#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wyo s MET 1 N 0.00 1.24 -0.18 -0.41 1.00 -1.26 -4.83 119.30 114.86 2wyo s MET 1 Ca 0.00 -0.84 -0.19 0.00 0.00 0.00 0.00 55.69 54.66 2wyo s MET 1 Cb 0.00 -1.30 -0.16 0.00 0.00 0.00 0.00 34.83 33.37 2wyo s MET 1 CO 0.00 0.33 0.22 0.28 0.00 0.00 0.00 175.02 175.86 2wyo h VAL 2 N 4.45 0.83 -1.02 -6.03 2.07 -1.95 -3.27 116.25 111.34 2wyo h VAL 2 Ca -0.40 -1.90 0.25 0.00 0.82 0.00 0.00 66.70 65.47 2wyo h VAL 2 Cb 1.17 1.85 -0.11 0.00 -1.52 0.00 0.00 31.29 32.68 2wyo h VAL 2 CO 0.44 0.28 0.63 0.25 0.02 0.00 0.00 177.57 179.20 2wyo h LEU 3 N -1.00 0.58 -0.23 2.57 5.85 -1.96 0.34 115.31 121.46 2wyo h LEU 3 Ca -0.19 0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.52 2wyo h LEU 3 Cb 1.00 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 2wyo h LEU 3 CO -0.12 0.12 -0.29 0.50 -0.34 0.00 0.00 178.44 178.31 2wyo h LYS 4 N 0.52 0.60 -0.52 1.25 3.64 -2.00 -2.52 116.57 117.53 2wyo h LYS 4 Ca 0.61 -0.34 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 2wyo h LYS 4 Cb 1.31 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.13 2wyo h LYS 4 CO -0.38 0.95 0.11 -0.07 -2.27 0.00 0.00 179.45 177.80 2wyo h LEU 5 N 0.30 0.75 -2.12 5.20 3.38 -0.95 -1.61 115.31 120.26 2wyo h LEU 5 Ca 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2wyo h LEU 5 Cb 0.87 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2wyo h LEU 5 CO 0.07 0.75 -0.06 -0.07 0.09 0.00 0.00 178.44 179.22 2wyo h LEU 6 N 0.77 0.00 0.09 1.67 4.07 -0.38 -2.52 115.31 119.02 2wyo h LEU 6 Ca 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.12 2wyo h LEU 6 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2wyo h LEU 6 CO 0.00 0.06 -0.04 -0.07 -1.08 0.00 0.00 178.44 177.30 2wyo h LEU 7 N 0.00 -0.10 -2.15 1.67 3.38 -0.86 -1.34 115.31 115.90 2wyo h LEU 7 Ca -0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2wyo h LEU 7 Cb 0.12 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2wyo h LEU 7 CO 0.01 0.42 -0.07 -0.33 0.09 0.00 0.00 178.44 178.56 2wyo h GLU 8 N -1.02 0.00 -0.25 1.13 5.08 -1.45 -0.80 114.58 117.27 2wyo h GLU 8 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2wyo h GLU 8 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2wyo h GLU 8 CO 0.02 0.07 0.00 1.28 -1.00 0.00 0.00 179.01 179.38 2wyo n LEU 9 N -3.79 2.56 -0.34 1.33 4.77 -0.95 -4.98 117.00 115.59 2wyo n LEU 9 Ca -0.02 -1.06 -0.04 0.00 -0.03 0.00 0.00 56.01 54.86 2wyo n LEU 9 Cb 0.17 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 2wyo n LEU 9 CO 0.29 0.53 -0.04 0.61 -1.33 0.00 0.00 177.39 177.45 2wyo n GLY 10 N 1.32 0.60 3.65 -0.72 0.00 -0.31 -4.90 105.19 104.83 2wyo n GLY 10 Ca 0.17 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 2wyo n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wyo n ALA 11 N 0.62 -0.47 -3.56 4.61 0.00 -0.51 -5.00 120.51 116.20 2wyo n ALA 11 Ca -0.04 -0.39 -0.11 0.00 0.00 0.00 0.00 53.44 52.89 2wyo n ALA 11 Cb 0.21 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.39 2wyo n ALA 11 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2wyo s GLU 12 N -4.09 0.51 -1.52 0.00 2.12 -1.26 -4.86 118.70 109.59 2wyo s GLU 12 Ca 0.70 0.80 -0.04 0.00 0.36 0.00 0.00 54.97 56.79 2wyo s GLU 12 Cb -0.28 0.12 0.03 0.00 0.26 0.00 0.00 34.13 34.27 2wyo s GLU 12 CO 0.54 -0.12 0.34 0.54 -0.54 0.00 0.00 175.26 176.02 2wyo n ARG 13 N 3.66 -2.39 0.07 4.30 1.74 -1.26 -4.87 116.66 117.92 2wyo n ARG 13 Ca -0.19 0.29 -0.20 0.00 -0.77 0.00 0.00 57.85 56.98 2wyo n ARG 13 Cb 0.56 -4.31 -0.15 0.00 -1.02 0.00 0.00 32.46 27.54 2wyo n ARG 13 CO 0.00 0.00 0.00 0.10 -1.52 0.00 0.00 177.63 176.21 2wyo h TYR 14 N -1.72 0.61 -0.39 -1.55 -0.00 -1.98 -2.71 116.97 109.22 2wyo h TYR 14 Ca -0.63 -0.45 0.07 0.00 0.00 0.00 0.00 58.73 57.72 2wyo h TYR 14 Cb 1.39 -0.02 -0.09 0.00 0.00 0.00 0.00 36.73 38.00 2wyo h TYR 14 CO 0.53 1.52 -0.38 0.00 -0.00 0.00 0.00 178.16 179.84 2wyo h ALA 15 N 0.31 -0.31 -0.95 0.10 0.00 -1.98 0.11 119.26 116.53 2wyo h ALA 15 Ca -0.29 0.08 0.13 0.00 0.00 0.00 0.00 54.91 54.84 2wyo h ALA 15 Cb 2.07 0.80 -0.08 0.00 0.00 0.00 0.00 17.79 20.57 2wyo h ALA 15 CO 0.18 -0.80 0.61 0.93 0.00 0.00 0.00 179.25 180.17 2wyo h GLU 16 N -0.30 0.83 0.00 0.00 3.07 -1.95 -1.89 114.58 114.35 2wyo h GLU 16 Ca 0.15 -0.05 -0.26 0.00 -0.50 0.00 0.00 59.36 58.70 2wyo h GLU 16 Cb 0.57 -0.19 0.02 0.00 -0.84 0.00 0.00 28.75 28.31 2wyo h GLU 16 CO -0.55 0.55 -1.04 0.37 -1.40 0.00 0.00 179.01 176.94 2wyo h GLN 17 N 0.85 0.66 -0.02 2.33 4.15 -0.99 -2.96 115.11 119.13 2wyo h GLN 17 Ca 0.48 -0.72 -0.13 0.00 0.77 0.00 0.00 58.65 59.06 2wyo h GLN 17 Cb 0.61 0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.49 2wyo h GLN 17 CO -0.25 1.30 -0.57 0.74 -1.93 0.00 0.00 178.83 178.12 2wyo h PHE 18 N 0.37 0.09 -0.36 3.99 0.04 -0.63 -2.51 116.94 117.92 2wyo h PHE 18 Ca -0.12 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.57 2wyo h PHE 18 Cb 1.69 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 39.80 2wyo h PHE 18 CO 0.10 0.63 0.06 0.00 -0.60 0.00 0.00 178.31 178.49 2wyo h ALA 19 N 1.37 1.42 -0.18 2.45 0.00 -1.33 -1.79 119.26 121.20 2wyo h ALA 19 Ca -0.00 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.56 2wyo h ALA 19 Cb 1.03 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.67 2wyo h ALA 19 CO 0.08 0.41 -0.56 0.00 0.00 0.00 0.00 179.25 179.18 2wyo h ALA 20 N 1.54 0.31 -0.45 0.00 0.00 -1.30 -2.22 119.26 117.15 2wyo h ALA 20 Ca 0.12 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2wyo h ALA 20 Cb 0.26 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2wyo h ALA 20 CO 0.00 0.53 0.08 -0.22 0.00 0.00 0.00 179.25 179.65 2wyo h LYS 21 N 0.40 0.69 -0.49 0.00 1.63 -1.31 -0.80 116.57 116.68 2wyo h LYS 21 Ca -0.02 -0.14 0.02 0.00 -0.85 0.00 0.00 60.65 59.66 2wyo h LYS 21 Cb 1.18 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.68 2wyo h LYS 21 CO 0.12 0.65 0.31 0.00 -3.45 0.00 0.00 179.45 177.07 2wyo h HIS 23 N 0.62 0.67 -0.99 0.00 3.86 -1.13 0.70 115.15 118.88 2wyo h HIS 23 Ca 0.19 -0.20 0.05 0.00 -1.16 0.00 0.00 60.37 59.25 2wyo h HIS 23 Cb -0.02 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.25 2wyo h HIS 23 CO -0.06 0.89 0.64 1.49 0.86 0.00 0.00 177.93 181.75 2wyo h GLU 24 N 0.46 1.16 0.00 2.45 4.81 -0.75 -2.63 114.58 120.07 2wyo h GLU 24 Ca 0.04 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2wyo h GLU 24 Cb 0.92 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2wyo h GLU 24 CO 0.08 0.77 -0.88 1.28 -0.73 0.00 0.00 179.01 179.53 2wyo n LEU 25 N -4.49 0.63 -0.09 1.64 4.77 -0.83 -4.95 117.00 113.69 2wyo n LEU 25 Ca 0.14 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2wyo n LEU 25 Cb 0.14 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2wyo n LEU 25 CO 0.33 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2wyo n GLY 26 N 1.37 0.57 2.86 -0.72 0.00 -0.56 -4.97 105.19 103.73 2wyo n GLY 26 Ca 0.03 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 2wyo n GLY 26 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2wyo n MET 27 N -0.90 3.17 -4.29 1.61 2.81 0.13 -4.94 117.12 114.71 2wyo n MET 27 Ca 0.00 -3.02 -0.16 0.00 -1.81 0.00 0.00 57.70 52.72 2wyo n MET 27 Cb 0.47 -3.16 -0.10 0.00 -0.71 0.00 0.00 33.22 29.71 2wyo n MET 27 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2wyo s VAL 28 N 2.20 0.92 0.11 2.03 -7.23 -1.26 -1.97 120.40 115.21 2wyo s VAL 28 Ca 0.45 -2.02 0.04 0.00 -1.81 0.00 0.00 61.98 58.63 2wyo s VAL 28 Cb 0.11 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 2wyo s VAL 28 CO -0.04 -0.42 -0.09 0.00 -0.31 0.00 0.00 175.10 174.23 2wyo s MET 29 N -3.87 0.90 0.33 4.82 0.23 0.30 -4.50 119.30 117.52 2wyo s MET 29 Ca 0.26 -1.27 -0.28 0.00 -1.03 0.00 0.00 55.69 53.36 2wyo s MET 29 Cb 0.05 -0.49 -0.10 0.00 -1.53 0.00 0.00 34.83 32.76 2wyo s MET 29 CO 0.06 0.06 1.21 0.21 -2.03 0.00 0.00 175.02 174.54 2wyo s LYS 30 N -3.26 4.38 0.00 3.16 2.20 -0.68 -0.47 119.74 125.08 2wyo s LYS 30 Ca 0.10 2.01 0.00 0.00 -0.36 0.00 0.00 55.97 57.72 2wyo s LYS 30 Cb 0.00 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.29 2wyo s LYS 30 CO -0.01 -0.09 0.00 -0.85 -0.36 0.00 0.00 175.35 174.04 2wyo n GLU 31 N 0.78 1.50 -0.13 4.03 0.28 -0.34 -4.80 120.64 121.96 2wyo n GLU 31 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.72 2wyo n GLU 31 Cb 0.44 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.20 2wyo n GLU 31 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2wyo n SER 32 N 0.00 1.95 -4.55 -1.84 7.64 -1.26 -4.74 113.62 110.82 2wyo n SER 32 Ca 0.00 0.33 -0.41 0.00 1.01 0.00 0.00 58.87 59.80 2wyo n SER 32 Cb 0.00 -0.82 -0.03 0.00 -1.01 0.00 0.00 64.21 62.35 2wyo n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wyo s ALA 33 N -2.49 2.76 0.00 -0.43 0.00 -1.26 -4.95 121.76 115.39 2wyo s ALA 33 Ca -0.38 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 50.18 2wyo s ALA 33 Cb 0.14 -4.25 0.00 0.00 0.00 0.00 0.00 23.12 19.01 2wyo s ALA 33 CO 0.51 -3.28 0.00 0.41 0.00 0.00 0.00 175.76 173.40 2wyo n GLY 34 N 5.40 3.39 0.09 0.00 0.00 -1.26 -4.27 105.19 108.54 2wyo n GLY 34 Ca 0.03 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2wyo n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wyo h PRO 35 N 0.00 0.00 -7.01 1.61 0.13 -1.94 -3.40 132.00 121.39 2wyo h PRO 35 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 2wyo h PRO 35 Cb 0.00 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.22 2wyo h PRO 35 CO 0.00 0.00 0.55 0.20 -0.23 0.00 0.00 178.00 178.52 2wyo s GLY 36 N -3.82 2.84 0.01 1.56 0.00 -1.26 -4.87 107.32 101.78 2wyo s GLY 36 Ca 0.05 1.13 0.01 0.00 0.00 0.00 0.00 44.72 45.91 2wyo s GLY 36 CO 0.72 1.63 0.02 0.50 0.00 0.00 0.00 173.10 175.96 2wyo s ARG 37 N -2.68 2.82 0.22 2.90 3.00 -1.26 -1.20 118.95 122.75 2wyo s ARG 37 Ca 0.65 -0.61 0.02 0.00 0.00 0.00 0.00 55.73 55.79 2wyo s ARG 37 Cb -0.34 -2.69 -0.05 0.00 0.00 0.00 0.00 34.95 31.86 2wyo s ARG 37 CO 0.42 0.62 0.03 0.14 0.00 0.00 0.00 175.30 176.51 2wyo s VAL 38 N -1.14 0.72 0.32 3.52 -7.23 0.38 -4.87 120.40 112.10 2wyo s VAL 38 Ca 0.21 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.10 2wyo s VAL 38 Cb -0.12 -2.35 -0.10 0.00 0.56 0.00 0.00 36.38 34.38 2wyo s VAL 38 CO 0.12 -0.28 1.19 -2.84 -0.31 0.00 0.00 175.10 172.98 2wyo s PRO 39 N -3.94 4.46 0.75 4.82 0.02 -1.26 -0.54 135.00 139.30 2wyo s PRO 39 Ca 0.30 1.97 -0.14 0.00 0.02 0.00 0.00 61.00 63.14 2wyo s PRO 39 Cb 0.07 -3.08 0.05 0.00 0.02 0.00 0.00 34.50 31.56 2wyo s PRO 39 CO 0.08 -0.01 1.20 0.14 -0.33 0.00 0.00 177.00 178.08 2wyo s VAL 40 N -1.19 2.33 0.01 3.83 -7.23 -0.83 -4.71 120.40 112.61 2wyo s VAL 40 Ca 0.48 0.16 -0.30 0.00 -1.81 0.00 0.00 61.98 60.50 2wyo s VAL 40 Cb -0.35 -2.68 -0.05 0.00 0.56 0.00 0.00 36.38 33.87 2wyo s VAL 40 CO 0.45 -0.09 1.25 -2.16 -0.31 0.00 0.00 175.10 174.24 2wyo s PRO 41 N -4.01 4.37 0.04 4.82 0.04 -1.26 -4.86 135.00 134.13 2wyo s PRO 41 Ca 0.73 1.79 0.03 0.00 0.04 0.00 0.00 61.00 63.59 2wyo s PRO 41 Cb -0.28 -3.47 -0.02 0.00 0.04 0.00 0.00 34.50 30.77 2wyo s PRO 41 CO 0.47 -0.40 -0.09 0.54 0.04 0.00 0.00 177.00 177.56 2wyo s VAL 42 N 1.76 0.65 0.37 -0.36 0.11 -1.03 -0.55 120.40 121.35 2wyo s VAL 42 Ca 0.59 -0.92 -0.27 0.00 -2.93 0.00 0.00 61.98 58.45 2wyo s VAL 42 Cb -0.28 -0.66 -0.09 0.00 -1.53 0.00 0.00 36.38 33.81 2wyo s VAL 42 CO 0.26 -0.22 1.27 0.42 -3.33 0.00 0.00 175.10 173.50 2wyo s THR 43 N -1.05 2.81 -2.00 5.04 -4.23 0.50 -1.06 115.64 115.64 2wyo s THR 43 Ca -0.05 0.75 0.09 0.00 -1.18 0.00 0.00 61.69 61.30 2wyo s THR 43 Cb -0.08 -3.45 0.27 0.00 1.34 0.00 0.00 72.50 70.57 2wyo s THR 43 CO 0.01 0.13 1.31 0.18 -0.54 0.00 0.00 174.62 175.71 2wyo n LEU 44 N 0.42 0.00 -3.48 4.79 4.77 -0.29 -4.84 117.00 118.37 2wyo n LEU 44 Ca 0.02 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.85 2wyo n LEU 44 Cb 0.44 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 2wyo n LEU 44 CO 0.56 0.00 0.45 0.00 -1.33 0.00 0.00 177.39 177.06 2wyo s GLN 45 N -2.00 1.12 0.57 3.23 0.00 -1.26 -4.96 119.66 116.37 2wyo s GLN 45 Ca 0.14 -0.05 -0.16 0.00 -0.00 0.00 0.00 55.36 55.29 2wyo s GLN 45 Cb 0.06 0.52 -0.05 0.00 0.00 0.00 0.00 33.01 33.55 2wyo s GLN 45 CO 0.11 -0.42 1.04 -2.14 0.00 0.00 0.00 175.29 173.89 2wyo s PRO 46 N -2.27 3.45 0.26 9.60 0.02 -1.26 -4.74 135.00 140.06 2wyo s PRO 46 Ca -0.05 1.17 -0.23 0.00 0.02 0.00 0.00 61.00 61.91 2wyo s PRO 46 Cb -0.00 -2.05 -0.09 0.00 0.02 0.00 0.00 34.50 32.37 2wyo s PRO 46 CO -0.00 -0.70 0.83 0.45 -0.33 0.00 0.00 177.00 177.25 2wyo s SER 47 N -2.79 7.24 0.11 2.53 0.15 -0.30 -4.83 113.70 115.81 2wyo s SER 47 Ca 0.63 1.64 -0.06 0.00 0.70 0.00 0.00 55.95 58.85 2wyo s SER 47 Cb -0.15 -2.50 -0.06 0.00 -1.71 0.00 0.00 66.02 61.60 2wyo s SER 47 CO 0.35 0.02 0.37 -0.04 1.20 0.00 0.00 173.24 175.14 2wyo s MET 48 N -1.87 3.65 0.05 5.44 1.00 -1.26 -1.08 119.30 125.24 2wyo s MET 48 Ca 0.45 -0.01 -0.14 0.00 0.00 0.00 0.00 55.69 55.99 2wyo s MET 48 Cb -0.19 -2.92 0.02 0.00 0.00 0.00 0.00 34.83 31.75 2wyo s MET 48 CO 0.23 0.52 0.31 -1.50 0.00 0.00 0.00 175.02 174.58 2wyo s ILE 49 N -1.54 0.08 0.40 2.53 2.07 -0.98 -4.91 121.20 118.86 2wyo s ILE 49 Ca 0.37 -0.69 -0.21 0.00 -1.41 0.00 0.00 60.65 58.72 2wyo s ILE 49 Cb -0.13 -0.97 -0.11 0.00 0.13 0.00 0.00 42.46 41.39 2wyo s ILE 49 CO 0.22 -0.38 0.92 -0.94 -1.91 0.00 0.00 174.94 172.85 2wyo s SER 50 N -2.13 6.97 0.21 4.50 1.04 -1.26 -0.17 113.70 122.87 2wyo s SER 50 Ca -0.04 1.66 -0.09 0.00 0.48 0.00 0.00 55.95 57.96 2wyo s SER 50 Cb -0.00 -2.52 0.24 0.00 0.10 0.00 0.00 66.02 63.83 2wyo s SER 50 CO -0.04 -0.31 1.82 -0.09 0.98 0.00 0.00 173.24 175.61 2wyo h ARG 51 N 2.10 0.75 0.06 4.02 2.43 -1.88 -0.63 114.38 121.24 2wyo h ARG 51 Ca -0.49 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 2wyo h ARG 51 Cb 1.18 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 2wyo h ARG 51 CO 0.62 0.50 -0.13 0.78 -1.51 0.00 0.00 179.97 180.23 2wyo h GLY 52 N 0.77 -1.08 0.15 2.80 0.00 -1.93 0.10 103.07 103.89 2wyo h GLY 52 Ca 0.31 0.49 0.12 0.00 0.00 0.00 0.00 47.33 48.24 2wyo h GLY 52 CO -0.16 -0.37 0.14 0.83 0.00 0.00 0.00 176.54 176.97 2wyo h GLU 53 N -0.21 0.26 -0.09 4.80 5.08 -1.92 0.83 114.58 123.32 2wyo h GLU 53 Ca -0.01 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 2wyo h GLU 53 Cb 0.19 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 2wyo h GLU 53 CO -0.05 0.17 -0.18 0.35 -1.00 0.00 0.00 179.01 178.30 2wyo h PHE 54 N 0.26 -0.47 -0.65 4.33 3.57 -1.11 -2.23 116.94 120.64 2wyo h PHE 54 Ca 0.33 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.91 2wyo h PHE 54 Cb 0.49 0.22 -0.09 0.00 2.79 0.00 0.00 35.95 39.36 2wyo h PHE 54 CO -0.25 -0.26 -0.52 0.78 -2.23 0.00 0.00 178.31 175.83 2wyo h GLY 55 N -0.24 -1.05 0.91 2.40 0.00 0.16 -0.87 103.07 104.37 2wyo h GLY 55 Ca 0.09 0.78 0.02 0.00 0.00 0.00 0.00 47.33 48.22 2wyo h GLY 55 CO -0.24 -0.11 0.43 -0.91 0.00 0.00 0.00 176.54 175.71 2wyo h THR 56 N -0.18 1.11 -0.28 4.70 1.35 -1.13 -0.11 112.91 118.37 2wyo h THR 56 Ca 0.11 -0.29 0.06 0.00 -0.55 0.00 0.00 66.41 65.74 2wyo h THR 56 Cb 0.46 0.19 -0.06 0.00 -1.73 0.00 0.00 68.15 67.00 2wyo h THR 56 CO -0.70 0.15 -0.14 -0.07 -0.25 0.00 0.00 175.52 174.51 2wyo h LEU 57 N 0.85 -0.46 0.03 3.87 3.38 -0.69 0.13 115.31 122.43 2wyo h LEU 57 Ca 0.26 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.34 2wyo h LEU 57 Cb -0.02 0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2wyo h LEU 57 CO -0.09 -0.17 -0.02 0.00 0.09 0.00 0.00 178.44 178.25 2wyo h MET 60 N 0.00 0.00 0.00 0.00 2.07 -0.64 -3.38 114.93 112.98 2wyo h MET 60 Ca 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 59.70 57.61 2wyo h MET 60 Cb 0.39 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.11 2wyo h MET 60 CO 0.00 0.00 -0.09 0.37 1.07 0.00 0.00 176.91 178.26 2wyo h GLN 61 N 0.00 0.00 0.00 1.72 5.75 -1.45 0.27 115.11 121.40 2wyo h GLN 61 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2wyo h GLN 61 Cb 0.77 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.32 2wyo h GLN 61 CO 0.00 0.09 0.00 -1.35 -2.65 0.00 0.00 178.83 174.92 2wyo h PRO 62 N 0.00 0.00 0.00 -2.39 0.11 -1.79 -0.27 132.00 127.67 2wyo h PRO 62 Ca -0.00 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.91 2wyo h PRO 62 Cb 0.16 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.24 2wyo h PRO 62 CO 0.01 0.00 -1.05 -0.07 -0.21 0.00 0.00 178.00 176.69 2wyo h LEU 63 N 0.00 0.00 -0.44 2.35 3.38 -0.76 -2.54 115.31 117.29 2wyo h LEU 63 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2wyo h LEU 63 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2wyo h LEU 63 CO 0.00 0.87 -0.61 -0.50 0.09 0.00 0.00 178.44 178.29 2wyo h TRP 64 N 0.00 0.73 -0.52 1.13 4.06 -1.05 -0.64 115.95 119.66 2wyo h TRP 64 Ca -0.07 -0.28 -0.05 0.00 2.06 0.00 0.00 58.89 60.55 2wyo h TRP 64 Cb 1.72 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 29.73 2wyo h TRP 64 CO 0.00 1.03 0.11 -0.91 -3.56 0.00 0.00 178.44 175.12 2wyo h ASN 65 N 0.42 0.80 -0.05 -3.49 2.35 -1.11 -2.12 115.58 112.38 2wyo h ASN 65 Ca -0.01 -0.24 -0.20 0.00 -0.55 0.00 0.00 56.30 55.30 2wyo h ASN 65 Cb 1.17 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2wyo h ASN 65 CO 0.11 0.83 -0.70 -0.08 -1.65 0.00 0.00 177.43 175.95 2wyo h GLU 66 N 0.73 0.69 -0.26 0.81 4.81 -1.46 -1.00 114.58 118.89 2wyo h GLU 66 Ca 0.16 -0.52 0.06 0.00 -0.13 0.00 0.00 59.36 58.93 2wyo h GLU 66 Cb 0.36 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 2wyo h GLU 66 CO 0.00 1.14 -0.11 0.00 -0.73 0.00 0.00 179.01 179.32 2wyo h ALA 67 N 0.72 0.12 -0.35 2.92 0.00 -1.06 -2.23 119.26 119.38 2wyo h ALA 67 Ca -0.03 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2wyo h ALA 67 Cb 1.31 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2wyo h ALA 67 CO 0.14 -0.51 0.04 0.28 0.00 0.00 0.00 179.25 179.20 2wyo h VAL 68 N -0.06 1.24 -0.99 0.00 2.07 -1.24 -2.73 116.25 114.54 2wyo h VAL 68 Ca 0.14 -0.87 0.13 0.00 0.82 0.00 0.00 66.70 66.91 2wyo h VAL 68 Cb 0.27 1.14 -0.09 0.00 -1.52 0.00 0.00 31.29 31.09 2wyo h VAL 68 CO -0.31 0.29 0.63 -0.78 0.02 0.00 0.00 177.57 177.42 2wyo h ASP 69 N 0.42 0.89 0.24 0.57 3.58 -0.79 0.22 116.42 121.55 2wyo h ASP 69 Ca 0.10 0.05 -0.34 0.00 0.42 0.00 0.00 57.03 57.26 2wyo h ASP 69 Cb 0.38 -0.12 0.01 0.00 1.72 0.00 0.00 39.33 41.31 2wyo h ASP 69 CO 0.01 0.46 -1.72 0.78 -2.88 0.00 0.00 179.24 175.89 2wyo h ASN 70 N 0.95 0.57 -0.75 2.28 2.35 -1.38 -2.03 115.58 117.57 2wyo h ASN 70 Ca 0.50 -0.85 -0.04 0.00 -0.55 0.00 0.00 56.30 55.36 2wyo h ASN 70 Cb 0.55 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 2wyo h ASN 70 CO -0.27 1.72 0.30 0.74 -1.65 0.00 0.00 177.43 178.27 2wyo h THR 71 N 0.10 1.25 0.62 2.81 2.02 -1.23 -2.62 112.91 115.87 2wyo h THR 71 Ca -0.33 -0.80 -0.03 0.00 0.77 0.00 0.00 66.41 66.03 2wyo h THR 71 Cb 2.09 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.87 2wyo h THR 71 CO 0.17 0.32 -0.36 0.00 0.37 0.00 0.00 175.52 176.03 2wyo h ALA 72 N 1.15 -0.93 0.00 6.16 0.00 -0.66 -3.31 119.26 121.67 2wyo h ALA 72 Ca 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wyo h ALA 72 Cb 0.22 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2wyo h ALA 72 CO -0.02 -1.04 0.00 0.54 0.00 0.00 0.00 179.25 178.73 2wyo n ARG 73 N -5.50 0.11 -3.37 0.00 1.74 -0.76 -3.74 116.66 105.14 2wyo n ARG 73 Ca -0.13 0.20 -0.44 0.00 -0.77 0.00 0.00 57.85 56.71 2wyo n ARG 73 Cb 0.39 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.32 2wyo n ARG 73 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2wyo s ASN 74 N -2.77 7.10 0.10 0.55 3.04 -1.01 -4.93 114.94 117.02 2wyo s ASN 74 Ca 0.10 -3.47 -0.21 0.00 0.04 0.00 0.00 52.86 49.32 2wyo s ASN 74 Cb 0.09 -2.18 -0.11 0.00 -1.54 0.00 0.00 41.25 37.51 2wyo s ASN 74 CO 0.23 -0.32 1.71 -0.26 -3.04 0.00 0.00 177.10 175.42 2wyo h PHE 75 N 6.78 0.16 -0.78 0.43 0.04 -1.84 -1.74 116.94 119.99 2wyo h PHE 75 Ca 0.16 -0.00 0.10 0.00 2.80 0.00 0.00 57.97 61.03 2wyo h PHE 75 Cb 0.89 -0.05 -0.11 0.00 2.20 0.00 0.00 35.95 38.88 2wyo h PHE 75 CO 0.80 0.16 -0.38 2.41 -0.60 0.00 0.00 178.31 180.70 2wyo n THR 76 N -4.97 -0.47 -0.24 -1.55 -1.04 -1.26 0.15 114.28 104.90 2wyo n THR 76 Ca -0.05 1.86 0.03 0.00 -2.04 0.00 0.00 64.05 63.86 2wyo n THR 76 Cb 0.06 -2.39 0.16 0.00 -1.82 0.00 0.00 70.33 66.34 2wyo n THR 76 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2wyo h PHE 77 N 0.00 0.47 0.80 -1.42 3.57 -1.68 -1.35 116.94 117.33 2wyo h PHE 77 Ca 0.21 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.70 2wyo h PHE 77 Cb 0.40 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 39.05 2wyo h PHE 77 CO -0.74 0.08 -0.38 -0.07 -2.23 0.00 0.00 178.31 174.96 2wyo h LEU 78 N 0.43 -0.91 -1.45 0.59 3.38 -0.21 0.27 115.31 117.41 2wyo h LEU 78 Ca 0.37 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.45 2wyo h LEU 78 Cb 0.53 0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 2wyo h LEU 78 CO -0.37 -0.65 0.45 -0.09 0.09 0.00 0.00 178.44 177.88 2wyo h ARG 79 N -1.07 0.64 0.45 1.13 2.43 -0.95 0.26 114.38 117.25 2wyo h ARG 79 Ca -0.11 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 2wyo h ARG 79 Cb 0.82 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2wyo h ARG 79 CO 0.18 0.42 -0.21 -0.44 -1.51 0.00 0.00 179.97 178.41 2wyo h ASP 80 N 0.66 -0.51 -0.84 -3.80 3.32 -1.22 -2.60 116.42 111.42 2wyo h ASP 80 Ca 0.30 -0.04 0.18 0.00 0.02 0.00 0.00 57.03 57.49 2wyo h ASP 80 Cb 0.34 0.13 -0.11 0.00 0.22 0.00 0.00 39.33 39.91 2wyo h ASP 80 CO -0.10 -0.27 0.35 0.00 -1.72 0.00 0.00 179.24 177.50 2wyo h ALA 81 N -0.22 1.27 -0.65 3.45 0.00 0.28 -1.82 119.26 121.58 2wyo h ALA 81 Ca -0.06 0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2wyo h ALA 81 Cb 0.52 0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.31 2wyo h ALA 81 CO 0.10 -0.27 0.22 1.28 0.00 0.00 0.00 179.25 180.58 2wyo n LEU 82 N -5.02 5.62 0.46 0.00 4.77 -0.08 -4.62 117.00 118.13 2wyo n LEU 82 Ca 0.19 -3.29 -0.20 0.00 -0.03 0.00 0.00 56.01 52.67 2wyo n LEU 82 Cb 0.54 -0.71 -0.10 0.00 -2.33 0.00 0.00 43.42 40.82 2wyo n LEU 82 CO 0.15 0.86 0.55 1.56 -1.33 0.00 0.00 177.39 179.18 2wyo h GLN 83 N 2.25 -1.18 0.00 3.23 4.20 -0.91 -0.71 115.11 121.98 2wyo h GLN 83 Ca 0.25 0.08 -0.05 0.00 0.06 0.00 0.00 58.65 59.00 2wyo h GLN 83 Cb 2.18 0.27 -0.01 0.00 0.30 0.00 0.00 27.48 30.22 2wyo h GLN 83 CO 0.66 -0.79 -0.22 1.49 -0.67 0.00 0.00 178.83 179.30 2wyo h GLU 84 N -1.23 0.00 -0.29 1.46 4.81 -1.82 0.27 114.58 117.78 2wyo h GLU 84 Ca -0.11 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 2wyo h GLU 84 Cb 0.97 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 2wyo h GLU 84 CO 0.14 0.22 0.09 1.15 -0.73 0.00 0.00 179.01 179.88 2wyo h THR 85 N 0.00 1.20 0.00 0.32 2.02 -1.85 -2.98 112.91 111.62 2wyo h THR 85 Ca -0.00 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2wyo h THR 85 Cb 0.76 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 2wyo h THR 85 CO 0.03 0.21 0.00 0.00 0.37 0.00 0.00 175.52 176.13 2wyo h ALA 86 N 0.93 1.00 -0.09 6.16 0.00 0.02 -1.16 119.26 126.11 2wyo h ALA 86 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2wyo h ALA 86 Cb 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2wyo h ALA 86 CO -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 179.25 179.06 2wyo h ALA 87 N 2.10 1.53 -1.61 0.00 0.00 -0.40 -3.38 119.26 117.50 2wyo h ALA 87 Ca 0.00 -0.22 -0.45 0.00 0.00 0.00 0.00 54.91 54.24 2wyo h ALA 87 Cb 0.53 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 18.32 2wyo h ALA 87 CO 0.00 0.34 0.05 -1.12 0.00 0.00 0.00 179.25 178.52 2wyo s SER 88 N -6.92 4.77 -1.41 0.00 0.01 -0.44 -4.60 113.70 105.11 2wyo s SER 88 Ca -0.05 -0.16 -0.13 0.00 1.31 0.00 0.00 55.95 56.92 2wyo s SER 88 Cb 0.15 -0.45 0.11 0.00 0.21 0.00 0.00 66.02 66.04 2wyo s SER 88 CO 0.72 -1.54 0.60 0.47 0.41 0.00 0.00 173.24 173.91 2wyo n ASP 89 N -2.63 -3.49 -0.63 2.44 9.92 -1.26 -4.31 116.55 116.59 2wyo n ASP 89 Ca 0.12 -0.61 0.48 0.00 -0.53 0.00 0.00 54.79 54.24 2wyo n ASP 89 Cb 0.60 -2.88 0.74 0.00 -0.64 0.00 0.00 41.12 38.94 2wyo n ASP 89 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 2wyo n VAL 90 N -4.07 -0.02 1.02 2.53 3.14 -1.26 0.80 118.33 120.47 2wyo n VAL 90 Ca 0.03 1.39 0.11 0.00 -2.96 0.00 0.00 64.34 62.91 2wyo n VAL 90 Cb 0.52 -2.31 0.04 0.00 -1.06 0.00 0.00 33.84 31.02 2wyo n VAL 90 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2wyo n ASN 91 N -3.83 2.00 0.00 6.55 3.02 -1.26 -3.13 115.26 118.61 2wyo n ASN 91 Ca 0.41 -1.49 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 2wyo n ASN 91 Cb 1.82 0.42 0.00 0.00 -0.61 0.00 0.00 39.78 41.41 2wyo n ASN 91 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 2wyo n PHE 92 N 0.00 0.00 0.06 3.10 7.35 0.24 -4.40 117.46 123.81 2wyo n PHE 92 Ca 0.10 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.78 2wyo n PHE 92 Cb 0.47 0.07 0.28 0.00 0.35 0.00 0.00 39.48 40.64 2wyo n PHE 92 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2wyo h THR 93 N 0.00 1.24 0.00 -2.13 2.02 -1.83 -0.53 112.91 111.68 2wyo h THR 93 Ca 0.00 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.09 2wyo h THR 93 Cb 0.00 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2wyo h THR 93 CO 0.00 0.34 0.00 1.23 0.37 0.00 0.00 175.52 177.46 2wyo h GLY 94 N 0.95 0.00 0.86 2.16 0.00 -1.52 0.23 103.07 105.75 2wyo h GLY 94 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.08 2wyo h GLY 94 CO 0.04 0.00 -1.80 0.28 0.00 0.00 0.00 176.54 175.06 2wyo n LYS 95 N -3.04 0.65 -0.06 4.80 5.02 -1.11 -3.27 118.16 121.15 2wyo n LYS 95 Ca 0.02 0.27 -0.13 0.00 -2.02 0.00 0.00 58.31 56.45 2wyo n LYS 95 Cb 0.39 -1.76 -0.07 0.00 -0.02 0.00 0.00 35.03 33.57 2wyo n LYS 95 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2wyo h LEU 96 N 0.01 0.41 -1.93 -0.35 3.38 -0.94 -2.57 115.31 113.32 2wyo h LEU 96 Ca -0.32 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.16 2wyo h LEU 96 Cb 2.03 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.66 2wyo h LEU 96 CO 0.08 0.79 -0.12 0.25 0.09 0.00 0.00 178.44 179.53 2wyo h LEU 97 N 0.04 0.00 0.14 1.67 5.85 -0.72 -2.27 115.31 120.02 2wyo h LEU 97 Ca 0.03 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2wyo h LEU 97 Cb 0.66 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 2wyo h LEU 97 CO 0.04 0.12 -0.09 0.78 -0.34 0.00 0.00 178.44 178.94 2wyo h ASN 98 N 0.00 -0.23 -0.46 1.25 2.35 -1.46 -1.97 115.58 115.06 2wyo h ASN 98 Ca -0.00 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.80 2wyo h ASN 98 Cb 0.29 0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.69 2wyo h ASN 98 CO 0.02 -0.15 0.23 0.24 -1.65 0.00 0.00 177.43 176.11 2wyo h MET 99 N -0.23 0.44 -0.45 0.81 2.86 -1.04 0.69 114.93 118.02 2wyo h MET 99 Ca -0.01 -0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.68 2wyo h MET 99 Cb 0.20 -0.10 -0.10 0.00 0.06 0.00 0.00 31.60 31.66 2wyo h MET 99 CO 0.01 0.29 -0.38 1.25 1.06 0.00 0.00 176.91 179.13 2wyo h LEU 100 N 0.45 -1.29 -0.01 1.22 5.85 -1.38 -0.10 115.31 120.06 2wyo h LEU 100 Ca 0.20 0.21 0.02 0.00 0.84 0.00 0.00 57.88 59.16 2wyo h LEU 100 Cb 0.11 0.59 -0.06 0.00 0.37 0.00 0.00 40.66 41.67 2wyo h LEU 100 CO -0.14 -0.34 -0.51 1.56 -0.34 0.00 0.00 178.44 178.67 2wyo h GLN 101 N -0.27 -0.62 0.00 1.25 4.20 -0.43 -2.42 115.11 116.82 2wyo h GLN 101 Ca 0.17 0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.82 2wyo h GLN 101 Cb 0.56 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2wyo h GLN 101 CO -0.59 -0.41 -0.48 0.93 -0.67 0.00 0.00 178.83 177.60 2wyo h GLU 102 N -0.64 0.00 0.03 1.46 5.08 0.27 0.18 114.58 120.96 2wyo h GLU 102 Ca 0.02 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.12 2wyo h GLU 102 Cb 0.71 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 2wyo h GLU 102 CO -0.36 0.48 -1.41 0.28 -1.00 0.00 0.00 179.01 177.00 2wyo h VAL 103 N 0.00 0.87 0.01 3.13 2.07 -1.10 -3.37 116.25 117.85 2wyo h VAL 103 Ca -0.00 -2.23 -0.36 0.00 0.82 0.00 0.00 66.70 64.92 2wyo h VAL 103 Cb 1.07 2.32 -0.06 0.00 -1.52 0.00 0.00 31.29 33.10 2wyo h VAL 103 CO 0.06 0.46 -2.29 -1.22 0.02 0.00 0.00 177.57 174.61 2wyo n TYR 104 N -4.20 0.24 -0.03 1.57 4.01 -0.91 -4.34 117.16 113.49 2wyo n TYR 104 Ca -0.31 0.07 0.02 0.00 -0.16 0.00 0.00 57.90 57.52 2wyo n TYR 104 Cb 0.77 -1.04 -0.12 0.00 -0.31 0.00 0.00 39.34 38.64 2wyo n TYR 104 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2wyo n LEU 105 N -2.99 0.00 0.18 7.72 4.77 -0.07 -4.44 117.00 122.17 2wyo n LEU 105 Ca -0.34 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 55.77 2wyo n LEU 105 Cb 1.09 0.13 0.62 0.00 -2.33 0.00 0.00 43.42 42.93 2wyo n LEU 105 CO 0.39 0.13 0.90 0.28 -1.33 0.00 0.00 177.39 177.76 2wyo h SER 106 N 0.00 0.00 0.00 -1.43 0.02 -0.92 -3.46 113.55 107.76 2wyo h SER 106 Ca -0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2wyo h SER 106 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2wyo h SER 106 CO 0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 2wyo n GLY 107 N -0.51 0.88 3.85 -3.77 0.00 -1.26 -5.08 105.19 99.30 2wyo n GLY 107 Ca 0.00 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 2wyo n GLY 107 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wyo s GLY 108 N -2.06 2.03 0.74 -0.02 0.00 -1.26 -5.06 107.32 101.69 2wyo s GLY 108 Ca 0.00 0.08 -0.12 0.00 0.00 0.00 0.00 44.72 44.68 2wyo s GLY 108 CO 0.00 0.33 1.10 2.56 0.00 0.00 0.00 173.10 177.09 2wyo s PRO 109 N -4.03 2.42 -0.00 2.90 0.04 -1.26 -4.78 135.00 130.29 2wyo s PRO 109 Ca 0.57 1.23 -0.14 0.00 0.04 0.00 0.00 61.00 62.70 2wyo s PRO 109 Cb -0.10 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.55 2wyo s PRO 109 CO 0.32 -1.53 0.29 -0.59 0.04 0.00 0.00 177.00 175.53 2wyo s PHE 110 N -2.74 -0.14 -0.29 0.56 -0.12 -1.26 -4.83 117.98 109.16 2wyo s PHE 110 Ca 0.63 0.15 -0.28 0.00 -0.05 0.00 0.00 56.93 57.39 2wyo s PHE 110 Cb -0.18 0.08 -0.05 0.00 -0.63 0.00 0.00 43.02 42.23 2wyo s PHE 110 CO 0.52 -0.40 2.27 -1.14 -0.05 0.00 0.00 175.22 176.42 2wyo s GLN 111 N -1.59 2.87 0.49 1.99 2.00 -1.25 -4.81 119.66 119.36 2wyo s GLN 111 Ca -0.12 1.87 0.29 0.00 -2.00 0.00 0.00 55.36 55.40 2wyo s GLN 111 Cb -0.05 -4.43 1.12 0.00 0.80 0.00 0.00 33.01 30.46 2wyo s GLN 111 CO 0.02 -2.41 1.90 0.37 -0.50 0.00 0.00 175.29 174.67 2wyo h GLN 112 N 16.23 0.00 -6.39 1.67 5.75 -1.94 -3.44 115.11 126.99 2wyo h GLN 112 Ca -0.37 0.00 -0.54 0.00 -0.15 0.00 0.00 58.65 57.59 2wyo h GLN 112 Cb 1.25 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.77 2wyo h GLN 112 CO 1.01 0.11 0.36 -0.51 -2.65 0.00 0.00 178.83 177.15 2wyo s LEU 113 N -6.50 4.37 -0.13 -2.39 1.43 -1.26 -4.04 118.68 110.16 2wyo s LEU 113 Ca 0.01 1.64 -0.02 0.00 -1.03 0.00 0.00 54.13 54.73 2wyo s LEU 113 Cb 0.09 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.81 2wyo s LEU 113 CO 0.59 -0.26 -0.00 -0.04 0.23 0.00 0.00 176.35 176.87 2wyo s MET 114 N 1.01 0.82 0.46 1.70 -1.94 -0.83 -4.29 119.30 116.23 2wyo s MET 114 Ca 0.51 -0.18 -0.20 0.00 -1.71 0.00 0.00 55.69 54.12 2wyo s MET 114 Cb -0.21 -1.53 -0.10 0.00 2.01 0.00 0.00 34.83 35.00 2wyo s MET 114 CO 0.27 -0.42 0.97 -1.17 -0.01 0.00 0.00 175.02 174.66 2wyo s LEU 115 N 1.87 3.86 -0.04 -0.03 2.96 -1.20 -2.87 118.68 123.22 2wyo s LEU 115 Ca 0.03 1.69 -0.02 0.00 -0.22 0.00 0.00 54.13 55.61 2wyo s LEU 115 Cb -0.14 -4.54 0.03 0.00 0.50 0.00 0.00 46.19 42.04 2wyo s LEU 115 CO -0.07 -0.46 0.07 -0.83 -1.32 0.00 0.00 176.35 173.74 2wyo s GLY 116 N -2.36 0.17 -0.40 7.98 0.00 0.94 -4.45 107.32 109.22 2wyo s GLY 116 Ca 0.62 0.25 0.04 0.00 0.00 0.00 0.00 44.72 45.63 2wyo s GLY 116 CO 0.18 1.31 0.12 -0.42 0.00 0.00 0.00 173.10 174.29 2wyo s ILE 117 N 2.00 2.41 0.45 0.90 1.01 -1.26 -1.68 121.20 125.03 2wyo s ILE 117 Ca 0.03 -2.63 0.07 0.00 0.00 0.00 0.00 60.65 58.12 2wyo s ILE 117 Cb -0.12 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.60 2wyo s ILE 117 CO -0.03 -0.66 0.39 -0.36 0.00 0.00 0.00 174.94 174.27 2wyo s PHE 118 N 0.55 2.43 -0.17 3.97 0.08 -0.02 -4.50 117.98 120.32 2wyo s PHE 118 Ca 0.13 -0.58 -0.08 0.00 0.12 0.00 0.00 56.93 56.52 2wyo s PHE 118 Cb -0.21 -2.11 0.07 0.00 -0.57 0.00 0.00 43.02 40.20 2wyo s PHE 118 CO -0.06 -0.21 0.39 0.50 -0.10 0.00 0.00 175.22 175.74 2wyo s ARG 119 N -4.17 0.33 -0.42 0.44 3.52 0.55 -1.65 118.95 117.55 2wyo s ARG 119 Ca 0.46 0.87 -0.12 0.00 -0.13 0.00 0.00 55.73 56.81 2wyo s ARG 119 Cb -0.02 0.11 0.06 0.00 -1.56 0.00 0.00 34.95 33.54 2wyo s ARG 119 CO 0.27 -0.21 0.29 0.99 -0.81 0.00 0.00 175.30 175.83 2wyo s THR 120 N 1.98 4.63 0.32 4.11 2.01 0.12 -1.20 115.64 127.61 2wyo s THR 120 Ca -0.05 -1.16 -0.27 0.00 0.31 0.00 0.00 61.69 60.52 2wyo s THR 120 Cb -0.10 -3.75 -0.10 0.00 0.01 0.00 0.00 72.50 68.56 2wyo s THR 120 CO -0.12 -0.47 0.96 -1.81 -0.69 0.00 0.00 174.62 172.50 2wyo s ASP 121 N 2.12 7.32 0.29 3.53 1.01 0.76 -1.18 116.67 130.52 2wyo s ASP 121 Ca 0.03 1.90 0.03 0.00 0.71 0.00 0.00 52.55 55.22 2wyo s ASP 121 Cb -0.22 -2.59 -0.06 0.00 1.01 0.00 0.00 42.92 41.06 2wyo s ASP 121 CO 0.05 -0.08 0.07 -0.31 0.21 0.00 0.00 175.17 175.11 2wyo s TYR 122 N -1.53 1.77 -0.09 4.23 2.02 0.23 -1.86 117.35 122.12 2wyo s TYR 122 Ca 0.49 -1.05 -0.10 0.00 -0.37 0.00 0.00 57.07 56.04 2wyo s TYR 122 Cb -0.21 -1.10 0.02 0.00 -0.40 0.00 0.00 41.96 40.27 2wyo s TYR 122 CO 0.26 -0.14 0.27 1.41 -1.57 0.00 0.00 175.55 175.78 2wyo s MET 123 N -3.95 0.37 -0.09 -0.62 1.75 0.51 -2.44 119.30 114.82 2wyo s MET 123 Ca 0.37 0.27 -0.17 0.00 -1.25 0.00 0.00 55.69 54.91 2wyo s MET 123 Cb 0.08 0.18 -0.05 0.00 2.84 0.00 0.00 34.83 37.88 2wyo s MET 123 CO 0.14 -0.06 0.45 0.50 -0.65 0.00 0.00 175.02 175.41 2wyo s ARG 124 N -0.12 4.24 0.94 4.11 3.52 -1.26 -1.06 118.95 129.31 2wyo s ARG 124 Ca -0.03 0.42 -0.14 0.00 -0.13 0.00 0.00 55.73 55.86 2wyo s ARG 124 Cb -0.03 -3.38 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 2wyo s ARG 124 CO 0.01 0.29 0.23 0.39 -0.81 0.00 0.00 175.30 175.41 2wyo n GLU 125 N 3.21 -0.20 -1.96 5.12 1.02 -0.58 -1.27 120.64 125.99 2wyo n GLU 125 Ca -0.09 -0.02 -0.08 0.00 -0.02 0.00 0.00 57.16 56.95 2wyo n GLU 125 Cb 0.52 -1.72 0.06 0.00 -0.02 0.00 0.00 31.44 30.28 2wyo n GLU 125 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wyo n GLY 126 N 1.82 4.05 0.01 0.62 0.00 0.30 -4.03 105.19 107.96 2wyo n GLY 126 Ca 0.06 -1.70 -0.00 0.00 0.00 0.00 0.00 46.02 44.38 2wyo n GLY 126 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wyo h VAL 127 N 3.67 0.00 0.00 1.61 2.07 -1.94 -3.47 116.25 118.20 2wyo h VAL 127 Ca 0.07 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2wyo h VAL 127 Cb 1.41 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2wyo h VAL 127 CO 0.36 0.00 -0.23 -1.14 0.02 0.00 0.00 177.57 176.59 2wyo n ARG 138 N -2.52 0.00 -3.09 1.57 3.00 -1.26 -5.17 116.66 109.20 2wyo n ARG 138 Ca -0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.41 2wyo n ARG 138 Cb 0.01 -0.23 -0.05 0.00 0.00 0.00 0.00 32.46 32.19 2wyo n ARG 138 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 2wyo s TRP 139 N -1.82 2.96 0.16 -0.14 0.52 -1.26 -1.52 118.94 117.84 2wyo s TRP 139 Ca 0.00 -0.84 -0.20 0.00 0.02 0.00 0.00 56.10 55.08 2wyo s TRP 139 Cb 0.00 -3.97 -0.08 0.00 -1.15 0.00 0.00 33.47 28.27 2wyo s TRP 139 CO 0.00 -1.30 0.67 0.15 0.02 0.00 0.00 176.95 176.50 2wyo s LYS 140 N 2.85 4.28 -0.08 4.98 -0.14 -0.23 -4.47 119.74 126.94 2wyo s LYS 140 Ca 0.13 0.86 -0.26 0.00 -1.36 0.00 0.00 55.97 55.34 2wyo s LYS 140 Cb -0.22 -3.07 -0.03 0.00 -1.68 0.00 0.00 37.83 32.82 2wyo s LYS 140 CO 0.08 0.51 0.84 1.21 -0.76 0.00 0.00 175.35 177.23 2wyo s ASN 141 N -1.39 7.12 -0.07 2.83 3.84 0.33 -0.37 114.94 127.23 2wyo s ASN 141 Ca 0.37 1.36 0.07 0.00 0.21 0.00 0.00 52.86 54.86 2wyo s ASN 141 Cb -0.19 -2.48 -0.10 0.00 -0.55 0.00 0.00 41.25 37.93 2wyo s ASN 141 CO 0.21 -0.26 0.04 0.55 -2.79 0.00 0.00 177.10 174.85 2wyo n VAL 142 N 4.12 0.51 -3.77 -5.21 3.14 -0.77 -4.62 118.33 111.72 2wyo n VAL 142 Ca 0.03 -0.33 -0.13 0.00 -2.96 0.00 0.00 64.34 60.96 2wyo n VAL 142 Cb 0.50 -0.72 -0.12 0.00 -1.06 0.00 0.00 33.84 32.44 2wyo n VAL 142 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 2wyo s GLU 143 N -2.22 0.30 -0.17 1.45 2.56 -1.19 -5.02 118.70 114.41 2wyo s GLU 143 Ca -0.04 0.39 -0.01 0.00 0.00 0.00 0.00 54.97 55.31 2wyo s GLU 143 Cb 0.03 0.12 -0.01 0.00 2.00 0.00 0.00 34.13 36.27 2wyo s GLU 143 CO 0.33 -0.05 -0.11 -1.50 -0.56 0.00 0.00 175.26 173.36 2wyo s ILE 144 N 0.28 2.99 -0.07 -3.70 1.10 -1.26 -0.17 121.20 120.36 2wyo s ILE 144 Ca -0.01 -0.65 -0.01 0.00 -0.51 0.00 0.00 60.65 59.47 2wyo s ILE 144 Cb -0.03 -2.30 0.03 0.00 0.15 0.00 0.00 42.46 40.31 2wyo s ILE 144 CO -0.01 0.49 -0.02 0.20 -2.11 0.00 0.00 174.94 173.49 2wyo s ASN 145 N 0.95 1.47 0.00 4.50 0.01 -0.34 -4.54 114.94 116.98 2wyo s ASN 145 Ca -0.02 -0.12 0.00 0.00 -0.71 0.00 0.00 52.86 52.01 2wyo s ASN 145 Cb -0.15 -0.48 0.00 0.00 0.41 0.00 0.00 41.25 41.03 2wyo s ASN 145 CO -0.01 -0.15 0.00 0.35 -1.51 0.00 0.00 177.10 175.78 2wyo n THR 146 N 4.83 0.00 -4.39 1.60 -2.24 -1.26 -0.33 114.28 112.48 2wyo n THR 146 Ca -0.12 -0.25 -0.34 0.00 -2.27 0.00 0.00 64.05 61.07 2wyo n THR 146 Cb 0.50 0.80 -0.12 0.00 -2.10 0.00 0.00 70.33 69.41 2wyo n THR 146 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2wyo s ILE 147 N -0.97 3.97 -1.44 2.28 2.07 -1.26 -4.28 121.20 121.56 2wyo s ILE 147 Ca 0.00 -0.34 -0.08 0.00 -1.41 0.00 0.00 60.65 58.83 2wyo s ILE 147 Cb 0.00 -2.73 0.01 0.00 0.13 0.00 0.00 42.46 39.87 2wyo s ILE 147 CO 0.00 0.51 0.25 -0.24 -1.91 0.00 0.00 174.94 173.55 2wyo n SER 148 N 3.30 -0.55 -4.73 4.50 2.88 -1.17 -4.86 113.62 112.99 2wyo n SER 148 Ca -0.17 -1.22 -0.42 0.00 -1.33 0.00 0.00 58.87 55.73 2wyo n SER 148 Cb 0.53 -1.99 -0.03 0.00 -0.75 0.00 0.00 64.21 61.97 2wyo n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wyo s SER 150 N 0.63 6.28 -0.93 0.00 0.01 -1.26 -4.60 113.70 113.83 2wyo s SER 150 Ca 0.61 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.95 2wyo s SER 150 Cb -0.39 -1.85 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2wyo s SER 150 CO 0.37 -0.04 0.00 0.49 0.41 0.00 0.00 173.24 174.47 2wyo n PHE 151 N -1.17 -0.34 0.53 2.43 3.72 -1.26 -4.90 117.46 116.47 2wyo n PHE 151 Ca -0.08 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.44 2wyo n PHE 151 Cb 0.56 -2.30 0.28 0.00 -0.94 0.00 0.00 39.48 37.09 2wyo n PHE 151 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wyo h ALA 152 N 0.34 0.85 0.03 4.37 0.00 -1.92 -2.94 119.26 119.99 2wyo h ALA 152 Ca -0.23 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.32 2wyo h ALA 152 Cb 1.02 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2wyo h ALA 152 CO 0.29 0.00 -2.16 0.41 0.00 0.00 0.00 179.25 177.79 2wyo n GLY 153 N 1.28 -0.72 0.04 0.00 0.00 -1.26 -2.45 105.19 102.08 2wyo n GLY 153 Ca 0.04 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.97 2wyo n GLY 153 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wyo n LEU 154 N -3.14 0.61 0.19 0.99 4.77 -1.25 -4.36 117.00 114.81 2wyo n LEU 154 Ca -0.32 0.11 0.06 0.00 -0.03 0.00 0.00 56.01 55.82 2wyo n LEU 154 Cb 1.06 -0.19 0.35 0.00 -2.33 0.00 0.00 43.42 42.31 2wyo n LEU 154 CO 0.39 0.02 0.69 -1.28 -1.33 0.00 0.00 177.39 175.88 2wyo h SER 155 N 0.00 0.00 0.96 -1.43 0.87 -1.74 -2.02 113.55 110.18 2wyo h SER 155 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2wyo h SER 155 Cb 0.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2wyo h SER 155 CO 0.00 0.36 0.00 -0.65 -0.53 0.00 0.00 176.83 176.01 2wyo h PRO 156 N 0.00 0.00 0.00 2.24 0.11 -1.76 -3.11 132.00 129.48 2wyo h PRO 156 Ca -0.00 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.95 2wyo h PRO 156 Cb 0.88 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 2wyo h PRO 156 CO 0.05 0.00 -0.95 -0.07 -0.21 0.00 0.00 178.00 176.82 2wyo h LEU 157 N 0.00 0.00 -1.04 2.35 3.38 -1.64 -3.26 115.31 115.10 2wyo h LEU 157 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2wyo h LEU 157 Cb 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2wyo h LEU 157 CO 0.00 0.65 -0.30 0.40 0.09 0.00 0.00 178.44 179.28 2wyo h ILE 158 N 0.00 1.27 -0.94 1.22 1.08 -1.51 0.65 117.51 119.28 2wyo h ILE 158 Ca -0.07 -1.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.12 2wyo h ILE 158 Cb 1.56 1.48 -0.05 0.00 -3.07 0.00 0.00 36.82 36.75 2wyo h ILE 158 CO 0.07 0.39 0.60 0.74 -0.69 0.00 0.00 178.15 179.27 2wyo h THR 159 N 0.27 1.25 -0.10 -0.27 2.02 -1.70 -0.29 112.91 114.10 2wyo h THR 159 Ca 0.04 -0.49 -0.11 0.00 0.77 0.00 0.00 66.41 66.62 2wyo h THR 159 Cb 0.67 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2wyo h THR 159 CO 0.05 0.25 -0.45 -0.33 0.37 0.00 0.00 175.52 175.40 2wyo h GLU 160 N 1.28 0.23 -0.30 6.66 5.08 -1.32 0.40 114.58 126.60 2wyo h GLU 160 Ca 0.34 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 2wyo h GLU 160 Cb -0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2wyo h GLU 160 CO -0.07 0.64 0.05 0.35 -1.00 0.00 0.00 179.01 178.98 2wyo h PHE 161 N 0.19 0.53 -0.18 4.33 3.57 -0.02 -3.02 116.94 122.33 2wyo h PHE 161 Ca 0.01 -0.07 -0.14 0.00 3.53 0.00 0.00 57.97 61.30 2wyo h PHE 161 Cb 0.88 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 2wyo h PHE 161 CO 0.01 0.59 -0.49 0.45 -2.23 0.00 0.00 178.31 176.64 2wyo h HIS 162 N 0.32 0.58 -1.00 0.41 3.86 -0.94 -2.55 115.15 115.84 2wyo h HIS 162 Ca 0.09 -0.19 0.24 0.00 -1.16 0.00 0.00 60.37 59.35 2wyo h HIS 162 Cb 0.34 -0.12 -0.08 0.00 1.06 0.00 0.00 27.41 28.61 2wyo h HIS 162 CO 0.02 0.87 0.65 1.96 0.86 0.00 0.00 177.93 182.29 2wyo h GLN 163 N 0.38 0.41 0.27 2.45 4.20 -0.90 -1.20 115.11 120.73 2wyo h GLN 163 Ca 0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2wyo h GLN 163 Cb 0.99 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.68 2wyo h GLN 163 CO 0.09 0.27 -0.13 1.25 -0.67 0.00 0.00 178.83 179.64 2wyo h HIS 164 N 0.42 -0.34 -0.84 2.96 2.76 -1.33 -2.31 115.15 116.47 2wyo h HIS 164 Ca 0.55 -0.01 0.20 0.00 -2.20 0.00 0.00 60.37 58.91 2wyo h HIS 164 Cb 1.36 0.11 -0.12 0.00 1.55 0.00 0.00 27.41 30.31 2wyo h HIS 164 CO -0.00 0.00 0.29 0.82 -1.30 0.00 0.00 177.93 177.74 2wyo h ILE 165 N -0.94 0.46 -0.71 6.26 2.04 -1.29 0.26 117.51 123.59 2wyo h ILE 165 Ca -0.04 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.73 2wyo h ILE 165 Cb 0.50 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 2wyo h ILE 165 CO 0.06 0.06 0.46 0.00 0.00 0.00 0.00 178.15 178.74 2wyo h ALA 166 N 1.69 0.92 -0.01 1.87 0.00 -1.16 0.21 119.26 122.77 2wyo h ALA 166 Ca 0.51 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 55.18 2wyo h ALA 166 Cb 0.94 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2wyo h ALA 166 CO -0.55 0.29 -0.84 0.00 0.00 0.00 0.00 179.25 178.15 2wyo h ALA 167 N 1.28 0.53 0.56 0.00 0.00 -0.46 -0.74 119.26 120.43 2wyo h ALA 167 Ca 0.27 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 2wyo h ALA 167 Cb -0.07 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2wyo h ALA 167 CO -0.08 0.86 -0.27 -0.92 0.00 0.00 0.00 179.25 178.84 2wyo h TYR 168 N 0.16 -0.70 -0.89 0.00 3.20 -0.01 0.15 116.97 118.88 2wyo h TYR 168 Ca -0.05 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.87 2wyo h TYR 168 Cb 1.46 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 39.89 2wyo h TYR 168 CO 0.04 -0.41 0.56 -0.07 -1.64 0.00 0.00 178.16 176.63 2wyo h LEU 169 N -0.81 0.88 0.28 2.82 3.38 -0.64 0.36 115.31 121.58 2wyo h LEU 169 Ca -0.08 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2wyo h LEU 169 Cb 0.60 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2wyo h LEU 169 CO 0.13 0.56 -0.20 1.56 0.09 0.00 0.00 178.44 180.58 2wyo h GLN 170 N 1.01 -0.46 -0.57 1.13 4.20 -0.92 -0.70 115.11 118.81 2wyo h GLN 170 Ca 0.39 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.13 2wyo h GLN 170 Cb 0.18 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 2wyo h GLN 170 CO -0.18 -0.30 0.36 0.28 -0.67 0.00 0.00 178.83 178.32 2wyo h VAL 171 N -0.47 1.15 -0.28 -0.54 2.07 -0.14 -2.55 116.25 115.49 2wyo h VAL 171 Ca -0.02 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 2wyo h VAL 171 Cb 0.41 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2wyo h VAL 171 CO 0.01 0.15 -0.12 -0.07 0.02 0.00 0.00 177.57 177.56 2wyo h LEU 172 N 0.78 0.46 0.46 2.57 3.38 0.43 -2.57 115.31 120.83 2wyo h LEU 172 Ca 0.21 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2wyo h LEU 172 Cb -0.06 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2wyo h LEU 172 CO -0.04 0.62 -0.22 1.56 0.09 0.00 0.00 178.44 180.45 2wyo h GLN 173 N 0.45 -0.60 -0.98 1.13 4.20 -0.73 -2.72 115.11 115.86 2wyo h GLN 173 Ca 0.08 0.04 0.33 0.00 0.06 0.00 0.00 58.65 59.16 2wyo h GLN 173 Cb 0.48 0.14 -0.16 0.00 0.30 0.00 0.00 27.48 28.23 2wyo h GLN 173 CO 0.03 -0.40 0.43 0.87 -0.67 0.00 0.00 178.83 179.09 2wyo h LYS 174 N -1.16 0.16 -0.11 1.46 1.57 -1.53 0.70 116.57 117.66 2wyo h LYS 174 Ca -0.06 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 2wyo h LYS 174 Cb 0.47 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2wyo h LYS 174 CO 0.10 0.11 -0.11 0.00 -0.57 0.00 0.00 179.45 178.98 2wyo h ALA 175 N 1.90 0.16 0.00 3.86 0.00 -1.48 -1.81 119.26 121.88 2wyo h ALA 175 Ca 0.72 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2wyo h ALA 175 Cb 1.68 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2wyo h ALA 175 CO -0.71 0.00 0.00 -2.13 0.00 0.00 0.00 179.25 176.42 2wyo n ARG 176 N -4.63 0.98 -0.57 0.00 0.63 -0.64 -4.88 116.66 107.54 2wyo n ARG 176 Ca -0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.86 2wyo n ARG 176 Cb 0.33 -1.09 0.00 0.00 0.45 0.00 0.00 32.46 32.15 2wyo n ARG 176 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wyo n GLY 177 N 0.39 0.67 0.00 5.14 0.00 0.15 -5.04 105.19 106.50 2wyo n GLY 177 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2wyo n GLY 177 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2wyo n LYS 178 N -2.57 1.97 -3.82 1.61 3.00 -0.90 -4.97 118.16 112.47 2wyo n LYS 178 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 2wyo n LYS 178 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2wyo n LYS 178 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2wyo s GLU 179 N -0.88 1.59 0.61 1.64 -1.05 -1.26 -4.12 118.70 115.23 2wyo s GLU 179 Ca 0.00 -0.97 0.39 0.00 -0.15 0.00 0.00 54.97 54.25 2wyo s GLU 179 Cb 0.00 0.48 1.96 0.00 -0.44 0.00 0.00 34.13 36.14 2wyo s GLU 179 CO 0.00 -0.74 2.21 0.38 0.95 0.00 0.00 175.26 178.06 2wyo h ASP 180 N 2.00 0.00 -0.64 0.83 3.04 -2.01 -3.21 116.42 116.43 2wyo h ASP 180 Ca -0.26 0.00 0.18 0.00 -3.24 0.00 0.00 57.03 53.71 2wyo h ASP 180 Cb 1.23 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.50 2wyo h ASP 180 CO 0.32 0.01 0.52 -2.24 -2.04 0.00 0.00 179.24 175.81 2wyo h ASP 181 N 0.00 0.00 0.04 4.15 2.03 -1.99 0.50 116.42 121.15 2wyo h ASP 181 Ca -0.00 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2wyo h ASP 181 Cb 0.21 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 2wyo h ASP 181 CO 0.00 0.00 -0.02 0.44 -1.03 0.00 0.00 179.24 178.63 2wyo h ASP 182 N 0.00 -0.04 0.08 4.15 3.32 -2.02 -3.35 116.42 118.56 2wyo h ASP 182 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2wyo h ASP 182 Cb 1.35 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.91 2wyo h ASP 182 CO -0.00 0.04 0.00 0.61 -1.72 0.00 0.00 179.24 178.17 2wyo n GLY 183 N 1.37 -0.75 0.23 2.75 0.00 -1.15 -3.97 105.19 103.66 2wyo n GLY 183 Ca -0.01 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 2wyo n GLY 183 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wyo h VAL 184 N 0.00 0.00 -0.20 1.61 2.07 -0.13 -1.32 116.25 118.28 2wyo h VAL 184 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2wyo h VAL 184 Cb 0.04 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2wyo h VAL 184 CO 0.00 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.97 2wyo n GLU 185 N -4.04 1.96 0.00 1.57 1.02 -1.26 -4.16 120.64 115.74 2wyo n GLU 185 Ca -0.02 -0.94 0.00 0.00 -0.02 0.00 0.00 57.16 56.19 2wyo n GLU 185 Cb 0.17 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 2wyo n GLU 185 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2wyo n ASN 186 N 0.19 0.00 -3.91 1.62 5.03 -0.90 -5.03 115.26 112.27 2wyo n ASN 186 Ca 0.08 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.24 2wyo n ASN 186 Cb 0.41 -0.25 -0.16 0.00 -1.02 0.00 0.00 39.78 38.76 2wyo n ASN 186 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 2wyo s MET 187 N -0.78 1.52 -0.06 3.52 -1.94 -0.55 -4.30 119.30 116.70 2wyo s MET 187 Ca 0.00 -0.70 0.14 0.00 -1.71 0.00 0.00 55.69 53.43 2wyo s MET 187 Cb 0.00 -2.25 -0.22 0.00 2.01 0.00 0.00 34.83 34.37 2wyo s MET 187 CO 0.00 -0.50 0.57 0.45 -0.01 0.00 0.00 175.02 175.53 2wyo n SER 188 N 4.80 0.69 -0.13 3.03 2.88 -1.26 -3.99 113.62 119.65 2wyo n SER 188 Ca -0.12 0.33 0.17 0.00 -1.33 0.00 0.00 58.87 57.91 2wyo n SER 188 Cb 0.46 0.20 0.55 0.00 -0.75 0.00 0.00 64.21 64.67 2wyo n SER 188 CO 0.00 0.00 0.00 4.11 -1.23 0.00 0.00 175.04 177.92 2wyo h TRP 189 N 0.00 0.38 -0.78 0.66 5.08 -1.93 -2.75 115.95 116.61 2wyo h TRP 189 Ca -0.31 0.01 0.06 0.00 1.08 0.00 0.00 58.89 59.73 2wyo h TRP 189 Cb 1.98 -0.12 -0.05 0.00 -3.00 0.00 0.00 29.16 27.97 2wyo h TRP 189 CO 0.00 0.14 0.51 0.82 -1.28 0.00 0.00 178.44 178.64 2wyo h ILE 190 N 0.32 1.05 -0.89 0.12 2.04 -1.93 -3.45 117.51 114.77 2wyo h ILE 190 Ca 0.35 -0.29 -0.59 0.00 1.00 0.00 0.00 64.86 65.33 2wyo h ILE 190 Cb 0.90 0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 2wyo h ILE 190 CO -0.09 0.16 -0.39 0.26 0.00 0.00 0.00 178.15 178.08 2wyo s TRP 191 N -5.76 2.02 -1.03 1.37 0.51 -1.04 -4.66 118.94 110.35 2wyo s TRP 191 Ca -0.10 -0.76 -0.21 0.00 -2.12 0.00 0.00 56.10 52.90 2wyo s TRP 191 Cb 0.19 -1.91 0.07 0.00 -0.81 0.00 0.00 33.47 31.02 2wyo s TRP 191 CO 0.78 -0.16 1.41 0.20 -0.51 0.00 0.00 176.95 178.66 2wyo s GLY 192 N -4.11 1.47 -0.06 0.98 0.00 -1.26 -4.94 107.32 99.39 2wyo s GLY 192 Ca 0.33 -2.46 -0.03 0.00 0.00 0.00 0.00 44.72 42.57 2wyo s GLY 192 CO 0.19 2.53 0.12 0.54 0.00 0.00 0.00 173.10 176.48 2wyo s LYS 193 N 4.34 -0.02 0.41 2.90 1.02 -1.26 -5.04 119.74 122.09 2wyo s LYS 193 Ca 0.44 0.48 0.13 0.00 0.02 0.00 0.00 55.97 57.04 2wyo s LYS 193 Cb -0.01 -0.38 0.97 0.00 -0.52 0.00 0.00 37.83 37.90 2wyo s LYS 193 CO -0.08 -0.32 1.94 0.78 -0.92 0.00 0.00 175.35 176.75 2wyo h GLY 194 N 8.39 0.75 -0.00 -3.33 0.00 -1.96 -0.23 103.07 106.69 2wyo h GLY 194 Ca -0.13 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2wyo h GLY 194 CO 0.15 0.10 0.00 1.16 0.00 0.00 0.00 176.54 177.95 2wyo n ASN 195 N -4.48 0.00 -3.59 0.19 6.94 -1.26 -4.57 115.26 108.48 2wyo n ASN 195 Ca 0.12 -0.51 -0.15 0.00 -0.02 0.00 0.00 54.58 54.02 2wyo n ASN 195 Cb 0.42 -0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.78 2wyo n ASN 195 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wyo s ARG 197 N -0.17 0.59 -0.02 0.00 3.52 -0.98 -4.56 118.95 117.33 2wyo s ARG 197 Ca -0.04 1.32 -0.30 0.00 -0.13 0.00 0.00 55.73 56.58 2wyo s ARG 197 Cb -0.03 0.63 -0.05 0.00 -1.56 0.00 0.00 34.95 33.94 2wyo s ARG 197 CO 0.04 -0.18 1.46 -0.51 -0.81 0.00 0.00 175.30 175.30 2wyo s LEU 198 N 2.49 4.31 -0.21 -0.88 1.43 -1.26 -0.62 118.68 123.93 2wyo s LEU 198 Ca -0.07 2.13 -0.14 0.00 -1.03 0.00 0.00 54.13 55.02 2wyo s LEU 198 Cb -0.09 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.53 2wyo s LEU 198 CO -0.19 -0.78 0.32 -0.70 0.23 0.00 0.00 176.35 175.23 2wyo s GLU 199 N 2.86 4.14 -0.24 1.70 2.56 -0.79 -4.93 118.70 124.00 2wyo s GLU 199 Ca 0.66 0.05 -0.23 0.00 0.00 0.00 0.00 54.97 55.45 2wyo s GLU 199 Cb -0.32 -3.54 -0.01 0.00 2.00 0.00 0.00 34.13 32.27 2wyo s GLU 199 CO 0.26 -0.00 0.74 0.50 -0.56 0.00 0.00 175.26 176.20 2wyo s ARG 200 N 1.22 4.16 -0.21 4.30 3.52 -1.26 -4.49 118.95 126.18 2wyo s ARG 200 Ca 0.15 0.77 -0.38 0.00 -0.13 0.00 0.00 55.73 56.14 2wyo s ARG 200 Cb -0.14 -3.64 -0.14 0.00 -1.56 0.00 0.00 34.95 29.47 2wyo s ARG 200 CO 0.07 -0.45 1.81 0.45 -0.81 0.00 0.00 175.30 176.36 2wyo n SER 201 N 5.81 2.79 0.00 -2.12 2.88 -1.26 -4.84 113.62 116.87 2wyo n SER 201 Ca 0.03 1.02 0.12 0.00 -1.33 0.00 0.00 58.87 58.71 2wyo n SER 201 Cb 0.48 -1.23 0.70 0.00 -0.75 0.00 0.00 64.21 63.41 2wyo n SER 201 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2wyo n VAL 202 N 4.88 0.08 -0.29 2.46 0.31 -1.26 -4.11 118.33 120.39 2wyo n VAL 202 Ca 0.25 0.02 0.07 0.00 -0.01 0.00 0.00 64.34 64.67 2wyo n VAL 202 Cb 0.19 -0.63 0.29 0.00 -0.91 0.00 0.00 33.84 32.78 2wyo n VAL 202 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2wyo h SER 203 N 0.00 0.82 0.29 4.52 4.64 -1.79 -1.80 113.55 120.23 2wyo h SER 203 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2wyo h SER 203 Cb 0.07 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 2wyo h SER 203 CO 0.00 0.49 0.00 1.23 -0.87 0.00 0.00 176.83 177.68 2wyo h GLY 204 N 0.91 0.00 0.00 -0.77 0.00 -1.63 -2.34 103.07 99.24 2wyo h GLY 204 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 47.33 47.34 2wyo h GLY 204 CO -0.18 0.00 -2.44 1.22 0.00 0.00 0.00 176.54 175.14 2wyo n ASP 205 N -2.96 1.96 -0.22 0.19 8.00 -0.75 -4.50 116.55 118.27 2wyo n ASP 205 Ca -0.02 0.12 -0.09 0.00 0.71 0.00 0.00 54.79 55.52 2wyo n ASP 205 Cb 0.13 -0.60 0.03 0.00 -0.02 0.00 0.00 41.12 40.66 2wyo n ASP 205 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2wyo h VAL 206 N -0.53 1.26 -0.01 2.53 2.07 -1.26 -2.85 116.25 117.47 2wyo h VAL 206 Ca -0.62 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 65.84 2wyo h VAL 206 Cb 1.70 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2wyo h VAL 206 CO -0.26 0.39 -0.06 0.58 0.02 0.00 0.00 177.57 178.24 2wyo h VAL 207 N 0.94 1.55 -0.82 2.57 2.07 -1.68 0.50 116.25 121.37 2wyo h VAL 207 Ca 0.18 -1.69 0.18 0.00 0.82 0.00 0.00 66.70 66.20 2wyo h VAL 207 Cb 0.47 2.66 -0.15 0.00 -1.52 0.00 0.00 31.29 32.75 2wyo h VAL 207 CO 0.02 0.45 -0.07 -0.65 0.02 0.00 0.00 177.57 177.33 2wyo h PRO 208 N -0.63 0.05 -0.59 1.57 0.11 -1.79 -0.98 132.00 129.74 2wyo h PRO 208 Ca -0.01 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 2wyo h PRO 208 Cb 0.76 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.83 2wyo h PRO 208 CO 0.01 0.03 0.12 -0.22 -0.21 0.00 0.00 178.00 177.73 2wyo h LYS 209 N 0.05 0.93 -0.08 1.05 3.64 -1.19 -0.76 116.57 120.20 2wyo h LYS 209 Ca 0.44 -0.21 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 2wyo h LYS 209 Cb 0.76 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.40 2wyo h LYS 209 CO -0.78 0.85 -0.25 0.00 -2.27 0.00 0.00 179.45 177.00 2wyo h ALA 210 N 1.24 -0.27 -0.40 5.00 0.00 0.33 0.47 119.26 125.64 2wyo h ALA 210 Ca 0.19 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2wyo h ALA 210 Cb 0.36 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2wyo h ALA 210 CO 0.00 -0.72 0.19 0.82 0.00 0.00 0.00 179.25 179.54 2wyo h ILE 211 N -0.34 0.96 -0.17 0.00 2.04 -0.52 0.28 117.51 119.76 2wyo h ILE 211 Ca 0.09 -0.13 -0.08 0.00 1.00 0.00 0.00 64.86 65.73 2wyo h ILE 211 Cb 0.46 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 2wyo h ILE 211 CO -0.28 0.07 -0.26 0.00 0.00 0.00 0.00 178.15 177.68 2wyo h ALA 212 N 1.22 1.24 -0.07 1.87 0.00 -0.70 -0.57 119.26 122.24 2wyo h ALA 212 Ca 0.17 -0.32 -0.23 0.00 0.00 0.00 0.00 54.91 54.53 2wyo h ALA 212 Cb 0.09 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2wyo h ALA 212 CO -0.13 0.50 -0.89 -0.44 0.00 0.00 0.00 179.25 178.30 2wyo h ASP 213 N 0.28 0.81 -0.71 0.00 3.32 0.77 -2.20 116.42 118.69 2wyo h ASP 213 Ca 0.04 -0.58 0.12 0.00 0.02 0.00 0.00 57.03 56.63 2wyo h ASP 213 Cb 0.62 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 2wyo h ASP 213 CO 0.04 1.38 0.47 0.00 -1.72 0.00 0.00 179.24 179.41 2wyo h ALA 214 N 0.59 2.00 -0.36 3.45 0.00 -0.00 -2.09 119.26 122.86 2wyo h ALA 214 Ca -0.08 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2wyo h ALA 214 Cb 1.52 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 2wyo h ALA 214 CO 0.17 -0.17 -0.33 0.28 0.00 0.00 0.00 179.25 179.20 2wyo h VAL 215 N 0.48 1.28 0.00 0.00 2.07 -0.77 -2.73 116.25 116.58 2wyo h VAL 215 Ca 0.34 -1.50 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 2wyo h VAL 215 Cb 0.65 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 2wyo h VAL 215 CO -0.11 0.49 -0.32 -0.09 0.02 0.00 0.00 177.57 177.57 2wyo h ARG 216 N 0.65 0.00 0.16 1.57 2.43 -0.82 -2.50 114.38 115.87 2wyo h ARG 216 Ca 0.06 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2wyo h ARG 216 Cb 0.91 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2wyo h ARG 216 CO 0.08 0.32 -0.08 0.00 -1.51 0.00 0.00 179.97 178.79 2wyo h ALA 217 N 1.68 -0.21 -0.94 2.80 0.00 -1.33 -1.81 119.26 119.44 2wyo h ALA 217 Ca -0.00 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 54.91 2wyo h ALA 217 Cb 0.60 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 2wyo h ALA 217 CO 0.04 -0.44 0.60 2.35 0.00 0.00 0.00 179.25 181.81 2wyo h TRP 218 N -0.57 0.81 0.02 0.00 7.01 -1.17 0.25 115.95 122.29 2wyo h TRP 218 Ca -0.02 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 60.92 2wyo h TRP 218 Cb 0.44 -0.25 0.01 0.00 -2.10 0.00 0.00 29.16 27.26 2wyo h TRP 218 CO 0.04 0.23 -0.33 0.28 -2.79 0.00 0.00 178.44 175.87 2wyo h VAL 219 N 0.62 1.56 -0.51 2.65 2.07 -1.46 -2.99 116.25 118.19 2wyo h VAL 219 Ca 0.50 -2.07 -0.03 0.00 0.82 0.00 0.00 66.70 65.91 2wyo h VAL 219 Cb 0.95 2.87 -0.02 0.00 -1.52 0.00 0.00 31.29 33.57 2wyo h VAL 219 CO -0.25 0.57 0.18 -0.08 0.02 0.00 0.00 177.57 178.00 2wyo h GLU 220 N -0.50 0.75 0.00 1.57 4.57 -0.30 1.05 114.58 121.73 2wyo h GLU 220 Ca -0.05 -0.12 -0.02 0.00 -1.18 0.00 0.00 59.36 58.00 2wyo h GLU 220 Cb 1.11 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.57 2wyo h GLU 220 CO 0.06 0.64 -0.09 0.37 -1.18 0.00 0.00 179.01 178.81 2wyo h GLN 221 N 0.73 0.00 -0.06 1.92 4.15 -0.64 -2.84 115.11 118.38 2wyo h GLN 221 Ca 0.17 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 2wyo h GLN 221 Cb 0.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.88 2wyo h GLN 221 CO -0.01 0.09 0.00 1.04 -1.93 0.00 0.00 178.83 178.02 2wyo n GLN 222 N -3.81 2.49 -3.99 1.69 6.02 -0.13 -5.02 117.38 114.63 2wyo n GLN 222 Ca -0.02 -1.96 -0.33 0.00 -0.01 0.00 0.00 57.00 54.68 2wyo n GLN 222 Cb 0.19 -1.23 -0.02 0.00 1.02 0.00 0.00 30.24 30.20 2wyo n GLN 222 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2wyo n LYS 223 N -0.66 -0.59 -0.11 -1.09 5.02 0.35 -4.27 118.16 116.81 2wyo n LYS 223 Ca 0.07 -0.02 0.25 0.00 -2.02 0.00 0.00 58.31 56.60 2wyo n LYS 223 Cb 0.42 -2.15 0.71 0.00 -0.02 0.00 0.00 35.03 34.00 2wyo n LYS 223 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2wyo h PHE 224 N -1.37 0.00 -0.99 2.13 3.57 -1.85 0.38 116.94 118.80 2wyo h PHE 224 Ca -0.55 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.02 2wyo h PHE 224 Cb 1.11 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.78 2wyo h PHE 224 CO 0.34 0.00 0.64 0.00 -2.23 0.00 0.00 178.31 177.06 2wyo h ALA 225 N 1.62 1.38 -0.18 2.41 0.00 -1.91 -0.35 119.26 122.24 2wyo h ALA 225 Ca 0.35 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 2wyo h ALA 225 Cb 1.43 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 2wyo h ALA 225 CO -0.00 0.43 -0.21 0.77 0.00 0.00 0.00 179.25 180.23 2wyo h SER 226 N 1.16 0.50 -0.68 0.00 0.02 -0.53 0.21 113.55 114.24 2wyo h SER 226 Ca 0.43 -0.49 0.10 0.00 -0.84 0.00 0.00 61.79 60.99 2wyo h SER 226 Cb 0.18 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.50 2wyo h SER 226 CO -0.18 0.90 0.30 0.25 -1.14 0.00 0.00 176.83 176.96 2wyo h LEU 227 N 0.12 0.34 0.26 5.07 5.85 -1.41 0.14 115.31 125.69 2wyo h LEU 227 Ca 0.03 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2wyo h LEU 227 Cb 0.77 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.82 2wyo h LEU 227 CO 0.05 0.19 -0.13 -0.09 -0.34 0.00 0.00 178.44 178.12 2wyo h ARG 228 N 0.50 -0.34 -1.01 1.25 2.43 -0.97 0.48 114.38 116.73 2wyo h ARG 228 Ca 0.34 0.02 0.23 0.00 -0.81 0.00 0.00 59.98 59.77 2wyo h ARG 228 Cb 0.41 0.08 -0.12 0.00 -0.42 0.00 0.00 29.97 29.92 2wyo h ARG 228 CO -0.30 -0.00 0.61 0.00 -1.51 0.00 0.00 179.97 178.76 2wyo h ALA 229 N -0.57 1.83 -0.34 2.80 0.00 -0.52 0.70 119.26 123.17 2wyo h ALA 229 Ca -0.04 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2wyo h ALA 229 Cb 0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2wyo h ALA 229 CO 0.06 -0.27 -0.12 1.03 0.00 0.00 0.00 179.25 179.95 2wyo h SER 230 N 0.60 0.69 -0.94 0.00 0.87 -0.65 -3.35 113.55 110.77 2wyo h SER 230 Ca 0.62 -0.38 0.25 0.00 -1.23 0.00 0.00 61.79 61.04 2wyo h SER 230 Cb 1.19 -0.19 -0.13 0.00 -0.44 0.00 0.00 62.40 62.83 2wyo h SER 230 CO -0.42 0.92 0.45 -0.25 -0.53 0.00 0.00 176.83 176.99 2wyo h TRP 231 N 0.46 0.74 0.00 2.24 2.91 0.24 -2.41 115.95 120.13 2wyo h TRP 231 Ca 0.08 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.14 2wyo h TRP 231 Cb 0.64 -0.18 0.00 0.00 -0.51 0.00 0.00 29.16 29.11 2wyo h TRP 231 CO 0.05 -0.07 0.06 0.39 -1.03 0.00 0.00 178.44 177.84 2wyo n GLU 232 N -5.04 0.06 -3.53 2.65 -0.58 -1.19 -5.09 120.64 107.92 2wyo n GLU 232 Ca 0.25 0.53 -0.27 0.00 -0.42 0.00 0.00 57.16 57.25 2wyo n GLU 232 Cb 0.74 -1.74 -0.10 0.00 -0.57 0.00 0.00 31.44 29.77 2wyo n GLU 232 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2wyo n GLN 233 N -1.79 0.83 0.00 3.49 3.00 -0.91 -5.19 117.38 116.80 2wyo n GLN 233 Ca -0.01 -3.64 0.00 0.00 -0.01 0.00 0.00 57.00 53.34 2wyo n GLN 233 Cb 0.07 -1.85 0.00 0.00 0.00 0.00 0.00 30.24 28.46 2wyo n GLN 233 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.06 176.95 2wyo n LEU 247 N 2.38 0.00 -4.45 1.08 7.94 -1.26 -5.16 117.00 117.52 2wyo n LEU 247 Ca 0.26 0.16 -0.44 0.00 -1.11 0.00 0.00 56.01 54.89 2wyo n LEU 247 Cb 0.44 -0.16 -0.02 0.00 0.53 0.00 0.00 43.42 44.21 2wyo n LEU 247 CO 0.16 -0.16 1.03 -0.83 -1.11 0.00 0.00 177.39 176.48 2wyo s GLY 248 N -2.20 1.97 -0.19 -3.96 0.00 -1.26 -5.01 107.32 96.67 2wyo s GLY 248 Ca 0.00 -2.83 -0.25 0.00 0.00 0.00 0.00 44.72 41.65 2wyo s GLY 248 CO 0.00 2.03 0.81 0.14 0.00 0.00 0.00 173.10 176.07 2wyo s VAL 249 N 2.60 4.89 0.46 1.40 1.01 -1.26 -4.95 120.40 124.54 2wyo s VAL 249 Ca 0.34 1.57 -0.23 0.00 0.00 0.00 0.00 61.98 63.65 2wyo s VAL 249 Cb -0.04 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.15 2wyo s VAL 249 CO -0.08 0.01 1.21 -0.76 0.00 0.00 0.00 175.10 175.48 2wyo s LEU 250 N 2.28 4.04 0.46 3.92 1.43 -1.26 -4.66 118.68 124.89 2wyo s LEU 250 Ca 0.36 2.42 -0.22 0.00 -1.03 0.00 0.00 54.13 55.67 2wyo s LEU 250 Cb -0.16 -4.17 -0.08 0.00 0.03 0.00 0.00 46.19 41.81 2wyo s LEU 250 CO 0.11 -0.97 1.08 -1.81 0.23 0.00 0.00 176.35 174.99 2wyo s ASP 251 N -1.19 6.35 0.55 2.29 1.01 -1.18 -4.93 116.67 119.58 2wyo s ASP 251 Ca 0.63 2.07 0.23 0.00 0.71 0.00 0.00 52.55 56.20 2wyo s ASP 251 Cb -0.32 -2.58 1.55 0.00 1.01 0.00 0.00 42.92 42.59 2wyo s ASP 251 CO 0.39 -0.78 2.20 0.71 0.21 0.00 0.00 175.17 177.90 2wyo h THR 252 N 1.78 0.75 -2.42 -1.27 1.35 -1.95 -3.42 112.91 107.72 2wyo h THR 252 Ca -0.49 -0.04 -0.61 0.00 -0.55 0.00 0.00 66.41 64.72 2wyo h THR 252 Cb 1.23 1.02 -0.14 0.00 -1.73 0.00 0.00 68.15 68.53 2wyo h THR 252 CO 0.60 0.01 -0.75 0.00 -0.25 0.00 0.00 175.52 175.13 2wyo s ALA 253 N -4.80 2.79 0.37 6.62 0.00 -1.26 -4.93 121.76 120.55 2wyo s ALA 253 Ca -0.05 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.13 2wyo s ALA 253 Cb 0.16 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.92 2wyo s ALA 253 CO 0.60 0.31 0.17 -0.35 0.00 0.00 0.00 175.76 176.50 2wyo n PRO 254 N -0.48 0.58 -3.85 0.00 -0.04 -1.26 -4.60 135.00 125.34 2wyo n PRO 254 Ca -0.07 -0.51 -0.12 0.00 -0.04 0.00 0.00 63.50 62.77 2wyo n PRO 254 Cb 0.59 -0.10 -0.10 0.00 -0.04 0.00 0.00 33.50 33.84 2wyo n PRO 254 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wyo s VAL 255 N -0.22 0.07 -0.52 0.52 1.01 -0.64 -4.48 120.40 116.15 2wyo s VAL 255 Ca 0.12 -0.56 -0.22 0.00 0.00 0.00 0.00 61.98 61.32 2wyo s VAL 255 Cb -0.01 -0.42 0.05 0.00 0.00 0.00 0.00 36.38 36.00 2wyo s VAL 255 CO 0.08 -0.31 0.80 -0.69 0.00 0.00 0.00 175.10 174.98 2wyo s VAL 256 N -1.14 4.61 -0.05 2.92 1.01 -1.03 -1.22 120.40 125.50 2wyo s VAL 256 Ca -0.12 -0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 2wyo s VAL 256 Cb -0.06 -4.42 -0.02 0.00 0.00 0.00 0.00 36.38 31.88 2wyo s VAL 256 CO 0.02 -0.94 1.02 -0.22 0.00 0.00 0.00 175.10 174.97 2wyo s LEU 257 N 3.35 4.30 -0.28 3.92 2.96 -0.51 -1.90 118.68 130.52 2wyo s LEU 257 Ca 0.24 1.62 -0.06 0.00 -0.22 0.00 0.00 54.13 55.71 2wyo s LEU 257 Cb -0.15 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 42.98 2wyo s LEU 257 CO 0.17 -0.38 0.07 -0.69 -1.32 0.00 0.00 176.35 174.19 2wyo s VAL 258 N 1.57 3.92 -0.56 1.68 1.01 0.39 -0.74 120.40 127.67 2wyo s VAL 258 Ca 0.51 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.65 2wyo s VAL 258 Cb -0.20 -2.99 0.08 0.00 0.00 0.00 0.00 36.38 33.27 2wyo s VAL 258 CO 0.23 0.13 0.69 -0.69 0.00 0.00 0.00 175.10 175.46 2wyo s VAL 259 N 1.50 4.80 0.53 2.92 1.01 -0.36 -1.71 120.40 129.08 2wyo s VAL 259 Ca 0.03 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.36 2wyo s VAL 259 Cb -0.17 -4.43 0.06 0.00 0.00 0.00 0.00 36.38 31.84 2wyo s VAL 259 CO 0.02 -1.02 0.68 0.68 0.00 0.00 0.00 175.10 175.46 2wyo s VAL 260 N 2.77 2.29 0.61 2.92 -7.23 -0.34 -2.35 120.40 119.07 2wyo s VAL 260 Ca 0.14 -1.08 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 2wyo s VAL 260 Cb -0.22 -2.37 0.06 0.00 0.56 0.00 0.00 36.38 34.42 2wyo s VAL 260 CO 0.09 0.00 0.85 -1.10 -0.31 0.00 0.00 175.10 174.63 2wyo s GLN 261 N -4.53 2.29 0.00 4.82 -0.21 -1.25 -4.49 119.66 116.28 2wyo s GLN 261 Ca 0.56 -0.84 0.26 0.00 0.02 0.00 0.00 55.36 55.36 2wyo s GLN 261 Cb -0.06 -2.42 0.67 0.00 1.00 0.00 0.00 33.01 32.19 2wyo s GLN 261 CO 0.35 -0.95 1.51 0.39 -2.12 0.00 0.00 175.29 174.47 2wyo n GLU 262 N -2.52 0.77 -2.71 2.91 -0.58 -1.26 -3.91 120.64 113.34 2wyo n GLU 262 Ca 0.10 -0.47 -0.04 0.00 -0.42 0.00 0.00 57.16 56.33 2wyo n GLU 262 Cb 0.60 -1.49 0.10 0.00 -0.57 0.00 0.00 31.44 30.08 2wyo n GLU 262 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2wyo n ASN 263 N -0.70 -0.48 -4.24 1.62 5.15 -1.26 -5.14 115.26 110.21 2wyo n ASN 263 Ca 0.11 -2.30 -0.46 0.00 -0.60 0.00 0.00 54.58 51.33 2wyo n ASN 263 Cb 0.35 0.33 -0.03 0.00 -0.53 0.00 0.00 39.78 39.91 2wyo n ASN 263 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2wyo n GLU 264 N -0.90 0.00 0.00 1.20 4.07 -1.25 -4.95 120.64 118.81 2wyo n GLU 264 Ca -0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 2wyo n GLU 264 Cb 0.85 -0.96 0.00 0.00 -0.06 0.00 0.00 31.44 31.26 2wyo n GLU 264 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2wyo n ARG 265 N 0.97 0.85 -0.49 5.31 1.85 -1.26 -4.77 116.66 119.13 2wyo n ARG 265 Ca 0.17 -0.29 -0.06 0.00 -1.00 0.00 0.00 57.85 56.67 2wyo n ARG 265 Cb 0.25 -0.76 0.11 0.00 -1.05 0.00 0.00 32.46 31.01 2wyo n ARG 265 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 2wyo n ASN 266 N -0.20 3.25 -0.26 2.89 2.85 -1.26 -1.68 115.26 120.84 2wyo n ASN 266 Ca 0.00 -2.60 -0.06 0.00 -0.11 0.00 0.00 54.58 51.81 2wyo n ASN 266 Cb 0.04 -0.63 0.05 0.00 1.24 0.00 0.00 39.78 40.49 2wyo n ASN 266 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2wyo h THR 267 N 0.90 1.23 -0.80 -0.44 1.35 -1.88 -1.46 112.91 111.81 2wyo h THR 267 Ca 0.18 -0.62 0.19 0.00 -0.55 0.00 0.00 66.41 65.61 2wyo h THR 267 Cb 1.59 0.31 -0.15 0.00 -1.73 0.00 0.00 68.15 68.17 2wyo h THR 267 CO 0.39 0.26 -0.10 0.00 -0.25 0.00 0.00 175.52 175.83 2wyo n ALA 268 N -2.37 0.29 0.08 6.62 0.00 -1.26 -0.43 120.51 123.45 2wyo n ALA 268 Ca 0.06 0.87 -0.13 0.00 0.00 0.00 0.00 53.44 54.24 2wyo n ALA 268 Cb 0.12 -0.57 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 2wyo n ALA 268 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2wyo h ASP 269 N 0.00 -0.15 -0.35 0.00 3.58 -1.56 0.12 116.42 118.06 2wyo h ASP 269 Ca 0.43 -0.21 0.05 0.00 0.42 0.00 0.00 57.03 57.72 2wyo h ASP 269 Cb 0.78 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.82 2wyo h ASP 269 CO -0.79 0.13 0.08 1.56 -2.88 0.00 0.00 179.24 177.34 2wyo h GLN 270 N -0.43 0.20 -0.16 0.28 4.20 -0.98 -2.42 115.11 115.79 2wyo h GLN 270 Ca -0.02 -0.01 -0.17 0.00 0.06 0.00 0.00 58.65 58.51 2wyo h GLN 270 Cb 0.35 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 2wyo h GLN 270 CO 0.03 0.13 -0.61 1.88 -0.67 0.00 0.00 178.83 179.59 2wyo h TYR 271 N 0.21 0.68 -0.73 2.96 0.05 -0.73 0.22 116.97 119.63 2wyo h TYR 271 Ca 0.16 -0.26 0.14 0.00 0.05 0.00 0.00 58.73 58.82 2wyo h TYR 271 Cb 0.18 -0.12 -0.10 0.00 1.01 0.00 0.00 36.73 37.70 2wyo h TYR 271 CO -0.18 1.00 0.26 0.00 -1.05 0.00 0.00 178.16 178.20 2wyo h ALA 272 N 0.94 1.00 0.25 3.88 0.00 -0.33 1.00 119.26 125.99 2wyo h ALA 272 Ca -0.01 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2wyo h ALA 272 Cb 1.16 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2wyo h ALA 272 CO 0.11 -0.25 -0.12 -0.07 0.00 0.00 0.00 179.25 178.92 2wyo h LEU 273 N 0.39 -0.29 -2.04 0.00 3.38 -1.20 -3.35 115.31 112.20 2wyo h LEU 273 Ca 0.40 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 2wyo h LEU 273 Cb 0.63 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2wyo h LEU 273 CO -0.42 0.21 -0.09 -0.07 0.09 0.00 0.00 178.44 178.16 2wyo h LEU 274 N -1.00 0.00 -1.26 1.67 3.38 0.36 -0.69 115.31 117.76 2wyo h LEU 274 Ca -0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2wyo h LEU 274 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2wyo h LEU 274 CO 0.06 0.09 -0.25 0.24 0.09 0.00 0.00 178.44 178.66 2wyo h MET 275 N 0.00 0.00 0.01 1.13 2.86 0.86 -2.74 114.93 117.04 2wyo h MET 275 Ca -0.00 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.42 2wyo h MET 275 Cb 0.21 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 2wyo h MET 275 CO 0.01 0.25 -1.04 -0.09 1.06 0.00 0.00 176.91 177.10 2wyo h ARG 276 N 0.00 0.02 -0.77 1.72 9.65 -1.25 -1.69 114.38 122.05 2wyo h ARG 276 Ca -0.00 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.80 2wyo h ARG 276 Cb 0.69 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.25 2wyo h ARG 276 CO 0.03 1.00 0.30 0.28 2.80 0.00 0.00 179.97 184.38 2wyo h VAL 277 N 0.00 1.26 0.32 0.20 2.07 -1.38 -1.65 116.25 117.07 2wyo h VAL 277 Ca -0.03 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 2wyo h VAL 277 Cb 1.79 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2wyo h VAL 277 CO 0.13 0.33 -0.15 0.25 0.02 0.00 0.00 177.57 178.15 2wyo h LEU 278 N 1.13 -0.36 0.01 2.57 5.85 -1.44 0.13 115.31 123.20 2wyo h LEU 278 Ca 0.26 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.99 2wyo h LEU 278 Cb 0.23 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.35 2wyo h LEU 278 CO -0.02 0.05 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.80 2wyo h GLU 279 N -1.05 -0.01 0.11 1.25 5.08 -1.40 0.03 114.58 118.58 2wyo h GLU 279 Ca -0.04 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.00 2wyo h GLU 279 Cb 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2wyo h GLU 279 CO 0.07 0.41 -1.67 1.49 -1.00 0.00 0.00 179.01 178.31 2wyo h GLU 280 N -0.45 0.24 -0.00 2.33 4.81 -1.52 -3.39 114.58 116.60 2wyo h GLU 280 Ca -0.00 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2wyo h GLU 280 Cb 0.44 0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2wyo h GLU 280 CO 0.00 1.20 -0.64 0.72 -0.73 0.00 0.00 179.01 179.56 2wyo n HIS 281 N -3.77 0.00 -2.83 0.92 8.25 -0.87 -5.00 115.22 111.93 2wyo n HIS 281 Ca -0.29 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.06 2wyo n HIS 281 Cb 0.95 -0.11 0.03 0.00 1.12 0.00 0.00 29.99 31.98 2wyo n HIS 281 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2wyo n ARG 282 N -1.19 -3.19 -4.28 -0.41 5.12 0.38 -4.92 116.66 108.17 2wyo n ARG 282 Ca 0.06 0.45 -0.25 0.00 -1.93 0.00 0.00 57.85 56.18 2wyo n ARG 282 Cb 0.35 -4.33 -0.17 0.00 -1.16 0.00 0.00 32.46 27.16 2wyo n ARG 282 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2wyo s ILE 283 N -2.99 1.08 0.57 0.55 1.01 -0.69 -4.98 121.20 115.75 2wyo s ILE 283 Ca 0.22 -0.39 -0.19 0.00 0.00 0.00 0.00 60.65 60.29 2wyo s ILE 283 Cb -0.10 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.30 2wyo s ILE 283 CO 0.27 0.36 1.15 -0.13 0.00 0.00 0.00 174.94 176.59 2wyo s ARG 284 N 1.12 3.18 -0.02 2.79 0.52 -1.26 -3.58 118.95 121.69 2wyo s ARG 284 Ca -0.06 1.66 0.05 0.00 -0.52 0.00 0.00 55.73 56.86 2wyo s ARG 284 Cb -0.14 -1.98 -0.01 0.00 0.52 0.00 0.00 34.95 33.34 2wyo s ARG 284 CO -0.02 -1.00 -0.17 -0.59 0.02 0.00 0.00 175.30 173.54 2wyo s PHE 285 N -1.77 1.56 -0.00 -0.53 -0.71 -1.26 -2.48 117.98 112.80 2wyo s PHE 285 Ca 0.74 -0.35 0.07 0.00 -1.04 0.00 0.00 56.93 56.35 2wyo s PHE 285 Cb -0.26 -1.03 -0.02 0.00 -1.21 0.00 0.00 43.02 40.51 2wyo s PHE 285 CO 0.30 -0.07 -0.21 0.96 -1.34 0.00 0.00 175.22 174.86 2wyo s ILE 286 N -0.24 1.68 -0.12 -4.49 -4.36 -0.80 -4.98 121.20 107.89 2wyo s ILE 286 Ca 0.03 -0.98 -0.13 0.00 -0.26 0.00 0.00 60.65 59.31 2wyo s ILE 286 Cb -0.08 -1.41 -0.05 0.00 1.25 0.00 0.00 42.46 42.17 2wyo s ILE 286 CO 0.00 0.41 0.30 -0.36 0.24 0.00 0.00 174.94 175.53 2wyo s PHE 287 N -0.57 3.53 0.09 1.37 0.08 -1.26 -0.46 117.98 120.75 2wyo s PHE 287 Ca 0.08 0.67 0.02 0.00 0.12 0.00 0.00 56.93 57.83 2wyo s PHE 287 Cb -0.08 -2.28 -0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2wyo s PHE 287 CO -0.00 0.38 -0.08 1.03 -0.10 0.00 0.00 175.22 176.45 2wyo s ARG 288 N -0.03 0.77 0.58 0.44 1.81 -0.70 -4.93 118.95 116.90 2wyo s ARG 288 Ca 0.18 -1.17 0.04 0.00 -1.72 0.00 0.00 55.73 53.07 2wyo s ARG 288 Cb -0.14 -0.31 0.07 0.00 -0.45 0.00 0.00 34.95 34.12 2wyo s ARG 288 CO 0.06 0.02 0.80 0.95 -0.68 0.00 0.00 175.30 176.45 2wyo s THR 289 N -2.85 2.45 0.22 0.02 -4.23 -1.26 -1.20 115.64 108.80 2wyo s THR 289 Ca 0.06 -0.81 -0.05 0.00 -1.18 0.00 0.00 61.69 59.71 2wyo s THR 289 Cb -0.00 -2.65 0.09 0.00 1.34 0.00 0.00 72.50 71.28 2wyo s THR 289 CO -0.02 0.00 1.70 -0.07 -0.54 0.00 0.00 174.62 175.69 2wyo h LEU 290 N 0.06 0.90 -0.62 4.79 3.38 -1.92 -2.79 115.31 119.12 2wyo h LEU 290 Ca -0.37 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.40 2wyo h LEU 290 Cb 1.28 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.75 2wyo h LEU 290 CO 0.44 0.97 0.36 1.56 0.09 0.00 0.00 178.44 181.86 2wyo h GLN 291 N 0.86 0.69 0.00 1.13 7.50 -1.91 -2.60 115.11 120.77 2wyo h GLN 291 Ca 0.16 -0.04 -0.14 0.00 0.50 0.00 0.00 58.65 59.13 2wyo h GLN 291 Cb 0.51 -0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.87 2wyo h GLN 291 CO 0.03 0.45 -0.67 0.93 -1.50 0.00 0.00 178.83 178.07 2wyo h GLU 292 N 0.71 0.00 -0.11 1.46 5.08 -1.93 -2.93 114.58 116.85 2wyo h GLU 292 Ca 0.26 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.59 2wyo h GLU 292 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2wyo h GLU 292 CO -0.13 0.67 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.44 2wyo h LEU 293 N 0.00 0.15 -1.88 1.33 3.38 -1.19 -0.69 115.31 116.41 2wyo h LEU 293 Ca -0.01 -0.02 0.23 0.00 0.09 0.00 0.00 57.88 58.17 2wyo h LEU 293 Cb 1.25 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.92 2wyo h LEU 293 CO 0.09 0.23 0.59 -0.74 0.09 0.00 0.00 178.44 178.69 2wyo h HIS 294 N 0.16 0.13 0.00 1.13 2.76 -1.36 0.52 115.15 118.49 2wyo h HIS 294 Ca 0.04 0.00 -0.23 0.00 -2.20 0.00 0.00 60.37 57.98 2wyo h HIS 294 Cb 0.19 -0.04 -0.04 0.00 1.55 0.00 0.00 27.41 29.08 2wyo h HIS 294 CO 0.00 0.03 -1.79 1.28 -1.30 0.00 0.00 177.93 176.16 2wyo n LEU 295 N -4.35 1.31 -0.27 0.26 4.77 -1.09 -4.69 117.00 112.94 2wyo n LEU 295 Ca 0.17 0.13 0.05 0.00 -0.03 0.00 0.00 56.01 56.33 2wyo n LEU 295 Cb 0.84 -0.42 0.19 0.00 -2.33 0.00 0.00 43.42 41.69 2wyo n LEU 295 CO 0.36 0.36 1.07 0.28 -1.33 0.00 0.00 177.39 178.14 2wyo h SER 296 N -0.43 0.46 -3.10 -1.43 0.02 -1.10 -3.44 113.55 104.54 2wyo h SER 296 Ca -0.35 0.08 -0.60 0.00 -0.84 0.00 0.00 61.79 60.08 2wyo h SER 296 Cb 1.34 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.83 2wyo h SER 296 CO -0.19 0.22 -0.22 -0.22 -1.14 0.00 0.00 176.83 175.28 2wyo s LEU 297 N -10.37 4.40 -0.08 5.07 2.96 0.17 -0.28 118.68 120.56 2wyo s LEU 297 Ca -0.12 0.85 -0.11 0.00 -0.22 0.00 0.00 54.13 54.53 2wyo s LEU 297 Cb 0.20 -2.56 0.02 0.00 0.50 0.00 0.00 46.19 44.36 2wyo s LEU 297 CO 0.77 0.23 0.28 -0.54 -1.32 0.00 0.00 176.35 175.78 2wyo s LYS 298 N -0.53 0.43 -0.14 1.98 1.02 -0.41 -4.81 119.74 117.30 2wyo s LYS 298 Ca 0.23 0.19 -0.05 0.00 0.02 0.00 0.00 55.97 56.35 2wyo s LYS 298 Cb -0.16 0.20 -0.04 0.00 -0.52 0.00 0.00 37.83 37.32 2wyo s LYS 298 CO 0.11 -0.08 0.05 -0.51 -0.92 0.00 0.00 175.35 174.00 2wyo s LEU 299 N -0.34 3.84 -0.14 3.17 1.43 -1.26 -1.85 118.68 123.52 2wyo s LEU 299 Ca -0.05 0.18 -0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2wyo s LEU 299 Cb -0.03 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.29 2wyo s LEU 299 CO 0.01 0.29 -0.08 -1.00 0.23 0.00 0.00 176.35 175.81 2wyo s HIS 300 N -0.35 1.72 0.55 0.29 3.76 0.07 -4.98 115.29 116.34 2wyo s HIS 300 Ca 0.09 -0.97 -0.16 0.00 -0.15 0.00 0.00 55.06 53.87 2wyo s HIS 300 Cb -0.12 -1.34 -0.06 0.00 1.11 0.00 0.00 32.58 32.16 2wyo s HIS 300 CO 0.02 -0.58 1.01 -1.12 -0.85 0.00 0.00 174.74 173.21 2wyo s SER 301 N 1.63 6.34 0.07 1.40 0.01 -1.26 -1.51 113.70 120.38 2wyo s SER 301 Ca 0.03 1.62 0.00 0.00 1.31 0.00 0.00 55.95 58.91 2wyo s SER 301 Cb -0.14 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2wyo s SER 301 CO -0.09 -0.78 0.00 -0.38 0.41 0.00 0.00 173.24 172.40 2wyo n ILE 302 N -1.84 0.26 -3.73 1.44 -0.00 -1.26 -4.94 119.36 109.29 2wyo n ILE 302 Ca 0.07 0.09 -0.23 0.00 -0.00 0.00 0.00 62.75 62.68 2wyo n ILE 302 Cb 0.54 -1.10 -0.18 0.00 -0.00 0.00 0.00 39.64 38.90 2wyo n ILE 302 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 2wyo s SER 303 N -5.21 1.65 0.61 4.38 0.15 -1.26 -5.02 113.70 108.99 2wyo s SER 303 Ca 0.00 -0.15 0.27 0.00 0.70 0.00 0.00 55.95 56.77 2wyo s SER 303 Cb 0.00 -0.37 1.14 0.00 -1.71 0.00 0.00 66.02 65.08 2wyo s SER 303 CO 0.00 -0.23 1.55 -0.65 1.20 0.00 0.00 173.24 175.11 2wyo h PRO 304 N 8.35 0.00 -0.00 5.44 0.11 -1.98 1.06 132.00 144.99 2wyo h PRO 304 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2wyo h PRO 304 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2wyo h PRO 304 CO 0.24 0.00 -0.00 0.39 -0.21 0.00 0.00 178.00 178.42 2wyo n GLU 305 N -3.37 1.02 -4.26 1.05 1.02 -1.26 -4.75 120.64 110.09 2wyo n GLU 305 Ca 0.15 -0.10 -0.19 0.00 -0.02 0.00 0.00 57.16 57.00 2wyo n GLU 305 Cb 1.12 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.89 2wyo n GLU 305 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2wyo s GLN 306 N -2.05 0.75 0.78 3.49 2.00 0.37 -5.02 119.66 119.97 2wyo s GLN 306 Ca 0.45 -0.21 -0.11 0.00 -2.00 0.00 0.00 55.36 53.50 2wyo s GLN 306 Cb 0.22 -0.73 0.06 0.00 0.80 0.00 0.00 33.01 33.36 2wyo s GLN 306 CO 0.38 0.06 1.10 -1.25 -0.50 0.00 0.00 175.29 175.07 2wyo s PRO 307 N 0.30 2.17 0.15 1.67 0.04 -1.26 -4.32 135.00 133.76 2wyo s PRO 307 Ca -0.04 1.22 -0.27 0.00 0.04 0.00 0.00 61.00 61.95 2wyo s PRO 307 Cb -0.08 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 2wyo s PRO 307 CO 0.00 -1.72 0.82 -1.25 0.04 0.00 0.00 177.00 174.90 2wyo s PRO 308 N -4.83 4.63 0.30 0.56 0.04 -1.26 -4.59 135.00 129.85 2wyo s PRO 308 Ca 0.62 1.24 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 2wyo s PRO 308 Cb -0.18 -3.29 -0.13 0.00 0.04 0.00 0.00 34.50 30.93 2wyo s PRO 308 CO 0.55 0.48 1.16 -0.11 0.04 0.00 0.00 177.00 179.12 2wyo n LEU 309 N 1.89 2.58 -4.39 -3.56 7.94 -0.57 -2.76 117.00 118.13 2wyo n LEU 309 Ca -0.04 1.19 -0.37 0.00 -1.11 0.00 0.00 56.01 55.68 2wyo n LEU 309 Cb 0.49 -1.37 -0.13 0.00 0.53 0.00 0.00 43.42 42.94 2wyo n LEU 309 CO 0.48 -0.96 -0.28 0.00 -1.11 0.00 0.00 177.39 175.52 2wyo s ALA 310 N -0.94 3.10 -0.18 1.96 0.00 -1.26 -0.75 121.76 123.69 2wyo s ALA 310 Ca 0.59 -1.30 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 2wyo s ALA 310 Cb -0.65 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.33 2wyo s ALA 310 CO 0.60 -0.72 -0.01 0.14 0.00 0.00 0.00 175.76 175.77 2wyo s VAL 311 N 1.55 4.04 -0.05 0.00 -7.23 -0.77 -1.94 120.40 116.00 2wyo s VAL 311 Ca 0.05 -0.30 -0.13 0.00 -1.81 0.00 0.00 61.98 59.79 2wyo s VAL 311 Cb -0.16 -2.80 -0.05 0.00 0.56 0.00 0.00 36.38 33.93 2wyo s VAL 311 CO 0.03 0.47 0.34 -0.69 -0.31 0.00 0.00 175.10 174.93 2wyo s VAL 312 N 0.59 5.17 -1.45 1.32 1.01 -0.84 -1.28 120.40 124.91 2wyo s VAL 312 Ca -0.01 0.68 0.00 0.00 0.00 0.00 0.00 61.98 62.65 2wyo s VAL 312 Cb -0.14 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2wyo s VAL 312 CO 0.02 0.55 0.00 0.47 0.00 0.00 0.00 175.10 176.14 2wyo n ASP 313 N 2.20 -5.44 -1.97 3.32 9.92 0.61 -2.14 116.55 123.04 2wyo n ASP 313 Ca -0.15 0.34 -0.18 0.00 -0.53 0.00 0.00 54.79 54.27 2wyo n ASP 313 Cb 0.53 -4.15 -0.04 0.00 -0.64 0.00 0.00 41.12 36.82 2wyo n ASP 313 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wyo n GLY 314 N -0.24 0.60 1.17 0.44 0.00 -1.26 -4.67 105.19 101.23 2wyo n GLY 314 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2wyo n GLY 314 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2wyo n HIS 315 N -2.99 -0.60 -1.71 1.61 1.44 -1.17 -4.50 115.22 107.30 2wyo n HIS 315 Ca -0.20 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.14 2wyo n HIS 315 Cb 0.63 0.29 -0.03 0.00 0.12 0.00 0.00 29.99 31.00 2wyo n HIS 315 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 2wyo s TYR 316 N -1.58 1.27 0.01 -1.40 2.02 -0.91 -3.13 117.35 113.63 2wyo s TYR 316 Ca 0.00 1.21 -0.27 0.00 -0.37 0.00 0.00 57.07 57.64 2wyo s TYR 316 Cb 0.00 -3.78 -0.04 0.00 -0.40 0.00 0.00 41.96 37.74 2wyo s TYR 316 CO 0.00 -2.66 0.86 -1.25 -1.57 0.00 0.00 175.55 170.94 2wyo s PRO 317 N 7.61 4.54 -0.52 -1.71 0.04 -1.26 -1.99 135.00 141.70 2wyo s PRO 317 Ca 0.89 1.22 -0.18 0.00 0.04 0.00 0.00 61.00 62.97 2wyo s PRO 317 Cb -0.18 -3.42 0.08 0.00 0.04 0.00 0.00 34.50 31.03 2wyo s PRO 317 CO 0.26 0.10 0.56 0.42 0.04 0.00 0.00 177.00 178.37 2wyo s ILE 318 N 0.55 5.02 0.01 0.56 -1.09 -0.82 -1.62 121.20 123.81 2wyo s ILE 318 Ca 0.45 -0.93 -0.19 0.00 -2.23 0.00 0.00 60.65 57.74 2wyo s ILE 318 Cb -0.20 -4.30 -0.26 0.00 -1.58 0.00 0.00 42.46 36.11 2wyo s ILE 318 CO 0.25 -0.83 1.06 0.00 -1.23 0.00 0.00 174.94 174.19 2wyo h ALA 319 N 8.95 0.03 -3.53 9.38 0.00 -1.51 -3.40 119.26 129.19 2wyo h ALA 319 Ca -0.29 -0.64 -0.30 0.00 0.00 0.00 0.00 54.91 53.68 2wyo h ALA 319 Cb 1.10 0.06 -0.34 0.00 0.00 0.00 0.00 17.79 18.62 2wyo h ALA 319 CO 0.98 0.43 -0.73 0.08 0.00 0.00 0.00 179.25 180.01 2wyo s VAL 320 N -3.01 -0.00 -0.51 0.00 1.01 -1.21 -1.83 120.40 114.84 2wyo s VAL 320 Ca -0.12 0.17 -0.17 0.00 0.00 0.00 0.00 61.98 61.86 2wyo s VAL 320 Cb 0.03 -0.12 0.08 0.00 0.00 0.00 0.00 36.38 36.38 2wyo s VAL 320 CO 0.85 0.10 0.53 0.00 0.00 0.00 0.00 175.10 176.58 2wyo s ALA 321 N 0.98 3.50 -0.29 5.51 0.00 -0.60 -1.43 121.76 129.43 2wyo s ALA 321 Ca -0.09 -2.10 -0.11 0.00 0.00 0.00 0.00 51.96 49.67 2wyo s ALA 321 Cb -0.12 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2wyo s ALA 321 CO -0.02 -1.97 0.19 -0.47 0.00 0.00 0.00 175.76 173.49 2wyo s TYR 322 N 2.11 3.21 -0.33 0.00 5.04 0.08 -0.32 117.35 127.13 2wyo s TYR 322 Ca 0.08 -0.02 -0.17 0.00 -2.44 0.00 0.00 57.07 54.53 2wyo s TYR 322 Cb -0.24 -2.39 -0.01 0.00 0.35 0.00 0.00 41.96 39.67 2wyo s TYR 322 CO 0.07 -0.23 0.45 -0.06 -1.34 0.00 0.00 175.55 174.45 2wyo s PHE 323 N 1.74 3.20 -0.73 4.97 0.08 -0.31 -1.23 117.98 125.71 2wyo s PHE 323 Ca 0.07 0.18 -0.00 0.00 0.12 0.00 0.00 56.93 57.30 2wyo s PHE 323 Cb -0.16 -2.79 0.38 0.00 -0.57 0.00 0.00 43.02 39.88 2wyo s PHE 323 CO 0.10 -0.45 1.82 0.54 -0.10 0.00 0.00 175.22 177.13 2wyo n ARG 324 N 5.57 2.91 0.00 0.44 5.12 -0.99 -3.01 116.66 126.69 2wyo n ARG 324 Ca -0.06 -3.71 0.00 0.00 -1.93 0.00 0.00 57.85 52.15 2wyo n ARG 324 Cb 0.49 -2.27 0.00 0.00 -1.16 0.00 0.00 32.46 29.52 2wyo n ARG 324 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2wyo n SER 325 N -0.58 0.00 0.00 0.55 2.88 -1.12 -3.97 113.62 111.38 2wyo n SER 325 Ca 0.52 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 2wyo n SER 325 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 2wyo n SER 325 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wyo n THR 326 N -0.21 0.00 0.96 2.46 -2.24 -1.26 -4.85 114.28 109.14 2wyo n THR 326 Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 2wyo n THR 326 Cb 0.00 -0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 68.06 2wyo n THR 326 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wyo n TYR 327 N -2.77 0.00 -4.73 4.78 0.18 -1.26 -4.96 117.16 108.41 2wyo n TYR 327 Ca 0.00 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.49 2wyo n TYR 327 Cb 0.00 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 38.82 2wyo n TYR 327 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 2wyo s VAL 328 N -2.73 2.04 0.16 -3.48 1.01 -1.26 -5.04 120.40 111.11 2wyo s VAL 328 Ca 0.11 -1.43 -0.19 0.00 0.00 0.00 0.00 61.98 60.47 2wyo s VAL 328 Cb 0.16 -1.77 0.08 0.00 0.00 0.00 0.00 36.38 34.85 2wyo s VAL 328 CO 0.73 0.26 1.65 -0.65 0.00 0.00 0.00 175.10 177.09 2wyo h PRO 329 N 4.60 -0.11 0.00 2.72 0.11 -1.96 -2.06 132.00 135.31 2wyo h PRO 329 Ca -0.46 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wyo h PRO 329 Cb 1.15 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wyo h PRO 329 CO 0.43 -0.07 0.64 0.93 -0.21 0.00 0.00 178.00 179.72 2wyo h GLU 330 N -0.11 0.00 -0.01 1.05 3.07 -2.01 0.19 114.58 116.75 2wyo h GLU 330 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 2wyo h GLU 330 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 2wyo h GLU 330 CO -0.42 0.00 -0.50 -0.25 -1.40 0.00 0.00 179.01 176.44 2wyo n ASP 331 N -2.16 1.76 -3.27 1.42 8.00 -0.77 -4.24 116.55 117.29 2wyo n ASP 331 Ca -0.00 -1.36 -0.30 0.00 0.71 0.00 0.00 54.79 53.84 2wyo n ASP 331 Cb 0.65 0.48 -0.04 0.00 -0.02 0.00 0.00 41.12 42.19 2wyo n ASP 331 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2wyo n PHE 332 N -0.28 3.63 0.04 1.24 3.72 0.65 -4.84 117.46 121.62 2wyo n PHE 332 Ca 0.09 -3.75 -0.06 0.00 -0.05 0.00 0.00 57.45 53.68 2wyo n PHE 332 Cb 0.44 -0.66 -0.04 0.00 -0.94 0.00 0.00 39.48 38.28 2wyo n PHE 332 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2wyo h PRO 333 N 3.71 -0.21 -7.16 -1.08 0.13 -1.74 -3.46 132.00 122.19 2wyo h PRO 333 Ca 0.21 0.01 -0.45 0.00 -0.87 0.00 0.00 66.00 64.90 2wyo h PRO 333 Cb 0.54 0.05 0.07 0.00 0.13 0.00 0.00 31.00 31.78 2wyo h PRO 333 CO 0.91 -0.00 0.15 0.95 -0.23 0.00 0.00 178.00 179.79 2wyo s THR 334 N -2.51 2.59 0.04 1.56 -4.23 -1.26 -5.00 115.64 106.83 2wyo s THR 334 Ca -0.06 -0.33 0.13 0.00 -1.18 0.00 0.00 61.69 60.25 2wyo s THR 334 Cb 0.00 -3.07 0.00 0.00 1.34 0.00 0.00 72.50 70.77 2wyo s THR 334 CO 0.21 -0.07 1.49 -0.78 -0.54 0.00 0.00 174.62 174.93 2wyo h ASP 335 N -0.37 0.00 -0.98 3.99 1.82 -2.01 -2.89 116.42 115.98 2wyo h ASP 335 Ca -0.44 0.00 0.21 0.00 -0.39 0.00 0.00 57.03 56.41 2wyo h ASP 335 Cb 1.30 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.22 2wyo h ASP 335 CO 0.58 0.61 0.62 0.00 -1.61 0.00 0.00 179.24 179.45 2wyo h ALA 336 N 1.39 1.97 0.60 -0.78 0.00 -1.97 -0.68 119.26 119.79 2wyo h ALA 336 Ca -0.01 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2wyo h ALA 336 Cb 1.33 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2wyo h ALA 336 CO 0.08 -0.33 -0.36 1.15 0.00 0.00 0.00 179.25 179.79 2wyo h THR 337 N 0.57 0.26 -0.35 0.00 2.02 -1.78 0.29 112.91 113.92 2wyo h THR 337 Ca 0.55 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.71 2wyo h THR 337 Cb 1.12 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 2wyo h THR 337 CO -0.30 0.00 0.15 -0.50 0.37 0.00 0.00 175.52 175.25 2wyo h TRP 338 N -0.91 0.48 -0.16 3.16 4.06 -1.53 -0.10 115.95 120.96 2wyo h TRP 338 Ca -0.07 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.86 2wyo h TRP 338 Cb 0.73 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.73 2wyo h TRP 338 CO -0.09 0.37 0.06 0.00 -3.56 0.00 0.00 178.44 175.22 2wyo h ALA 339 N 1.68 0.21 0.21 1.49 0.00 -0.78 -1.34 119.26 120.72 2wyo h ALA 339 Ca 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2wyo h ALA 339 Cb 0.08 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2wyo h ALA 339 CO -0.01 -0.20 -0.11 0.00 0.00 0.00 0.00 179.25 178.93 2wyo h ALA 340 N 0.89 -0.29 -0.80 0.00 0.00 0.05 0.29 119.26 119.39 2wyo h ALA 340 Ca 0.05 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.03 2wyo h ALA 340 Cb 0.19 0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.02 2wyo h ALA 340 CO -0.00 -0.67 0.40 -0.09 0.00 0.00 0.00 179.25 178.89 2wyo h ARG 341 N -0.30 0.60 0.68 0.00 9.65 -0.99 -0.35 114.38 123.68 2wyo h ARG 341 Ca -0.02 -0.04 -0.03 0.00 -1.10 0.00 0.00 59.98 58.79 2wyo h ARG 341 Cb 0.24 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.68 2wyo h ARG 341 CO 0.04 0.40 -0.34 1.25 2.80 0.00 0.00 179.97 184.11 2wyo h LEU 342 N 0.62 -0.83 -0.92 3.80 5.85 -0.96 -1.55 115.31 121.33 2wyo h LEU 342 Ca 0.42 0.03 0.25 0.00 0.84 0.00 0.00 57.88 59.43 2wyo h LEU 342 Cb 0.54 0.22 -0.16 0.00 0.37 0.00 0.00 40.66 41.62 2wyo h LEU 342 CO -0.33 -0.57 0.11 0.28 -0.34 0.00 0.00 178.44 177.59 2wyo h SER 343 N -0.94 -0.27 -0.48 1.25 0.02 0.37 0.21 113.55 113.72 2wyo h SER 343 Ca -0.09 0.24 -0.11 0.00 -0.84 0.00 0.00 61.79 60.99 2wyo h SER 343 Cb 0.73 0.39 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 2wyo h SER 343 CO 0.14 -0.27 -0.14 -0.07 -1.14 0.00 0.00 176.83 175.35 2wyo h LEU 344 N 0.08 0.94 -0.34 5.07 3.38 -0.89 -3.21 115.31 120.34 2wyo h LEU 344 Ca 0.57 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 58.12 2wyo h LEU 344 Cb 1.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2wyo h LEU 344 CO -0.80 1.10 0.00 -0.08 0.09 0.00 0.00 178.44 178.76 2wyo h GLU 345 N 0.78 0.60 0.00 1.13 4.57 0.43 -2.77 114.58 119.32 2wyo h GLU 345 Ca 0.12 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2wyo h GLU 345 Cb 0.70 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 2wyo h GLU 345 CO 0.05 0.72 0.00 0.00 -1.18 0.00 0.00 179.01 178.60 2wyo h ARG 346 N 0.41 0.00 0.00 1.92 3.08 -1.40 -3.44 114.38 114.95 2wyo h ARG 346 Ca 0.10 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.97 2wyo h ARG 346 Cb 0.44 0.00 0.08 0.00 0.08 0.00 0.00 29.97 30.58 2wyo h ARG 346 CO 0.02 0.00 0.09 -1.13 -1.07 0.00 0.00 179.97 177.88 2wyo n SER 347 N -2.63 -1.06 -0.72 7.04 3.41 -1.05 -4.42 113.62 114.19 2wyo n SER 347 Ca 0.00 -0.91 0.12 0.00 -0.26 0.00 0.00 58.87 57.83 2wyo n SER 347 Cb 0.20 -0.44 0.34 0.00 -0.26 0.00 0.00 64.21 64.05 2wyo n SER 347 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wyo n SER 348 N -3.70 2.20 -4.71 4.04 3.41 -1.11 -3.75 113.62 110.00 2wyo n SER 348 Ca 0.07 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.51 2wyo n SER 348 Cb 0.26 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 2wyo n SER 348 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wyo s ALA 349 N -1.85 3.37 -0.32 7.33 0.00 -1.26 -4.86 121.76 124.16 2wyo s ALA 349 Ca 0.34 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 52.84 2wyo s ALA 349 Cb 0.20 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 2wyo s ALA 349 CO 0.30 -0.41 1.74 0.42 0.00 0.00 0.00 175.76 177.81 2wyo s ILE 350 N 1.02 3.54 0.07 0.00 1.01 -0.76 -4.72 121.20 121.36 2wyo s ILE 350 Ca 0.58 0.56 -0.07 0.00 0.00 0.00 0.00 60.65 61.72 2wyo s ILE 350 Cb -0.29 -3.69 -0.05 0.00 0.01 0.00 0.00 42.46 38.44 2wyo s ILE 350 CO 0.29 -0.42 0.33 -0.54 0.00 0.00 0.00 174.94 174.60 2wyo s LYS 351 N 5.44 3.63 -0.37 2.79 1.02 -1.26 -1.56 119.74 129.43 2wyo s LYS 351 Ca 0.77 -0.03 0.02 0.00 0.02 0.00 0.00 55.97 56.75 2wyo s LYS 351 Cb -0.22 -2.99 0.15 0.00 -0.52 0.00 0.00 37.83 34.25 2wyo s LYS 351 CO 0.33 0.57 0.29 0.00 -0.92 0.00 0.00 175.35 175.62 2wyo s PRO 353 N 0.89 3.60 0.67 0.00 0.04 -1.26 -1.16 135.00 137.78 2wyo s PRO 353 Ca 0.22 0.45 -0.11 0.00 0.04 0.00 0.00 61.00 61.60 2wyo s PRO 353 Cb -0.14 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 2wyo s PRO 353 CO -0.05 -0.32 1.05 -1.54 0.04 0.00 0.00 177.00 176.18 2wyo s SER 354 N -4.01 5.69 0.18 6.66 1.04 -1.11 -4.78 113.70 117.37 2wyo s SER 354 Ca 0.51 1.55 -0.14 0.00 0.48 0.00 0.00 55.95 58.34 2wyo s SER 354 Cb -0.11 -2.49 0.16 0.00 0.10 0.00 0.00 66.02 63.69 2wyo s SER 354 CO 0.46 -1.24 1.68 0.40 0.98 0.00 0.00 173.24 175.53 2wyo h ILE 355 N -0.57 0.62 -0.65 -1.02 1.08 -1.98 0.28 117.51 115.26 2wyo h ILE 355 Ca -0.44 -0.03 0.11 0.00 -0.39 0.00 0.00 64.86 64.10 2wyo h ILE 355 Cb 1.20 0.52 -0.08 0.00 -3.07 0.00 0.00 36.82 35.39 2wyo h ILE 355 CO 0.59 0.02 0.25 -0.65 -0.69 0.00 0.00 178.15 177.66 2wyo h PRO 356 N 0.10 0.41 -0.13 2.37 0.10 -1.94 0.37 132.00 133.27 2wyo h PRO 356 Ca 0.23 -0.02 0.01 0.00 0.10 0.00 0.00 66.00 66.32 2wyo h PRO 356 Cb 0.35 -0.09 -0.01 0.00 0.10 0.00 0.00 31.00 31.35 2wyo h PRO 356 CO -0.40 0.27 0.06 1.88 0.10 0.00 0.00 178.00 179.91 2wyo h TYR 357 N 0.42 0.12 -0.68 0.65 0.99 -1.29 -2.75 116.97 114.43 2wyo h TYR 357 Ca 0.33 0.01 0.15 0.00 2.00 0.00 0.00 58.73 61.22 2wyo h TYR 357 Cb 0.44 -0.03 -0.12 0.00 1.00 0.00 0.00 36.73 38.02 2wyo h TYR 357 CO -0.17 0.07 0.00 1.25 -0.00 0.00 0.00 178.16 179.31 2wyo h HIS 358 N 0.14 -0.05 -0.56 4.88 2.76 0.71 -1.45 115.15 121.59 2wyo h HIS 358 Ca 0.05 0.05 0.08 0.00 -2.20 0.00 0.00 60.37 58.35 2wyo h HIS 358 Cb 0.01 0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.06 2wyo h HIS 358 CO -0.09 -0.20 0.37 -0.07 -1.30 0.00 0.00 177.93 176.65 2wyo h LEU 359 N 0.11 0.38 -0.48 0.26 3.38 -0.68 -1.64 115.31 116.64 2wyo h LEU 359 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2wyo h LEU 359 Cb 0.60 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2wyo h LEU 359 CO -0.59 0.24 0.00 0.18 0.09 0.00 0.00 178.44 178.36 2wyo n LEU 360 N -4.47 0.29 0.04 1.67 4.32 -0.55 -1.35 117.00 116.95 2wyo n LEU 360 Ca 0.08 0.60 0.11 0.00 -0.02 0.00 0.00 56.01 56.79 2wyo n LEU 360 Cb 0.32 -0.59 0.47 0.00 -1.62 0.00 0.00 43.42 41.99 2wyo n LEU 360 CO 0.34 -0.54 0.86 0.41 -1.22 0.00 0.00 177.39 177.24 2wyo n THR 361 N -1.85 0.54 -2.43 -5.08 -1.04 -0.61 -4.68 114.28 99.13 2wyo n THR 361 Ca 0.01 0.06 -0.41 0.00 -2.04 0.00 0.00 64.05 61.67 2wyo n THR 361 Cb 0.11 -0.77 -0.04 0.00 -1.82 0.00 0.00 70.33 67.81 2wyo n THR 361 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2wyo s PHE 362 N -3.07 3.50 0.45 -1.42 0.08 -0.46 -4.90 117.98 112.17 2wyo s PHE 362 Ca 0.10 1.56 0.24 0.00 0.12 0.00 0.00 56.93 58.95 2wyo s PHE 362 Cb 0.13 -3.35 1.24 0.00 -0.57 0.00 0.00 43.02 40.47 2wyo s PHE 362 CO 0.44 -0.86 1.81 0.87 -0.10 0.00 0.00 175.22 177.38 2wyo h LYS 363 N 4.59 0.25 0.00 0.44 1.79 -1.89 -0.88 116.57 120.87 2wyo h LYS 363 Ca -0.45 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 57.96 2wyo h LYS 363 Cb 1.21 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.80 2wyo h LYS 363 CO 0.71 0.17 -0.18 -0.22 -1.08 0.00 0.00 179.45 178.84 2wyo h LYS 364 N 0.26 0.00 0.00 3.15 1.63 -1.94 -1.23 116.57 118.44 2wyo h LYS 364 Ca 0.54 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 60.19 2wyo h LYS 364 Cb 1.61 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.21 2wyo h LYS 364 CO -0.17 0.18 -1.14 -0.07 -3.45 0.00 0.00 179.45 174.80 2wyo h LEU 365 N 0.00 0.00 -0.17 5.20 4.07 -1.48 -0.13 115.31 122.80 2wyo h LEU 365 Ca -0.00 0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.00 2wyo h LEU 365 Cb 0.47 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.16 2wyo h LEU 365 CO 0.02 0.54 -0.09 -0.61 -1.08 0.00 0.00 178.44 177.22 2wyo h GLN 366 N 0.00 -0.07 -0.07 1.13 4.15 -1.24 -0.85 115.11 118.16 2wyo h GLN 366 Ca -0.11 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.31 2wyo h GLN 366 Cb 1.51 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 29.21 2wyo h GLN 366 CO 0.05 -0.05 0.03 0.37 -1.93 0.00 0.00 178.83 177.31 2wyo h GLN 367 N -0.08 0.09 -0.19 1.69 4.15 -1.29 -3.12 115.11 116.37 2wyo h GLN 367 Ca 0.10 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 2wyo h GLN 367 Cb 0.22 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 2wyo h GLN 367 CO -0.22 0.17 -0.02 -0.07 -1.93 0.00 0.00 178.83 176.76 2wyo h LEU 368 N -0.00 0.25 -0.04 -2.39 3.38 -0.93 -2.28 115.31 113.30 2wyo h LEU 368 Ca 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2wyo h LEU 368 Cb 0.10 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2wyo h LEU 368 CO -0.00 0.32 0.00 0.18 0.09 0.00 0.00 178.44 179.03 2wyo n LEU 369 N -4.36 0.07 0.10 1.67 4.77 -0.33 -2.76 117.00 116.17 2wyo n LEU 369 Ca -0.00 0.51 0.12 0.00 -0.03 0.00 0.00 56.01 56.61 2wyo n LEU 369 Cb 0.19 -0.50 0.45 0.00 -2.33 0.00 0.00 43.42 41.24 2wyo n LEU 369 CO 0.37 -0.17 0.87 0.00 -1.33 0.00 0.00 177.39 177.12 2wyo s ASP 371 N -4.21 6.25 0.08 0.00 -1.08 -1.11 -4.91 116.67 111.68 2wyo s ASP 371 Ca 0.08 -0.49 -0.20 0.00 -0.52 0.00 0.00 52.55 51.41 2wyo s ASP 371 Cb 0.11 -2.49 -0.10 0.00 -1.46 0.00 0.00 42.92 38.98 2wyo s ASP 371 CO 0.48 -1.53 1.57 0.58 0.52 0.00 0.00 175.17 176.78 2wyo h VAL 372 N 6.03 1.20 -0.06 1.11 2.07 -1.89 -0.72 116.25 123.99 2wyo h VAL 372 Ca -0.27 -0.64 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 2wyo h VAL 372 Cb 1.06 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 2wyo h VAL 372 CO 1.19 0.20 -0.03 0.44 0.02 0.00 0.00 177.57 179.39 2wyo h ASP 373 N 0.09 0.13 0.07 0.57 5.19 -1.97 -1.56 116.42 118.94 2wyo h ASP 373 Ca 0.05 -0.42 -0.13 0.00 -0.62 0.00 0.00 57.03 55.92 2wyo h ASP 373 Cb 0.26 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.75 2wyo h ASP 373 CO 0.00 0.52 -0.56 0.03 -3.12 0.00 0.00 179.24 176.11 2wyo h ARG 374 N -0.25 0.25 0.00 3.56 3.08 -1.96 -3.40 114.38 115.65 2wyo h ARG 374 Ca 0.01 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2wyo h ARG 374 Cb 0.47 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2wyo h ARG 374 CO 0.01 1.13 -0.51 0.28 -1.07 0.00 0.00 179.97 179.82 2wyo n VAL 375 N -4.28 1.31 -0.10 2.04 0.31 -0.79 -4.43 118.33 112.39 2wyo n VAL 375 Ca -0.12 0.27 -0.07 0.00 -0.01 0.00 0.00 64.34 64.41 2wyo n VAL 375 Cb 0.69 -1.96 0.01 0.00 -0.91 0.00 0.00 33.84 31.68 2wyo n VAL 375 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2wyo h LEU 376 N -0.51 0.19 0.13 7.52 5.85 -1.15 -0.66 115.31 126.67 2wyo h LEU 376 Ca 0.00 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2wyo h LEU 376 Cb 0.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.54 2wyo h LEU 376 CO 0.00 0.15 -0.06 0.58 -0.34 0.00 0.00 178.44 178.76 2wyo h VAL 377 N 0.31 0.31 0.00 1.05 2.07 -1.53 -2.44 116.25 116.03 2wyo h VAL 377 Ca 0.16 -1.05 -0.18 0.00 0.82 0.00 0.00 66.70 66.44 2wyo h VAL 377 Cb 0.10 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2wyo h VAL 377 CO -0.14 0.10 -0.88 1.55 0.02 0.00 0.00 177.57 178.22 2wyo h PRO 378 N -1.02 0.00 0.01 1.57 0.13 -1.77 0.27 132.00 131.20 2wyo h PRO 378 Ca -0.02 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.71 2wyo h PRO 378 Cb 0.29 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.36 2wyo h PRO 378 CO 0.03 0.88 -2.33 0.28 -0.23 0.00 0.00 178.00 176.63 2wyo n VAL 379 N -3.33 1.54 0.05 1.56 0.31 -0.33 -3.59 118.33 114.55 2wyo n VAL 379 Ca 0.00 -0.45 -0.22 0.00 -0.01 0.00 0.00 64.34 63.66 2wyo n VAL 379 Cb 0.88 -1.70 -0.15 0.00 -0.91 0.00 0.00 33.84 31.97 2wyo n VAL 379 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wyo h ALA 380 N -0.44 0.13 -0.30 3.52 0.00 -1.35 -3.37 119.26 117.46 2wyo h ALA 380 Ca -0.59 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.24 2wyo h ALA 380 Cb 1.74 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.97 2wyo h ALA 380 CO -0.22 0.90 0.00 1.19 0.00 0.00 0.00 179.25 181.12 2wyo n PHE 381 N -3.75 0.53 -3.98 0.00 3.72 -0.92 -4.27 117.46 108.80 2wyo n PHE 381 Ca -0.24 -0.59 -0.26 0.00 -0.05 0.00 0.00 57.45 56.31 2wyo n PHE 381 Cb 1.00 -0.10 -0.02 0.00 -0.94 0.00 0.00 39.48 39.42 2wyo n PHE 381 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wyo n GLY 383 N -1.99 0.05 3.10 0.00 0.00 0.88 -4.96 105.19 102.27 2wyo n GLY 383 Ca -0.30 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 2wyo n GLY 383 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wyo s ASP 384 N -3.55 5.17 0.33 1.61 -1.08 -0.88 -4.97 116.67 113.29 2wyo s ASP 384 Ca 0.10 -2.20 0.01 0.00 -0.52 0.00 0.00 52.55 49.95 2wyo s ASP 384 Cb -0.05 -1.81 0.57 0.00 -1.46 0.00 0.00 42.92 40.17 2wyo s ASP 384 CO 0.40 -0.49 1.94 -1.28 0.52 0.00 0.00 175.17 176.26 2wyo h SER 385 N 7.80 0.71 -0.40 -0.34 0.87 -1.90 -3.02 113.55 117.27 2wyo h SER 385 Ca -0.10 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.38 2wyo h SER 385 Cb 1.03 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.79 2wyo h SER 385 CO 0.68 0.60 0.19 0.44 -0.53 0.00 0.00 176.83 178.21 2wyo h ASP 386 N 0.80 0.53 -0.35 6.23 3.32 -1.99 -1.77 116.42 123.18 2wyo h ASP 386 Ca 0.20 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2wyo h ASP 386 Cb 0.06 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2wyo h ASP 386 CO -0.03 0.52 0.10 0.11 -1.72 0.00 0.00 179.24 178.22 2wyo h LYS 387 N 0.51 0.56 -0.54 3.56 1.57 -1.97 0.31 116.57 120.56 2wyo h LYS 387 Ca 0.14 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2wyo h LYS 387 Cb 0.13 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 2wyo h LYS 387 CO -0.02 0.59 0.30 0.00 -0.57 0.00 0.00 179.45 179.76 2wyo h ALA 388 N 0.94 1.52 -0.23 3.86 0.00 -1.47 -1.18 119.26 122.70 2wyo h ALA 388 Ca 0.11 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2wyo h ALA 388 Cb 0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2wyo h ALA 388 CO -0.00 0.41 -0.06 0.78 0.00 0.00 0.00 179.25 180.37 2wyo h GLY 389 N 0.81 0.49 0.72 0.00 0.00 -0.79 0.96 103.07 105.26 2wyo h GLY 389 Ca 0.19 -0.41 0.05 0.00 0.00 0.00 0.00 47.33 47.16 2wyo h GLY 389 CO -0.03 0.38 0.31 1.41 0.00 0.00 0.00 176.54 178.60 2wyo h LEU 390 N 0.19 0.46 -0.61 3.11 3.38 -0.46 -2.80 115.31 118.57 2wyo h LEU 390 Ca 0.06 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 2wyo h LEU 390 Cb 0.53 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2wyo h LEU 390 CO 0.02 0.31 -0.59 -0.07 0.09 0.00 0.00 178.44 178.20 2wyo h LEU 391 N 0.59 0.36 -1.63 1.67 3.38 -1.03 -3.16 115.31 115.49 2wyo h LEU 391 Ca 0.25 -0.21 0.08 0.00 0.09 0.00 0.00 57.88 58.10 2wyo h LEU 391 Cb 0.14 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2wyo h LEU 391 CO -0.16 0.87 0.38 -0.61 0.09 0.00 0.00 178.44 179.01 2wyo h GLN 392 N 0.24 0.43 -1.33 1.13 4.15 -0.53 -1.86 115.11 117.34 2wyo h GLN 392 Ca -0.00 -0.03 0.39 0.00 0.77 0.00 0.00 58.65 59.78 2wyo h GLN 392 Cb 1.11 -0.10 -0.09 0.00 0.21 0.00 0.00 27.48 28.62 2wyo h GLN 392 CO 0.10 0.28 0.91 0.00 -1.93 0.00 0.00 178.83 178.19 2wyo h ARG 393 N 0.44 0.11 -0.64 1.69 3.08 -1.51 0.22 114.38 117.76 2wyo h ARG 393 Ca 0.26 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.30 2wyo h ARG 393 Cb 0.43 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2wyo h ARG 393 CO -0.07 0.07 0.00 0.72 -1.07 0.00 0.00 179.97 179.62 2wyo n HIS 394 N -4.38 1.57 -3.69 3.04 8.25 -0.70 -4.19 115.22 115.11 2wyo n HIS 394 Ca 0.32 -0.60 -0.31 0.00 -0.26 0.00 0.00 57.72 56.87 2wyo n HIS 394 Cb 1.35 -0.30 -0.04 0.00 1.12 0.00 0.00 29.99 32.11 2wyo n HIS 394 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2wyo s PHE 395 N -2.04 3.48 -0.26 4.41 0.40 0.76 -0.51 117.98 124.21 2wyo s PHE 395 Ca 0.50 0.51 -0.04 0.00 -0.60 0.00 0.00 56.93 57.29 2wyo s PHE 395 Cb 0.33 -1.97 0.01 0.00 0.51 0.00 0.00 43.02 41.91 2wyo s PHE 395 CO 0.21 0.44 0.01 0.08 0.70 0.00 0.00 175.22 176.66 2wyo s VAL 396 N -1.67 3.47 0.16 -0.44 1.01 -1.26 -4.92 120.40 116.75 2wyo s VAL 396 Ca 0.40 -0.76 -0.33 0.00 0.00 0.00 0.00 61.98 61.28 2wyo s VAL 396 Cb -0.12 -2.74 -0.16 0.00 0.00 0.00 0.00 36.38 33.36 2wyo s VAL 396 CO 0.25 0.19 1.17 -2.65 0.00 0.00 0.00 175.10 174.07 2wyo n PRO 397 N 4.78 1.12 -3.67 2.72 -0.02 -1.26 -4.80 135.00 133.87 2wyo n PRO 397 Ca -0.16 0.40 -0.29 0.00 -2.02 0.00 0.00 63.50 61.43 2wyo n PRO 397 Cb 0.48 -1.91 -0.15 0.00 -0.02 0.00 0.00 33.50 31.90 2wyo n PRO 397 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2wyo s GLN 398 N -0.27 0.54 0.62 -0.52 -0.21 -1.26 -2.53 119.66 116.03 2wyo s GLN 398 Ca 0.75 -0.81 0.01 0.00 0.02 0.00 0.00 55.36 55.32 2wyo s GLN 398 Cb -0.88 -1.75 0.07 0.00 1.00 0.00 0.00 33.01 31.45 2wyo s GLN 398 CO 0.52 -0.95 0.86 0.71 -2.12 0.00 0.00 175.29 174.31 2wyo s TYR 399 N 1.80 2.35 0.10 0.91 2.02 -0.86 -4.86 117.35 118.81 2wyo s TYR 399 Ca 0.08 -0.12 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 2wyo s TYR 399 Cb -0.17 -2.84 0.00 0.00 -0.40 0.00 0.00 41.96 38.56 2wyo s TYR 399 CO -0.26 -1.21 0.00 0.45 -1.57 0.00 0.00 175.55 172.96 2wyo n SER 400 N -2.54 1.11 0.00 2.29 2.88 -1.26 -3.50 113.62 112.60 2wyo n SER 400 Ca 0.11 0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2wyo n SER 400 Cb 0.60 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 2wyo n SER 400 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wyo n GLY 407 N 3.50 -0.52 0.01 0.46 0.00 -1.26 -4.96 105.19 102.42 2wyo n GLY 407 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 2wyo n GLY 407 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wyo n GLU 408 N 0.00 0.51 -0.01 1.61 -0.58 -1.26 -4.61 120.64 116.29 2wyo n GLU 408 Ca 0.00 0.01 0.12 0.00 -0.42 0.00 0.00 57.16 56.88 2wyo n GLU 408 Cb 0.00 -1.05 0.65 0.00 -0.57 0.00 0.00 31.44 30.48 2wyo n GLU 408 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2wyo n GLU 409 N -2.51 1.21 -0.08 3.49 1.02 -1.26 0.45 120.64 122.96 2wyo n GLU 409 Ca -0.04 -0.31 -0.09 0.00 -0.02 0.00 0.00 57.16 56.70 2wyo n GLU 409 Cb 0.55 -1.40 -0.16 0.00 -0.02 0.00 0.00 31.44 30.41 2wyo n GLU 409 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wyo n ALA 410 N -0.55 1.54 0.15 0.62 0.00 -1.26 -3.59 120.51 117.42 2wyo n ALA 410 Ca 0.18 -1.22 0.03 0.00 0.00 0.00 0.00 53.44 52.43 2wyo n ALA 410 Cb 0.16 -0.31 0.15 0.00 0.00 0.00 0.00 19.45 19.45 2wyo n ALA 410 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wyo h VAL 411 N 0.00 0.97 -0.00 0.00 2.07 -1.42 0.45 116.25 118.31 2wyo h VAL 411 Ca -0.49 -2.05 0.00 0.00 0.82 0.00 0.00 66.70 64.98 2wyo h VAL 411 Cb 2.17 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 34.19 2wyo h VAL 411 CO 0.04 0.49 -0.21 -0.62 0.02 0.00 0.00 177.57 177.28 2wyo n GLU 412 N -3.38 0.07 0.02 1.57 1.02 0.17 -0.30 120.64 119.81 2wyo n GLU 412 Ca 0.01 -0.02 -0.08 0.00 -0.02 0.00 0.00 57.16 57.05 2wyo n GLU 412 Cb 0.66 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.45 2wyo n GLU 412 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2wyo h LYS 413 N 0.06 0.00 0.00 3.49 1.79 -1.49 -3.34 116.57 117.09 2wyo h LYS 413 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2wyo h LYS 413 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2wyo h LYS 413 CO 0.00 0.72 -0.11 0.28 -1.08 0.00 0.00 179.45 179.27 2wyo h VAL 414 N 0.00 0.00 -0.19 0.50 2.07 0.06 -2.63 116.25 116.05 2wyo h VAL 414 Ca -0.16 -0.55 0.05 0.00 0.82 0.00 0.00 66.70 66.87 2wyo h VAL 414 Cb 1.89 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 33.09 2wyo h VAL 414 CO 0.10 0.00 -0.13 0.40 0.02 0.00 0.00 177.57 177.96 2wyo h ILE 415 N 0.00 0.63 0.07 4.57 2.04 -0.77 -3.35 117.51 120.70 2wyo h ILE 415 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2wyo h ILE 415 Cb 0.77 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2wyo h ILE 415 CO 0.00 0.00 -0.03 -0.74 0.00 0.00 0.00 178.15 177.38 2wyo h HIS 416 N -0.12 -0.09 -2.97 1.37 2.76 -1.69 -3.40 115.15 111.01 2wyo h HIS 416 Ca 0.11 -0.00 -0.71 0.00 -2.20 0.00 0.00 60.37 57.57 2wyo h HIS 416 Cb 0.29 0.03 -0.21 0.00 1.55 0.00 0.00 27.41 29.07 2wyo h HIS 416 CO -0.28 -0.05 0.04 -0.51 -1.30 0.00 0.00 177.93 175.82 2wyo s ASP 417 N -3.84 6.19 -0.24 3.26 1.11 -1.00 -4.90 116.67 117.25 2wyo s ASP 417 Ca -0.01 -1.46 -0.13 0.00 0.18 0.00 0.00 52.55 51.12 2wyo s ASP 417 Cb 0.00 -2.28 -0.16 0.00 1.07 0.00 0.00 42.92 41.55 2wyo s ASP 417 CO 0.04 -1.04 -0.09 0.52 1.18 0.00 0.00 175.17 175.77 2wyo n VAL 418 N 5.49 1.55 -0.37 -1.27 0.31 -1.26 -4.44 118.33 118.34 2wyo n VAL 418 Ca -0.10 -0.34 -0.02 0.00 -0.01 0.00 0.00 64.34 63.87 2wyo n VAL 418 Cb 0.42 -1.85 0.01 0.00 -0.91 0.00 0.00 33.84 31.51 2wyo n VAL 418 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2wyo n LEU 419 N -4.08 5.21 -0.62 7.52 4.77 -1.26 -3.85 117.00 124.70 2wyo n LEU 419 Ca -0.44 -2.42 -0.00 0.00 -0.03 0.00 0.00 56.01 53.11 2wyo n LEU 419 Cb 0.86 -1.04 -0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2wyo n LEU 419 CO 0.15 0.97 0.25 0.00 -1.33 0.00 0.00 177.39 177.43 2wyo n GLN 420 N 1.21 0.00 -2.81 3.23 6.02 -1.26 -5.02 117.38 118.74 2wyo n GLN 420 Ca 0.04 -0.56 -0.11 0.00 -0.01 0.00 0.00 57.00 56.37 2wyo n GLN 420 Cb 0.52 -0.11 0.05 0.00 1.02 0.00 0.00 30.24 31.72 2wyo n GLN 420 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2wyo n ARG 421 N 0.03 1.09 0.00 -1.09 1.74 -1.25 -1.55 116.66 115.63 2wyo n ARG 421 Ca -0.03 -2.61 0.00 0.00 -0.77 0.00 0.00 57.85 54.45 2wyo n ARG 421 Cb 0.63 -0.99 0.00 0.00 -1.02 0.00 0.00 32.46 31.08 2wyo n ARG 421 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2wyo n PRO 422 N -0.03 0.00 -3.65 5.56 -0.02 -1.20 -4.24 135.00 131.43 2wyo n PRO 422 Ca 0.09 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.53 2wyo n PRO 422 Cb 0.76 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 34.18 2wyo n PRO 422 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2wyo s ASP 423 N 0.00 -0.12 0.00 2.55 1.47 -1.26 -4.28 116.67 115.02 2wyo s ASP 423 Ca 0.00 0.23 0.00 0.00 1.18 0.00 0.00 52.55 53.96 2wyo s ASP 423 Cb 0.00 0.23 0.00 0.00 -0.34 0.00 0.00 42.92 42.81 2wyo s ASP 423 CO 0.00 -0.05 0.00 0.00 0.68 0.00 0.00 175.17 175.80 2wyo n GLN 424 N 1.61 0.00 0.00 2.11 6.02 -1.26 -5.01 117.38 120.85 2wyo n GLN 424 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 2wyo n GLN 424 Cb 0.57 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.83 2wyo n GLN 424 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 177.06 178.02 2wyo n PHE 425 N -1.30 0.00 0.00 1.08 -0.00 -1.26 -4.86 117.46 111.13 2wyo n PHE 425 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2wyo n PHE 425 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 2wyo n PHE 425 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 2wyo n TYR 465 N 0.00 0.00 -3.75 2.97 -0.00 -1.26 -5.05 117.16 110.07 2wyo n TYR 465 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.77 2wyo n TYR 465 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 39.34 39.25 2wyo n TYR 465 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2wyo s VAL 466 N -2.00 0.05 0.13 2.97 1.01 -1.26 -5.10 120.40 116.20 2wyo s VAL 466 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 61.98 61.29 2wyo s VAL 466 Cb 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 36.38 35.69 2wyo s VAL 466 CO 0.00 -0.21 1.29 0.54 0.00 0.00 0.00 175.10 176.72 2wyo s VAL 467 N -1.11 3.51 0.09 2.92 0.11 -1.23 -4.54 120.40 120.15 2wyo s VAL 467 Ca -0.12 1.15 0.04 0.00 -2.93 0.00 0.00 61.98 60.12 2wyo s VAL 467 Cb -0.05 -3.73 -0.03 0.00 -1.53 0.00 0.00 36.38 31.04 2wyo s VAL 467 CO 0.04 0.12 -0.11 -0.32 -3.33 0.00 0.00 175.10 171.51 2wyo s MET 468 N 0.58 0.81 0.17 1.54 0.00 -1.26 -2.03 119.30 119.11 2wyo s MET 468 Ca 0.59 -1.07 -0.12 0.00 0.00 0.00 0.00 55.69 55.09 2wyo s MET 468 Cb -0.34 -0.57 -0.07 0.00 0.00 0.00 0.00 34.83 33.85 2wyo s MET 468 CO 0.33 0.10 0.52 0.45 0.00 0.00 0.00 175.02 176.42 2wyo s SER 469 N -2.21 6.71 -0.22 1.11 0.15 -1.05 -3.23 113.70 114.96 2wyo s SER 469 Ca 0.02 0.96 -0.19 0.00 0.70 0.00 0.00 55.95 57.45 2wyo s SER 469 Cb -0.05 -2.24 -0.03 0.00 -1.71 0.00 0.00 66.02 61.99 2wyo s SER 469 CO 0.01 0.04 0.54 -0.60 1.20 0.00 0.00 173.24 174.43 2wyo s ARG 470 N -2.32 4.16 0.04 5.44 3.52 -0.60 -4.79 118.95 124.40 2wyo s ARG 470 Ca 0.41 0.43 0.08 0.00 -0.13 0.00 0.00 55.73 56.52 2wyo s ARG 470 Cb -0.13 -3.59 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 2wyo s ARG 470 CO 0.20 -0.23 -0.23 0.42 -0.81 0.00 0.00 175.30 174.65 2wyo s ILE 471 N 1.90 1.84 -0.95 4.11 1.01 -1.26 -4.91 121.20 122.94 2wyo s ILE 471 Ca 0.24 -1.27 -0.18 0.00 0.00 0.00 0.00 60.65 59.45 2wyo s ILE 471 Cb -0.16 -1.59 0.15 0.00 0.01 0.00 0.00 42.46 40.88 2wyo s ILE 471 CO 0.09 0.26 1.12 -1.58 0.00 0.00 0.00 174.94 174.84 2wyo s GLN 472 N -1.20 3.66 0.53 2.79 2.00 -1.26 -5.03 119.66 121.15 2wyo s GLN 472 Ca 0.09 -1.95 -0.19 0.00 -2.00 0.00 0.00 55.36 51.31 2wyo s GLN 472 Cb -0.09 -4.87 -0.06 0.00 0.80 0.00 0.00 33.01 28.78 2wyo s GLN 472 CO 0.02 -1.71 1.08 -0.06 -0.50 0.00 0.00 175.29 174.12 2wyo s PHE 473 N 2.23 2.84 0.18 1.67 0.08 -1.26 0.11 117.98 123.82 2wyo s PHE 473 Ca 0.32 1.55 -0.31 0.00 0.12 0.00 0.00 56.93 58.61 2wyo s PHE 473 Cb -0.05 -3.16 -0.10 0.00 -0.57 0.00 0.00 43.02 39.14 2wyo s PHE 473 CO -0.08 -1.22 1.58 -1.58 -0.10 0.00 0.00 175.22 173.81 2wyo s HIS 474 N -1.96 3.04 -0.10 0.36 5.65 -0.39 -4.52 115.29 117.36 2wyo s HIS 474 Ca 0.69 0.63 -0.01 0.00 0.25 0.00 0.00 55.06 56.62 2wyo s HIS 474 Cb -0.20 -3.95 -0.03 0.00 -1.18 0.00 0.00 32.58 27.23 2wyo s HIS 474 CO 0.26 -3.47 -0.07 0.08 -0.65 0.00 0.00 174.74 170.89 2wyo s VAL 475 N 1.05 3.63 0.39 0.89 1.01 -1.26 -4.56 120.40 121.54 2wyo s VAL 475 Ca 0.70 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 62.23 2wyo s VAL 475 Cb -0.44 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2wyo s VAL 475 CO 0.32 0.56 0.08 -0.94 0.00 0.00 0.00 175.10 175.12 2wyo s SER 476 N -0.27 2.83 -0.22 3.32 1.04 0.23 -4.92 113.70 115.70 2wyo s SER 476 Ca 0.04 -1.54 -0.14 0.00 0.48 0.00 0.00 55.95 54.79 2wyo s SER 476 Cb -0.13 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 2wyo s SER 476 CO 0.03 -0.77 0.30 -0.89 0.98 0.00 0.00 173.24 172.89 2wyo s THR 477 N -3.19 5.26 -0.07 2.02 2.01 -1.22 -2.73 115.64 117.72 2wyo s THR 477 Ca 0.27 0.50 -0.23 0.00 0.31 0.00 0.00 61.69 62.54 2wyo s THR 477 Cb 0.05 -3.64 0.05 0.00 0.01 0.00 0.00 72.50 68.98 2wyo s THR 477 CO 0.14 0.29 0.53 -0.83 -0.69 0.00 0.00 174.62 174.05 2wyo s GLY 478 N 1.04 -0.40 0.28 4.40 0.00 -0.09 -4.96 107.32 107.59 2wyo s GLY 478 Ca 0.14 1.04 0.12 0.00 0.00 0.00 0.00 44.72 46.03 2wyo s GLY 478 CO 0.06 0.76 -0.20 -0.56 0.00 0.00 0.00 173.10 173.17 2wyo s SER 479 N -0.90 3.60 0.34 1.64 0.01 -1.26 0.86 113.70 117.99 2wyo s SER 479 Ca -0.09 -1.02 0.03 0.00 1.31 0.00 0.00 55.95 56.18 2wyo s SER 479 Cb -0.03 -0.31 -0.04 0.00 0.21 0.00 0.00 66.02 65.85 2wyo s SER 479 CO 0.06 0.04 0.11 -0.76 0.41 0.00 0.00 173.24 173.10 2wyo s LEU 480 N -3.49 1.94 -0.27 2.44 1.43 -0.07 -1.14 118.68 119.52 2wyo s LEU 480 Ca 0.30 -1.51 -0.04 0.00 -1.03 0.00 0.00 54.13 51.85 2wyo s LEU 480 Cb -0.05 -0.13 0.09 0.00 0.03 0.00 0.00 46.19 46.13 2wyo s LEU 480 CO 0.15 -0.79 0.12 -0.22 0.23 0.00 0.00 176.35 175.84 2wyo s LEU 481 N -3.48 0.71 0.01 1.79 2.96 -0.22 -3.41 118.68 117.03 2wyo s LEU 481 Ca 0.32 -1.22 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 2wyo s LEU 481 Cb 0.06 -0.40 -0.01 0.00 0.50 0.00 0.00 46.19 46.34 2wyo s LEU 481 CO 0.15 -0.42 -0.07 0.00 -1.32 0.00 0.00 176.35 174.69 2wyo s ALA 482 N 2.05 0.54 -1.21 5.97 0.00 0.08 -2.47 121.76 126.72 2wyo s ALA 482 Ca 0.08 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.64 2wyo s ALA 482 Cb -0.16 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.87 2wyo s ALA 482 CO -0.31 0.09 0.00 0.54 0.00 0.00 0.00 175.76 176.08 2wyo n ARG 483 N 2.55 -1.62 -0.21 0.00 1.74 -1.26 -0.70 116.66 117.16 2wyo n ARG 483 Ca -0.15 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 2wyo n ARG 483 Cb 0.57 -5.04 0.00 0.00 -1.02 0.00 0.00 32.46 26.97 2wyo n ARG 483 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wyo n GLY 484 N -0.44 1.04 3.61 -0.13 0.00 -1.26 -5.06 105.19 102.95 2wyo n GLY 484 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 2wyo n GLY 484 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wyo s ASP 485 N -2.94 4.21 -0.15 1.61 1.01 0.13 -5.00 116.67 115.54 2wyo s ASP 485 Ca 0.00 -0.86 -0.03 0.00 0.71 0.00 0.00 52.55 52.38 2wyo s ASP 485 Cb 0.00 -0.61 -0.02 0.00 1.01 0.00 0.00 42.92 43.30 2wyo s ASP 485 CO 0.00 -0.09 -0.07 -0.69 0.21 0.00 0.00 175.17 174.54 2wyo s VAL 486 N -2.44 3.60 -0.02 -1.27 1.01 -1.26 -0.74 120.40 119.27 2wyo s VAL 486 Ca 0.33 -0.46 0.08 0.00 0.00 0.00 0.00 61.98 61.92 2wyo s VAL 486 Cb -0.04 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 2wyo s VAL 486 CO 0.19 0.50 -0.26 -0.69 0.00 0.00 0.00 175.10 174.84 2wyo s VAL 487 N 0.40 2.05 -0.12 2.92 1.01 -1.22 -4.95 120.40 120.48 2wyo s VAL 487 Ca -0.06 -1.10 -0.04 0.00 0.00 0.00 0.00 61.98 60.77 2wyo s VAL 487 Cb -0.15 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2wyo s VAL 487 CO 0.04 0.58 0.03 -1.58 0.00 0.00 0.00 175.10 174.16 2wyo s GLN 488 N -0.56 3.39 -0.36 2.72 2.00 -1.26 -0.89 119.66 124.70 2wyo s GLN 488 Ca 0.08 -0.37 0.03 0.00 -2.00 0.00 0.00 55.36 53.10 2wyo s GLN 488 Cb -0.10 -2.96 0.10 0.00 0.80 0.00 0.00 33.01 30.85 2wyo s GLN 488 CO -0.00 0.54 0.08 -0.51 -0.50 0.00 0.00 175.29 174.89 2wyo s LEU 489 N -0.40 4.34 0.00 3.68 1.43 0.25 -4.99 118.68 122.98 2wyo s LEU 489 Ca 0.08 -2.20 0.00 0.00 -1.03 0.00 0.00 54.13 50.99 2wyo s LEU 489 Cb -0.12 -1.52 0.00 0.00 0.03 0.00 0.00 46.19 44.58 2wyo s LEU 489 CO 0.02 -0.37 0.65 -0.62 0.23 0.00 0.00 176.35 176.26 2wyo n GLU 490 N 4.19 0.00 -2.79 1.70 -0.58 -1.26 -0.91 120.64 120.98 2wyo n GLU 490 Ca 0.03 0.19 -0.26 0.00 -0.42 0.00 0.00 57.16 56.70 2wyo n GLU 490 Cb 0.41 -1.15 -0.02 0.00 -0.57 0.00 0.00 31.44 30.10 2wyo n GLU 490 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2wyo n ARG 491 N -1.00 3.10 -2.24 3.49 1.74 -1.26 -3.41 116.66 117.08 2wyo n ARG 491 Ca 0.00 -4.60 0.00 0.00 -0.77 0.00 0.00 57.85 52.48 2wyo n ARG 491 Cb 0.00 -2.18 0.04 0.00 -1.02 0.00 0.00 32.46 29.30 2wyo n ARG 491 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2wyo n ASN 492 N -0.29 0.67 -3.89 0.55 5.15 -1.21 -4.84 115.26 111.41 2wyo n ASN 492 Ca 0.33 -2.04 -0.20 0.00 -0.60 0.00 0.00 54.58 52.06 2wyo n ASN 492 Cb 0.51 -0.17 -0.16 0.00 -0.53 0.00 0.00 39.78 39.43 2wyo n ASN 492 CO 0.00 0.00 0.00 -0.32 1.40 0.00 0.00 177.26 178.34 2wyo s MET 493 N -1.71 0.79 -0.08 1.20 1.75 -1.11 -2.56 119.30 117.60 2wyo s MET 493 Ca 0.23 -0.09 0.02 0.00 -1.25 0.00 0.00 55.69 54.61 2wyo s MET 493 Cb 0.33 -0.82 0.01 0.00 2.84 0.00 0.00 34.83 37.19 2wyo s MET 493 CO -0.09 -0.08 -0.15 0.00 -0.65 0.00 0.00 175.02 174.05 2wyo s SER 495 N 0.67 6.01 -0.39 0.00 0.01 -1.26 -1.89 113.70 116.85 2wyo s SER 495 Ca -0.14 0.06 0.02 0.00 1.31 0.00 0.00 55.95 57.20 2wyo s SER 495 Cb -0.16 -1.50 0.15 0.00 0.21 0.00 0.00 66.02 64.73 2wyo s SER 495 CO 0.04 -0.44 0.28 -0.70 0.41 0.00 0.00 173.24 172.82 2wyo s GLU 496 N -4.27 0.80 0.19 12.44 2.12 -0.93 -4.78 118.70 124.27 2wyo s GLU 496 Ca 0.44 -1.77 -0.31 0.00 0.36 0.00 0.00 54.97 53.68 2wyo s GLU 496 Cb -0.10 -1.48 -0.10 0.00 0.26 0.00 0.00 34.13 32.71 2wyo s GLU 496 CO 0.33 -1.29 1.58 0.08 -0.54 0.00 0.00 175.26 175.43 2wyo s VAL 497 N 0.51 2.48 -0.15 3.70 1.01 -1.02 -2.68 120.40 124.25 2wyo s VAL 497 Ca 0.25 0.35 -0.01 0.00 0.00 0.00 0.00 61.98 62.57 2wyo s VAL 497 Cb -0.11 -3.23 0.04 0.00 0.00 0.00 0.00 36.38 33.09 2wyo s VAL 497 CO -0.09 0.03 -0.02 -0.83 0.00 0.00 0.00 175.10 174.20 2wyo s GLY 498 N 1.02 0.79 -0.29 4.51 0.00 -0.49 0.74 107.32 113.61 2wyo s GLY 498 Ca 0.69 -0.64 -0.17 0.00 0.00 0.00 0.00 44.72 44.60 2wyo s GLY 498 CO 0.34 1.10 0.48 -0.42 0.00 0.00 0.00 173.10 174.59 2wyo s ILE 499 N 1.76 5.08 0.57 0.90 -1.09 -0.33 -1.29 121.20 126.80 2wyo s ILE 499 Ca 0.01 0.65 -0.14 0.00 -2.23 0.00 0.00 60.65 58.94 2wyo s ILE 499 Cb -0.15 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 36.85 2wyo s ILE 499 CO -0.07 0.02 1.02 -0.36 -1.23 0.00 0.00 174.94 174.32 2wyo s PHE 500 N 2.27 3.38 -0.16 3.97 0.08 -0.13 -0.70 117.98 126.69 2wyo s PHE 500 Ca 0.19 1.43 -0.14 0.00 0.12 0.00 0.00 56.93 58.52 2wyo s PHE 500 Cb -0.16 -2.82 0.04 0.00 -0.57 0.00 0.00 43.02 39.52 2wyo s PHE 500 CO 0.10 -0.66 0.43 0.20 -0.10 0.00 0.00 175.22 175.19 2wyo s GLY 501 N -3.37 -0.32 0.06 4.36 0.00 -0.66 -1.69 107.32 105.71 2wyo s GLY 501 Ca 0.59 1.22 0.08 0.00 0.00 0.00 0.00 44.72 46.61 2wyo s GLY 501 CO 0.40 1.08 -0.20 -1.34 0.00 0.00 0.00 173.10 173.04 2wyo s VAL 502 N 0.30 2.65 -0.22 1.40 -7.23 -0.79 -0.84 120.40 115.68 2wyo s VAL 502 Ca -0.01 -1.32 -0.17 0.00 -1.81 0.00 0.00 61.98 58.67 2wyo s VAL 502 Cb -0.03 -2.13 0.06 0.00 0.56 0.00 0.00 36.38 34.84 2wyo s VAL 502 CO -0.00 0.28 0.56 -0.51 -0.31 0.00 0.00 175.10 175.12 2wyo s ILE 503 N -0.96 -0.00 -0.22 -0.62 2.07 -0.68 -1.65 121.20 119.14 2wyo s ILE 503 Ca 0.15 0.02 -0.02 0.00 -1.41 0.00 0.00 60.65 59.38 2wyo s ILE 503 Cb -0.10 -0.79 0.07 0.00 0.13 0.00 0.00 42.46 41.76 2wyo s ILE 503 CO 0.06 0.01 0.03 -0.22 -1.91 0.00 0.00 174.94 172.91 2wyo s LEU 504 N 0.75 1.57 0.08 8.50 2.96 -0.66 -0.04 118.68 131.84 2wyo s LEU 504 Ca -0.04 -1.02 0.05 0.00 -0.22 0.00 0.00 54.13 52.90 2wyo s LEU 504 Cb -0.05 -0.73 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 2wyo s LEU 504 CO -0.06 -0.32 -0.14 -0.94 -1.32 0.00 0.00 176.35 173.58 2wyo s SER 505 N 1.75 1.78 0.00 3.68 1.04 -1.14 -0.73 113.70 120.07 2wyo s SER 505 Ca 0.00 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 55.76 2wyo s SER 505 Cb -0.17 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 65.89 2wyo s SER 505 CO -0.11 -0.09 0.00 0.00 0.98 0.00 0.00 173.24 174.02 2wyo n ALA 506 N 1.09 0.00 -1.74 5.32 0.00 -0.24 -1.96 120.51 122.98 2wyo n ALA 506 Ca -0.20 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.85 2wyo n ALA 506 Cb 0.55 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.03 2wyo n ALA 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wyo n ALA 507 N -3.00 1.63 -1.73 0.00 0.00 -1.26 -4.90 120.51 111.25 2wyo n ALA 507 Ca 0.00 0.19 -0.42 0.00 0.00 0.00 0.00 53.44 53.21 2wyo n ALA 507 Cb 0.00 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.08 2wyo n ALA 507 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wyo s LYS 508 N -2.58 4.14 -0.94 0.00 1.02 -1.26 -2.76 119.74 117.36 2wyo s LYS 508 Ca 0.66 2.59 -0.03 0.00 0.02 0.00 0.00 55.97 59.20 2wyo s LYS 508 Cb -0.45 -3.49 -0.04 0.00 -0.52 0.00 0.00 37.83 33.33 2wyo s LYS 508 CO 0.54 -0.82 0.81 0.41 -0.92 0.00 0.00 175.35 175.37 2wyo n GLY 509 N 4.17 -0.67 3.26 -3.33 0.00 -1.26 -5.05 105.19 102.31 2wyo n GLY 509 Ca 0.17 0.32 -0.25 0.00 0.00 0.00 0.00 46.02 46.26 2wyo n GLY 509 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wyo s SER 510 N -3.61 2.49 0.00 1.61 1.04 -1.11 -5.02 113.70 109.11 2wyo s SER 510 Ca 0.27 -0.54 0.25 0.00 0.48 0.00 0.00 55.95 56.41 2wyo s SER 510 Cb -0.03 -0.20 1.49 0.00 0.10 0.00 0.00 66.02 67.37 2wyo s SER 510 CO 0.63 0.15 1.93 -0.24 0.98 0.00 0.00 173.24 176.70 2wyo n SER 511 N 1.78 0.00 0.30 7.02 2.88 -1.26 -3.33 113.62 121.01 2wyo n SER 511 Ca -0.17 -1.12 0.19 0.00 -1.33 0.00 0.00 58.87 56.43 2wyo n SER 511 Cb 0.53 0.00 1.00 0.00 -0.75 0.00 0.00 64.21 65.00 2wyo n SER 511 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 2wyo h VAL 512 N 0.00 0.00 0.00 2.46 3.04 -1.90 -3.38 116.25 116.47 2wyo h VAL 512 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2wyo h VAL 512 Cb 0.00 0.82 0.00 0.00 -2.01 0.00 0.00 31.29 30.10 2wyo h VAL 512 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.17 2wyo n GLY 513 N -1.15 0.95 0.00 3.17 0.00 0.63 -4.93 105.19 103.86 2wyo n GLY 513 Ca -0.02 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2wyo n GLY 513 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wyo n THR 514 N 0.00 0.00 -0.27 2.61 -2.24 -1.24 -4.58 114.28 108.56 2wyo n THR 514 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 2wyo n THR 514 Cb 0.00 -0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 67.50 2wyo n THR 514 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wyo n ASN 515 N -0.81 2.34 -3.21 3.42 3.02 -1.26 -4.34 115.26 114.42 2wyo n ASN 515 Ca 0.00 -1.69 -0.20 0.00 -0.03 0.00 0.00 54.58 52.66 2wyo n ASN 515 Cb 0.00 -0.53 0.07 0.00 -0.61 0.00 0.00 39.78 38.72 2wyo n ASN 515 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wyo n GLY 516 N 2.02 -0.34 3.67 7.41 0.00 -1.26 -5.02 105.19 111.66 2wyo n GLY 516 Ca 0.05 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 2wyo n GLY 516 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wyo s SER 517 N -3.49 4.68 0.47 1.61 0.15 -1.25 -4.52 113.70 111.34 2wyo s SER 517 Ca 0.40 -0.57 0.23 0.00 0.70 0.00 0.00 55.95 56.71 2wyo s SER 517 Cb -0.18 -0.93 1.14 0.00 -1.71 0.00 0.00 66.02 64.34 2wyo s SER 517 CO 0.64 0.01 1.95 -1.28 1.20 0.00 0.00 173.24 175.76 2wyo h SER 518 N 1.94 0.00 -3.71 5.45 0.87 -1.83 0.18 113.55 116.45 2wyo h SER 518 Ca -0.45 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.44 2wyo h SER 518 Cb 1.24 0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 63.03 2wyo h SER 518 CO 0.60 0.21 -0.38 -0.69 -0.53 0.00 0.00 176.83 176.03 2wyo s VAL 519 N -4.04 5.23 0.01 2.23 1.01 -1.26 -1.08 120.40 122.50 2wyo s VAL 519 Ca -0.02 -0.03 -0.22 0.00 0.00 0.00 0.00 61.98 61.72 2wyo s VAL 519 Cb 0.13 -3.75 -0.18 0.00 0.00 0.00 0.00 36.38 32.58 2wyo s VAL 519 CO 0.63 -0.02 1.22 -0.07 0.00 0.00 0.00 175.10 176.87 2wyo h LEU 520 N 8.60 0.34 -7.35 3.92 3.38 -1.23 -3.30 115.31 119.68 2wyo h LEU 520 Ca -0.31 -0.60 -0.07 0.00 0.09 0.00 0.00 57.88 56.99 2wyo h LEU 520 Cb 1.15 -0.10 -0.16 0.00 0.09 0.00 0.00 40.66 41.64 2wyo h LEU 520 CO 0.65 0.88 -0.08 0.72 0.09 0.00 0.00 178.44 180.70 2wyo s PHE 521 N -3.84 -0.29 -0.28 1.13 -0.12 -1.19 -4.76 117.98 108.63 2wyo s PHE 521 Ca -0.15 0.26 0.01 0.00 -0.05 0.00 0.00 56.93 57.01 2wyo s PHE 521 Cb 0.04 0.24 0.17 0.00 -0.63 0.00 0.00 43.02 42.84 2wyo s PHE 521 CO 0.76 -0.59 0.49 1.21 -0.05 0.00 0.00 175.22 177.04 2wyo s ASN 522 N -2.02 -0.53 0.10 1.98 2.47 -1.26 -1.66 114.94 114.03 2wyo s ASN 522 Ca -0.05 0.15 -0.00 0.00 0.42 0.00 0.00 52.86 53.37 2wyo s ASN 522 Cb -0.01 1.56 -0.04 0.00 -1.45 0.00 0.00 41.25 41.32 2wyo s ASN 522 CO -0.02 -0.31 -0.01 0.42 -3.72 0.00 0.00 177.10 173.46 2wyo s THR 523 N 2.68 0.34 0.44 -5.21 -4.23 -0.66 -4.82 115.64 104.18 2wyo s THR 523 Ca 0.13 -1.88 -0.24 0.00 -1.18 0.00 0.00 61.69 58.51 2wyo s THR 523 Cb -0.13 -1.77 -0.08 0.00 1.34 0.00 0.00 72.50 71.86 2wyo s THR 523 CO -0.24 -0.76 1.24 0.12 -0.54 0.00 0.00 174.62 174.44 2wyo s PHE 524 N -3.86 2.83 -0.22 3.99 5.36 -1.26 -1.88 117.98 122.93 2wyo s PHE 524 Ca 0.15 1.48 0.16 0.00 -0.96 0.00 0.00 56.93 57.75 2wyo s PHE 524 Cb 0.07 -3.54 0.46 0.00 -0.34 0.00 0.00 43.02 39.68 2wyo s PHE 524 CO -0.04 -1.84 1.17 0.00 -1.46 0.00 0.00 175.22 173.05 2wyo n ALA 525 N -0.19 3.56 -0.02 11.12 0.00 -0.68 -4.73 120.51 129.57 2wyo n ALA 525 Ca 0.06 -3.13 0.00 0.00 0.00 0.00 0.00 53.44 50.36 2wyo n ALA 525 Cb 0.46 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.33 2wyo n ALA 525 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wyo n GLY 526 N -0.55 -1.25 3.49 0.00 0.00 -1.26 -2.89 105.19 102.73 2wyo n GLY 526 Ca 0.21 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 2wyo n GLY 526 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wyo s TYR 527 N 0.00 0.07 0.41 1.61 -0.85 -1.26 -0.96 117.35 116.37 2wyo s TYR 527 Ca 0.00 -0.42 0.04 0.00 -0.52 0.00 0.00 57.07 56.16 2wyo s TYR 527 Cb 0.00 0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.56 2wyo s TYR 527 CO 0.00 -0.88 0.07 -0.08 -1.52 0.00 0.00 175.55 173.14 2wyo s THR 528 N -3.91 1.04 0.04 -3.49 -1.32 -0.42 -4.73 115.64 102.85 2wyo s THR 528 Ca 0.13 -2.00 0.02 0.00 -1.21 0.00 0.00 61.69 58.63 2wyo s THR 528 Cb 0.00 -2.50 -0.02 0.00 -1.51 0.00 0.00 72.50 68.46 2wyo s THR 528 CO -0.01 0.00 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.64 2wyo s VAL 529 N -3.11 0.52 -0.17 5.08 1.01 -1.24 -1.39 120.40 121.11 2wyo s VAL 529 Ca 0.25 -1.11 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 2wyo s VAL 529 Cb 0.05 -0.64 0.07 0.00 0.00 0.00 0.00 36.38 35.86 2wyo s VAL 529 CO 0.13 -0.41 0.17 -0.13 0.00 0.00 0.00 175.10 174.85 2wyo s ARG 530 N -1.68 0.11 0.26 2.72 0.52 -1.09 -2.57 118.95 117.23 2wyo s ARG 530 Ca -0.09 0.20 0.01 0.00 -0.52 0.00 0.00 55.73 55.33 2wyo s ARG 530 Cb -0.09 -1.19 -0.04 0.00 0.52 0.00 0.00 34.95 34.15 2wyo s ARG 530 CO 0.00 -0.58 0.43 -1.12 0.02 0.00 0.00 175.30 174.05 2wyo s SER 531 N 2.26 6.33 0.03 0.23 0.01 -0.54 -2.19 113.70 119.83 2wyo s SER 531 Ca 0.05 0.32 -0.27 0.00 1.31 0.00 0.00 55.95 57.35 2wyo s SER 531 Cb -0.15 -1.97 0.09 0.00 0.21 0.00 0.00 66.02 64.20 2wyo s SER 531 CO -0.10 -0.14 0.79 -1.59 0.41 0.00 0.00 173.24 172.62 2wyo s LYS 532 N -3.85 0.96 0.82 12.44 -2.85 -0.79 0.29 119.74 126.76 2wyo s LYS 532 Ca 0.38 -0.29 -0.13 0.00 -1.00 0.00 0.00 55.97 54.92 2wyo s LYS 532 Cb -0.10 0.44 0.07 0.00 -2.06 0.00 0.00 37.83 36.19 2wyo s LYS 532 CO 0.31 -0.41 1.05 -2.30 0.10 0.00 0.00 175.35 174.11 2wyo n PRO 533 N -0.16 0.10 -0.11 1.78 -0.02 -1.26 -2.10 135.00 133.23 2wyo n PRO 533 Ca -0.12 0.11 -0.13 0.00 -2.02 0.00 0.00 63.50 61.34 2wyo n PRO 533 Cb 0.62 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 2wyo n PRO 533 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wyo h ALA 534 N -0.99 0.47 -0.32 3.55 0.00 -1.84 -3.29 119.26 116.84 2wyo h ALA 534 Ca -0.46 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.06 2wyo h ALA 534 Cb 1.30 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2wyo h ALA 534 CO 0.44 0.46 0.00 -0.40 0.00 0.00 0.00 179.25 179.75 2wyo n ASP 535 N -4.25 2.80 -4.42 0.00 5.75 -1.26 -4.95 116.55 110.22 2wyo n ASP 535 Ca -0.03 -1.90 -0.29 0.00 -0.01 0.00 0.00 54.79 52.55 2wyo n ASP 535 Cb 0.46 -0.20 0.16 0.00 -1.03 0.00 0.00 41.12 40.51 2wyo n ASP 535 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wyo s ALA 536 N -1.59 1.87 1.00 2.12 0.00 -1.24 -5.09 121.76 118.83 2wyo s ALA 536 Ca 0.36 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.48 2wyo s ALA 536 Cb 0.21 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.42 2wyo s ALA 536 CO 0.29 -2.47 0.00 -0.25 0.00 0.00 0.00 175.76 173.34 2wyo n ASP 537 N -3.87 -0.18 -4.36 0.00 8.00 -1.26 -5.03 116.55 109.86 2wyo n ASP 537 Ca 0.11 -0.21 -0.30 0.00 0.71 0.00 0.00 54.79 55.10 2wyo n ASP 537 Cb 0.60 0.00 0.16 0.00 -0.02 0.00 0.00 41.12 41.86 2wyo n ASP 537 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2wyo s ASP 538 N -1.30 3.23 0.00 -2.24 1.11 -1.26 -5.00 116.67 111.21 2wyo s ASP 538 Ca 0.00 0.52 0.00 0.00 0.18 0.00 0.00 52.55 53.25 2wyo s ASP 538 Cb 0.00 -0.76 0.00 0.00 1.07 0.00 0.00 42.92 43.23 2wyo s ASP 538 CO 0.00 -2.68 0.00 0.61 1.18 0.00 0.00 175.17 174.28 2wyo n GLY 539 N -3.13 -2.10 0.00 0.21 0.00 -1.26 -4.91 105.19 94.00 2wyo n GLY 539 Ca 0.12 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2wyo n GLY 539 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wyo n GLY 540 N -0.06 4.90 0.15 -0.02 0.00 -1.26 -4.61 105.19 104.28 2wyo n GLY 540 Ca 0.00 -1.25 -0.15 0.00 0.00 0.00 0.00 46.02 44.62 2wyo n GLY 540 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2wyo h VAL 541 N 0.00 1.41 -0.71 1.61 3.04 -1.91 0.17 116.25 119.85 2wyo h VAL 541 Ca 0.00 -2.60 -0.07 0.00 -1.01 0.00 0.00 66.70 63.02 2wyo h VAL 541 Cb 0.00 2.60 -0.03 0.00 -2.01 0.00 0.00 31.29 31.85 2wyo h VAL 541 CO 0.00 0.77 0.17 0.24 -1.01 0.00 0.00 177.57 177.74 2wyo h MET 542 N 0.20 1.14 0.00 4.17 2.86 -1.97 -0.96 114.93 120.37 2wyo h MET 542 Ca -0.11 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 2wyo h MET 542 Cb 1.73 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 33.24 2wyo h MET 542 CO 0.19 1.00 0.25 0.00 1.06 0.00 0.00 176.91 179.41 2wyo h ALA 543 N 1.10 1.24 -0.65 6.32 0.00 -1.93 -3.45 119.26 121.89 2wyo h ALA 543 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2wyo h ALA 543 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wyo h ALA 543 CO 0.00 -0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.42 2wyo n GLY 544 N -1.20 0.88 0.00 0.00 0.00 -0.36 -4.97 105.19 99.54 2wyo n GLY 544 Ca -0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2wyo n GLY 544 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wyo n VAL 545 N -2.48 0.00 -3.47 1.61 0.31 -0.95 -5.05 118.33 108.30 2wyo n VAL 545 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 64.10 2wyo n VAL 545 Cb 0.43 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.38 2wyo n VAL 545 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wyo s ALA 546 N -1.00 4.52 0.11 3.52 0.00 0.55 -4.57 121.76 124.89 2wyo s ALA 546 Ca 0.00 -1.70 0.03 0.00 0.00 0.00 0.00 51.96 50.29 2wyo s ALA 546 Cb 0.00 -1.09 -0.04 0.00 0.00 0.00 0.00 23.12 21.99 2wyo s ALA 546 CO 0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 175.76 175.09 2wyo s ALA 547 N -2.69 1.15 0.47 0.00 0.00 0.14 -4.16 121.76 116.68 2wyo s ALA 547 Ca 0.48 -1.37 -0.16 0.00 0.00 0.00 0.00 51.96 50.91 2wyo s ALA 547 Cb -0.04 0.10 -0.08 0.00 0.00 0.00 0.00 23.12 23.10 2wyo s ALA 547 CO 0.30 -0.16 0.92 -0.51 0.00 0.00 0.00 175.76 176.31 2wyo s LEU 548 N -2.98 3.74 0.16 0.00 1.43 0.29 -1.47 118.68 119.84 2wyo s LEU 548 Ca 0.12 1.47 -0.13 0.00 -1.03 0.00 0.00 54.13 54.56 2wyo s LEU 548 Cb 0.03 -4.38 0.01 0.00 0.03 0.00 0.00 46.19 41.89 2wyo s LEU 548 CO -0.02 -0.49 0.38 -0.62 0.23 0.00 0.00 176.35 175.82 2wyo s ASP 549 N -2.93 -0.11 0.36 2.29 -1.08 -1.06 -0.37 116.67 113.77 2wyo s ASP 549 Ca 0.57 -0.59 0.09 0.00 -0.52 0.00 0.00 52.55 52.10 2wyo s ASP 549 Cb -0.10 0.48 -0.07 0.00 -1.46 0.00 0.00 42.92 41.77 2wyo s ASP 549 CO 0.28 -0.92 -0.06 -0.55 0.52 0.00 0.00 175.17 174.44 2wyo s SER 550 N -2.89 3.79 -0.04 -0.34 0.15 -1.26 -3.68 113.70 109.42 2wyo s SER 550 Ca 0.10 -1.24 -0.03 0.00 0.70 0.00 0.00 55.95 55.48 2wyo s SER 550 Cb 0.02 -0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 63.92 2wyo s SER 550 CO -0.05 -0.27 0.14 -0.76 1.20 0.00 0.00 173.24 173.50 2wyo s LEU 551 N -3.64 4.22 -0.17 3.45 1.43 -1.26 -1.15 118.68 121.56 2wyo s LEU 551 Ca 0.33 0.32 0.01 0.00 -1.03 0.00 0.00 54.13 53.76 2wyo s LEU 551 Cb 0.04 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.95 2wyo s LEU 551 CO 0.17 0.31 -0.18 0.00 0.23 0.00 0.00 176.35 176.89 2wyo s ALA 552 N -1.18 2.14 -0.41 4.21 0.00 -0.24 -1.89 121.76 124.39 2wyo s ALA 552 Ca 0.22 -1.09 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 2wyo s ALA 552 Cb -0.12 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.89 2wyo s ALA 552 CO 0.12 -0.35 0.45 0.08 0.00 0.00 0.00 175.76 176.07 2wyo s VAL 553 N 1.35 5.06 -0.41 0.00 1.01 0.21 -2.31 120.40 125.31 2wyo s VAL 553 Ca 0.05 -0.20 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 2wyo s VAL 553 Cb -0.13 -4.02 0.07 0.00 0.00 0.00 0.00 36.38 32.29 2wyo s VAL 553 CO -0.12 -0.39 0.25 0.68 0.00 0.00 0.00 175.10 175.53 2wyo s VAL 554 N 2.21 4.35 0.00 2.92 -7.23 0.77 -2.31 120.40 121.10 2wyo s VAL 554 Ca 0.14 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.05 2wyo s VAL 554 Cb -0.17 -3.60 0.00 0.00 0.56 0.00 0.00 36.38 33.18 2wyo s VAL 554 CO 0.14 -0.44 0.00 -2.65 -0.31 0.00 0.00 175.10 171.84