.78 0.00 0.00 0.00 179.25 179.94 3fyu h GLY 255 N 0.30 0.00 0.86 0.00 0.00 -1.73 0.36 103.07 102.87 3fyu h GLY 255 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 3fyu h GLY 255 CO -0.52 0.00 -0.92 0.79 0.00 0.00 0.00 176.54 175.89 3fyu n TRP 256 N -2.25 0.53 -2.06 5.60 8.01 -0.03 -4.77 117.44 122.47 3fyu n TRP 256 Ca -0.01 0.15 -0.42 0.00 -1.31 0.00 0.00 57.50 55.91 3fyu n TRP 256 Cb 0.22 -0.64 -0.03 0.00 -2.01 0.00 0.00 31.31 28.84 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 -3.24 3.29 -0.23 -0.99 1.01 0.12 -4.68 120.40 115.67 3fyu s VAL 257 Ca 0.03 0.74 0.05 0.00 0.00 0.00 0.00 61.98 62.81 3fyu s VAL 257 Cb 0.13 -3.48 -0.06 0.00 0.00 0.00 0.00 36.38 32.97 3fyu s VAL 257 CO 0.78 0.00 0.22 0.29 0.00 0.00 0.00 175.10 176.39 3fyu n LYS 258 N 5.33 4.91 -2.72 2.72 4.76 -1.26 -4.48 118.16 127.43 3fyu n LYS 258 Ca 0.14 -0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.26 3fyu n LYS 258 Cb 0.42 -0.78 -0.05 0.00 -1.84 0.00 0.00 35.03 32.78 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 -1.56 4.07 0.19 1.97 1.11 -1.26 -4.68 119.66 119.49 3fyu s GLN 259 Ca 0.02 0.95 -0.32 0.00 0.01 0.00 0.00 55.36 56.02 3fyu s GLN 259 Cb 0.04 -2.21 -0.11 0.00 -1.01 0.00 0.00 33.01 29.72 3fyu s GLN 259 CO 0.22 -0.09 1.66 -2.14 0.01 0.00 0.00 175.29 174.94 3fyu s PRO 260 N -3.52 4.16 -0.04 2.91 0.02 -1.24 -4.46 135.00 132.84 3fyu s PRO 260 Ca 0.59 2.50 0.07 0.00 0.02 0.00 0.00 61.00 64.18 3fyu s PRO 260 Cb -0.10 -3.13 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 3fyu s PRO 260 CO 0.21 -0.69 -0.25 0.99 -0.33 0.00 0.00 177.00 176.93 3fyu s THR 261 N 1.22 2.02 -0.17 0.99 2.01 0.12 -1.39 115.64 120.43 3fyu s THR 261 Ca 0.73 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 61.67 3fyu s THR 261 Cb -0.47 -1.69 0.02 0.00 0.01 0.00 0.00 72.50 70.37 3fyu s THR 261 CO 0.32 0.57 -0.20 -0.22 -0.69 0.00 0.00 174.62 174.40 3fyu s LEU 262 N -0.41 2.09 0.18 4.42 2.96 0.69 -1.37 118.68 127.24 3fyu s LEU 262 Ca 0.04 -0.63 0.09 0.00 -0.22 0.00 0.00 54.13 53.41 3fyu s LEU 262 Cb -0.11 -1.45 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 3fyu s LEU 262 CO 0.01 0.00 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.81 3fyu s MET 263 N 1.25 1.35 0.16 1.98 -1.94 0.06 -0.67 119.30 121.50 3fyu s MET 263 Ca 0.04 -1.46 0.07 0.00 -1.71 0.00 0.00 55.69 52.62 3fyu s MET 263 Cb -0.13 -1.46 -0.04 0.00 2.01 0.00 0.00 34.83 35.21 3fyu s MET 263 CO -0.12 0.30 -0.14 0.00 -0.01 0.00 0.00 175.02 175.05 3fyu s ALA 264 N -2.04 1.72 -0.29 3.03 0.00 -0.98 0.66 121.76 123.86 3fyu s ALA 264 Ca 0.18 -1.48 -0.15 0.00 0.00 0.00 0.00 51.96 50.51 3fyu s ALA 264 Cb -0.06 -0.07 0.11 0.00 0.00 0.00 0.00 23.12 23.10 3fyu s ALA 264 CO 0.08 0.07 0.77 -1.50 0.00 0.00 0.00 175.76 175.18 3fyu s ILE 265 N -2.63 -0.16 -0.09 0.00 1.10 -0.36 -0.52 121.20 118.53 3fyu s ILE 265 Ca 0.16 0.00 -0.15 0.00 -0.51 0.00 0.00 60.65 60.15 3fyu s ILE 265 Cb -0.02 -1.00 -0.05 0.00 0.15 0.00 0.00 42.46 41.54 3fyu s ILE 265 CO 0.04 0.00 0.36 -0.83 -2.11 0.00 0.00 174.94 172.40 3fyu s GLY 266 N 1.78 2.34 0.17 1.50 0.00 -1.26 -0.97 107.32 110.87 3fyu s GLY 266 Ca -0.09 -0.33 0.20 0.00 0.00 0.00 0.00 44.72 44.51 3fyu s GLY 266 CO -0.18 0.35 1.62 1.04 0.00 0.00 0.00 173.10 175.93 3fyu n LEU 267 N 2.88 0.43 -0.92 0.66 4.77 -0.59 -2.34 117.00 121.89 3fyu n LEU 267 Ca -0.12 0.61 0.08 0.00 -0.03 0.00 0.00 56.01 56.54 3fyu n LEU 267 Cb 0.52 -0.55 0.26 0.00 -2.33 0.00 0.00 43.42 41.32 3fyu n LEU 267 CO 0.39 -0.46 0.71 2.30 -1.33 0.00 0.00 177.39 179.01 3fyu n ILE 268 N -1.98 2.32 -2.23 -0.08 -5.35 -0.83 -4.51 119.36 106.69 3fyu n ILE 268 Ca 0.03 -1.94 -0.43 0.00 -0.27 0.00 0.00 62.75 60.14 3fyu n ILE 268 Cb 0.21 -0.26 -0.02 0.00 -1.74 0.00 0.00 39.64 37.82 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 6.71 -0.00 7.28 -1.08 -0.99 -4.60 116.67 122.02 3fyu s ASP 269 Ca 0.43 1.78 0.22 0.00 -0.52 0.00 0.00 52.55 54.45 3fyu s ASP 269 Cb 0.35 -2.54 -0.20 0.00 -1.46 0.00 0.00 42.92 39.07 3fyu s ASP 269 CO 0.08 -0.95 0.84 0.29 0.52 0.00 0.00 175.17 175.95 3fyu n LYS 270 N 7.07 0.16 -0.04 4.34 5.02 -1.26 -3.80 118.16 129.65 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 0.44 -1.51 -0.13 0.00 -0.02 0.00 0.00 35.03 33.81 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 1.31 -3.17 -0.18 2.04 -1.86 -2.57 117.51 113.07 3fyu h ILE 271 Ca 0.00 -2.34 -0.63 0.00 1.00 0.00 0.00 64.86 62.89 3fyu h ILE 271 Cb 0.62 2.86 -0.41 0.00 -0.74 0.00 0.00 36.82 39.16 3fyu h ILE 271 CO 0.00 0.57 -0.65 0.42 0.00 0.00 0.00 178.15 178.49 3fyu s THR 272 N -2.36 2.33 0.17 -0.27 -4.23 -1.26 -4.73 115.64 105.30 3fyu s THR 272 Ca -0.21 -3.42 -0.32 0.00 -1.18 0.00 0.00 61.69 56.55 3fyu s THR 272 Cb 0.02 -2.59 -0.16 0.00 1.34 0.00 0.00 72.50 71.10 3fyu s THR 272 CO 0.70 -0.90 1.00 -2.65 -0.54 0.00 0.00 174.62 172.23 3fyu n PRO 273 N 2.85 0.79 -0.34 3.99 -0.02 -1.25 -4.74 135.00 136.28 3fyu n PRO 273 Ca 0.11 0.28 0.20 0.00 -2.02 0.00 0.00 63.50 62.08 3fyu n PRO 273 Cb 0.34 -1.66 0.43 0.00 -0.02 0.00 0.00 33.50 32.59 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 2.66 0.46 -0.88 0.52 0.11 -1.81 0.10 132.00 133.17 3fyu h PRO 274 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3fyu h PRO 274 Cb 1.37 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 3fyu h PRO 274 CO 0.65 0.30 0.56 0.66 -0.21 0.00 0.00 178.00 179.97 3fyu h SER 275 N 0.47 1.03 0.00 -2.05 4.64 -1.93 0.20 113.55 115.90 3fyu h SER 275 Ca 0.68 -0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 61.83 3fyu h SER 275 Cb 1.43 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3fyu h SER 275 CO -0.51 0.76 -0.42 0.71 -0.87 0.00 0.00 176.83 176.51 3fyu h THR 276 N 1.20 1.30 -0.10 2.95 1.35 -1.12 -0.11 112.91 118.39 3fyu h THR 276 Ca 0.32 -1.59 -0.15 0.00 -0.55 0.00 0.00 66.41 64.44 3fyu h THR 276 Cb -0.10 1.59 0.01 0.00 -1.73 0.00 0.00 68.15 67.92 3fyu h THR 276 CO -0.07 0.50 -0.52 0.58 -0.25 0.00 0.00 175.52 175.77 3fyu h VAL 277 N 0.43 1.36 -0.41 6.82 2.07 -1.09 -2.81 116.25 122.63 3fyu h VAL 277 Ca 0.03 -1.84 -0.02 0.00 0.82 0.00 0.00 66.70 65.70 3fyu h VAL 277 Cb 0.91 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.85 3fyu h VAL 277 CO 0.08 0.55 0.17 -0.26 0.02 0.00 0.00 177.57 178.13 3fyu h PHE 278 N 0.13 0.56 -0.79 1.57 -1.00 -0.54 -0.96 116.94 115.91 3fyu h PHE 278 Ca -0.04 -0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.73 3fyu h PHE 278 Cb 1.16 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 40.50 3fyu h PHE 278 CO 0.11 0.43 0.49 0.00 -1.61 0.00 0.00 178.31 177.73 3fyu h ALA 279 N 1.63 1.01 -0.26 2.45 0.00 -0.90 0.15 119.26 123.34 3fyu h ALA 279 Ca 0.14 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.79 3fyu h ALA 279 Cb 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3fyu h ALA 279 CO -0.02 0.47 -0.54 0.00 0.00 0.00 0.00 179.25 179.17 3fyu h ALA 280 N 1.26 0.41 -0.56 0.00 0.00 -1.11 -2.97 119.26 116.29 3fyu h ALA 280 Ca 0.29 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3fyu h ALA 280 Cb -0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3fyu h ALA 280 CO -0.06 0.62 0.23 -0.92 0.00 0.00 0.00 179.25 179.12 3fyu h TYR 281 N 0.58 0.85 0.00 0.00 3.20 -0.80 -2.61 116.97 118.20 3fyu h TYR 281 Ca 0.01 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.81 3fyu h TYR 281 Cb 1.15 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.16 3fyu h TYR 281 CO 0.08 0.69 0.00 0.09 -1.64 0.00 0.00 178.16 177.38 3fyu n ASN 282 N -4.50 0.33 -0.65 -2.11 3.02 0.48 -2.05 115.26 109.78 3fyu n ASN 282 Ca 0.03 0.56 0.13 0.00 -0.03 0.00 0.00 54.58 55.27 3fyu n ASN 282 Cb 0.16 -0.64 0.35 0.00 -0.61 0.00 0.00 39.78 39.04 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 -1.84 0.00 -3.10 3.10 8.25 -0.99 -4.88 115.22 115.76 3fyu n HIS 283 Ca 0.04 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.15 3fyu n HIS 283 Cb 0.26 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.30 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 -2.03 4.24 -0.44 2.41 1.43 -0.87 -2.70 118.68 120.72 3fyu s LEU 284 Ca 0.33 1.39 0.04 0.00 -1.03 0.00 0.00 54.13 54.86 3fyu s LEU 284 Cb 0.21 -3.79 0.17 0.00 0.03 0.00 0.00 46.19 42.81 3fyu s LEU 284 CO 0.33 -0.06 0.35 -1.61 0.23 0.00 0.00 176.35 175.60 3fyu s GLU 285 N -2.35 1.06 0.27 1.70 2.02 -1.26 -4.98 118.70 115.15 3fyu s GLU 285 Ca 0.47 -2.21 -0.20 0.00 0.02 0.00 0.00 54.97 53.05 3fyu s GLU 285 Cb -0.14 -1.62 0.06 0.00 0.10 0.00 0.00 34.13 32.52 3fyu s GLU 285 CO 0.20 -1.37 0.90 -0.08 0.02 0.00 0.00 175.26 174.92 3fyu s THR 286 N -0.06 0.00 -0.27 3.63 -1.32 -1.26 -4.77 115.64 111.58 3fyu s THR 286 Ca 0.32 -0.80 -0.29 0.00 -1.21 0.00 0.00 61.69 59.71 3fyu s THR 286 Cb 0.02 -2.63 -0.02 0.00 -1.51 0.00 0.00 72.50 68.35 3fyu s THR 286 CO -0.19 0.00 1.74 -1.81 -2.21 0.00 0.00 174.62 172.15 3fyu s ASP 287 N -3.15 6.09 0.11 8.08 1.01 -1.26 -4.90 116.67 122.66 3fyu s ASP 287 Ca 0.17 1.48 0.03 0.00 0.71 0.00 0.00 52.55 54.94 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 0.07 -1.52 -0.08 -1.59 0.21 0.00 0.00 175.17 172.27 3fyu s LYS 288 N 5.25 0.91 -0.19 8.23 -2.85 -1.26 0.12 119.74 129.94 3fyu s LYS 288 Ca 0.77 -1.36 -0.10 0.00 -1.00 0.00 0.00 55.97 54.28 3fyu s LYS 288 Cb -0.24 -0.35 0.07 0.00 -2.06 0.00 0.00 37.83 35.25 3fyu s LYS 288 CO 0.32 0.02 0.45 0.34 0.10 0.00 0.00 175.35 176.58 3fyu s ASP 289 N -3.06 -0.54 -0.27 0.03 2.15 -0.47 -4.96 116.67 109.54 3fyu s ASP 289 Ca 0.13 0.99 -0.05 0.00 0.43 0.00 0.00 52.55 54.05 3fyu s ASP 289 Cb 0.04 0.94 0.01 0.00 -0.30 0.00 0.00 42.92 43.62 3fyu s ASP 289 CO -0.03 -0.20 0.02 -0.22 -0.17 0.00 0.00 175.17 174.57 3fyu s LEU 290 N 1.62 3.56 -0.21 -1.34 2.96 -1.26 -0.76 118.68 123.25 3fyu s LEU 290 Ca -0.09 -0.74 -0.23 0.00 -0.22 0.00 0.00 54.13 52.85 3fyu s LEU 290 Cb -0.09 -1.80 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 3fyu s LEU 290 CO -0.14 -0.16 0.76 -0.54 -1.32 0.00 0.00 176.35 174.96 3fyu s LYS 291 N 1.44 4.22 -0.23 1.98 -0.14 0.21 -4.97 119.74 122.25 3fyu s LYS 291 Ca 0.02 0.85 -0.07 0.00 -1.36 0.00 0.00 55.97 55.41 3fyu s LYS 291 Cb -0.17 -3.60 -0.03 0.00 -1.68 0.00 0.00 37.83 32.35 3fyu s LYS 291 CO -0.00 -0.37 0.06 0.08 -0.76 0.00 0.00 175.35 174.35 3fyu s VAL 292 N 2.33 4.35 -0.39 3.17 1.01 -1.26 -1.23 120.40 128.37 3fyu s VAL 292 Ca 0.34 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.17 3fyu s VAL 292 Cb -0.16 -3.00 0.11 0.00 0.00 0.00 0.00 36.38 33.33 3fyu s VAL 292 CO 0.10 0.38 0.13 -0.31 0.00 0.00 0.00 175.10 175.39 3fyu s TYR 293 N 1.24 3.63 0.24 5.22 2.02 -0.14 -4.99 117.35 124.57 3fyu s TYR 293 Ca 0.04 -2.92 -0.06 0.00 -0.37 0.00 0.00 57.07 53.76 3fyu s TYR 293 Cb -0.15 -2.97 0.43 0.00 -0.40 0.00 0.00 41.96 38.87 3fyu s TYR 293 CO 0.03 -0.92 1.67 -0.09 -1.57 0.00 0.00 175.55 174.67 3fyu h ARG 294 N 7.49 0.19 -0.43 -0.62 9.65 -1.95 -1.50 114.38 127.21 3fyu h ARG 294 Ca -0.06 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 3fyu h ARG 294 Cb 1.00 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.54 3fyu h ARG 294 CO 0.58 0.12 0.00 0.66 2.80 0.00 0.00 179.97 184.14 3fyu n TYR 295 N -5.23 0.57 -4.49 2.20 4.01 -1.26 -4.02 117.16 108.94 3fyu n TYR 295 Ca 0.13 -0.27 -0.25 0.00 -0.16 0.00 0.00 57.90 57.36 3fyu n TYR 295 Cb 0.45 -0.03 -0.10 0.00 -0.31 0.00 0.00 39.34 39.35 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 2.33 0.00 -0.72 0.40 -1.03 -4.96 117.98 112.48 3fyu s PHE 296 Ca 0.26 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 56.21 3fyu s PHE 296 Cb 0.14 -1.12 0.00 0.00 0.51 0.00 0.00 43.02 42.55 3fyu s PHE 296 CO 0.17 0.67 0.00 0.41 0.70 0.00 0.00 175.22 177.17 3fyu n GLY 297 N -0.68 5.28 3.38 4.36 0.00 -1.26 -1.96 105.19 114.30 3fyu n GLY 297 Ca -0.05 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 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 4.41 -3.83 1.61 -0.00 -1.26 -4.38 115.22 111.77 3fyu n HIS 298 Ca 0.00 -2.89 -0.09 0.00 0.46 0.00 0.00 57.72 55.20 3fyu n HIS 298 Cb 0.00 -2.59 0.02 0.00 -0.12 0.00 0.00 29.99 27.29 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 3.83 2.20 0.09 1.57 -1.05 -1.26 -5.06 118.70 119.02 3fyu s GLU 299 Ca 0.52 -1.44 -0.31 0.00 -0.15 0.00 0.00 54.97 53.59 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 -1.02 1.38 0.12 0.95 0.00 0.00 175.26 176.72 3fyu s PHE 300 N -2.43 3.19 -0.38 4.83 5.36 -1.26 -4.99 117.98 122.31 3fyu s PHE 300 Ca 0.16 0.96 -0.01 0.00 -0.96 0.00 0.00 56.93 57.08 3fyu s PHE 300 Cb -0.05 -3.66 0.10 0.00 -0.34 0.00 0.00 43.02 39.07 3fyu s PHE 300 CO 0.12 -2.31 0.14 0.42 -1.46 0.00 0.00 175.22 172.12 3fyu s ILE 301 N 1.30 3.04 0.23 3.12 1.01 -1.26 -5.00 121.20 123.64 3fyu s ILE 301 Ca 0.64 -1.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.17 3fyu s ILE 301 Cb -0.35 -3.05 0.30 0.00 0.01 0.00 0.00 42.46 39.37 3fyu s ILE 301 CO 0.30 -0.57 1.59 -0.65 0.00 0.00 0.00 174.94 175.61 3fyu h PRO 302 N 7.95 -0.02 -0.93 2.79 0.11 -2.01 0.63 132.00 140.53 3fyu h PRO 302 Ca -0.13 0.00 0.15 0.00 0.11 0.00 0.00 66.00 66.13 3fyu h PRO 302 Cb 1.04 0.01 -0.09 0.00 0.11 0.00 0.00 31.00 32.07 3fyu h PRO 302 CO 0.63 -0.02 0.54 0.00 -0.21 0.00 0.00 178.00 178.95 3fyu h ALA 303 N 1.64 1.43 0.00 -0.75 0.00 -2.02 -0.88 119.26 118.69 3fyu h ALA 303 Ca 0.36 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 3fyu h ALA 303 Cb 0.58 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3fyu h ALA 303 CO -0.81 0.02 -0.17 0.35 0.00 0.00 0.00 179.25 178.64 3fyu h PHE 304 N 0.78 0.00 -0.61 0.00 3.57 -1.31 -2.89 116.94 116.48 3fyu h PHE 304 Ca 0.50 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.91 3fyu h PHE 304 Cb 0.65 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 3fyu h PHE 304 CO -0.04 0.17 0.03 0.37 -2.23 0.00 0.00 178.31 176.61 3fyu h GLN 305 N 0.00 1.04 -0.35 1.11 5.75 -0.73 0.23 115.11 122.17 3fyu h GLN 305 Ca -0.00 -0.31 -0.02 0.00 -0.15 0.00 0.00 58.65 58.17 3fyu h GLN 305 Cb 0.75 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.17 3fyu h GLN 305 CO 0.02 1.00 0.14 1.15 -2.65 0.00 0.00 178.83 178.49 3fyu h THR 306 N 0.96 1.19 -0.37 2.39 2.02 -1.43 0.33 112.91 118.01 3fyu h THR 306 Ca 0.18 -0.58 0.02 0.00 0.77 0.00 0.00 66.41 66.80 3fyu h THR 306 Cb 0.51 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 3fyu h THR 306 CO 0.02 0.20 0.19 -0.33 0.37 0.00 0.00 175.52 175.98 3fyu h GLU 307 N 0.41 0.38 -0.00 6.66 4.39 -1.29 0.00 114.58 125.14 3fyu h GLU 307 Ca 0.12 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 3fyu h GLU 307 Cb 0.19 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 3fyu h GLU 307 CO -0.01 0.25 0.00 -0.22 -1.16 0.00 0.00 179.01 177.88 3fyu h LYS 308 N 0.39 0.01 -0.63 2.33 3.64 -0.28 0.96 116.57 122.99 3fyu h LYS 308 Ca 0.15 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3fyu h LYS 308 Cb 0.05 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 3fyu h LYS 308 CO -0.10 0.07 0.22 -0.07 -2.27 0.00 0.00 179.45 177.31 3fyu h LEU 309 N -0.06 0.90 -0.06 5.20 3.38 -0.82 -0.13 115.31 123.73 3fyu h LEU 309 Ca 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 3fyu h LEU 309 Cb 0.07 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3fyu h LEU 309 CO -0.00 0.85 0.03 -1.28 0.09 0.00 0.00 178.44 178.13 3fyu h SER 310 N 0.90 0.07 -0.19 -0.43 0.87 -0.83 0.56 113.55 114.50 3fyu h SER 310 Ca 0.21 -0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 3fyu h SER 310 Cb 0.26 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 3fyu h SER 310 CO -0.01 0.15 0.10 0.15 -0.53 0.00 0.00 176.83 176.69 3fyu h PHE 311 N -0.01 0.19 -0.28 2.24 3.04 -0.60 0.40 116.94 121.92 3fyu h PHE 311 Ca 0.02 0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.90 3fyu h PHE 311 Cb 0.10 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 3fyu h PHE 311 CO -0.04 0.12 -0.16 -0.07 -2.02 0.00 0.00 178.31 176.13 3fyu h LEU 312 N 0.22 0.49 -0.25 0.59 3.38 -0.94 -1.65 115.31 117.16 3fyu h LEU 312 Ca 0.07 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 3fyu h LEU 312 Cb 0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3fyu h LEU 312 CO -0.04 0.68 0.01 -0.61 0.09 0.00 0.00 178.44 178.56 3fyu h GLN 313 N 0.46 0.43 -0.43 1.13 4.15 -0.43 0.27 115.11 120.68 3fyu h GLN 313 Ca 0.08 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3fyu h GLN 313 Cb 0.55 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 3fyu h GLN 313 CO 0.04 0.60 0.28 -0.22 -1.93 0.00 0.00 178.83 177.60 3fyu h LYS 314 N 0.21 0.57 0.00 1.69 3.64 -0.67 -2.56 116.57 119.45 3fyu h LYS 314 Ca 0.07 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 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 0.39 -0.92 0.72 -2.27 0.00 0.00 179.45 177.38 3fyu n HIS 315 N -4.78 0.79 0.00 1.91 8.25 -0.64 -4.74 115.22 116.01 3fyu n HIS 315 Ca 0.01 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.70 3fyu n HIS 315 Cb 0.03 -0.83 0.00 0.00 1.12 0.00 0.00 29.99 30.31 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 -2.46 0.26 0.00 2.41 4.77 0.95 -4.96 117.00 117.96 3fyu n LEU 316 Ca 0.01 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.03 3fyu n LEU 316 Cb 0.51 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.83 3fyu n LEU 316 CO 0.39 -0.02 0.46 -0.11 -1.33 0.00 0.00 177.39 176.79