#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wyo n HIS 0 N 0.00 0.90 -0.39 1.61 -0.00 -1.26 -4.38 115.22 111.70 2wyo n HIS 0 Ca 0.00 0.91 -0.10 0.00 -0.00 0.00 0.00 57.72 58.52 2wyo n HIS 0 Cb 0.00 -1.33 -0.09 0.00 -0.00 0.00 0.00 29.99 28.57 2wyo n HIS 0 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2wyo h MET 1 N 0.00 -0.00 0.00 -0.41 -0.00 -1.99 -3.26 114.93 109.26 2wyo h MET 1 Ca 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.53 2wyo h MET 1 Cb 2.46 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 34.06 2wyo h MET 1 CO -0.59 -0.00 0.00 0.28 -0.00 0.00 0.00 176.91 176.59 2wyo n VAL 2 N -5.10 0.00 0.07 -0.10 0.31 -1.26 0.10 118.33 112.35 2wyo n VAL 2 Ca 0.02 1.44 0.21 0.00 -0.01 0.00 0.00 64.34 65.99 2wyo n VAL 2 Cb 0.24 -1.92 0.74 0.00 -0.91 0.00 0.00 33.84 32.00 2wyo n VAL 2 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2wyo h LEU 3 N 0.00 0.00 -0.02 7.52 5.85 -1.93 0.28 115.31 127.02 2wyo h LEU 3 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2wyo h LEU 3 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 2wyo h LEU 3 CO 0.00 0.00 -0.46 0.50 -0.34 0.00 0.00 178.44 178.14 2wyo h LYS 4 N 0.00 0.34 -0.92 1.25 3.64 0.56 -2.64 116.57 118.80 2wyo h LYS 4 Ca 0.21 -0.34 0.10 0.00 -1.27 0.00 0.00 60.65 59.34 2wyo h LYS 4 Cb 1.04 0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.89 2wyo h LYS 4 CO -0.00 1.02 0.59 -0.07 -2.27 0.00 0.00 179.45 178.72 2wyo h LEU 5 N -0.20 0.85 0.47 5.20 3.38 0.12 -0.02 115.31 125.10 2wyo h LEU 5 Ca -0.05 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2wyo h LEU 5 Cb 1.16 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2wyo h LEU 5 CO 0.09 0.50 -0.23 -0.07 0.09 0.00 0.00 178.44 178.82 2wyo h LEU 6 N 0.94 -0.53 -0.86 1.67 3.38 -1.08 -0.10 115.31 118.73 2wyo h LEU 6 Ca 0.43 0.02 0.22 0.00 0.09 0.00 0.00 57.88 58.64 2wyo h LEU 6 Cb 0.40 0.14 -0.14 0.00 0.09 0.00 0.00 40.66 41.14 2wyo h LEU 6 CO -0.19 -0.19 0.15 -0.07 0.09 0.00 0.00 178.44 178.23 2wyo h LEU 7 N -1.02 -0.14 -0.04 1.67 3.38 -1.43 -1.91 115.31 115.81 2wyo h LEU 7 Ca -0.06 0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2wyo h LEU 7 Cb 0.48 0.31 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2wyo h LEU 7 CO 0.11 -0.18 0.00 -0.08 0.09 0.00 0.00 178.44 178.37 2wyo h GLU 8 N 0.16 0.07 0.00 1.13 4.81 -1.00 -3.12 114.58 116.64 2wyo h GLU 8 Ca 0.52 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 2wyo h GLU 8 Cb 1.02 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.40 2wyo h GLU 8 CO -0.69 0.35 0.00 1.28 -0.73 0.00 0.00 179.01 179.23 2wyo n LEU 9 N -4.89 0.00 -0.03 1.64 4.77 -0.05 -4.87 117.00 113.57 2wyo n LEU 9 Ca -0.07 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.90 2wyo n LEU 9 Cb 0.18 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.27 2wyo n LEU 9 CO 0.34 0.00 -0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2wyo n GLY 10 N 0.57 0.40 3.70 -0.72 0.00 -0.88 -4.99 105.19 103.27 2wyo n GLY 10 Ca 0.16 -1.04 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 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 0.61 0.93 -3.65 4.61 0.00 -0.77 -5.01 120.51 117.22 2wyo n ALA 11 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2wyo n ALA 11 Cb 0.11 -2.28 -0.06 0.00 0.00 0.00 0.00 19.45 17.22 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 -3.22 0.57 -1.77 0.00 2.12 -1.26 -4.73 118.70 110.40 2wyo s GLU 12 Ca 0.81 1.32 0.00 0.00 0.36 0.00 0.00 54.97 57.46 2wyo s GLU 12 Cb -0.39 0.59 0.00 0.00 0.26 0.00 0.00 34.13 34.59 2wyo s GLU 12 CO 0.42 -0.19 0.00 0.54 -0.54 0.00 0.00 175.26 175.49 2wyo n ARG 13 N 5.10 -1.70 0.10 4.30 1.74 -1.26 -4.91 116.66 120.04 2wyo n ARG 13 Ca -0.14 1.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.95 2wyo n ARG 13 Cb 0.52 -5.63 0.32 0.00 -1.02 0.00 0.00 32.46 26.65 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 0.00 0.27 0.00 -1.55 -0.00 -1.99 -1.35 116.97 112.34 2wyo h TYR 14 Ca -0.47 -0.05 -0.01 0.00 0.00 0.00 0.00 58.73 58.21 2wyo h TYR 14 Cb 1.35 -0.07 -0.00 0.00 0.00 0.00 0.00 36.73 38.01 2wyo h TYR 14 CO 0.57 0.48 -0.03 0.00 -0.00 0.00 0.00 178.16 179.17 2wyo h ALA 15 N 1.53 1.74 0.13 0.10 0.00 -1.97 0.16 119.26 120.95 2wyo h ALA 15 Ca 0.04 -0.03 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 2wyo h ALA 15 Cb 0.55 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2wyo h ALA 15 CO 0.04 0.04 -1.82 0.93 0.00 0.00 0.00 179.25 178.44 2wyo h GLU 16 N 0.00 0.28 -0.48 0.00 3.07 -1.66 -1.58 114.58 114.20 2wyo h GLU 16 Ca -0.00 -0.47 0.07 0.00 -0.50 0.00 0.00 59.36 58.46 2wyo h GLU 16 Cb 0.07 0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 28.10 2wyo h GLU 16 CO 0.00 1.23 0.14 0.37 -1.40 0.00 0.00 179.01 179.36 2wyo h GLN 17 N -0.04 0.29 0.00 2.33 4.15 -1.30 0.57 115.11 121.11 2wyo h GLN 17 Ca -0.39 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 58.93 2wyo h GLN 17 Cb 1.97 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 29.58 2wyo h GLN 17 CO 0.09 0.19 -0.42 0.74 -1.93 0.00 0.00 178.83 177.50 2wyo h PHE 18 N 0.30 0.00 -0.08 3.99 0.04 -0.63 0.88 116.94 121.44 2wyo h PHE 18 Ca 0.23 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.79 2wyo h PHE 18 Cb 0.27 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.43 2wyo h PHE 18 CO -0.18 0.42 -0.83 0.00 -0.60 0.00 0.00 178.31 177.12 2wyo h ALA 19 N 1.58 0.39 -0.24 2.45 0.00 -0.84 -2.59 119.26 120.00 2wyo h ALA 19 Ca -0.00 -0.63 0.04 0.00 0.00 0.00 0.00 54.91 54.31 2wyo h ALA 19 Cb 0.81 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2wyo h ALA 19 CO 0.05 0.73 -0.01 0.00 0.00 0.00 0.00 179.25 180.03 2wyo h ALA 20 N 0.69 0.21 -0.67 0.00 0.00 0.12 -2.09 119.26 117.51 2wyo h ALA 20 Ca -0.06 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2wyo h ALA 20 Cb 1.44 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.33 2wyo h ALA 20 CO 0.16 -0.43 0.34 -0.22 0.00 0.00 0.00 179.25 179.10 2wyo h LYS 21 N 0.06 0.94 0.38 0.00 1.63 -0.73 -1.39 116.57 117.46 2wyo h LYS 21 Ca 0.12 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 2wyo h LYS 21 Cb 0.15 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.60 2wyo h LYS 21 CO -0.21 0.71 -0.22 0.00 -3.45 0.00 0.00 179.45 176.29 2wyo h HIS 23 N -0.56 0.03 -0.02 0.00 3.86 -0.77 0.29 115.15 117.98 2wyo h HIS 23 Ca -0.04 -0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 58.95 2wyo h HIS 23 Cb 0.45 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.91 2wyo h HIS 23 CO -0.08 0.11 -0.89 1.49 0.86 0.00 0.00 177.93 179.42 2wyo h GLU 24 N 0.03 0.42 -0.00 2.45 4.81 -0.86 -2.94 114.58 118.49 2wyo h GLU 24 Ca 0.01 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2wyo h GLU 24 Cb 0.17 0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.66 2wyo h GLU 24 CO 0.01 1.08 -0.26 1.28 -0.73 0.00 0.00 179.01 180.40 2wyo n LEU 25 N -3.77 0.34 -0.56 1.64 4.77 0.12 -4.93 117.00 114.61 2wyo n LEU 25 Ca -0.06 0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 56.02 2wyo n LEU 25 Cb 0.81 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.56 2wyo n LEU 25 CO 0.51 0.08 -0.07 0.61 -1.33 0.00 0.00 177.39 177.19 2wyo n GLY 26 N 1.46 0.63 3.50 -0.72 0.00 0.81 -4.99 105.19 105.89 2wyo n GLY 26 Ca 0.08 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 2wyo n GLY 26 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wyo s MET 27 N -3.09 3.54 0.24 1.61 -1.94 -0.87 -4.93 119.30 113.86 2wyo s MET 27 Ca 0.00 -1.38 -0.07 0.00 -1.71 0.00 0.00 55.69 52.52 2wyo s MET 27 Cb 0.00 -5.00 -0.02 0.00 2.01 0.00 0.00 34.83 31.82 2wyo s MET 27 CO 0.00 -1.96 0.36 0.14 -0.01 0.00 0.00 175.02 173.55 2wyo s VAL 28 N 3.79 0.00 -0.12 -6.03 -7.23 -1.26 -2.76 120.40 106.78 2wyo s VAL 28 Ca 0.37 -1.64 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 2wyo s VAL 28 Cb -0.04 -2.36 0.03 0.00 0.56 0.00 0.00 36.38 34.58 2wyo s VAL 28 CO -0.07 0.00 0.33 -0.32 -0.31 0.00 0.00 175.10 174.73 2wyo s MET 29 N -3.96 0.37 0.36 4.82 1.75 0.65 -4.54 119.30 118.76 2wyo s MET 29 Ca 0.29 0.48 -0.27 0.00 -1.25 0.00 0.00 55.69 54.94 2wyo s MET 29 Cb 0.02 0.16 -0.09 0.00 2.84 0.00 0.00 34.83 37.75 2wyo s MET 29 CO 0.11 -0.06 1.23 0.21 -0.65 0.00 0.00 175.02 175.87 2wyo s LYS 30 N 0.31 4.22 0.77 4.11 2.20 -1.01 -0.16 119.74 130.17 2wyo s LYS 30 Ca -0.01 2.02 -0.13 0.00 -0.36 0.00 0.00 55.97 57.49 2wyo s LYS 30 Cb -0.03 -2.89 0.06 0.00 -1.51 0.00 0.00 37.83 33.46 2wyo s LYS 30 CO -0.01 -0.24 1.15 -1.21 -0.36 0.00 0.00 175.35 174.68 2wyo s GLU 31 N -2.00 2.02 0.42 4.03 2.02 -0.33 -4.85 118.70 120.01 2wyo s GLU 31 Ca 0.53 1.50 0.15 0.00 0.02 0.00 0.00 54.97 57.16 2wyo s GLU 31 Cb -0.35 -1.85 1.03 0.00 0.10 0.00 0.00 34.13 33.06 2wyo s GLU 31 CO 0.46 -1.87 1.92 0.66 0.02 0.00 0.00 175.26 176.44 2wyo h SER 32 N -0.81 0.42 -2.96 -0.19 4.64 -1.95 -3.35 113.55 109.35 2wyo h SER 32 Ca -0.45 0.02 -0.75 0.00 -0.47 0.00 0.00 61.79 60.14 2wyo h SER 32 Cb 1.26 -0.06 -0.22 0.00 -0.31 0.00 0.00 62.40 63.07 2wyo h SER 32 CO 0.49 0.22 0.70 0.00 -0.87 0.00 0.00 176.83 177.36 2wyo s ALA 33 N -5.43 4.02 0.00 5.18 0.00 -1.26 -5.04 121.76 119.23 2wyo s ALA 33 Ca -0.08 -3.30 0.00 0.00 0.00 0.00 0.00 51.96 48.58 2wyo s ALA 33 Cb 0.21 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2wyo s ALA 33 CO 0.77 -2.58 0.00 0.41 0.00 0.00 0.00 175.76 174.36 2wyo n GLY 34 N 4.13 0.96 0.32 0.00 0.00 -1.26 -4.18 105.19 105.18 2wyo n GLY 34 Ca 0.25 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.65 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 0.72 -6.69 1.61 0.13 -1.96 -3.37 132.00 122.44 2wyo h PRO 35 Ca 0.00 -0.05 -0.58 0.00 -0.87 0.00 0.00 66.00 64.51 2wyo h PRO 35 Cb 0.00 -0.16 0.17 0.00 0.13 0.00 0.00 31.00 31.13 2wyo h PRO 35 CO 0.00 0.49 -0.08 0.41 -0.23 0.00 0.00 178.00 178.58 2wyo n GLY 36 N -1.43 -0.80 3.09 1.56 0.00 -1.26 -4.77 105.19 101.59 2wyo n GLY 36 Ca 0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 2wyo n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wyo s ARG 37 N -2.47 1.12 0.19 1.61 1.81 -1.26 -1.18 118.95 118.76 2wyo s ARG 37 Ca 0.73 -0.48 0.07 0.00 -1.72 0.00 0.00 55.73 54.33 2wyo s ARG 37 Cb -0.43 -1.07 -0.05 0.00 -0.45 0.00 0.00 34.95 32.95 2wyo s ARG 37 CO 0.50 0.28 -0.13 0.14 -0.68 0.00 0.00 175.30 175.40 2wyo s VAL 38 N -0.27 1.57 0.59 3.52 -7.23 0.77 -4.87 120.40 114.48 2wyo s VAL 38 Ca 0.04 -2.15 -0.19 0.00 -1.81 0.00 0.00 61.98 57.87 2wyo s VAL 38 Cb -0.06 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 2wyo s VAL 38 CO -0.00 -0.63 1.26 -2.84 -0.31 0.00 0.00 175.10 172.58 2wyo s PRO 39 N -3.63 2.91 0.88 4.82 0.02 -1.26 -0.25 135.00 138.49 2wyo s PRO 39 Ca 0.20 1.98 -0.10 0.00 0.02 0.00 0.00 61.00 63.10 2wyo s PRO 39 Cb -0.00 -1.99 0.12 0.00 0.02 0.00 0.00 34.50 32.65 2wyo s PRO 39 CO 0.05 -1.29 1.14 0.14 -0.33 0.00 0.00 177.00 176.71 2wyo s VAL 40 N -1.47 2.33 -0.02 3.83 -7.23 -1.11 -4.63 120.40 112.10 2wyo s VAL 40 Ca 0.77 0.11 -0.30 0.00 -1.81 0.00 0.00 61.98 60.75 2wyo s VAL 40 Cb -0.34 -2.25 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 2wyo s VAL 40 CO 0.38 -0.14 1.32 -2.84 -0.31 0.00 0.00 175.10 173.51 2wyo s PRO 41 N -4.67 4.31 0.11 4.82 0.02 -1.26 -4.88 135.00 133.45 2wyo s PRO 41 Ca 0.66 1.86 0.04 0.00 0.02 0.00 0.00 61.00 63.58 2wyo s PRO 41 Cb -0.22 -3.55 -0.04 0.00 0.02 0.00 0.00 34.50 30.71 2wyo s PRO 41 CO 0.57 -0.52 -0.11 0.54 -0.33 0.00 0.00 177.00 177.15 2wyo s VAL 42 N 2.27 1.08 0.23 3.83 0.11 -0.97 0.58 120.40 127.53 2wyo s VAL 42 Ca 0.61 -1.69 -0.18 0.00 -2.93 0.00 0.00 61.98 57.78 2wyo s VAL 42 Cb -0.29 -1.44 -0.08 0.00 -1.53 0.00 0.00 36.38 33.03 2wyo s VAL 42 CO 0.25 -0.52 0.71 0.42 -3.33 0.00 0.00 175.10 172.63 2wyo s THR 43 N -2.39 4.62 -1.78 5.04 -4.23 -0.28 -0.59 115.64 116.03 2wyo s THR 43 Ca 0.07 1.18 0.05 0.00 -1.18 0.00 0.00 61.69 61.81 2wyo s THR 43 Cb -0.03 -3.80 0.17 0.00 1.34 0.00 0.00 72.50 70.17 2wyo s THR 43 CO 0.01 0.14 1.07 0.18 -0.54 0.00 0.00 174.62 175.48 2wyo n LEU 44 N 0.53 1.18 -3.51 4.79 4.77 -0.85 -4.83 117.00 119.08 2wyo n LEU 44 Ca -0.02 -0.59 -0.14 0.00 -0.03 0.00 0.00 56.01 55.23 2wyo n LEU 44 Cb 0.51 -0.20 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 2wyo n LEU 44 CO 0.43 0.26 0.36 0.00 -1.33 0.00 0.00 177.39 177.11 2wyo s GLN 45 N -1.70 1.12 0.90 3.23 0.00 -1.26 -4.91 119.66 117.05 2wyo s GLN 45 Ca 0.12 -0.18 -0.13 0.00 -0.00 0.00 0.00 55.36 55.18 2wyo s GLN 45 Cb 0.07 0.52 0.13 0.00 0.00 0.00 0.00 33.01 33.73 2wyo s GLN 45 CO 0.07 -0.42 1.15 -2.14 0.00 0.00 0.00 175.29 173.95 2wyo s PRO 46 N -2.54 1.20 -0.11 9.60 0.02 -1.26 -4.77 135.00 137.13 2wyo s PRO 46 Ca -0.05 0.22 -0.06 0.00 0.02 0.00 0.00 61.00 61.12 2wyo s PRO 46 Cb -0.01 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 2wyo s PRO 46 CO -0.02 -2.14 0.13 0.45 -0.33 0.00 0.00 177.00 175.09 2wyo s SER 47 N -4.16 6.31 -0.01 2.53 0.15 0.21 -4.89 113.70 113.83 2wyo s SER 47 Ca 0.64 0.44 -0.13 0.00 0.70 0.00 0.00 55.95 57.60 2wyo s SER 47 Cb -0.13 -2.03 -0.05 0.00 -1.71 0.00 0.00 66.02 62.09 2wyo s SER 47 CO 0.53 0.40 0.37 -0.04 1.20 0.00 0.00 173.24 175.70 2wyo s MET 48 N -1.05 3.84 -0.03 5.44 1.00 -1.26 0.29 119.30 127.52 2wyo s MET 48 Ca 0.15 0.33 -0.09 0.00 0.00 0.00 0.00 55.69 56.08 2wyo s MET 48 Cb -0.12 -3.21 0.01 0.00 0.00 0.00 0.00 34.83 31.52 2wyo s MET 48 CO 0.04 0.70 0.20 -1.50 0.00 0.00 0.00 175.02 174.46 2wyo s ILE 49 N -1.09 0.04 0.37 2.53 2.07 -0.84 -4.90 121.20 119.39 2wyo s ILE 49 Ca 0.23 -0.37 -0.26 0.00 -1.41 0.00 0.00 60.65 58.84 2wyo s ILE 49 Cb -0.16 -0.41 -0.09 0.00 0.13 0.00 0.00 42.46 41.93 2wyo s ILE 49 CO 0.12 -0.20 1.14 -0.94 -1.91 0.00 0.00 174.94 173.15 2wyo s SER 50 N -0.75 6.72 0.34 4.50 1.04 -1.26 -0.20 113.70 124.08 2wyo s SER 50 Ca -0.08 2.30 0.09 0.00 0.48 0.00 0.00 55.95 58.73 2wyo s SER 50 Cb -0.05 -2.61 0.82 0.00 0.10 0.00 0.00 66.02 64.28 2wyo s SER 50 CO 0.01 -0.54 1.81 -0.09 0.98 0.00 0.00 173.24 175.42 2wyo h ARG 51 N 2.87 0.67 -0.27 4.02 2.43 -1.75 0.07 114.38 122.42 2wyo h ARG 51 Ca -0.48 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.50 2wyo h ARG 51 Cb 1.23 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 2wyo h ARG 51 CO 0.63 0.45 -0.42 0.78 -1.51 0.00 0.00 179.97 179.90 2wyo h GLY 52 N 0.69 0.71 0.78 2.80 0.00 -1.92 0.32 103.07 106.46 2wyo h GLY 52 Ca 0.53 -0.73 -0.16 0.00 0.00 0.00 0.00 47.33 46.97 2wyo h GLY 52 CO -0.30 0.66 -0.65 0.83 0.00 0.00 0.00 176.54 177.08 2wyo h GLU 53 N 0.53 0.40 -0.61 4.80 5.08 -1.86 -2.45 114.58 120.47 2wyo h GLU 53 Ca 0.04 -0.46 0.02 0.00 -1.00 0.00 0.00 59.36 57.96 2wyo h GLU 53 Cb 0.95 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 2wyo h GLU 53 CO 0.09 1.13 0.40 0.35 -1.00 0.00 0.00 179.01 179.98 2wyo h PHE 54 N -0.13 0.72 0.47 4.33 3.57 -0.94 -1.76 116.94 123.20 2wyo h PHE 54 Ca -0.09 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 2wyo h PHE 54 Cb 1.38 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.87 2wyo h PHE 54 CO 0.15 0.44 -0.29 0.78 -2.23 0.00 0.00 178.31 177.17 2wyo h GLY 55 N 0.76 -0.76 0.95 2.40 0.00 -0.29 -2.30 103.07 103.83 2wyo h GLY 55 Ca 0.23 0.32 0.03 0.00 0.00 0.00 0.00 47.33 47.91 2wyo h GLY 55 CO -0.06 -0.28 0.65 -0.84 0.00 0.00 0.00 176.54 176.00 2wyo h THR 56 N -0.72 1.20 -0.85 4.70 2.02 -1.05 -0.71 112.91 117.50 2wyo h THR 56 Ca -0.05 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 2wyo h THR 56 Cb 0.59 -0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 2wyo h THR 56 CO 0.06 0.23 0.49 -0.07 0.37 0.00 0.00 175.52 176.60 2wyo h LEU 57 N 1.27 1.04 -0.08 2.58 3.38 -1.20 0.31 115.31 122.61 2wyo h LEU 57 Ca 0.38 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 2wyo h LEU 57 Cb -0.05 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.44 2wyo h LEU 57 CO -0.11 0.82 -0.03 0.00 0.09 0.00 0.00 178.44 179.21 2wyo h MET 60 N 0.00 0.00 -0.44 0.00 2.07 -0.87 -3.36 114.93 112.33 2wyo h MET 60 Ca 0.00 0.00 -0.03 0.00 -2.07 0.00 0.00 59.70 57.60 2wyo h MET 60 Cb 0.35 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.06 2wyo h MET 60 CO 0.00 0.16 0.16 0.37 1.07 0.00 0.00 176.91 178.67 2wyo h GLN 61 N 0.00 0.63 0.00 1.72 5.75 -1.37 -0.69 115.11 121.15 2wyo h GLN 61 Ca -0.00 -0.09 -0.07 0.00 -0.15 0.00 0.00 58.65 58.34 2wyo h GLN 61 Cb 0.94 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.37 2wyo h GLN 61 CO 0.02 0.53 -0.32 -1.35 -2.65 0.00 0.00 178.83 175.06 2wyo h PRO 62 N 0.62 0.00 0.00 -2.39 0.11 -1.76 -0.21 132.00 128.37 2wyo h PRO 62 Ca 0.15 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.15 2wyo h PRO 62 Cb 0.15 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2wyo h PRO 62 CO -0.01 0.32 -0.54 -0.07 -0.21 0.00 0.00 178.00 177.49 2wyo h LEU 63 N 0.00 0.00 -0.09 2.35 3.38 -1.38 -1.49 115.31 118.08 2wyo h LEU 63 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 2wyo h LEU 63 Cb 0.66 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.42 2wyo h LEU 63 CO 0.04 0.54 -0.58 -0.50 0.09 0.00 0.00 178.44 178.03 2wyo h TRP 64 N 0.00 0.75 -0.49 1.13 4.06 -0.48 0.21 115.95 121.13 2wyo h TRP 64 Ca -0.01 -0.35 -0.03 0.00 2.06 0.00 0.00 58.89 60.57 2wyo h TRP 64 Cb 1.06 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 29.09 2wyo h TRP 64 CO 0.00 1.14 0.20 -0.91 -3.56 0.00 0.00 178.44 175.31 2wyo h ASN 65 N 0.15 0.68 -0.15 -3.49 2.35 -1.09 -1.28 115.58 112.75 2wyo h ASN 65 Ca -0.05 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.53 2wyo h ASN 65 Cb 1.23 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 2wyo h ASN 65 CO 0.12 0.66 0.07 -0.08 -1.65 0.00 0.00 177.43 176.55 2wyo h GLU 66 N 0.65 0.22 -0.87 0.81 4.81 -1.17 0.16 114.58 119.19 2wyo h GLU 66 Ca 0.16 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.38 2wyo h GLU 66 Cb 0.19 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.49 2wyo h GLU 66 CO -0.01 0.27 0.58 0.00 -0.73 0.00 0.00 179.01 179.11 2wyo h ALA 67 N 0.94 1.40 -0.36 2.92 0.00 -0.80 -1.46 119.26 121.91 2wyo h ALA 67 Ca 0.05 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 2wyo h ALA 67 Cb 0.12 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2wyo h ALA 67 CO -0.01 0.54 -0.42 0.28 0.00 0.00 0.00 179.25 179.64 2wyo h VAL 68 N 1.15 1.27 -0.68 0.00 2.07 -0.93 -2.93 116.25 116.21 2wyo h VAL 68 Ca 0.33 -1.60 0.02 0.00 0.82 0.00 0.00 66.70 66.28 2wyo h VAL 68 Cb -0.08 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 2wyo h VAL 68 CO -0.08 0.53 0.43 -0.78 0.02 0.00 0.00 177.57 177.69 2wyo h ASP 69 N 0.73 0.71 0.21 0.57 3.58 0.07 -2.13 116.42 120.16 2wyo h ASP 69 Ca 0.05 -0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.48 2wyo h ASP 69 Cb 1.02 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.91 2wyo h ASP 69 CO 0.10 0.50 -0.10 0.78 -2.88 0.00 0.00 179.24 177.64 2wyo h ASN 70 N 0.85 -0.24 -0.78 2.28 2.35 -1.30 -2.58 115.58 116.16 2wyo h ASN 70 Ca 0.27 -0.23 0.18 0.00 -0.55 0.00 0.00 56.30 55.97 2wyo h ASN 70 Cb -0.01 0.06 -0.12 0.00 0.05 0.00 0.00 38.32 38.31 2wyo h ASN 70 CO -0.10 0.29 0.22 0.74 -1.65 0.00 0.00 177.43 176.93 2wyo h THR 71 N -0.97 0.48 -0.99 2.81 2.02 -1.60 -0.41 112.91 114.25 2wyo h THR 71 Ca -0.03 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.07 2wyo h THR 71 Cb 0.45 0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 2wyo h THR 71 CO 0.05 0.05 0.66 0.00 0.37 0.00 0.00 175.52 176.65 2wyo h ALA 72 N 1.65 1.27 -0.00 6.16 0.00 -1.39 -2.35 119.26 124.59 2wyo h ALA 72 Ca 0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2wyo h ALA 72 Cb 0.81 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2wyo h ALA 72 CO -0.53 0.64 -0.03 0.54 0.00 0.00 0.00 179.25 179.86 2wyo n ARG 73 N -4.40 0.91 -2.76 0.00 1.74 -0.23 -4.18 116.66 107.74 2wyo n ARG 73 Ca 0.12 -0.20 -0.43 0.00 -0.77 0.00 0.00 57.85 56.57 2wyo n ARG 73 Cb 0.02 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 29.97 2wyo n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2wyo n ASN 74 N -0.87 5.97 -0.33 0.55 2.85 -0.82 -4.87 115.26 117.74 2wyo n ASN 74 Ca 0.19 -3.31 0.06 0.00 -0.11 0.00 0.00 54.58 51.40 2wyo n ASN 74 Cb 0.21 -1.34 0.21 0.00 1.24 0.00 0.00 39.78 40.10 2wyo n ASN 74 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 2wyo h PHE 75 N 5.53 0.99 -0.05 1.20 0.04 -1.80 0.07 116.94 122.92 2wyo h PHE 75 Ca 0.27 0.03 -0.14 0.00 2.80 0.00 0.00 57.97 60.93 2wyo h PHE 75 Cb 0.62 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 2wyo h PHE 75 CO 1.10 0.38 -0.60 1.79 -0.60 0.00 0.00 178.31 180.38 2wyo h THR 76 N 0.87 1.40 -0.01 -1.55 1.35 -1.94 -0.97 112.91 112.06 2wyo h THR 76 Ca 0.46 -2.00 -0.00 0.00 -0.55 0.00 0.00 66.41 64.32 2wyo h THR 76 Cb 0.46 2.03 -0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2wyo h THR 76 CO -0.27 0.58 -0.00 0.15 -0.25 0.00 0.00 175.52 175.73 2wyo h PHE 77 N 0.12 0.02 -0.94 4.73 3.04 -1.41 -2.42 116.94 120.09 2wyo h PHE 77 Ca -0.01 -0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.02 2wyo h PHE 77 Cb 1.09 -0.00 -0.07 0.00 2.56 0.00 0.00 35.95 39.52 2wyo h PHE 77 CO 0.01 0.32 0.59 1.25 -2.02 0.00 0.00 178.31 178.47 2wyo h LEU 78 N -0.29 0.91 0.77 0.59 5.85 -0.83 -1.79 115.31 120.52 2wyo h LEU 78 Ca 0.00 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2wyo h LEU 78 Cb 0.32 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.19 2wyo h LEU 78 CO 0.00 0.55 -0.37 -0.09 -0.34 0.00 0.00 178.44 178.19 2wyo h ARG 79 N 1.03 -1.00 -0.99 1.25 2.43 -1.14 -3.13 114.38 112.82 2wyo h ARG 79 Ca 0.42 0.07 0.22 0.00 -0.81 0.00 0.00 59.98 59.88 2wyo h ARG 79 Cb 0.26 0.23 -0.09 0.00 -0.42 0.00 0.00 29.97 29.94 2wyo h ARG 79 CO -0.20 -0.65 0.62 -0.44 -1.51 0.00 0.00 179.97 177.79 2wyo h ASP 80 N -1.18 0.59 -0.50 -3.80 5.19 -1.16 -1.76 116.42 113.80 2wyo h ASP 80 Ca -0.11 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.35 2wyo h ASP 80 Cb 0.81 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 40.28 2wyo h ASP 80 CO 0.17 0.18 0.20 0.00 -3.12 0.00 0.00 179.24 176.67 2wyo h ALA 81 N 1.64 1.32 -0.51 3.45 0.00 -1.29 -3.22 119.26 120.65 2wyo h ALA 81 Ca 0.56 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2wyo h ALA 81 Cb 1.17 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2wyo h ALA 81 CO -0.31 0.50 0.00 1.28 0.00 0.00 0.00 179.25 180.72 2wyo n LEU 82 N -4.32 3.47 -0.05 0.00 4.77 -0.67 -4.69 117.00 115.51 2wyo n LEU 82 Ca 0.04 -1.80 -0.13 0.00 -0.03 0.00 0.00 56.01 54.09 2wyo n LEU 82 Cb 0.18 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 40.86 2wyo n LEU 82 CO 0.39 0.83 0.56 1.56 -1.33 0.00 0.00 177.39 179.40 2wyo h GLN 83 N 3.69 0.39 -0.59 3.23 4.20 -1.55 0.26 115.11 124.75 2wyo h GLN 83 Ca 0.00 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.49 2wyo h GLN 83 Cb 0.90 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.67 2wyo h GLN 83 CO 0.00 0.80 0.38 1.49 -0.67 0.00 0.00 178.83 180.83 2wyo h GLU 84 N 0.00 0.78 0.00 1.46 4.57 -1.84 0.14 114.58 119.69 2wyo h GLU 84 Ca 0.02 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 2wyo h GLU 84 Cb 0.76 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2wyo h GLU 84 CO 0.05 0.52 0.00 2.41 -1.18 0.00 0.00 179.01 180.81 2wyo n THR 85 N -4.67 0.97 -0.04 0.32 -1.04 -0.92 -1.89 114.28 107.02 2wyo n THR 85 Ca 0.04 0.30 -0.18 0.00 -2.04 0.00 0.00 64.05 62.16 2wyo n THR 85 Cb 0.03 -1.18 -0.14 0.00 -1.82 0.00 0.00 70.33 67.22 2wyo n THR 85 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wyo n ALA 86 N -1.67 1.13 -0.28 2.41 0.00 0.88 -3.72 120.51 119.26 2wyo n ALA 86 Ca 0.02 -0.78 0.13 0.00 0.00 0.00 0.00 53.44 52.81 2wyo n ALA 86 Cb 0.18 -0.52 0.39 0.00 0.00 0.00 0.00 19.45 19.49 2wyo n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wyo h ALA 87 N 0.21 1.87 -0.28 0.00 0.00 -0.70 -2.44 119.26 117.91 2wyo h ALA 87 Ca -0.46 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 2wyo h ALA 87 Cb 2.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.69 2wyo h ALA 87 CO 0.04 -0.13 -0.55 0.66 0.00 0.00 0.00 179.25 179.27 2wyo h SER 88 N 0.66 0.95 -3.09 0.00 4.64 -1.52 -3.40 113.55 111.80 2wyo h SER 88 Ca 0.47 -0.51 -0.60 0.00 -0.47 0.00 0.00 61.79 60.68 2wyo h SER 88 Cb 0.81 -0.27 -0.40 0.00 -0.31 0.00 0.00 62.40 62.23 2wyo h SER 88 CO -0.22 1.31 -0.79 -0.62 -0.87 0.00 0.00 176.83 175.64 2wyo s ASP 89 N -6.95 3.27 0.17 4.97 2.15 -0.95 -5.00 116.67 114.33 2wyo s ASP 89 Ca -0.10 -2.66 0.09 0.00 0.43 0.00 0.00 52.55 50.31 2wyo s ASP 89 Cb 0.10 -0.84 -0.07 0.00 -0.30 0.00 0.00 42.92 41.81 2wyo s ASP 89 CO 0.89 -0.25 1.36 1.62 -0.17 0.00 0.00 175.17 178.61 2wyo h VAL 90 N 5.05 1.55 -0.01 1.11 3.04 -1.69 -2.63 116.25 122.67 2wyo h VAL 90 Ca 0.05 -3.04 0.00 0.00 -1.01 0.00 0.00 66.70 62.70 2wyo h VAL 90 Cb 0.92 2.67 0.00 0.00 -2.01 0.00 0.00 31.29 32.88 2wyo h VAL 90 CO 0.43 0.85 0.00 0.59 -1.01 0.00 0.00 177.57 178.43 2wyo n ASN 91 N -3.40 0.64 0.00 3.17 4.13 -1.26 -2.83 115.26 115.70 2wyo n ASN 91 Ca 0.00 -1.23 0.00 0.00 1.68 0.00 0.00 54.58 55.03 2wyo n ASN 91 Cb 0.86 -0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.10 2wyo n ASN 91 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 2wyo n PHE 92 N -0.49 0.00 -0.42 3.10 7.35 -1.25 -4.77 117.46 120.97 2wyo n PHE 92 Ca 0.22 0.00 0.35 0.00 -0.76 0.00 0.00 57.45 57.25 2wyo n PHE 92 Cb 0.21 0.00 0.64 0.00 0.35 0.00 0.00 39.48 40.68 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 0.25 -0.03 -2.13 2.02 -1.78 -0.30 112.91 110.95 2wyo h THR 93 Ca 0.00 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 2wyo h THR 93 Cb 0.00 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.50 2wyo h THR 93 CO 0.00 0.03 0.00 1.23 0.37 0.00 0.00 175.52 177.15 2wyo h GLY 94 N 0.14 0.04 1.60 2.16 0.00 -1.31 -0.34 103.07 105.37 2wyo h GLY 94 Ca 0.74 -0.03 -0.08 0.00 0.00 0.00 0.00 47.33 47.97 2wyo h GLY 94 CO -0.30 0.03 -0.16 0.50 0.00 0.00 0.00 176.54 176.60 2wyo h LYS 95 N -0.21 0.48 0.10 4.80 1.79 -0.95 0.47 116.57 123.05 2wyo h LYS 95 Ca 0.01 -0.15 -0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2wyo h LYS 95 Cb 0.26 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 2wyo h LYS 95 CO 0.00 0.63 -0.05 -0.07 -1.08 0.00 0.00 179.45 178.88 2wyo h LEU 96 N 0.44 -0.11 -1.76 2.94 3.38 -1.27 -2.20 115.31 116.72 2wyo h LEU 96 Ca 0.08 -0.36 0.10 0.00 0.09 0.00 0.00 57.88 57.79 2wyo h LEU 96 Cb 0.54 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2wyo h LEU 96 CO 0.03 0.32 0.35 0.25 0.09 0.00 0.00 178.44 179.48 2wyo h LEU 97 N -0.57 0.25 -1.02 1.67 5.85 -0.86 -0.23 115.31 120.41 2wyo h LEU 97 Ca -0.01 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 2wyo h LEU 97 Cb 0.46 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2wyo h LEU 97 CO 0.02 0.15 -0.18 -1.13 -0.34 0.00 0.00 178.44 176.96 2wyo h ASN 98 N 0.28 0.49 -0.58 1.25 -0.73 -0.62 -1.83 115.58 113.83 2wyo h ASN 98 Ca 0.24 -0.14 -0.08 0.00 1.87 0.00 0.00 56.30 58.18 2wyo h ASN 98 Cb 0.58 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 39.01 2wyo h ASN 98 CO -0.05 0.69 0.06 0.24 -0.37 0.00 0.00 177.43 177.99 2wyo h MET 99 N 0.45 1.02 0.34 6.67 2.86 -0.42 0.16 114.93 126.01 2wyo h MET 99 Ca 0.08 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 2wyo h MET 99 Cb 0.58 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 2wyo h MET 99 CO 0.04 0.96 -0.22 1.25 1.06 0.00 0.00 176.91 180.00 2wyo h LEU 100 N 0.95 -0.55 -0.16 1.22 5.85 -1.18 0.15 115.31 121.58 2wyo h LEU 100 Ca 0.18 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.99 2wyo h LEU 100 Cb 0.47 0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 2wyo h LEU 100 CO 0.02 -0.35 -0.29 -0.61 -0.34 0.00 0.00 178.44 176.88 2wyo h GLN 101 N -0.54 -0.33 0.43 1.25 5.75 -1.14 -1.14 115.11 119.39 2wyo h GLN 101 Ca -0.03 0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 2wyo h GLN 101 Cb 0.45 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.08 2wyo h GLN 101 CO 0.03 -0.22 -0.21 1.49 -2.65 0.00 0.00 178.83 177.27 2wyo h GLU 102 N -0.34 -0.56 0.32 1.69 4.22 -0.26 -1.16 114.58 118.49 2wyo h GLU 102 Ca 0.11 0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.57 2wyo h GLU 102 Cb 0.51 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2wyo h GLU 102 CO -0.36 -0.37 -0.15 0.28 -2.18 0.00 0.00 179.01 176.23 2wyo h VAL 103 N -0.79 0.70 0.00 0.32 2.07 -0.78 -3.35 116.25 114.43 2wyo h VAL 103 Ca -0.06 -0.15 -0.32 0.00 0.82 0.00 0.00 66.70 66.99 2wyo h VAL 103 Cb 0.45 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.95 2wyo h VAL 103 CO 0.10 0.03 -1.95 -1.22 0.02 0.00 0.00 177.57 174.55 2wyo n TYR 104 N -5.24 0.65 0.00 1.57 4.01 -0.47 -4.35 117.16 113.33 2wyo n TYR 104 Ca -0.10 0.23 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 2wyo n TYR 104 Cb 0.21 -1.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.12 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 -2.94 0.15 -4.59 7.72 4.77 -0.62 -4.87 117.00 116.62 2wyo n LEU 105 Ca -0.23 0.07 -0.55 0.00 -0.03 0.00 0.00 56.01 55.28 2wyo n LEU 105 Cb 1.09 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 41.74 2wyo n LEU 105 CO 0.44 -0.37 0.88 -1.54 -1.33 0.00 0.00 177.39 175.47 2wyo n SER 106 N -2.12 1.31 -2.06 -1.43 3.41 -0.54 -4.61 113.62 107.59 2wyo n SER 106 Ca 0.00 1.13 -0.01 0.00 -0.26 0.00 0.00 58.87 59.72 2wyo n SER 106 Cb 0.00 -1.10 -0.02 0.00 -0.26 0.00 0.00 64.21 62.83 2wyo n SER 106 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wyo n GLY 107 N 2.54 1.25 3.87 5.00 0.00 -1.26 -4.72 105.19 111.87 2wyo n GLY 107 Ca 0.20 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 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 2.28 1.65 0.51 -0.02 0.00 -1.26 -5.07 107.32 105.42 2wyo s GLY 108 Ca 0.07 -0.82 -0.12 0.00 0.00 0.00 0.00 44.72 43.85 2wyo s GLY 108 CO 0.00 -0.20 0.92 2.56 0.00 0.00 0.00 173.10 176.38 2wyo s PRO 109 N -5.61 3.76 0.06 2.90 0.04 -1.26 -4.93 135.00 129.95 2wyo s PRO 109 Ca 0.67 0.68 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 2wyo s PRO 109 Cb -0.09 -2.21 0.02 0.00 0.04 0.00 0.00 34.50 32.26 2wyo s PRO 109 CO 0.52 -0.29 0.33 -0.59 0.04 0.00 0.00 177.00 177.01 2wyo s PHE 110 N -2.74 -0.14 -0.11 0.56 -0.12 -1.26 -4.74 117.98 109.44 2wyo s PHE 110 Ca 0.54 -0.02 -0.30 0.00 -0.05 0.00 0.00 56.93 57.11 2wyo s PHE 110 Cb -0.10 0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.39 2wyo s PHE 110 CO 0.39 -0.55 1.34 -1.14 -0.05 0.00 0.00 175.22 175.22 2wyo s GLN 111 N -2.79 4.25 0.20 1.99 2.00 -1.26 -4.77 119.66 119.28 2wyo s GLN 111 Ca -0.03 1.80 0.23 0.00 -2.00 0.00 0.00 55.36 55.35 2wyo s GLN 111 Cb -0.00 -3.74 0.01 0.00 0.80 0.00 0.00 33.01 30.08 2wyo s GLN 111 CO -0.05 -0.67 1.05 0.37 -0.50 0.00 0.00 175.29 175.49 2wyo h GLN 112 N 8.26 0.00 -6.38 1.67 5.75 -1.94 -3.46 115.11 119.01 2wyo h GLN 112 Ca -0.31 0.00 -0.54 0.00 -0.15 0.00 0.00 58.65 57.64 2wyo h GLN 112 Cb 1.14 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.66 2wyo h GLN 112 CO 0.94 0.00 0.39 -0.51 -2.65 0.00 0.00 178.83 177.00 2wyo s LEU 113 N -5.32 4.35 -0.02 -2.39 1.43 -1.26 -4.09 118.68 111.38 2wyo s LEU 113 Ca -0.00 1.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.77 2wyo s LEU 113 Cb 0.10 -3.56 -0.01 0.00 0.03 0.00 0.00 46.19 42.75 2wyo s LEU 113 CO 0.79 -0.28 -0.14 -0.04 0.23 0.00 0.00 176.35 176.90 2wyo s MET 114 N 1.14 1.25 -0.24 1.70 -1.94 -0.36 -4.39 119.30 116.46 2wyo s MET 114 Ca 0.51 -0.51 -0.02 0.00 -1.71 0.00 0.00 55.69 53.96 2wyo s MET 114 Cb -0.21 -1.18 0.02 0.00 2.01 0.00 0.00 34.83 35.47 2wyo s MET 114 CO 0.27 0.28 -0.05 -1.17 -0.01 0.00 0.00 175.02 174.33 2wyo s LEU 115 N -0.22 3.14 -0.22 -0.03 2.96 -1.22 -2.04 118.68 121.05 2wyo s LEU 115 Ca 0.03 -0.76 -0.06 0.00 -0.22 0.00 0.00 54.13 53.12 2wyo s LEU 115 Cb -0.07 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 2wyo s LEU 115 CO -0.00 -0.11 0.04 -0.83 -1.32 0.00 0.00 176.35 174.13 2wyo s GLY 116 N 1.37 1.76 -0.52 7.98 0.00 0.12 -4.16 107.32 113.88 2wyo s GLY 116 Ca 0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 44.72 43.69 2wyo s GLY 116 CO -0.04 0.33 0.34 -0.42 0.00 0.00 0.00 173.10 173.30 2wyo s ILE 117 N 1.15 3.64 0.39 0.90 1.01 -1.26 -0.57 121.20 126.46 2wyo s ILE 117 Ca 0.04 -2.42 0.08 0.00 0.00 0.00 0.00 60.65 58.34 2wyo s ILE 117 Cb -0.14 -3.42 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 2wyo s ILE 117 CO 0.02 -0.79 0.45 -0.36 0.00 0.00 0.00 174.94 174.27 2wyo s PHE 118 N 0.63 2.85 -0.25 3.97 0.08 0.10 -4.46 117.98 120.90 2wyo s PHE 118 Ca 0.12 -0.38 -0.02 0.00 0.12 0.00 0.00 56.93 56.77 2wyo s PHE 118 Cb -0.22 -2.17 0.13 0.00 -0.57 0.00 0.00 43.02 40.20 2wyo s PHE 118 CO -0.04 -0.17 0.36 0.50 -0.10 0.00 0.00 175.22 175.77 2wyo s ARG 119 N -4.20 0.34 -0.20 0.44 3.52 -0.14 -1.09 118.95 117.61 2wyo s ARG 119 Ca 0.49 0.38 -0.27 0.00 -0.13 0.00 0.00 55.73 56.20 2wyo s ARG 119 Cb -0.07 -0.55 -0.00 0.00 -1.56 0.00 0.00 34.95 32.76 2wyo s ARG 119 CO 0.30 -0.74 0.93 0.99 -0.81 0.00 0.00 175.30 175.98 2wyo s THR 120 N 2.50 4.78 -0.04 4.11 2.01 -0.54 -2.08 115.64 126.38 2wyo s THR 120 Ca 0.11 1.82 -0.07 0.00 0.31 0.00 0.00 61.69 63.86 2wyo s THR 120 Cb -0.15 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 2wyo s THR 120 CO -0.19 -0.08 0.22 -1.81 -0.69 0.00 0.00 174.62 172.08 2wyo s ASP 121 N 1.21 6.46 0.29 3.53 -0.00 -0.68 -1.07 116.67 126.42 2wyo s ASP 121 Ca 0.41 0.53 0.07 0.00 -0.00 0.00 0.00 52.55 53.55 2wyo s ASP 121 Cb -0.16 -2.08 -0.06 0.00 -0.00 0.00 0.00 42.92 40.62 2wyo s ASP 121 CO 0.10 0.31 -0.06 -0.31 -0.00 0.00 0.00 175.17 175.21 2wyo s TYR 122 N -1.19 2.02 -0.07 4.23 2.02 0.38 -0.84 117.35 123.89 2wyo s TYR 122 Ca 0.23 -0.68 -0.04 0.00 -0.37 0.00 0.00 57.07 56.21 2wyo s TYR 122 Cb -0.13 -1.17 0.04 0.00 -0.40 0.00 0.00 41.96 40.29 2wyo s TYR 122 CO 0.12 0.31 0.17 -1.64 -1.57 0.00 0.00 175.55 172.94 2wyo s MET 123 N -3.72 0.13 0.07 -0.62 -1.94 0.29 -1.68 119.30 111.83 2wyo s MET 123 Ca 0.30 0.37 -0.30 0.00 -1.71 0.00 0.00 55.69 54.36 2wyo s MET 123 Cb 0.04 -0.12 -0.05 0.00 2.01 0.00 0.00 34.83 36.71 2wyo s MET 123 CO 0.13 -0.14 1.02 0.50 -0.01 0.00 0.00 175.02 176.52 2wyo s ARG 124 N 0.98 4.59 0.53 2.03 3.52 -1.26 -1.30 118.95 128.04 2wyo s ARG 124 Ca -0.07 1.52 -0.18 0.00 -0.13 0.00 0.00 55.73 56.87 2wyo s ARG 124 Cb -0.09 -3.39 -0.06 0.00 -1.56 0.00 0.00 34.95 29.84 2wyo s ARG 124 CO -0.05 0.02 1.03 -1.83 -0.81 0.00 0.00 175.30 173.65 2wyo s GLU 125 N 0.53 3.65 0.00 5.12 -1.05 -0.24 -1.04 118.70 125.68 2wyo s GLU 125 Ca 0.51 1.19 0.22 0.00 -0.15 0.00 0.00 54.97 56.75 2wyo s GLU 125 Cb -0.24 -2.08 0.38 0.00 -0.44 0.00 0.00 34.13 31.75 2wyo s GLU 125 CO 0.30 -0.53 1.36 0.41 0.95 0.00 0.00 175.26 177.74 2wyo n GLY 126 N -0.86 1.61 0.00 -3.83 0.00 -0.40 -4.52 105.19 97.18 2wyo n GLY 126 Ca 0.08 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2wyo n GLY 126 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wyo n VAL 127 N 1.42 0.00 -0.34 1.61 0.31 -1.26 -4.94 118.33 115.13 2wyo n VAL 127 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 2wyo n VAL 127 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 2wyo n VAL 127 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2wyo n SER 133 N 0.00 0.00 0.00 4.52 7.64 -1.26 -5.18 113.62 119.33 2wyo n SER 133 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.91 2wyo n SER 133 Cb 0.00 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.35 2wyo n SER 133 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2wyo n THR 134 N 0.00 0.00 -0.53 0.44 -2.24 -1.26 -1.83 114.28 108.87 2wyo n THR 134 Ca 0.00 0.00 0.43 0.00 -2.27 0.00 0.00 64.05 62.21 2wyo n THR 134 Cb 0.00 -0.82 0.66 0.00 -2.10 0.00 0.00 70.33 68.07 2wyo n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2wyo n THR 135 N -0.92 0.00 -4.24 4.28 5.66 -1.26 -4.43 114.28 113.37 2wyo n THR 135 Ca 0.04 1.35 -0.16 0.00 -3.05 0.00 0.00 64.05 62.23 2wyo n THR 135 Cb 0.02 -2.30 -0.11 0.00 -1.55 0.00 0.00 70.33 66.39 2wyo n THR 135 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wyo s ALA 136 N -4.62 1.42 0.62 1.79 0.00 -0.76 -4.85 121.76 115.36 2wyo s ALA 136 Ca -0.04 -1.37 -0.13 0.00 0.00 0.00 0.00 51.96 50.42 2wyo s ALA 136 Cb 0.22 -0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.30 2wyo s ALA 136 CO 0.72 -0.01 1.04 0.45 0.00 0.00 0.00 175.76 177.96 2wyo s SER 137 N -2.79 5.89 0.19 0.00 0.15 -0.83 -4.93 113.70 111.39 2wyo s SER 137 Ca 0.12 1.60 0.24 0.00 0.70 0.00 0.00 55.95 58.62 2wyo s SER 137 Cb -0.01 -2.50 0.43 0.00 -1.71 0.00 0.00 66.02 62.23 2wyo s SER 137 CO 0.02 -1.09 1.44 -0.09 1.20 0.00 0.00 173.24 174.72 2wyo h ARG 138 N -0.09 0.00 -5.36 5.44 9.65 -1.96 -3.44 114.38 118.63 2wyo h ARG 138 Ca -0.45 0.00 -0.61 0.00 -1.10 0.00 0.00 59.98 57.82 2wyo h ARG 138 Cb 1.20 0.00 -0.12 0.00 -1.39 0.00 0.00 29.97 29.66 2wyo h ARG 138 CO 0.59 0.00 -0.18 -1.58 2.80 0.00 0.00 179.97 181.60 2wyo s TRP 139 N -3.18 3.33 -0.04 2.20 0.52 -1.26 -1.08 118.94 119.43 2wyo s TRP 139 Ca 0.07 0.57 0.01 0.00 0.02 0.00 0.00 56.10 56.77 2wyo s TRP 139 Cb 0.12 -2.56 -0.03 0.00 -1.15 0.00 0.00 33.47 29.84 2wyo s TRP 139 CO 0.69 -0.09 -0.03 0.15 0.02 0.00 0.00 176.95 177.68 2wyo s LYS 140 N 1.61 2.78 -0.03 4.98 -0.14 -0.42 -4.53 119.74 123.98 2wyo s LYS 140 Ca 0.18 -0.56 -0.30 0.00 -1.36 0.00 0.00 55.97 53.93 2wyo s LYS 140 Cb -0.15 -2.64 -0.03 0.00 -1.68 0.00 0.00 37.83 33.33 2wyo s LYS 140 CO 0.09 0.65 0.99 1.21 -0.76 0.00 0.00 175.35 177.53 2wyo s ASN 141 N -1.12 7.34 -0.13 2.83 3.04 0.64 0.11 114.94 127.64 2wyo s ASN 141 Ca 0.15 1.63 -0.02 0.00 0.04 0.00 0.00 52.86 54.66 2wyo s ASN 141 Cb -0.11 -2.57 -0.07 0.00 -1.54 0.00 0.00 41.25 36.96 2wyo s ASN 141 CO 0.05 -0.31 -0.14 1.33 -3.04 0.00 0.00 177.10 174.99 2wyo n VAL 142 N 4.07 0.73 -4.08 -5.21 0.24 -0.02 -4.62 118.33 109.44 2wyo n VAL 142 Ca 0.07 -0.24 -0.14 0.00 -2.04 0.00 0.00 64.34 61.99 2wyo n VAL 142 Cb 0.50 -1.25 -0.13 0.00 -1.47 0.00 0.00 33.84 31.50 2wyo n VAL 142 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2wyo s GLU 143 N -2.25 0.39 -0.17 7.34 2.56 -1.23 -5.04 118.70 120.30 2wyo s GLU 143 Ca -0.18 -0.38 -0.08 0.00 0.00 0.00 0.00 54.97 54.34 2wyo s GLU 143 Cb 0.06 -0.28 -0.04 0.00 2.00 0.00 0.00 34.13 35.87 2wyo s GLU 143 CO 0.27 0.06 0.09 0.42 -0.56 0.00 0.00 175.26 175.54 2wyo s ILE 144 N -0.61 5.05 -0.16 -3.70 1.01 -1.26 -1.69 121.20 119.84 2wyo s ILE 144 Ca -0.04 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2wyo s ILE 144 Cb -0.05 -3.26 0.03 0.00 0.01 0.00 0.00 42.46 39.20 2wyo s ILE 144 CO -0.00 0.50 -0.09 0.20 0.00 0.00 0.00 174.94 175.55 2wyo s ASN 145 N 0.00 2.86 0.00 3.58 0.01 -0.89 -4.60 114.94 115.91 2wyo s ASN 145 Ca 0.07 -0.63 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 2wyo s ASN 145 Cb -0.12 -1.05 0.00 0.00 0.41 0.00 0.00 41.25 40.49 2wyo s ASN 145 CO 0.00 -0.13 0.31 0.35 -1.51 0.00 0.00 177.10 176.12 2wyo n THR 146 N 4.81 0.00 -3.99 1.60 -2.24 -1.26 -0.96 114.28 112.23 2wyo n THR 146 Ca -0.14 -0.46 -0.30 0.00 -2.27 0.00 0.00 64.05 60.89 2wyo n THR 146 Cb 0.48 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.61 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 -0.29 1.50 -1.45 2.28 2.07 -1.26 -4.23 121.20 119.83 2wyo s ILE 147 Ca 0.00 -0.70 -0.11 0.00 -1.41 0.00 0.00 60.65 58.43 2wyo s ILE 147 Cb 0.00 -1.48 0.05 0.00 0.13 0.00 0.00 42.46 41.15 2wyo s ILE 147 CO 0.00 0.35 1.08 -0.24 -1.91 0.00 0.00 174.94 174.22 2wyo n SER 148 N 4.77 -5.54 -4.61 4.50 2.88 -1.21 -4.90 113.62 109.52 2wyo n SER 148 Ca -0.16 -0.66 -0.50 0.00 -1.33 0.00 0.00 58.87 56.22 2wyo n SER 148 Cb 0.49 -4.45 -0.05 0.00 -0.75 0.00 0.00 64.21 59.45 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 0.46 6.02 0.00 0.00 0.01 -1.26 -4.70 113.70 114.23 2wyo s SER 150 Ca 0.81 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 58.03 2wyo s SER 150 Cb -0.87 -1.42 0.00 0.00 0.21 0.00 0.00 66.02 63.94 2wyo s SER 150 CO 0.46 -0.41 0.00 0.49 0.41 0.00 0.00 173.24 174.19 2wyo n PHE 151 N -1.68 0.00 0.19 2.43 3.72 -1.26 -4.89 117.46 115.97 2wyo n PHE 151 Ca -0.02 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.42 2wyo n PHE 151 Cb 0.58 -0.17 0.38 0.00 -0.94 0.00 0.00 39.48 39.33 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 0.00 1.38 0.13 4.37 0.00 -1.92 0.74 119.26 123.96 2wyo h ALA 152 Ca 0.00 -0.32 -0.20 0.00 0.00 0.00 0.00 54.91 54.40 2wyo h ALA 152 Cb 0.05 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.80 2wyo h ALA 152 CO 0.00 0.44 -0.90 0.78 0.00 0.00 0.00 179.25 179.57 2wyo h GLY 153 N 1.11 0.32 1.55 0.00 0.00 -1.86 -2.26 103.07 101.93 2wyo h GLY 153 Ca -0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 47.33 46.38 2wyo h GLY 153 CO 0.05 0.72 -0.90 1.41 0.00 0.00 0.00 176.54 177.82 2wyo h LEU 154 N -0.38 0.00 -0.92 3.11 3.38 -1.82 -3.39 115.31 115.29 2wyo h LEU 154 Ca -0.17 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.00 2wyo h LEU 154 Cb 1.64 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.28 2wyo h LEU 154 CO 0.13 0.51 0.47 -1.28 0.09 0.00 0.00 178.44 178.36 2wyo h SER 155 N 0.00 0.51 1.36 -0.43 0.87 -1.05 -0.59 113.55 114.21 2wyo h SER 155 Ca -0.07 0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2wyo h SER 155 Cb 1.45 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 2wyo h SER 155 CO 0.05 0.11 0.00 -0.65 -0.53 0.00 0.00 176.83 175.82 2wyo h PRO 156 N 0.54 0.00 0.00 2.24 0.11 -1.83 -1.26 132.00 131.80 2wyo h PRO 156 Ca 0.55 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.57 2wyo h PRO 156 Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2wyo h PRO 156 CO -0.46 0.00 -0.46 -0.07 -0.21 0.00 0.00 178.00 176.81 2wyo h LEU 157 N 0.00 0.00 -1.06 2.35 3.38 -1.37 -2.94 115.31 115.67 2wyo h LEU 157 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2wyo h LEU 157 Cb 0.68 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2wyo h LEU 157 CO 0.00 0.46 -0.02 0.40 0.09 0.00 0.00 178.44 179.37 2wyo h ILE 158 N 0.00 1.22 -0.28 1.22 1.08 -1.04 -0.23 117.51 119.48 2wyo h ILE 158 Ca -0.00 -0.92 -0.07 0.00 -0.39 0.00 0.00 64.86 63.47 2wyo h ILE 158 Cb 0.81 0.95 -0.02 0.00 -3.07 0.00 0.00 36.82 35.49 2wyo h ILE 158 CO 0.06 0.32 -0.14 0.74 -0.69 0.00 0.00 178.15 178.44 2wyo h THR 159 N 0.60 1.23 -0.12 -0.27 2.02 -1.53 -1.52 112.91 113.32 2wyo h THR 159 Ca 0.12 -1.03 -0.20 0.00 0.77 0.00 0.00 66.41 66.07 2wyo h THR 159 Cb 0.41 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2wyo h THR 159 CO 0.02 0.34 -0.73 -0.33 0.37 0.00 0.00 175.52 175.18 2wyo h GLU 160 N 0.45 0.56 0.41 6.66 5.08 -1.14 0.22 114.58 126.83 2wyo h GLU 160 Ca 0.08 -0.45 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 2wyo h GLU 160 Cb 0.51 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2wyo h GLU 160 CO 0.03 1.08 -0.23 0.35 -1.00 0.00 0.00 179.01 179.24 2wyo h PHE 161 N 0.39 -0.59 -0.77 4.33 3.57 -0.96 -1.33 116.94 121.59 2wyo h PHE 161 Ca -0.04 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.49 2wyo h PHE 161 Cb 1.33 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 40.23 2wyo h PHE 161 CO 0.06 -0.36 0.51 0.45 -2.23 0.00 0.00 178.31 176.74 2wyo h HIS 162 N -0.60 0.92 -0.49 0.41 3.86 -1.12 0.02 115.15 118.15 2wyo h HIS 162 Ca -0.05 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 2wyo h HIS 162 Cb 0.48 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 2wyo h HIS 162 CO -0.07 0.54 0.33 1.96 0.86 0.00 0.00 177.93 181.55 2wyo h GLN 163 N 0.96 0.63 0.08 2.45 4.20 -0.34 -1.46 115.11 121.63 2wyo h GLN 163 Ca 0.30 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.97 2wyo h GLN 163 Cb 0.02 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2wyo h GLN 163 CO -0.09 0.42 -0.04 1.25 -0.67 0.00 0.00 178.83 179.70 2wyo h HIS 164 N 0.65 -0.10 -0.99 2.96 2.76 0.17 -2.09 115.15 118.51 2wyo h HIS 164 Ca 0.18 -0.00 0.13 0.00 -2.20 0.00 0.00 60.37 58.48 2wyo h HIS 164 Cb -0.05 0.03 -0.08 0.00 1.55 0.00 0.00 27.41 28.86 2wyo h HIS 164 CO -0.00 0.06 0.62 0.82 -1.30 0.00 0.00 177.93 178.14 2wyo h ILE 165 N -0.25 0.89 -0.20 6.26 2.04 -1.03 0.11 117.51 125.33 2wyo h ILE 165 Ca -0.01 -0.32 -0.15 0.00 1.00 0.00 0.00 64.86 65.38 2wyo h ILE 165 Cb 0.21 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 2wyo h ILE 165 CO 0.02 0.17 -0.50 0.00 0.00 0.00 0.00 178.15 177.84 2wyo h ALA 166 N 1.56 0.76 -0.36 1.87 0.00 -1.10 -0.98 119.26 121.02 2wyo h ALA 166 Ca 0.50 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2wyo h ALA 166 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2wyo h ALA 166 CO -0.27 0.67 0.01 0.00 0.00 0.00 0.00 179.25 179.67 2wyo h ALA 167 N 1.02 0.48 -0.42 0.00 0.00 -0.79 -1.90 119.26 117.65 2wyo h ALA 167 Ca 0.02 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2wyo h ALA 167 Cb 1.02 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2wyo h ALA 167 CO 0.09 0.23 0.04 -0.92 0.00 0.00 0.00 179.25 178.69 2wyo h TYR 168 N 0.44 0.68 0.04 0.00 3.20 -0.78 -2.64 116.97 117.91 2wyo h TYR 168 Ca 0.10 -0.07 -0.24 0.00 3.14 0.00 0.00 58.73 61.66 2wyo h TYR 168 Cb 0.44 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2wyo h TYR 168 CO 0.03 0.63 -1.18 -0.07 -1.64 0.00 0.00 178.16 175.94 2wyo h LEU 169 N 0.63 0.14 -0.37 2.82 3.38 -1.04 -2.16 115.31 118.72 2wyo h LEU 169 Ca 0.13 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2wyo h LEU 169 Cb 0.34 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2wyo h LEU 169 CO 0.01 1.13 0.20 1.56 0.09 0.00 0.00 178.44 181.43 2wyo h GLN 170 N 0.03 0.52 -0.60 1.13 4.20 -1.21 -1.21 115.11 117.96 2wyo h GLN 170 Ca -0.09 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.48 2wyo h GLN 170 Cb 1.87 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 29.52 2wyo h GLN 170 CO 0.15 0.42 0.07 0.28 -0.67 0.00 0.00 178.83 179.09 2wyo h VAL 171 N 0.47 1.26 -0.62 -0.54 2.07 -1.45 0.73 116.25 118.18 2wyo h VAL 171 Ca 0.13 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.55 2wyo h VAL 171 Cb 0.06 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 2wyo h VAL 171 CO -0.02 0.38 0.14 -0.07 0.02 0.00 0.00 177.57 178.02 2wyo h LEU 172 N 0.91 0.94 -0.25 2.57 3.38 -1.35 -2.10 115.31 119.42 2wyo h LEU 172 Ca 0.18 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2wyo h LEU 172 Cb 0.46 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2wyo h LEU 172 CO 0.02 0.94 -0.03 1.56 0.09 0.00 0.00 178.44 181.01 2wyo h GLN 173 N 0.91 0.46 -0.99 1.13 4.20 -0.90 -3.17 115.11 116.75 2wyo h GLN 173 Ca 0.19 -0.16 0.06 0.00 0.06 0.00 0.00 58.65 58.80 2wyo h GLN 173 Cb 0.37 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.06 2wyo h GLN 173 CO 0.00 0.66 0.64 0.87 -0.67 0.00 0.00 178.83 180.34 2wyo h LYS 174 N 0.22 1.14 0.00 1.46 1.57 -0.76 -2.41 116.57 117.79 2wyo h LYS 174 Ca 0.07 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wyo h LYS 174 Cb 0.48 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2wyo h LYS 174 CO 0.02 0.76 0.00 0.00 -0.57 0.00 0.00 179.45 179.66 2wyo n ALA 175 N -2.36 1.31 -3.45 3.86 0.00 -0.80 -3.99 120.51 115.08 2wyo n ALA 175 Ca 0.15 0.07 -0.21 0.00 0.00 0.00 0.00 53.44 53.44 2wyo n ALA 175 Cb 0.16 -1.23 -0.12 0.00 0.00 0.00 0.00 19.45 18.26 2wyo n ALA 175 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2wyo s ARG 176 N -3.24 0.27 5.45 0.00 1.70 -0.91 -5.10 118.95 117.13 2wyo s ARG 176 Ca 0.02 -0.26 0.00 0.00 -0.47 0.00 0.00 55.73 55.02 2wyo s ARG 176 Cb 0.06 -0.85 0.00 0.00 -0.57 0.00 0.00 34.95 33.59 2wyo s ARG 176 CO 0.21 -1.01 0.00 0.41 -1.08 0.00 0.00 175.30 173.83 2wyo n GLY 177 N 5.29 2.35 1.04 3.88 0.00 -1.26 -4.89 105.19 111.61 2wyo n GLY 177 Ca -0.04 -0.49 0.13 0.00 0.00 0.00 0.00 46.02 45.62 2wyo n GLY 177 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wyo n LYS 178 N 12.35 -1.99 -0.03 1.61 4.76 -1.26 -4.42 118.16 129.17 2wyo n LYS 178 Ca 0.00 1.41 0.00 0.00 -2.87 0.00 0.00 58.31 56.85 2wyo n LYS 178 Cb 0.00 -2.50 0.00 0.00 -1.84 0.00 0.00 35.03 30.69 2wyo n LYS 178 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2wyo n SER 188 N -4.30 -0.48 0.31 4.39 2.88 -1.26 -4.53 113.62 110.63 2wyo n SER 188 Ca -0.01 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 57.73 2wyo n SER 188 Cb 0.62 0.11 0.99 0.00 -0.75 0.00 0.00 64.21 65.18 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 0.00 -0.77 0.66 5.08 -1.98 -3.25 115.95 115.69 2wyo h TRP 189 Ca 0.00 0.00 0.13 0.00 1.08 0.00 0.00 58.89 60.10 2wyo h TRP 189 Cb 0.00 0.00 -0.09 0.00 -3.00 0.00 0.00 29.16 26.07 2wyo h TRP 189 CO 0.00 0.00 0.35 0.82 -1.28 0.00 0.00 178.44 178.33 2wyo h ILE 190 N 0.00 0.73 -3.42 0.12 5.03 -1.92 -3.38 117.51 114.68 2wyo h ILE 190 Ca 0.00 -0.18 -0.59 0.00 -0.12 0.00 0.00 64.86 63.97 2wyo h ILE 190 Cb 0.22 0.14 -0.10 0.00 -3.03 0.00 0.00 36.82 34.06 2wyo h ILE 190 CO 0.00 0.10 -0.07 0.26 -0.68 0.00 0.00 178.15 177.76 2wyo s TRP 191 N -6.02 3.42 -2.00 1.37 0.52 -1.23 -4.69 118.94 110.32 2wyo s TRP 191 Ca -0.12 0.82 0.02 0.00 0.02 0.00 0.00 56.10 56.83 2wyo s TRP 191 Cb 0.20 -2.63 0.09 0.00 -1.15 0.00 0.00 33.47 29.98 2wyo s TRP 191 CO 0.77 -0.01 0.35 0.41 0.02 0.00 0.00 176.95 178.49 2wyo n GLY 192 N 3.67 -0.13 0.00 0.98 0.00 -1.26 -4.57 105.19 103.88 2wyo n GLY 192 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2wyo n GLY 192 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wyo n LYS 193 N -0.69 0.00 0.00 1.61 5.02 -1.26 -4.62 118.16 118.22 2wyo n LYS 193 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2wyo n LYS 193 Cb 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.02 2wyo n LYS 193 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wyo n GLY 194 N -0.56 2.58 0.02 0.72 0.00 -1.26 -4.82 105.19 101.87 2wyo n GLY 194 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.82 2wyo n GLY 194 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wyo n ASN 195 N 0.21 0.07 -3.17 1.61 3.02 -1.26 -4.58 115.26 111.15 2wyo n ASN 195 Ca 0.00 -1.68 0.04 0.00 -0.03 0.00 0.00 54.58 52.91 2wyo n ASN 195 Cb 0.00 -0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.15 2wyo n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wyo s ARG 197 N 2.89 0.64 -0.21 0.00 1.70 -1.08 -4.50 118.95 118.39 2wyo s ARG 197 Ca 0.11 -0.02 -0.29 0.00 -0.47 0.00 0.00 55.73 55.06 2wyo s ARG 197 Cb -0.13 -0.75 -0.01 0.00 -0.57 0.00 0.00 34.95 33.49 2wyo s ARG 197 CO -0.17 -0.13 1.28 -0.51 -1.08 0.00 0.00 175.30 174.70 2wyo s LEU 198 N 1.09 4.08 -0.28 -1.89 1.43 -1.26 -1.43 118.68 120.42 2wyo s LEU 198 Ca -0.09 1.54 -0.10 0.00 -1.03 0.00 0.00 54.13 54.46 2wyo s LEU 198 Cb -0.14 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 2wyo s LEU 198 CO -0.01 -0.87 0.15 -1.61 0.23 0.00 0.00 176.35 174.24 2wyo s GLU 199 N 3.74 3.77 0.04 1.70 0.41 -1.23 -4.97 118.70 122.15 2wyo s GLU 199 Ca 0.56 -0.43 -0.30 0.00 -0.41 0.00 0.00 54.97 54.38 2wyo s GLU 199 Cb -0.20 -3.55 -0.05 0.00 -1.78 0.00 0.00 34.13 28.55 2wyo s GLU 199 CO 0.17 -0.22 1.11 0.50 -0.49 0.00 0.00 175.26 176.34 2wyo s ARG 200 N 1.70 4.48 0.61 1.61 3.52 -1.26 -4.67 118.95 124.94 2wyo s ARG 200 Ca 0.07 1.63 -0.18 0.00 -0.13 0.00 0.00 55.73 57.12 2wyo s ARG 200 Cb -0.16 -3.39 -0.07 0.00 -1.56 0.00 0.00 34.95 29.77 2wyo s ARG 200 CO 0.08 -0.18 0.64 0.45 -0.81 0.00 0.00 175.30 175.49 2wyo n SER 201 N 3.92 -0.59 -0.85 -2.12 2.88 -1.26 -4.92 113.62 110.67 2wyo n SER 201 Ca 0.08 0.72 0.09 0.00 -1.33 0.00 0.00 58.87 58.43 2wyo n SER 201 Cb 0.48 -1.24 0.16 0.00 -0.75 0.00 0.00 64.21 62.86 2wyo n SER 201 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2wyo n VAL 202 N -1.86 0.54 -0.08 2.46 0.24 -1.26 -4.59 118.33 113.78 2wyo n VAL 202 Ca 0.12 -0.77 0.04 0.00 -2.04 0.00 0.00 64.34 61.69 2wyo n VAL 202 Cb 0.48 0.89 0.38 0.00 -1.47 0.00 0.00 33.84 34.12 2wyo n VAL 202 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2wyo h SER 203 N 3.25 0.58 0.22 -1.34 4.64 -1.78 -0.36 113.55 118.75 2wyo h SER 203 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2wyo h SER 203 Cb 0.80 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 2wyo h SER 203 CO 0.00 0.41 0.00 1.23 -0.87 0.00 0.00 176.83 177.60 2wyo h GLY 204 N 0.68 0.00 0.00 -0.77 0.00 -1.65 -2.81 103.07 98.52 2wyo h GLY 204 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.27 2wyo h GLY 204 CO -0.05 0.00 -1.97 1.22 0.00 0.00 0.00 176.54 175.73 2wyo n ASP 205 N -2.64 1.91 0.18 0.19 8.00 -0.56 -4.47 116.55 119.16 2wyo n ASP 205 Ca -0.01 0.08 0.05 0.00 0.71 0.00 0.00 54.79 55.62 2wyo n ASP 205 Cb 0.10 -0.41 0.32 0.00 -0.02 0.00 0.00 41.12 41.12 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 -0.35 0.94 0.16 2.53 2.07 -1.13 -2.80 116.25 117.68 2wyo h VAL 206 Ca -0.42 -1.57 -0.01 0.00 0.82 0.00 0.00 66.70 65.53 2wyo h VAL 206 Cb 1.48 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 2wyo h VAL 206 CO -0.18 0.39 -0.08 0.58 0.02 0.00 0.00 177.57 178.30 2wyo h VAL 207 N 0.00 0.00 -0.89 2.57 2.07 -1.73 -2.07 116.25 116.19 2wyo h VAL 207 Ca -0.00 -0.78 0.21 0.00 0.82 0.00 0.00 66.70 66.95 2wyo h VAL 207 Cb 0.91 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.52 2wyo h VAL 207 CO 0.05 0.00 -0.09 -0.65 0.02 0.00 0.00 177.57 176.90 2wyo h PRO 208 N -0.99 0.03 -0.65 1.57 0.11 -1.78 0.84 132.00 131.12 2wyo h PRO 208 Ca -0.02 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.19 2wyo h PRO 208 Cb 0.17 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 31.23 2wyo h PRO 208 CO 0.04 0.02 0.43 -0.22 -0.21 0.00 0.00 178.00 178.06 2wyo h LYS 209 N 0.03 0.46 -0.52 1.05 3.64 -1.51 0.23 116.57 119.95 2wyo h LYS 209 Ca 0.48 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.75 2wyo h LYS 209 Cb 0.86 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 2wyo h LYS 209 CO -0.86 0.30 0.01 0.00 -2.27 0.00 0.00 179.45 176.63 2wyo h ALA 210 N 1.67 0.69 -0.26 5.00 0.00 0.14 -0.21 119.26 126.30 2wyo h ALA 210 Ca 0.30 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2wyo h ALA 210 Cb 0.55 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2wyo h ALA 210 CO -0.09 0.50 -0.30 0.82 0.00 0.00 0.00 179.25 180.18 2wyo h ILE 211 N 0.77 1.31 -0.57 0.00 2.04 0.21 -1.54 117.51 119.74 2wyo h ILE 211 Ca 0.15 -1.47 0.11 0.00 1.00 0.00 0.00 64.86 64.64 2wyo h ILE 211 Cb 0.51 1.65 -0.09 0.00 -0.74 0.00 0.00 36.82 38.15 2wyo h ILE 211 CO 0.02 0.47 0.06 0.00 0.00 0.00 0.00 178.15 178.70 2wyo h ALA 212 N 0.68 0.61 -0.18 1.87 0.00 -0.44 -1.62 119.26 120.18 2wyo h ALA 212 Ca 0.04 0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.94 2wyo h ALA 212 Cb 0.87 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2wyo h ALA 212 CO 0.07 -0.35 -0.54 -0.44 0.00 0.00 0.00 179.25 177.99 2wyo h ASP 213 N 0.18 0.58 -0.12 0.00 3.32 -0.80 -1.40 116.42 118.17 2wyo h ASP 213 Ca 0.29 -0.31 0.02 0.00 0.02 0.00 0.00 57.03 57.05 2wyo h ASP 213 Cb 0.45 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2wyo h ASP 213 CO -0.43 1.01 0.01 0.00 -1.72 0.00 0.00 179.24 178.11 2wyo h ALA 214 N 1.00 0.11 -0.14 3.45 0.00 -0.81 0.26 119.26 123.14 2wyo h ALA 214 Ca 0.01 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2wyo h ALA 214 Cb 1.08 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2wyo h ALA 214 CO 0.10 -0.45 -0.09 0.28 0.00 0.00 0.00 179.25 179.10 2wyo h VAL 215 N 0.05 0.74 -0.92 0.00 2.07 -1.11 -0.96 116.25 116.13 2wyo h VAL 215 Ca 0.06 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.75 2wyo h VAL 215 Cb 0.06 0.74 -0.10 0.00 -1.52 0.00 0.00 31.29 30.47 2wyo h VAL 215 CO -0.09 0.00 0.50 -0.09 0.02 0.00 0.00 177.57 177.91 2wyo h ARG 216 N -0.08 0.63 -0.35 1.57 2.43 -0.89 0.37 114.38 118.04 2wyo h ARG 216 Ca 0.08 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 59.06 2wyo h ARG 216 Cb 0.20 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2wyo h ARG 216 CO -0.19 0.41 -0.37 0.00 -1.51 0.00 0.00 179.97 178.31 2wyo h ALA 217 N 1.62 0.52 0.05 2.80 0.00 0.49 -1.36 119.26 123.37 2wyo h ALA 217 Ca 0.53 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wyo h ALA 217 Cb 0.82 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2wyo h ALA 217 CO -0.40 0.61 -0.02 2.35 0.00 0.00 0.00 179.25 181.79 2wyo h TRP 218 N 0.67 -0.06 -0.87 0.00 7.01 -0.46 -0.28 115.95 121.96 2wyo h TRP 218 Ca 0.05 -0.00 0.19 0.00 2.11 0.00 0.00 58.89 61.24 2wyo h TRP 218 Cb 0.97 0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.98 2wyo h TRP 218 CO 0.07 0.04 0.58 0.28 -2.79 0.00 0.00 178.44 176.61 2wyo h VAL 219 N -0.15 0.71 0.05 2.65 2.07 -0.20 -2.12 116.25 119.27 2wyo h VAL 219 Ca -0.01 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 2wyo h VAL 219 Cb 0.13 0.25 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2wyo h VAL 219 CO 0.01 0.08 -0.35 -0.08 0.02 0.00 0.00 177.57 177.25 2wyo h GLU 220 N 0.43 0.14 -0.69 1.57 4.81 -0.81 -2.87 114.58 117.16 2wyo h GLU 220 Ca 0.45 -0.23 0.12 0.00 -0.13 0.00 0.00 59.36 59.57 2wyo h GLU 220 Cb 1.07 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.45 2wyo h GLU 220 CO -0.17 1.08 0.27 0.37 -0.73 0.00 0.00 179.01 179.83 2wyo h GLN 221 N -0.68 0.43 0.00 1.92 4.15 -0.69 0.29 115.11 120.52 2wyo h GLN 221 Ca -0.06 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.33 2wyo h GLN 221 Cb 1.25 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2wyo h GLN 221 CO 0.07 0.28 0.00 1.96 -1.93 0.00 0.00 178.83 179.21 2wyo h GLN 222 N 0.44 0.00 -5.61 1.69 1.08 -1.54 -3.48 115.11 107.69 2wyo h GLN 222 Ca 0.36 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.45 2wyo h GLN 222 Cb 0.50 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.95 2wyo h GLN 222 CO -0.35 0.00 -0.29 1.63 -0.95 0.00 0.00 178.83 178.87 2wyo n LYS 223 N -2.83 -1.44 0.22 1.46 5.02 0.09 -4.55 118.16 116.12 2wyo n LYS 223 Ca 0.04 1.28 -0.14 0.00 -2.02 0.00 0.00 58.31 57.47 2wyo n LYS 223 Cb 0.47 -5.21 -0.08 0.00 -0.02 0.00 0.00 35.03 30.19 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 0.09 -0.52 -0.85 2.13 3.04 -1.78 -1.72 116.94 117.33 2wyo h PHE 224 Ca -0.18 -0.01 0.22 0.00 3.98 0.00 0.00 57.97 61.97 2wyo h PHE 224 Cb 1.10 0.17 -0.14 0.00 2.56 0.00 0.00 35.95 39.65 2wyo h PHE 224 CO 0.22 -0.20 0.17 0.00 -2.02 0.00 0.00 178.31 176.48 2wyo h ALA 225 N -0.37 1.15 -0.86 2.41 0.00 -1.90 1.50 119.26 121.18 2wyo h ALA 225 Ca -0.06 0.23 0.14 0.00 0.00 0.00 0.00 54.91 55.22 2wyo h ALA 225 Cb 0.54 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 2wyo h ALA 225 CO 0.09 -0.45 0.46 0.77 0.00 0.00 0.00 179.25 180.13 2wyo h SER 226 N 0.18 0.59 -0.09 0.00 0.02 -1.78 -0.55 113.55 111.92 2wyo h SER 226 Ca 0.52 0.08 -0.07 0.00 -0.84 0.00 0.00 61.79 61.48 2wyo h SER 226 Cb 1.01 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2wyo h SER 226 CO -0.66 0.26 -0.21 0.25 -1.14 0.00 0.00 176.83 175.34 2wyo h LEU 227 N 0.68 0.34 -1.35 5.07 5.85 0.26 -2.91 115.31 123.25 2wyo h LEU 227 Ca 0.46 -0.58 0.05 0.00 0.84 0.00 0.00 57.88 58.66 2wyo h LEU 227 Cb 0.62 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 2wyo h LEU 227 CO -0.34 0.85 0.48 -0.09 -0.34 0.00 0.00 178.44 179.00 2wyo h ARG 228 N -0.16 0.80 0.31 1.25 2.43 0.72 -1.72 114.38 118.02 2wyo h ARG 228 Ca -0.00 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2wyo h ARG 228 Cb 0.81 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 2wyo h ARG 228 CO 0.05 0.53 -0.16 0.00 -1.51 0.00 0.00 179.97 178.87 2wyo h ALA 229 N 1.59 -0.43 -0.90 2.80 0.00 -1.12 -3.04 119.26 118.16 2wyo h ALA 229 Ca 0.30 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.24 2wyo h ALA 229 Cb 0.15 0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 2wyo h ALA 229 CO -0.09 -0.75 0.58 0.77 0.00 0.00 0.00 179.25 179.76 2wyo h SER 230 N -0.44 0.73 -0.55 0.00 0.02 -1.12 -2.30 113.55 109.89 2wyo h SER 230 Ca -0.04 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2wyo h SER 230 Cb 0.34 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 2wyo h SER 230 CO 0.06 0.39 0.32 -0.25 -1.14 0.00 0.00 176.83 176.21 2wyo h TRP 231 N 0.79 0.60 -0.53 3.45 2.91 -1.31 -1.55 115.95 120.29 2wyo h TRP 231 Ca 0.44 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.48 2wyo h TRP 231 Cb 0.59 -0.19 -0.03 0.00 -0.51 0.00 0.00 29.16 29.03 2wyo h TRP 231 CO -0.00 0.33 0.31 0.93 -1.03 0.00 0.00 178.44 178.98 2wyo h GLU 232 N 0.63 0.72 0.10 2.65 4.39 -1.40 -2.78 114.58 118.89 2wyo h GLU 232 Ca 0.23 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 2wyo h GLU 232 Cb 0.05 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 2wyo h GLU 232 CO -0.11 0.51 -0.05 1.96 -1.16 0.00 0.00 179.01 180.16 2wyo h GLN 233 N 0.73 -0.13 -6.41 2.33 4.20 -1.26 -3.53 115.11 111.05 2wyo h GLN 233 Ca 0.19 0.01 -0.53 0.00 0.06 0.00 0.00 58.65 58.38 2wyo h GLN 233 Cb -0.02 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 2wyo h GLN 233 CO -0.04 0.14 -0.18 0.12 -0.67 0.00 0.00 178.83 178.20 2wyo s PHE 234 N -5.14 3.46 0.18 2.96 5.36 -0.68 -5.14 117.98 118.98 2wyo s PHE 234 Ca -0.15 0.66 0.00 0.00 -0.96 0.00 0.00 56.93 56.48 2wyo s PHE 234 Cb 0.03 -2.10 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 2wyo s PHE 234 CO 0.64 0.25 0.00 0.94 -1.46 0.00 0.00 175.22 175.59 2wyo n GLN 246 N -0.57 -1.15 0.00 10.12 7.27 -1.26 -4.94 117.38 126.85 2wyo n GLN 246 Ca -0.02 0.91 0.00 0.00 0.07 0.00 0.00 57.00 57.96 2wyo n GLN 246 Cb 0.53 -1.18 0.00 0.00 2.41 0.00 0.00 30.24 32.00 2wyo n GLN 246 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2wyo n LEU 247 N -2.08 0.00 -4.25 1.69 0.00 -1.26 -4.95 117.00 106.16 2wyo n LEU 247 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 56.01 55.86 2wyo n LEU 247 Cb 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.48 2wyo n LEU 247 CO 0.00 0.00 -0.41 -0.83 0.00 0.00 0.00 177.39 176.16 2wyo s GLY 248 N 0.00 1.07 -0.10 -3.96 0.00 -1.26 -5.08 107.32 97.99 2wyo s GLY 248 Ca 0.00 -1.49 -0.09 0.00 0.00 0.00 0.00 44.72 43.14 2wyo s GLY 248 CO 0.00 -1.59 0.37 3.33 0.00 0.00 0.00 173.10 175.21 2wyo n VAL 249 N -0.20 0.00 -3.69 1.40 0.24 -1.26 -4.89 118.33 109.93 2wyo n VAL 249 Ca -0.10 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.83 2wyo n VAL 249 Cb 0.61 -0.10 -0.10 0.00 -1.47 0.00 0.00 33.84 32.78 2wyo n VAL 249 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2wyo s LEU 250 N 0.93 4.01 0.48 1.34 2.96 -1.26 -4.78 118.68 122.37 2wyo s LEU 250 Ca 0.22 0.06 -0.17 0.00 -0.22 0.00 0.00 54.13 54.02 2wyo s LEU 250 Cb -0.29 -2.08 -0.15 0.00 0.50 0.00 0.00 46.19 44.18 2wyo s LEU 250 CO 0.14 0.05 -0.12 0.47 -1.32 0.00 0.00 176.35 175.57 2wyo n ASP 251 N 4.40 -3.54 0.08 3.68 9.92 -1.16 -4.84 116.55 125.09 2wyo n ASP 251 Ca -0.15 0.64 0.12 0.00 -0.53 0.00 0.00 54.79 54.87 2wyo n ASP 251 Cb 0.52 -0.82 0.46 0.00 -0.64 0.00 0.00 41.12 40.63 2wyo n ASP 251 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2wyo n THR 252 N -1.45 0.64 -3.68 -3.53 -2.24 -1.26 -4.77 114.28 97.98 2wyo n THR 252 Ca 0.08 0.01 -0.15 0.00 -2.27 0.00 0.00 64.05 61.72 2wyo n THR 252 Cb 0.46 -0.83 -0.08 0.00 -2.10 0.00 0.00 70.33 67.78 2wyo n THR 252 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wyo s ALA 253 N -3.14 -1.16 0.97 6.98 0.00 -1.26 -4.95 121.76 119.19 2wyo s ALA 253 Ca 0.08 0.85 -0.16 0.00 0.00 0.00 0.00 51.96 52.74 2wyo s ALA 253 Cb 0.12 -0.15 0.19 0.00 0.00 0.00 0.00 23.12 23.29 2wyo s ALA 253 CO 0.47 -0.28 1.28 -1.25 0.00 0.00 0.00 175.76 175.97 2wyo s PRO 254 N -0.92 0.62 0.18 0.00 0.04 -1.26 -4.65 135.00 129.01 2wyo s PRO 254 Ca -0.10 -0.28 0.07 0.00 0.04 0.00 0.00 61.00 60.73 2wyo s PRO 254 Cb -0.03 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 2wyo s PRO 254 CO 0.05 -2.45 -0.15 0.14 0.04 0.00 0.00 177.00 174.64 2wyo s VAL 255 N -3.74 1.64 -0.13 -0.36 -7.23 0.04 -4.51 120.40 106.11 2wyo s VAL 255 Ca 0.72 -2.09 -0.23 0.00 -1.81 0.00 0.00 61.98 58.57 2wyo s VAL 255 Cb -0.06 -1.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 2wyo s VAL 255 CO 0.53 -0.54 0.73 -0.69 -0.31 0.00 0.00 175.10 174.81 2wyo s VAL 256 N -2.75 4.98 -0.25 1.32 1.01 -0.05 -2.32 120.40 122.34 2wyo s VAL 256 Ca 0.19 1.44 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 2wyo s VAL 256 Cb -0.02 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.27 2wyo s VAL 256 CO 0.06 0.14 0.18 -0.22 0.00 0.00 0.00 175.10 175.25 2wyo s LEU 257 N 1.54 4.09 -0.38 3.92 2.96 0.92 -1.58 118.68 130.14 2wyo s LEU 257 Ca 0.35 0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 54.20 2wyo s LEU 257 Cb -0.17 -2.12 0.01 0.00 0.50 0.00 0.00 46.19 44.40 2wyo s LEU 257 CO 0.14 0.02 0.32 -0.69 -1.32 0.00 0.00 176.35 174.82 2wyo s VAL 258 N 1.30 5.22 -0.46 1.68 1.01 -0.56 -1.24 120.40 127.34 2wyo s VAL 258 Ca 0.08 -0.38 -0.27 0.00 0.00 0.00 0.00 61.98 61.41 2wyo s VAL 258 Cb -0.14 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.38 2wyo s VAL 258 CO 0.07 -0.22 0.99 -0.69 0.00 0.00 0.00 175.10 175.24 2wyo s VAL 259 N 1.83 4.40 0.02 2.92 1.01 0.68 -1.84 120.40 129.42 2wyo s VAL 259 Ca 0.08 0.93 0.04 0.00 0.00 0.00 0.00 61.98 63.02 2wyo s VAL 259 Cb -0.18 -4.48 -0.03 0.00 0.00 0.00 0.00 36.38 31.69 2wyo s VAL 259 CO 0.11 -0.86 -0.07 -0.69 0.00 0.00 0.00 175.10 173.58 2wyo s VAL 260 N 3.94 3.59 0.70 2.92 1.01 0.14 -1.28 120.40 131.42 2wyo s VAL 260 Ca 0.40 -0.87 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 2wyo s VAL 260 Cb -0.09 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2wyo s VAL 260 CO 0.27 0.34 1.20 -1.10 0.00 0.00 0.00 175.10 175.82 2wyo s GLN 261 N -1.56 2.34 0.54 2.72 -0.21 -1.24 -4.24 119.66 118.01 2wyo s GLN 261 Ca 0.18 1.75 0.22 0.00 0.02 0.00 0.00 55.36 57.53 2wyo s GLN 261 Cb -0.11 -1.86 1.45 0.00 1.00 0.00 0.00 33.01 33.49 2wyo s GLN 261 CO 0.09 -1.68 2.16 1.49 -2.12 0.00 0.00 175.29 175.23 2wyo h GLU 262 N -0.05 0.00 -0.87 2.91 4.57 -1.96 -3.22 114.58 115.96 2wyo h GLU 262 Ca -0.48 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 57.36 2wyo h GLU 262 Cb 1.29 0.00 -0.37 0.00 -0.16 0.00 0.00 28.75 29.51 2wyo h GLU 262 CO 0.51 0.04 -1.10 -1.71 -1.18 0.00 0.00 179.01 175.56 2wyo n ASN 263 N -4.18 1.07 -4.61 1.04 2.85 -1.26 -5.12 115.26 105.04 2wyo n ASN 263 Ca -0.03 -2.66 -0.46 0.00 -0.11 0.00 0.00 54.58 51.31 2wyo n ASN 263 Cb 0.12 -0.36 -0.03 0.00 1.24 0.00 0.00 39.78 40.76 2wyo n ASN 263 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 2wyo n GLU 264 N -0.14 1.50 -0.06 1.20 4.07 -1.22 -4.94 120.64 121.05 2wyo n GLU 264 Ca 0.08 0.53 -0.07 0.00 -0.06 0.00 0.00 57.16 57.63 2wyo n GLU 264 Cb 0.82 -2.05 -0.07 0.00 -0.06 0.00 0.00 31.44 30.08 2wyo n GLU 264 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2wyo n ARG 265 N 1.58 1.29 -1.17 5.31 1.74 -1.26 -4.72 116.66 119.43 2wyo n ARG 265 Ca 0.12 0.04 -0.18 0.00 -0.77 0.00 0.00 57.85 57.06 2wyo n ARG 265 Cb 0.29 -1.27 -0.10 0.00 -1.02 0.00 0.00 32.46 30.35 2wyo n ARG 265 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2wyo n ASN 266 N -2.65 5.85 0.27 0.55 5.15 -1.26 -2.42 115.26 120.74 2wyo n ASN 266 Ca -0.21 -2.82 0.16 0.00 -0.60 0.00 0.00 54.58 51.11 2wyo n ASN 266 Cb 0.80 -1.30 0.60 0.00 -0.53 0.00 0.00 39.78 39.35 2wyo n ASN 266 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 2wyo h THR 267 N 1.88 0.00 0.91 -0.44 1.35 -1.88 -3.26 112.91 111.47 2wyo h THR 267 Ca 0.27 -0.58 -0.04 0.00 -0.55 0.00 0.00 66.41 65.50 2wyo h THR 267 Cb 1.11 1.58 0.01 0.00 -1.73 0.00 0.00 68.15 69.12 2wyo h THR 267 CO 0.53 0.00 -0.44 0.00 -0.25 0.00 0.00 175.52 175.36 2wyo h ALA 268 N 2.01 -1.22 -0.66 6.62 0.00 -1.80 0.60 119.26 124.81 2wyo h ALA 268 Ca 0.00 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.74 2wyo h ALA 268 Cb 0.59 0.47 -0.12 0.00 0.00 0.00 0.00 17.79 18.74 2wyo h ALA 268 CO 0.00 -1.17 -0.41 0.22 0.00 0.00 0.00 179.25 177.89 2wyo h ASP 269 N -1.25 -1.43 0.20 0.00 3.58 -1.88 1.00 116.42 116.64 2wyo h ASP 269 Ca -0.12 0.25 0.01 0.00 0.42 0.00 0.00 57.03 57.59 2wyo h ASP 269 Cb 0.94 0.68 -0.03 0.00 1.72 0.00 0.00 39.33 42.63 2wyo h ASP 269 CO 0.21 -0.32 -0.35 1.56 -2.88 0.00 0.00 179.24 177.46 2wyo h GLN 270 N -0.17 -0.61 -0.40 0.28 4.20 -1.57 -2.40 115.11 114.45 2wyo h GLN 270 Ca 0.22 0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.83 2wyo h GLN 270 Cb 0.56 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2wyo h GLN 270 CO -0.74 -0.40 -0.28 1.88 -0.67 0.00 0.00 178.83 178.62 2wyo h TYR 271 N -0.63 1.06 -0.89 2.96 0.05 -0.50 -0.46 116.97 118.55 2wyo h TYR 271 Ca 0.01 -0.29 0.24 0.00 0.05 0.00 0.00 58.73 58.75 2wyo h TYR 271 Cb 0.63 -0.23 -0.15 0.00 1.01 0.00 0.00 36.73 37.98 2wyo h TYR 271 CO -0.27 1.09 0.23 0.00 -1.05 0.00 0.00 178.16 178.16 2wyo h ALA 272 N 0.80 1.30 0.17 3.88 0.00 0.15 0.30 119.26 125.85 2wyo h ALA 272 Ca 0.08 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 2wyo h ALA 272 Cb 0.86 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2wyo h ALA 272 CO 0.08 -0.49 -0.08 -0.07 0.00 0.00 0.00 179.25 178.68 2wyo h LEU 273 N 0.18 -0.20 -1.53 0.00 3.38 -1.17 -3.34 115.31 112.63 2wyo h LEU 273 Ca 0.57 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 58.25 2wyo h LEU 273 Cb 1.16 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2wyo h LEU 273 CO -0.68 0.36 0.03 -0.07 0.09 0.00 0.00 178.44 178.17 2wyo h LEU 274 N -0.96 0.30 -1.60 1.67 3.38 0.34 0.37 115.31 118.80 2wyo h LEU 274 Ca -0.02 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2wyo h LEU 274 Cb 0.45 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2wyo h LEU 274 CO 0.04 0.33 -0.19 0.24 0.09 0.00 0.00 178.44 178.95 2wyo h MET 275 N 0.33 0.00 -0.03 1.13 2.86 -0.61 -1.88 114.93 116.72 2wyo h MET 275 Ca 0.08 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.48 2wyo h MET 275 Cb 0.17 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.84 2wyo h MET 275 CO 0.00 0.19 -0.92 -0.09 1.06 0.00 0.00 176.91 177.15 2wyo h ARG 276 N 0.00 0.57 -0.78 1.72 2.43 -1.04 0.14 114.38 117.42 2wyo h ARG 276 Ca -0.00 -0.56 0.12 0.00 -0.81 0.00 0.00 59.98 58.72 2wyo h ARG 276 Cb 0.49 0.15 -0.08 0.00 -0.42 0.00 0.00 29.97 30.11 2wyo h ARG 276 CO 0.02 1.19 0.39 0.28 -1.51 0.00 0.00 179.97 180.34 2wyo h VAL 277 N 0.34 0.79 0.26 0.20 2.07 -1.17 0.40 116.25 119.14 2wyo h VAL 277 Ca -0.09 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2wyo h VAL 277 Cb 1.56 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 2wyo h VAL 277 CO 0.17 0.11 -0.13 0.25 0.02 0.00 0.00 177.57 178.00 2wyo h LEU 278 N 0.61 -0.30 0.03 2.57 5.85 -1.20 -2.10 115.31 120.78 2wyo h LEU 278 Ca 0.40 -0.21 -0.24 0.00 0.84 0.00 0.00 57.88 58.67 2wyo h LEU 278 Cb 0.50 0.08 0.02 0.00 0.37 0.00 0.00 40.66 41.63 2wyo h LEU 278 CO -0.32 0.19 -0.97 -0.33 -0.34 0.00 0.00 178.44 176.68 2wyo h GLU 279 N -0.95 0.61 0.00 1.25 5.08 -0.86 -2.25 114.58 117.46 2wyo h GLU 279 Ca -0.04 -0.69 -0.17 0.00 -1.00 0.00 0.00 59.36 57.46 2wyo h GLU 279 Cb 0.49 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.92 2wyo h GLU 279 CO 0.06 1.28 -0.98 1.49 -1.00 0.00 0.00 179.01 179.87 2wyo h GLU 280 N 0.23 0.00 -0.60 2.33 4.81 -0.39 -3.39 114.58 117.57 2wyo h GLU 280 Ca -0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2wyo h GLU 280 Cb 1.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.03 2wyo h GLU 280 CO 0.19 0.90 0.00 0.72 -0.73 0.00 0.00 179.01 180.09 2wyo n HIS 281 N -4.48 0.90 -3.99 0.92 8.25 -0.92 -4.94 115.22 110.95 2wyo n HIS 281 Ca -0.26 -0.41 -0.33 0.00 -0.26 0.00 0.00 57.72 56.46 2wyo n HIS 281 Cb 0.60 -0.06 -0.02 0.00 1.12 0.00 0.00 29.99 31.63 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 1.11 -3.24 -5.12 -0.41 5.12 -0.84 -4.90 116.66 108.37 2wyo n ARG 282 Ca 0.20 0.39 -0.29 0.00 -1.93 0.00 0.00 57.85 56.21 2wyo n ARG 282 Cb 0.56 -5.11 -0.16 0.00 -1.16 0.00 0.00 32.46 26.58 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 -3.16 1.80 -0.01 0.55 1.01 -0.83 -5.00 121.20 115.56 2wyo s ILE 283 Ca 0.65 -0.96 -0.20 0.00 0.00 0.00 0.00 60.65 60.15 2wyo s ILE 283 Cb -0.36 -1.51 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 2wyo s ILE 283 CO 0.80 0.51 0.57 -0.60 0.00 0.00 0.00 174.94 176.23 2wyo s ARG 284 N -0.37 4.29 0.13 2.79 3.52 -1.26 -3.25 118.95 124.79 2wyo s ARG 284 Ca 0.04 0.69 0.05 0.00 -0.13 0.00 0.00 55.73 56.38 2wyo s ARG 284 Cb -0.10 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.91 2wyo s ARG 284 CO 0.01 0.38 0.07 -0.59 -0.81 0.00 0.00 175.30 174.36 2wyo s PHE 285 N -0.22 3.08 -0.01 5.12 -0.71 -1.26 -0.87 117.98 123.11 2wyo s PHE 285 Ca 0.30 -0.01 0.01 0.00 -1.04 0.00 0.00 56.93 56.19 2wyo s PHE 285 Cb -0.18 -1.53 0.00 0.00 -1.21 0.00 0.00 43.02 40.11 2wyo s PHE 285 CO 0.16 0.51 -0.03 0.96 -1.34 0.00 0.00 175.22 175.48 2wyo s ILE 286 N -1.55 0.30 -0.14 -4.49 -4.36 -0.61 -4.93 121.20 105.41 2wyo s ILE 286 Ca 0.29 -0.12 -0.14 0.00 -0.26 0.00 0.00 60.65 60.42 2wyo s ILE 286 Cb -0.11 -0.28 -0.05 0.00 1.25 0.00 0.00 42.46 43.28 2wyo s ILE 286 CO 0.21 0.10 0.31 -0.36 0.24 0.00 0.00 174.94 175.44 2wyo s PHE 287 N 0.14 3.50 -0.01 1.37 0.08 -1.26 -1.50 117.98 120.30 2wyo s PHE 287 Ca -0.01 0.65 -0.06 0.00 0.12 0.00 0.00 56.93 57.63 2wyo s PHE 287 Cb -0.04 -2.33 0.00 0.00 -0.57 0.00 0.00 43.02 40.08 2wyo s PHE 287 CO -0.00 0.30 0.11 1.03 -0.10 0.00 0.00 175.22 176.56 2wyo s ARG 288 N 0.25 0.38 0.84 0.44 1.81 -0.77 -4.98 118.95 116.92 2wyo s ARG 288 Ca 0.18 -0.28 -0.12 0.00 -1.72 0.00 0.00 55.73 53.78 2wyo s ARG 288 Cb -0.13 0.16 0.11 0.00 -0.45 0.00 0.00 34.95 34.63 2wyo s ARG 288 CO 0.05 -0.08 1.20 0.95 -0.68 0.00 0.00 175.30 176.74 2wyo s THR 289 N -1.03 2.03 -0.00 0.02 -4.23 -1.26 -0.68 115.64 110.49 2wyo s THR 289 Ca -0.11 -0.04 -0.25 0.00 -1.18 0.00 0.00 61.69 60.10 2wyo s THR 289 Cb -0.06 -2.99 -0.19 0.00 1.34 0.00 0.00 72.50 70.60 2wyo s THR 289 CO 0.01 0.00 1.33 -0.07 -0.54 0.00 0.00 174.62 175.35 2wyo h LEU 290 N -1.16 -0.06 -0.93 4.79 3.38 -1.92 -2.27 115.31 117.15 2wyo h LEU 290 Ca -0.45 -0.36 0.27 0.00 0.09 0.00 0.00 57.88 57.44 2wyo h LEU 290 Cb 1.30 0.02 -0.16 0.00 0.09 0.00 0.00 40.66 41.91 2wyo h LEU 290 CO 0.57 0.33 0.26 1.56 0.09 0.00 0.00 178.44 181.26 2wyo h GLN 291 N -0.46 0.14 -0.28 1.13 1.08 -1.91 0.33 115.11 115.14 2wyo h GLN 291 Ca -0.01 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.13 2wyo h GLN 291 Cb 0.41 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 2wyo h GLN 291 CO 0.01 0.10 -0.03 0.93 -0.95 0.00 0.00 178.83 178.89 2wyo h GLU 292 N 0.15 0.52 -0.39 1.46 5.08 -1.92 -3.19 114.58 116.28 2wyo h GLU 292 Ca 0.62 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.78 2wyo h GLU 292 Cb 1.33 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 2wyo h GLU 292 CO -0.72 0.69 0.17 -0.07 -1.00 0.00 0.00 179.01 178.07 2wyo h LEU 293 N 0.29 0.49 -1.54 1.33 3.38 0.20 -0.28 115.31 119.18 2wyo h LEU 293 Ca 0.08 -0.04 0.23 0.00 0.09 0.00 0.00 57.88 58.23 2wyo h LEU 293 Cb 0.47 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 2wyo h LEU 293 CO 0.02 0.44 0.63 -0.74 0.09 0.00 0.00 178.44 178.88 2wyo h HIS 294 N 0.55 0.49 0.11 1.13 2.76 -1.13 0.23 115.15 119.29 2wyo h HIS 294 Ca 0.14 0.02 -0.36 0.00 -2.20 0.00 0.00 60.37 57.96 2wyo h HIS 294 Cb 0.09 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.88 2wyo h HIS 294 CO 0.00 0.11 -2.01 1.28 -1.30 0.00 0.00 177.93 176.01 2wyo n LEU 295 N -4.50 2.55 0.07 0.26 4.32 -0.64 -4.49 117.00 114.57 2wyo n LEU 295 Ca 0.21 0.20 0.13 0.00 -0.02 0.00 0.00 56.01 56.53 2wyo n LEU 295 Cb 0.78 -1.03 0.48 0.00 -1.62 0.00 0.00 43.42 42.04 2wyo n LEU 295 CO 0.31 0.83 0.91 -1.20 -1.22 0.00 0.00 177.39 177.02 2wyo n SER 296 N -3.44 0.51 -3.95 -1.43 7.64 -0.21 -4.82 113.62 107.91 2wyo n SER 296 Ca -0.32 0.55 -0.29 0.00 1.01 0.00 0.00 58.87 59.83 2wyo n SER 296 Cb 1.05 -0.69 -0.17 0.00 -1.01 0.00 0.00 64.21 63.39 2wyo n SER 296 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2wyo s LEU 297 N -3.97 1.55 0.25 -3.43 2.96 0.72 -0.62 118.68 116.13 2wyo s LEU 297 Ca 0.11 -0.49 0.09 0.00 -0.22 0.00 0.00 54.13 53.63 2wyo s LEU 297 Cb 0.14 -1.02 -0.05 0.00 0.50 0.00 0.00 46.19 45.77 2wyo s LEU 297 CO 0.56 -0.11 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.79 2wyo s LYS 298 N 1.58 1.51 -0.01 1.98 1.02 -1.04 -4.80 119.74 119.98 2wyo s LYS 298 Ca 0.04 -1.70 0.01 0.00 0.02 0.00 0.00 55.97 54.34 2wyo s LYS 298 Cb -0.13 -1.39 -0.04 0.00 -0.52 0.00 0.00 37.83 35.75 2wyo s LYS 298 CO -0.09 0.22 0.02 -0.51 -0.92 0.00 0.00 175.35 174.07 2wyo s LEU 299 N -3.42 3.61 -0.28 3.17 1.43 -1.26 -2.85 118.68 119.08 2wyo s LEU 299 Ca 0.27 0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 53.39 2wyo s LEU 299 Cb -0.02 -2.07 0.09 0.00 0.03 0.00 0.00 46.19 44.23 2wyo s LEU 299 CO 0.11 0.28 0.07 -1.00 0.23 0.00 0.00 176.35 176.04 2wyo s HIS 300 N -1.10 1.69 0.13 0.29 3.76 0.92 -4.97 115.29 116.00 2wyo s HIS 300 Ca 0.20 -1.59 -0.30 0.00 -0.15 0.00 0.00 55.06 53.21 2wyo s HIS 300 Cb -0.12 -1.59 -0.07 0.00 1.11 0.00 0.00 32.58 31.91 2wyo s HIS 300 CO 0.11 -0.82 1.21 0.45 -0.85 0.00 0.00 174.74 174.84 2wyo s SER 301 N 1.63 7.07 -0.07 1.40 0.15 -1.26 -2.08 113.70 120.53 2wyo s SER 301 Ca 0.06 2.14 -0.08 0.00 0.70 0.00 0.00 55.95 58.77 2wyo s SER 301 Cb -0.17 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.52 2wyo s SER 301 CO -0.20 -0.43 -0.16 -0.38 1.20 0.00 0.00 173.24 173.28 2wyo n ILE 302 N 3.23 0.75 -4.34 6.45 5.41 -1.26 -4.97 119.36 124.63 2wyo n ILE 302 Ca 0.07 0.30 -0.35 0.00 1.00 0.00 0.00 62.75 63.77 2wyo n ILE 302 Cb 0.45 -1.85 -0.09 0.00 -0.71 0.00 0.00 39.64 37.44 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 -5.06 5.29 0.15 4.38 0.15 -1.26 -5.01 113.70 112.34 2wyo s SER 303 Ca -0.13 0.15 0.19 0.00 0.70 0.00 0.00 55.95 56.86 2wyo s SER 303 Cb 0.02 -1.53 0.81 0.00 -1.71 0.00 0.00 66.02 63.61 2wyo s SER 303 CO 0.19 0.37 1.59 -0.81 1.20 0.00 0.00 173.24 175.77 2wyo n PRO 304 N 2.22 0.11 0.03 5.44 -0.04 -1.26 -2.10 135.00 139.39 2wyo n PRO 304 Ca -0.19 0.37 0.13 0.00 -0.04 0.00 0.00 63.50 63.77 2wyo n PRO 304 Cb 0.54 -1.72 0.37 0.00 -0.04 0.00 0.00 33.50 32.64 2wyo n PRO 304 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2wyo n GLU 305 N -1.93 0.11 -4.42 0.54 4.07 -1.26 -4.76 120.64 112.99 2wyo n GLU 305 Ca 0.02 0.05 -0.31 0.00 -0.06 0.00 0.00 57.16 56.87 2wyo n GLU 305 Cb 0.19 -1.59 -0.11 0.00 -0.06 0.00 0.00 31.44 29.87 2wyo n GLU 305 CO 0.00 0.00 0.00 -0.65 -0.06 0.00 0.00 177.13 176.42 2wyo s GLN 306 N -3.05 2.19 0.60 5.31 -0.21 -0.89 -4.79 119.66 118.81 2wyo s GLN 306 Ca 0.11 -0.95 -0.20 0.00 0.02 0.00 0.00 55.36 54.34 2wyo s GLN 306 Cb 0.16 -2.30 -0.03 0.00 1.00 0.00 0.00 33.01 31.84 2wyo s GLN 306 CO 0.64 0.54 1.30 -1.25 -2.12 0.00 0.00 175.29 174.39 2wyo s PRO 307 N -1.79 2.88 0.37 2.91 0.04 -1.26 -4.67 135.00 133.48 2wyo s PRO 307 Ca 0.18 2.07 -0.26 0.00 0.04 0.00 0.00 61.00 63.03 2wyo s PRO 307 Cb -0.11 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 2wyo s PRO 307 CO 0.09 -1.35 1.11 -1.25 0.04 0.00 0.00 177.00 175.64 2wyo s PRO 308 N -3.18 4.23 0.45 0.56 0.04 -1.26 -4.45 135.00 131.39 2wyo s PRO 308 Ca 0.77 1.70 -0.24 0.00 0.04 0.00 0.00 61.00 63.27 2wyo s PRO 308 Cb -0.37 -2.74 -0.09 0.00 0.04 0.00 0.00 34.50 31.35 2wyo s PRO 308 CO 0.41 -0.13 1.21 -0.11 0.04 0.00 0.00 177.00 178.42 2wyo n LEU 309 N 0.27 3.93 -4.19 -3.56 7.94 -0.88 -2.30 117.00 118.21 2wyo n LEU 309 Ca 0.03 1.05 -0.35 0.00 -1.11 0.00 0.00 56.01 55.63 2wyo n LEU 309 Cb 0.47 -1.47 -0.14 0.00 0.53 0.00 0.00 43.42 42.81 2wyo n LEU 309 CO 0.49 -0.90 -0.34 0.00 -1.11 0.00 0.00 177.39 175.53 2wyo s ALA 310 N -1.25 2.84 -0.04 1.96 0.00 -1.26 -0.06 121.76 123.95 2wyo s ALA 310 Ca 0.64 -1.74 -0.06 0.00 0.00 0.00 0.00 51.96 50.80 2wyo s ALA 310 Cb -0.50 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 2wyo s ALA 310 CO 0.56 -1.26 0.20 0.14 0.00 0.00 0.00 175.76 175.40 2wyo s VAL 311 N 1.28 5.40 0.09 0.00 -7.23 -1.13 -0.54 120.40 118.27 2wyo s VAL 311 Ca -0.05 0.11 0.07 0.00 -1.81 0.00 0.00 61.98 60.31 2wyo s VAL 311 Cb -0.20 -3.51 -0.04 0.00 0.56 0.00 0.00 36.38 33.20 2wyo s VAL 311 CO -0.01 0.45 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.45 2wyo s VAL 312 N -1.20 3.37 -1.74 1.32 1.01 0.18 -2.51 120.40 120.83 2wyo s VAL 312 Ca 0.23 -1.21 -0.19 0.00 0.00 0.00 0.00 61.98 60.81 2wyo s VAL 312 Cb -0.13 -2.55 0.17 0.00 0.00 0.00 0.00 36.38 33.87 2wyo s VAL 312 CO 0.12 0.16 0.68 0.47 0.00 0.00 0.00 175.10 176.53 2wyo n ASP 313 N 0.85 -2.52 0.00 3.32 8.00 0.21 -0.44 116.55 125.96 2wyo n ASP 313 Ca -0.14 -1.10 0.00 0.00 0.71 0.00 0.00 54.79 54.26 2wyo n ASP 313 Cb 0.52 -2.35 0.00 0.00 -0.02 0.00 0.00 41.12 39.27 2wyo n ASP 313 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wyo n GLY 314 N -1.37 1.27 0.00 0.44 0.00 -1.26 -4.49 105.19 99.77 2wyo n GLY 314 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.37 0.00 -2.52 1.61 1.44 -0.01 -4.84 115.22 110.52 2wyo n HIS 315 Ca 0.00 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.28 2wyo n HIS 315 Cb 0.00 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.09 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 -1.80 2.90 -0.09 -1.40 2.02 0.41 -2.98 117.35 116.43 2wyo s TYR 316 Ca 0.00 1.02 -0.25 0.00 -0.37 0.00 0.00 57.07 57.47 2wyo s TYR 316 Cb 0.00 -3.81 -0.03 0.00 -0.40 0.00 0.00 41.96 37.72 2wyo s TYR 316 CO 0.00 -1.28 0.76 -2.14 -1.57 0.00 0.00 175.55 171.32 2wyo s PRO 317 N 3.91 4.41 -0.35 -1.71 0.02 -1.26 -0.64 135.00 139.38 2wyo s PRO 317 Ca 0.51 0.97 -0.20 0.00 0.02 0.00 0.00 61.00 62.29 2wyo s PRO 317 Cb -0.15 -3.49 0.00 0.00 0.02 0.00 0.00 34.50 30.89 2wyo s PRO 317 CO 0.19 -0.06 0.63 0.42 -0.33 0.00 0.00 177.00 177.86 2wyo s ILE 318 N 1.20 4.90 -0.22 2.83 -1.09 0.30 -0.78 121.20 128.34 2wyo s ILE 318 Ca 0.39 0.64 0.13 0.00 -2.23 0.00 0.00 60.65 59.58 2wyo s ILE 318 Cb -0.18 -4.06 -0.22 0.00 -1.58 0.00 0.00 42.46 36.42 2wyo s ILE 318 CO 0.18 -0.28 -0.02 0.00 -1.23 0.00 0.00 174.94 173.59 2wyo n ALA 319 N 6.01 1.48 -3.68 9.38 0.00 -0.98 -4.01 120.51 128.71 2wyo n ALA 319 Ca -0.01 -1.26 -0.18 0.00 0.00 0.00 0.00 53.44 51.99 2wyo n ALA 319 Cb 0.49 -0.16 -0.16 0.00 0.00 0.00 0.00 19.45 19.61 2wyo n ALA 319 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wyo s VAL 320 N -2.50 0.31 -1.02 0.00 1.01 -1.23 -0.21 120.40 116.75 2wyo s VAL 320 Ca -0.18 0.02 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 2wyo s VAL 320 Cb 0.07 -0.38 0.26 0.00 0.00 0.00 0.00 36.38 36.33 2wyo s VAL 320 CO 0.76 0.18 1.00 0.00 0.00 0.00 0.00 175.10 177.03 2wyo n ALA 321 N 4.15 4.12 -2.28 5.51 0.00 0.34 -0.06 120.51 132.30 2wyo n ALA 321 Ca -0.25 -4.65 -0.42 0.00 0.00 0.00 0.00 53.44 48.12 2wyo n ALA 321 Cb 0.50 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.81 2wyo n ALA 321 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2wyo s TYR 322 N -1.45 3.28 -0.24 0.00 6.04 -0.38 -2.03 117.35 122.58 2wyo s TYR 322 Ca 0.30 1.08 -0.06 0.00 0.04 0.00 0.00 57.07 58.43 2wyo s TYR 322 Cb -0.07 -3.57 -0.02 0.00 -1.04 0.00 0.00 41.96 37.25 2wyo s TYR 322 CO -0.09 -1.94 0.04 -0.06 -1.54 0.00 0.00 175.55 171.97 2wyo s PHE 323 N 1.23 3.05 -0.43 4.97 0.08 -0.65 -0.23 117.98 126.00 2wyo s PHE 323 Ca 0.62 -0.56 0.04 0.00 0.12 0.00 0.00 56.93 57.16 2wyo s PHE 323 Cb -0.33 -2.20 0.45 0.00 -0.57 0.00 0.00 43.02 40.36 2wyo s PHE 323 CO 0.29 -0.41 1.43 0.54 -0.10 0.00 0.00 175.22 176.97 2wyo n ARG 324 N 4.89 3.33 0.00 0.44 5.12 -0.40 -3.31 116.66 126.72 2wyo n ARG 324 Ca -0.17 -3.97 0.00 0.00 -1.93 0.00 0.00 57.85 51.78 2wyo n ARG 324 Cb 0.51 -2.28 0.00 0.00 -1.16 0.00 0.00 32.46 29.53 2wyo n ARG 324 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2wyo n SER 325 N -0.72 0.00 0.00 0.55 3.41 -1.22 -3.62 113.62 112.02 2wyo n SER 325 Ca 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 2wyo n SER 325 Cb 0.81 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 2wyo n SER 325 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2wyo n THR 326 N -0.02 0.00 0.26 6.66 -1.04 -1.26 -4.91 114.28 113.97 2wyo n THR 326 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 2wyo n THR 326 Cb 0.00 0.00 0.70 0.00 -1.82 0.00 0.00 70.33 69.21 2wyo n THR 326 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 2wyo h TYR 327 N 0.00 0.00 -4.03 -1.42 -0.00 -1.96 -3.44 116.97 106.12 2wyo h TYR 327 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 58.73 58.16 2wyo h TYR 327 Cb 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 36.73 36.50 2wyo h TYR 327 CO 0.00 0.12 -0.83 0.14 -0.00 0.00 0.00 178.16 177.59 2wyo s VAL 328 N -3.99 1.70 0.48 -0.90 -7.23 -1.26 -5.05 120.40 104.15 2wyo s VAL 328 Ca -0.02 -1.40 0.22 0.00 -1.81 0.00 0.00 61.98 58.97 2wyo s VAL 328 Cb 0.12 -1.52 0.40 0.00 0.56 0.00 0.00 36.38 35.94 2wyo s VAL 328 CO 0.58 0.05 1.93 -0.65 -0.31 0.00 0.00 175.10 176.70 2wyo h PRO 329 N 4.41 0.18 0.00 4.82 0.11 -1.97 -2.63 132.00 136.92 2wyo h PRO 329 Ca -0.45 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wyo h PRO 329 Cb 1.17 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2wyo h PRO 329 CO 0.41 0.12 -0.01 0.93 -0.21 0.00 0.00 178.00 179.24 2wyo h GLU 330 N 0.19 0.00 -0.03 1.05 3.07 -1.96 0.14 114.58 117.03 2wyo h GLU 330 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 2wyo h GLU 330 Cb 1.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 2wyo h GLU 330 CO -0.06 0.01 0.00 -0.25 -1.40 0.00 0.00 179.01 177.31 2wyo n ASP 331 N -3.24 0.40 -3.01 1.42 8.00 -0.99 -4.06 116.55 115.07 2wyo n ASP 331 Ca -0.02 -1.39 -0.25 0.00 0.71 0.00 0.00 54.79 53.84 2wyo n ASP 331 Cb 0.13 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.18 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 -0.57 3.18 -0.27 1.24 3.72 0.47 -4.88 117.46 120.36 2wyo n PHE 332 Ca 0.17 -3.96 -0.07 0.00 -0.05 0.00 0.00 57.45 53.54 2wyo n PHE 332 Cb 0.14 -0.48 0.05 0.00 -0.94 0.00 0.00 39.48 38.26 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 3.04 1.15 -6.52 -1.08 0.13 -1.75 -3.45 132.00 123.53 2wyo h PRO 333 Ca 0.13 -0.24 -0.67 0.00 -0.87 0.00 0.00 66.00 64.34 2wyo h PRO 333 Cb 0.61 -0.17 -0.17 0.00 0.13 0.00 0.00 31.00 31.40 2wyo h PRO 333 CO 0.75 0.98 -0.75 0.95 -0.23 0.00 0.00 178.00 179.70 2wyo s THR 334 N -5.43 3.28 0.49 1.56 -4.23 -1.26 -5.01 115.64 105.04 2wyo s THR 334 Ca -0.12 -1.18 0.24 0.00 -1.18 0.00 0.00 61.69 59.45 2wyo s THR 334 Cb 0.15 -2.48 0.41 0.00 1.34 0.00 0.00 72.50 71.92 2wyo s THR 334 CO 0.84 0.21 1.93 0.44 -0.54 0.00 0.00 174.62 177.50 2wyo h ASP 335 N 3.96 0.14 -0.89 3.99 3.32 -2.00 0.47 116.42 125.41 2wyo h ASP 335 Ca -0.49 0.01 0.20 0.00 0.02 0.00 0.00 57.03 56.78 2wyo h ASP 335 Cb 1.16 -0.02 -0.12 0.00 0.22 0.00 0.00 39.33 40.58 2wyo h ASP 335 CO 0.51 0.07 0.42 0.00 -1.72 0.00 0.00 179.24 178.52 2wyo h ALA 336 N 1.65 1.42 -0.23 3.45 0.00 -1.98 -0.33 119.26 123.25 2wyo h ALA 336 Ca 0.35 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.33 2wyo h ALA 336 Cb 1.18 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2wyo h ALA 336 CO -0.05 -0.26 -0.12 1.15 0.00 0.00 0.00 179.25 179.97 2wyo h THR 337 N 0.48 1.30 -0.65 0.00 2.02 -0.41 -0.54 112.91 115.12 2wyo h THR 337 Ca 0.54 -1.20 -0.05 0.00 0.77 0.00 0.00 66.41 66.47 2wyo h THR 337 Cb 0.96 1.59 -0.03 0.00 -1.74 0.00 0.00 68.15 68.93 2wyo h THR 337 CO -0.48 0.37 0.19 -0.50 0.37 0.00 0.00 175.52 175.47 2wyo h TRP 338 N 0.20 1.03 0.23 3.16 4.06 -1.29 -1.20 115.95 122.14 2wyo h TRP 338 Ca 0.05 -0.10 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 2wyo h TRP 338 Cb 0.62 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.47 2wyo h TRP 338 CO 0.06 0.83 -0.23 0.00 -3.56 0.00 0.00 178.44 175.55 2wyo h ALA 339 N 1.24 -0.93 -0.99 1.49 0.00 -0.79 -0.66 119.26 118.62 2wyo h ALA 339 Ca 0.21 -0.09 0.31 0.00 0.00 0.00 0.00 54.91 55.34 2wyo h ALA 339 Cb 0.30 0.47 -0.18 0.00 0.00 0.00 0.00 17.79 18.38 2wyo h ALA 339 CO -0.01 -0.95 0.15 0.00 0.00 0.00 0.00 179.25 178.45 2wyo h ALA 340 N -1.36 1.42 -0.46 0.00 0.00 -1.04 0.82 119.26 118.63 2wyo h ALA 340 Ca -0.03 0.32 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2wyo h ALA 340 Cb 0.40 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2wyo h ALA 340 CO -0.03 -0.67 -0.11 -0.09 0.00 0.00 0.00 179.25 178.35 2wyo h ARG 341 N 0.01 0.85 -0.53 0.00 9.65 -0.70 -2.26 114.38 121.40 2wyo h ARG 341 Ca 0.66 -0.29 -0.05 0.00 -1.10 0.00 0.00 59.98 59.20 2wyo h ARG 341 Cb 1.48 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.98 2wyo h ARG 341 CO -0.89 0.92 0.13 1.25 2.80 0.00 0.00 179.97 184.19 2wyo h LEU 342 N 0.76 0.81 -0.46 3.80 5.85 0.66 -1.38 115.31 125.35 2wyo h LEU 342 Ca 0.13 -0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2wyo h LEU 342 Cb 0.62 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 2wyo h LEU 342 CO 0.04 0.83 0.17 0.28 -0.34 0.00 0.00 178.44 179.42 2wyo h SER 343 N 0.75 0.19 0.25 1.25 0.02 -0.71 0.62 113.55 115.92 2wyo h SER 343 Ca 0.17 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2wyo h SER 343 Cb 0.34 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2wyo h SER 343 CO 0.00 0.14 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.52 2wyo h LEU 344 N 0.35 -0.64 -0.29 5.07 3.38 -1.37 -1.92 115.31 119.88 2wyo h LEU 344 Ca 0.21 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.29 2wyo h LEU 344 Cb 0.20 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2wyo h LEU 344 CO -0.21 -0.35 0.02 -0.08 0.09 0.00 0.00 178.44 177.90 2wyo h GLU 345 N -0.52 0.11 -0.22 1.13 4.57 0.31 -0.69 114.58 119.27 2wyo h GLU 345 Ca -0.01 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.19 2wyo h GLU 345 Cb 0.48 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2wyo h GLU 345 CO -0.05 0.07 0.15 0.00 -1.18 0.00 0.00 179.01 178.00 2wyo h ARG 346 N 0.11 0.18 -7.11 1.92 3.08 0.21 -3.43 114.38 109.33 2wyo h ARG 346 Ca 0.14 -0.01 -0.40 0.00 0.07 0.00 0.00 59.98 59.78 2wyo h ARG 346 Cb 0.18 -0.04 0.21 0.00 0.08 0.00 0.00 29.97 30.39 2wyo h ARG 346 CO -0.22 0.12 -0.05 -1.54 -1.07 0.00 0.00 179.97 177.21 2wyo s SER 347 N -6.81 -0.20 0.38 7.04 1.04 -0.27 -4.28 113.70 110.61 2wyo s SER 347 Ca -0.06 1.02 0.15 0.00 0.48 0.00 0.00 55.95 57.55 2wyo s SER 347 Cb 0.18 -1.51 0.78 0.00 0.10 0.00 0.00 66.02 65.57 2wyo s SER 347 CO 0.70 -4.86 1.83 0.77 0.98 0.00 0.00 173.24 172.66 2wyo h SER 348 N -3.08 0.00 -2.79 7.02 4.64 -1.68 -3.34 113.55 114.33 2wyo h SER 348 Ca -0.50 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.25 2wyo h SER 348 Cb 1.34 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 63.51 2wyo h SER 348 CO 0.37 0.36 0.67 0.00 -0.87 0.00 0.00 176.83 177.36 2wyo n ALA 349 N -2.41 1.42 -2.05 5.18 0.00 -1.26 -4.81 120.51 116.58 2wyo n ALA 349 Ca -0.02 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.41 2wyo n ALA 349 Cb 0.42 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.52 2wyo n ALA 349 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wyo s ILE 350 N -0.02 3.22 -0.08 0.00 1.01 0.70 -4.76 121.20 121.28 2wyo s ILE 350 Ca 0.68 0.72 -0.02 0.00 0.00 0.00 0.00 60.65 62.02 2wyo s ILE 350 Cb -0.62 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 2wyo s ILE 350 CO 0.49 0.01 0.04 -0.54 0.00 0.00 0.00 174.94 174.94 2wyo s LYS 351 N 2.17 3.06 -0.47 2.79 1.02 -1.26 -0.50 119.74 126.55 2wyo s LYS 351 Ca 0.69 -0.38 0.05 0.00 0.02 0.00 0.00 55.97 56.35 2wyo s LYS 351 Cb -0.37 -2.86 0.19 0.00 -0.52 0.00 0.00 37.83 34.27 2wyo s LYS 351 CO 0.30 0.70 0.44 0.00 -0.92 0.00 0.00 175.35 175.87 2wyo s PRO 353 N -0.65 3.31 0.71 0.00 0.04 -1.26 -1.64 135.00 135.51 2wyo s PRO 353 Ca 0.33 -0.47 -0.11 0.00 0.04 0.00 0.00 61.00 60.79 2wyo s PRO 353 Cb 0.06 -2.65 0.02 0.00 0.04 0.00 0.00 34.50 31.97 2wyo s PRO 353 CO -0.16 0.02 1.07 -1.54 0.04 0.00 0.00 177.00 176.43 2wyo s SER 354 N -4.10 5.19 0.19 6.66 1.04 -0.92 -4.79 113.70 116.96 2wyo s SER 354 Ca 0.43 1.68 -0.14 0.00 0.48 0.00 0.00 55.95 58.40 2wyo s SER 354 Cb -0.10 -2.50 0.18 0.00 0.10 0.00 0.00 66.02 63.70 2wyo s SER 354 CO 0.36 -1.57 1.68 0.40 0.98 0.00 0.00 173.24 175.09 2wyo h ILE 355 N -0.76 0.62 0.00 -1.02 1.08 -1.98 0.34 117.51 115.79 2wyo h ILE 355 Ca -0.44 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 63.99 2wyo h ILE 355 Cb 1.22 0.49 -0.00 0.00 -3.07 0.00 0.00 36.82 35.46 2wyo h ILE 355 CO 0.55 0.02 -0.02 -0.65 -0.69 0.00 0.00 178.15 177.36 2wyo h PRO 356 N 0.12 0.00 0.04 2.37 0.11 -1.94 -0.47 132.00 132.23 2wyo h PRO 356 Ca 0.25 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.27 2wyo h PRO 356 Cb 0.37 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.49 2wyo h PRO 356 CO -0.41 0.02 -0.37 1.88 -0.21 0.00 0.00 178.00 178.92 2wyo h TYR 357 N 0.00 0.29 -0.90 0.65 -1.99 -1.19 -3.34 116.97 110.49 2wyo h TYR 357 Ca -0.00 -0.19 0.23 0.00 2.00 0.00 0.00 58.73 60.78 2wyo h TYR 357 Cb 0.14 -0.02 -0.16 0.00 2.00 0.00 0.00 36.73 38.68 2wyo h TYR 357 CO 0.00 1.08 0.03 1.25 -0.00 0.00 0.00 178.16 180.52 2wyo h HIS 358 N -0.58 -0.02 0.00 4.88 2.76 0.53 -0.72 115.15 121.99 2wyo h HIS 358 Ca -0.06 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2wyo h HIS 358 Cb 1.21 0.16 0.00 0.00 1.55 0.00 0.00 27.41 30.33 2wyo h HIS 358 CO 0.21 -0.35 0.00 1.28 -1.30 0.00 0.00 177.93 177.78 2wyo n LEU 359 N -5.42 0.00 0.06 0.26 4.77 -0.28 -1.57 117.00 114.83 2wyo n LEU 359 Ca 0.20 0.22 0.12 0.00 -0.03 0.00 0.00 56.01 56.52 2wyo n LEU 359 Cb 0.65 -0.22 0.17 0.00 -2.33 0.00 0.00 43.42 41.69 2wyo n LEU 359 CO -0.02 -0.07 0.36 0.18 -1.33 0.00 0.00 177.39 176.51 2wyo n LEU 360 N -1.22 0.70 0.25 2.23 4.32 -0.28 -3.28 117.00 119.72 2wyo n LEU 360 Ca 0.11 0.24 0.07 0.00 -0.02 0.00 0.00 56.01 56.41 2wyo n LEU 360 Cb 0.14 -0.18 0.61 0.00 -1.62 0.00 0.00 43.42 42.37 2wyo n LEU 360 CO 0.15 -0.06 1.01 0.74 -1.22 0.00 0.00 177.39 178.01 2wyo h THR 361 N 0.00 1.02 -3.79 -5.08 2.02 -1.40 -3.41 112.91 102.27 2wyo h THR 361 Ca 0.00 -0.23 -0.56 0.00 0.77 0.00 0.00 66.41 66.39 2wyo h THR 361 Cb 0.75 1.13 0.14 0.00 -1.74 0.00 0.00 68.15 68.42 2wyo h THR 361 CO 0.00 0.07 0.49 0.49 0.37 0.00 0.00 175.52 176.93 2wyo n PHE 362 N -4.41 2.01 0.12 3.16 3.72 -1.21 -4.85 117.46 116.00 2wyo n PHE 362 Ca -0.03 0.46 0.04 0.00 -0.05 0.00 0.00 57.45 57.86 2wyo n PHE 362 Cb 0.15 -2.33 0.44 0.00 -0.94 0.00 0.00 39.48 36.79 2wyo n PHE 362 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2wyo h LYS 363 N 1.50 0.26 -0.39 -1.08 1.79 -1.91 -2.89 116.57 113.85 2wyo h LYS 363 Ca -0.49 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 57.92 2wyo h LYS 363 Cb 1.31 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.90 2wyo h LYS 363 CO 0.57 0.31 0.19 0.87 -1.08 0.00 0.00 179.45 180.32 2wyo h LYS 364 N 0.25 0.55 -0.43 3.15 1.79 -1.94 -1.69 116.57 118.26 2wyo h LYS 364 Ca 0.06 -0.08 -0.07 0.00 -2.18 0.00 0.00 60.65 58.38 2wyo h LYS 364 Cb 0.23 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2wyo h LYS 364 CO 0.01 0.48 -0.01 -0.07 -1.08 0.00 0.00 179.45 178.78 2wyo h LEU 365 N 0.49 0.66 -1.02 2.94 -0.00 -1.80 -0.21 115.31 116.37 2wyo h LEU 365 Ca 0.13 -0.15 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 2wyo h LEU 365 Cb 0.11 -0.17 -0.04 0.00 -0.00 0.00 0.00 40.66 40.55 2wyo h LEU 365 CO -0.02 0.73 0.44 1.56 -0.00 0.00 0.00 178.44 181.16 2wyo h GLN 366 N 0.65 1.13 0.00 1.13 4.20 -1.39 0.73 115.11 121.56 2wyo h GLN 366 Ca 0.13 -0.13 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2wyo h GLN 366 Cb 0.42 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 2wyo h GLN 366 CO 0.02 0.83 -0.57 0.37 -0.67 0.00 0.00 178.83 178.80 2wyo h GLN 367 N 1.14 0.00 0.15 1.46 -0.00 -0.61 -3.24 115.11 114.00 2wyo h GLN 367 Ca 0.29 0.00 -0.31 0.00 -0.00 0.00 0.00 58.65 58.62 2wyo h GLN 367 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.51 2wyo h GLN 367 CO -0.05 0.57 -1.52 -0.07 0.00 0.00 0.00 178.83 177.76 2wyo h LEU 368 N 0.00 0.50 0.00 -2.39 3.38 -0.47 -3.17 115.31 113.16 2wyo h LEU 368 Ca -0.01 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.31 2wyo h LEU 368 Cb 1.07 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2wyo h LEU 368 CO 0.07 1.53 0.02 0.18 0.09 0.00 0.00 178.44 180.34 2wyo n LEU 369 N -3.53 0.00 -0.02 1.67 4.77 0.20 -2.98 117.00 117.12 2wyo n LEU 369 Ca -0.17 0.37 -0.11 0.00 -0.03 0.00 0.00 56.01 56.07 2wyo n LEU 369 Cb 1.06 -0.37 -0.09 0.00 -2.33 0.00 0.00 43.42 41.69 2wyo n LEU 369 CO 0.53 -0.37 0.36 0.00 -1.33 0.00 0.00 177.39 176.58 2wyo s ASP 371 N -5.79 7.30 -0.15 0.00 -0.00 -1.16 -4.91 116.67 111.96 2wyo s ASP 371 Ca -0.13 1.78 -0.12 0.00 -0.00 0.00 0.00 52.55 54.08 2wyo s ASP 371 Cb -0.01 -2.58 -0.07 0.00 -0.00 0.00 0.00 42.92 40.26 2wyo s ASP 371 CO 0.50 -0.30 -0.01 0.58 -0.00 0.00 0.00 175.17 175.94 2wyo h VAL 372 N 4.62 0.30 -0.60 -1.27 2.07 -1.87 -2.64 116.25 116.85 2wyo h VAL 372 Ca -0.41 -1.34 0.05 0.00 0.82 0.00 0.00 66.70 65.82 2wyo h VAL 372 Cb 1.22 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.64 2wyo h VAL 372 CO 0.76 0.10 0.40 0.44 0.02 0.00 0.00 177.57 179.29 2wyo h ASP 373 N -1.00 0.55 0.10 0.57 5.19 -1.97 -0.47 116.42 119.39 2wyo h ASP 373 Ca -0.08 -0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.09 2wyo h ASP 373 Cb 0.64 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.03 2wyo h ASP 373 CO -0.05 0.36 -1.23 -0.09 -3.12 0.00 0.00 179.24 175.11 2wyo h ARG 374 N 0.63 0.21 0.00 3.56 9.65 -1.97 -3.40 114.38 123.05 2wyo h ARG 374 Ca 0.25 -0.35 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 2wyo h ARG 374 Cb 0.21 0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 2wyo h ARG 374 CO -0.07 1.17 -0.81 0.28 2.80 0.00 0.00 179.97 183.33 2wyo n VAL 375 N -4.04 0.00 -0.06 0.20 0.31 -1.02 -4.64 118.33 109.08 2wyo n VAL 375 Ca -0.23 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 63.99 2wyo n VAL 375 Cb 0.84 -0.85 -0.05 0.00 -0.91 0.00 0.00 33.84 32.87 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 0.00 0.31 0.19 7.52 5.85 -1.20 -1.72 115.31 126.26 2wyo h LEU 376 Ca 0.00 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 2wyo h LEU 376 Cb 0.81 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2wyo h LEU 376 CO 0.00 0.46 -0.09 0.58 -0.34 0.00 0.00 178.44 179.05 2wyo h VAL 377 N 0.14 0.58 -0.03 1.05 2.07 -1.37 -2.31 116.25 116.37 2wyo h VAL 377 Ca 0.06 -1.05 -0.23 0.00 0.82 0.00 0.00 66.70 66.30 2wyo h VAL 377 Cb 0.27 1.00 0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2wyo h VAL 377 CO 0.00 0.16 -0.90 1.55 0.02 0.00 0.00 177.57 178.40 2wyo h PRO 378 N -0.96 0.52 0.00 1.57 0.13 -1.78 0.39 132.00 131.88 2wyo h PRO 378 Ca -0.03 -0.52 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2wyo h PRO 378 Cb 0.46 0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.72 2wyo h PRO 378 CO 0.04 1.15 0.00 0.28 -0.23 0.00 0.00 178.00 179.24 2wyo n VAL 379 N -3.81 0.00 0.21 1.56 0.31 -0.67 -3.42 118.33 112.50 2wyo n VAL 379 Ca -0.07 0.45 0.08 0.00 -0.01 0.00 0.00 64.34 64.78 2wyo n VAL 379 Cb 0.81 -1.34 0.38 0.00 -0.91 0.00 0.00 33.84 32.78 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 -2.00 0.98 0.00 3.52 0.00 -1.41 -3.24 119.26 117.12 2wyo h ALA 380 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2wyo h ALA 380 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2wyo h ALA 380 CO 0.00 0.36 -0.00 1.19 0.00 0.00 0.00 179.25 180.79 2wyo n PHE 381 N -3.41 0.00 -3.63 0.00 3.72 -0.88 -4.22 117.46 109.04 2wyo n PHE 381 Ca 0.00 -0.44 -0.23 0.00 -0.05 0.00 0.00 57.45 56.74 2wyo n PHE 381 Cb 0.48 -0.05 0.06 0.00 -0.94 0.00 0.00 39.48 39.04 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 -1.60 0.81 3.55 0.00 0.00 0.12 -4.95 105.19 103.12 2wyo n GLY 383 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.71 6.19 0.35 1.61 -1.08 -0.84 -4.81 116.67 115.38 2wyo s ASP 384 Ca 0.00 -0.78 0.16 0.00 -0.52 0.00 0.00 52.55 51.40 2wyo s ASP 384 Cb 0.00 -2.56 0.60 0.00 -1.46 0.00 0.00 42.92 39.50 2wyo s ASP 384 CO 0.00 -1.79 1.71 0.77 0.52 0.00 0.00 175.17 176.38 2wyo h SER 385 N 10.29 0.00 0.21 -0.34 4.64 -1.89 -3.18 113.55 123.28 2wyo h SER 385 Ca -0.09 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 2wyo h SER 385 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2wyo h SER 385 CO 1.33 0.44 -0.10 0.44 -0.87 0.00 0.00 176.83 178.07 2wyo h ASP 386 N 0.00 -0.24 -0.37 4.97 3.32 -1.99 -0.39 116.42 121.72 2wyo h ASP 386 Ca -0.00 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.01 2wyo h ASP 386 Cb 0.93 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 2wyo h ASP 386 CO 0.06 -0.10 0.20 0.11 -1.72 0.00 0.00 179.24 177.79 2wyo h LYS 387 N -0.36 0.40 -0.73 3.56 1.57 -1.98 -2.32 116.57 116.70 2wyo h LYS 387 Ca -0.03 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2wyo h LYS 387 Cb 0.28 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 2wyo h LYS 387 CO 0.05 0.27 0.44 0.00 -0.57 0.00 0.00 179.45 179.63 2wyo h ALA 388 N 1.18 0.99 0.00 3.86 0.00 -1.49 -0.55 119.26 123.24 2wyo h ALA 388 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2wyo h ALA 388 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2wyo h ALA 388 CO -0.09 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.73 2wyo n GLY 389 N -1.30 -0.95 0.02 0.00 0.00 -0.17 -0.44 105.19 102.35 2wyo n GLY 389 Ca 0.09 0.18 -0.01 0.00 0.00 0.00 0.00 46.02 46.29 2wyo n GLY 389 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wyo h LEU 390 N 0.00 0.00 -1.17 0.99 3.38 -0.94 -3.32 115.31 114.25 2wyo h LEU 390 Ca 0.00 0.00 0.37 0.00 0.09 0.00 0.00 57.88 58.34 2wyo h LEU 390 Cb 0.08 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.68 2wyo h LEU 390 CO 0.00 0.25 0.66 -0.07 0.09 0.00 0.00 178.44 179.38 2wyo h LEU 391 N -0.44 0.40 -1.83 1.67 3.38 -1.41 -0.08 115.31 117.00 2wyo h LEU 391 Ca 0.00 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2wyo h LEU 391 Cb 0.07 0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2wyo h LEU 391 CO 0.00 -0.17 0.00 -0.61 0.09 0.00 0.00 178.44 177.75 2wyo h GLN 392 N 0.21 0.00 0.00 1.13 4.15 -0.87 -1.51 115.11 118.22 2wyo h GLN 392 Ca 0.76 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.18 2wyo h GLN 392 Cb 2.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.71 2wyo h GLN 392 CO -0.54 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 176.90 2wyo n ARG 393 N -2.52 0.10 -0.30 1.69 1.74 -0.04 -3.72 116.66 113.61 2wyo n ARG 393 Ca -0.02 0.31 0.08 0.00 -0.77 0.00 0.00 57.85 57.46 2wyo n ARG 393 Cb 0.07 -1.68 0.19 0.00 -1.02 0.00 0.00 32.46 30.01 2wyo n ARG 393 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2wyo n HIS 394 N -1.87 0.35 -3.58 -1.55 8.25 -0.57 -1.96 115.22 114.30 2wyo n HIS 394 Ca 0.03 -1.08 -0.38 0.00 -0.26 0.00 0.00 57.72 56.03 2wyo n HIS 394 Cb 0.22 -0.24 -0.06 0.00 1.12 0.00 0.00 29.99 31.03 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 -2.95 3.70 -0.37 4.41 0.40 -1.24 -0.26 117.98 121.68 2wyo s PHE 395 Ca 0.37 0.90 -0.19 0.00 -0.60 0.00 0.00 56.93 57.41 2wyo s PHE 395 Cb 0.32 -2.22 0.00 0.00 0.51 0.00 0.00 43.02 41.63 2wyo s PHE 395 CO 0.03 0.66 0.58 0.08 0.70 0.00 0.00 175.22 177.27 2wyo s VAL 396 N -1.08 4.94 -0.24 -0.44 1.01 -1.26 -4.94 120.40 118.40 2wyo s VAL 396 Ca 0.22 0.39 -0.37 0.00 0.00 0.00 0.00 61.98 62.22 2wyo s VAL 396 Cb -0.16 -4.04 -0.13 0.00 0.00 0.00 0.00 36.38 32.05 2wyo s VAL 396 CO 0.12 -0.31 1.92 -2.65 0.00 0.00 0.00 175.10 174.18 2wyo n PRO 397 N 5.92 1.49 -4.01 2.72 -0.02 -1.26 -4.76 135.00 135.08 2wyo n PRO 397 Ca -0.03 0.52 -0.35 0.00 -2.02 0.00 0.00 63.50 61.62 2wyo n PRO 397 Cb 0.49 -2.40 -0.09 0.00 -0.02 0.00 0.00 33.50 31.47 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 4.53 3.90 0.53 -0.52 -0.21 -1.26 -1.27 119.66 125.36 2wyo s GLN 398 Ca 1.00 -0.33 0.05 0.00 0.02 0.00 0.00 55.36 56.09 2wyo s GLN 398 Cb -0.87 -3.19 0.03 0.00 1.00 0.00 0.00 33.01 29.97 2wyo s GLN 398 CO 0.56 0.33 0.34 0.71 -2.12 0.00 0.00 175.29 175.11 2wyo s TYR 399 N 0.22 1.70 -0.32 0.91 2.02 0.20 -4.65 117.35 117.43 2wyo s TYR 399 Ca 0.04 -0.85 0.04 0.00 -0.37 0.00 0.00 57.07 55.93 2wyo s TYR 399 Cb -0.12 -1.88 0.09 0.00 -0.40 0.00 0.00 41.96 39.65 2wyo s TYR 399 CO 0.00 -0.35 0.02 0.45 -1.57 0.00 0.00 175.55 174.10 2wyo s SER 400 N -4.21 4.66 0.30 2.29 0.15 -1.26 -3.26 113.70 112.36 2wyo s SER 400 Ca 0.30 -1.96 -0.05 0.00 0.70 0.00 0.00 55.95 54.94 2wyo s SER 400 Cb -0.02 -1.58 -0.05 0.00 -1.71 0.00 0.00 66.02 62.67 2wyo s SER 400 CO 0.19 -0.34 0.56 -0.22 1.20 0.00 0.00 173.24 174.63 2wyo s LEU 401 N 0.98 4.04 -0.54 3.45 1.98 -1.26 -4.44 118.68 122.88 2wyo s LEU 401 Ca 0.06 0.71 -0.06 0.00 -2.89 0.00 0.00 54.13 51.95 2wyo s LEU 401 Cb -0.19 -3.53 0.01 0.00 0.66 0.00 0.00 46.19 43.14 2wyo s LEU 401 CO -0.08 -0.22 0.59 0.59 -1.89 0.00 0.00 176.35 175.35 2wyo n ASN 402 N -1.03 -7.32 -4.70 3.68 3.02 -1.26 -4.68 115.26 102.97 2wyo n ASN 402 Ca -0.02 0.18 -0.31 0.00 -0.03 0.00 0.00 54.58 54.41 2wyo n ASN 402 Cb 0.54 -4.94 -0.08 0.00 -0.61 0.00 0.00 39.78 34.69 2wyo n ASN 402 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2wyo s PRO 403 N -2.76 2.66 0.35 3.52 0.04 -1.26 -4.99 135.00 132.56 2wyo s PRO 403 Ca 0.10 -0.75 0.19 0.00 0.04 0.00 0.00 61.00 60.57 2wyo s PRO 403 Cb -0.03 -2.60 0.43 0.00 0.04 0.00 0.00 34.50 32.33 2wyo s PRO 403 CO 0.69 0.57 1.61 0.87 0.04 0.00 0.00 177.00 180.77 2wyo h LYS 404 N 3.65 0.00 0.00 4.56 1.79 -1.95 -3.46 116.57 121.17 2wyo h LYS 404 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 2wyo h LYS 404 Cb 1.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2wyo h LYS 404 CO 0.60 0.38 0.00 0.39 -1.08 0.00 0.00 179.45 179.74 2wyo n GLU 405 N -3.32 1.00 -0.13 3.15 4.71 -1.26 -5.01 120.64 119.78 2wyo n GLU 405 Ca 0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.05 2wyo n GLU 405 Cb 0.60 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 31.04 2wyo n GLU 405 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 2wyo h VAL 406 N -0.34 1.27 -5.13 2.62 3.04 -1.99 -3.48 116.25 112.25 2wyo h VAL 406 Ca 0.00 -1.44 -0.40 0.00 -1.01 0.00 0.00 66.70 63.85 2wyo h VAL 406 Cb 0.00 1.22 -0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2wyo h VAL 406 CO 0.00 0.49 -0.61 0.61 -1.01 0.00 0.00 177.57 177.05 2wyo n GLY 407 N -0.06 -0.51 0.03 3.17 0.00 -1.26 -4.87 105.19 101.70 2wyo n GLY 407 Ca -0.01 0.13 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 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 -4.04 1.61 0.00 1.61 -0.58 -1.26 -4.47 120.64 113.51 2wyo n GLU 408 Ca -0.05 -0.04 0.14 0.00 -0.42 0.00 0.00 57.16 56.79 2wyo n GLU 408 Cb 0.58 -1.26 0.60 0.00 -0.57 0.00 0.00 31.44 30.79 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 -2.20 0.30 0.02 3.49 1.02 -1.26 0.44 120.64 122.45 2wyo n GLU 409 Ca -0.11 -0.07 -0.21 0.00 -0.02 0.00 0.00 57.16 56.75 2wyo n GLU 409 Cb 0.63 -1.50 -0.14 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 h ALA 410 N 3.28 0.13 -0.05 0.62 0.00 -1.99 -3.00 119.26 118.25 2wyo h ALA 410 Ca 0.00 -1.02 -0.06 0.00 0.00 0.00 0.00 54.91 53.83 2wyo h ALA 410 Cb 0.41 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2wyo h ALA 410 CO 0.00 0.74 -0.26 0.28 0.00 0.00 0.00 179.25 180.02 2wyo h VAL 411 N -0.32 1.21 -0.03 0.00 2.07 -1.63 0.15 116.25 117.70 2wyo h VAL 411 Ca -0.28 -0.99 -0.24 0.00 0.82 0.00 0.00 66.70 66.02 2wyo h VAL 411 Cb 1.74 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 32.99 2wyo h VAL 411 CO 0.07 0.29 -0.94 -0.33 0.02 0.00 0.00 177.57 176.69 2wyo h GLU 412 N 0.08 0.59 0.40 1.57 5.08 -0.19 -3.33 114.58 118.78 2wyo h GLU 412 Ca 0.01 -0.59 -0.01 0.00 -1.00 0.00 0.00 59.36 57.77 2wyo h GLU 412 Cb 0.51 0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2wyo h GLU 412 CO 0.04 1.21 -0.38 0.87 -1.00 0.00 0.00 179.01 179.74 2wyo h LYS 413 N 0.35 -0.77 -0.65 2.33 1.79 -1.22 -3.34 116.57 115.06 2wyo h LYS 413 Ca -0.09 0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.53 2wyo h LYS 413 Cb 1.57 0.18 -0.12 0.00 -1.58 0.00 0.00 32.23 32.29 2wyo h LYS 413 CO 0.18 -0.52 -0.41 0.28 -1.08 0.00 0.00 179.45 177.90 2wyo h VAL 414 N -0.80 0.09 0.00 0.50 2.07 -0.84 -0.94 116.25 116.33 2wyo h VAL 414 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2wyo h VAL 414 Cb 0.71 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2wyo h VAL 414 CO -0.05 0.00 0.00 -0.38 0.02 0.00 0.00 177.57 177.16 2wyo n ILE 415 N -5.41 1.14 -0.07 4.57 5.41 -1.25 -1.16 119.36 122.58 2wyo n ILE 415 Ca 0.03 -0.07 -0.05 0.00 1.00 0.00 0.00 62.75 63.67 2wyo n ILE 415 Cb 0.35 -1.07 -0.02 0.00 -0.71 0.00 0.00 39.64 38.20 2wyo n ILE 415 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 2wyo n HIS 416 N 0.64 0.76 -3.58 1.39 8.25 -0.36 -4.80 115.22 117.54 2wyo n HIS 416 Ca 0.00 0.33 -0.32 0.00 -0.26 0.00 0.00 57.72 57.47 2wyo n HIS 416 Cb 0.50 -0.70 -0.08 0.00 1.12 0.00 0.00 29.99 30.83 2wyo n HIS 416 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2wyo n ASP 417 N -4.41 4.02 0.07 0.41 9.92 -0.31 -4.95 116.55 121.30 2wyo n ASP 417 Ca -0.07 -3.27 0.13 0.00 -0.53 0.00 0.00 54.79 51.05 2wyo n ASP 417 Cb 0.27 -0.89 0.45 0.00 -0.64 0.00 0.00 41.12 40.31 2wyo n ASP 417 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 2wyo n VAL 418 N 1.69 0.39 0.07 2.53 3.14 -0.69 -4.23 118.33 121.24 2wyo n VAL 418 Ca 0.24 -0.19 0.02 0.00 -2.96 0.00 0.00 64.34 61.45 2wyo n VAL 418 Cb 0.37 -0.51 0.19 0.00 -1.06 0.00 0.00 33.84 32.82 2wyo n VAL 418 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2wyo n LEU 419 N -2.01 3.41 -2.71 6.55 7.99 -1.26 -4.37 117.00 124.60 2wyo n LEU 419 Ca 0.06 -1.73 -0.09 0.00 -0.01 0.00 0.00 56.01 54.24 2wyo n LEU 419 Cb 0.40 -0.60 0.07 0.00 -0.11 0.00 0.00 43.42 43.19 2wyo n LEU 419 CO 0.30 0.46 0.20 0.00 -1.51 0.00 0.00 177.39 176.84 2wyo n GLN 420 N 0.26 1.15 -3.45 3.23 0.00 -1.26 -5.08 117.38 112.23 2wyo n GLN 420 Ca 0.15 -2.49 -0.18 0.00 0.00 0.00 0.00 57.00 54.47 2wyo n GLN 420 Cb 0.74 -0.68 -0.11 0.00 0.00 0.00 0.00 30.24 30.18 2wyo n GLN 420 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2wyo s ARG 421 N -1.28 0.26 0.00 2.61 0.52 -1.26 -1.35 118.95 118.44 2wyo s ARG 421 Ca 0.25 0.02 0.00 0.00 -0.52 0.00 0.00 55.73 55.48 2wyo s ARG 421 Cb 0.41 -0.93 0.00 0.00 0.52 0.00 0.00 34.95 34.96 2wyo s ARG 421 CO -0.03 -0.84 0.00 -0.35 0.02 0.00 0.00 175.30 174.09 2wyo n PRO 422 N 5.31 1.12 -3.61 3.54 -0.04 -1.23 -4.84 135.00 135.25 2wyo n PRO 422 Ca -0.04 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.27 2wyo n PRO 422 Cb 0.48 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.87 2wyo n PRO 422 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2wyo s ASP 423 N -1.08 -0.69 0.24 3.54 1.47 -1.26 -2.34 116.67 116.55 2wyo s ASP 423 Ca 0.00 1.19 0.01 0.00 1.18 0.00 0.00 52.55 54.93 2wyo s ASP 423 Cb 0.00 1.17 0.28 0.00 -0.34 0.00 0.00 42.92 44.03 2wyo s ASP 423 CO 0.00 -0.34 1.63 -0.61 0.68 0.00 0.00 175.17 176.53 2wyo h GLN 424 N 4.50 0.49 0.00 2.11 4.15 -1.99 -3.46 115.11 120.91 2wyo h GLN 424 Ca -0.28 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 58.90 2wyo h GLN 424 Cb 1.16 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.85 2wyo h GLN 424 CO 0.16 0.80 0.00 0.98 -1.93 0.00 0.00 178.83 178.84 2wyo n TYR 465 N -4.04 0.00 -3.97 3.99 9.36 -1.26 -5.06 117.16 116.19 2wyo n TYR 465 Ca -0.01 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.92 2wyo n TYR 465 Cb 0.50 0.00 -0.17 0.00 -0.63 0.00 0.00 39.34 39.04 2wyo n TYR 465 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2wyo s VAL 466 N -0.79 1.34 -0.00 2.97 1.01 -1.26 -4.28 120.40 119.38 2wyo s VAL 466 Ca 0.00 -0.51 -0.32 0.00 0.00 0.00 0.00 61.98 61.15 2wyo s VAL 466 Cb 0.00 -1.31 -0.10 0.00 0.00 0.00 0.00 36.38 34.97 2wyo s VAL 466 CO 0.00 0.40 1.91 0.52 0.00 0.00 0.00 175.10 177.93 2wyo n VAL 467 N 4.84 0.63 -4.24 2.92 0.31 -1.20 -4.32 118.33 117.27 2wyo n VAL 467 Ca -0.15 -0.11 -0.24 0.00 -0.01 0.00 0.00 64.34 63.83 2wyo n VAL 467 Cb 0.50 -2.09 -0.07 0.00 -0.91 0.00 0.00 33.84 31.26 2wyo n VAL 467 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2wyo s MET 468 N 4.02 2.23 0.03 5.55 0.00 -0.99 0.58 119.30 130.72 2wyo s MET 468 Ca 0.90 -1.62 -0.07 0.00 0.00 0.00 0.00 55.69 54.90 2wyo s MET 468 Cb -0.55 -2.06 -0.05 0.00 0.00 0.00 0.00 34.83 32.16 2wyo s MET 468 CO 0.45 0.16 0.31 0.45 0.00 0.00 0.00 175.02 176.39 2wyo s SER 469 N -3.76 6.53 -0.79 1.11 0.15 -0.39 -3.55 113.70 112.99 2wyo s SER 469 Ca 0.35 0.61 -0.16 0.00 0.70 0.00 0.00 55.95 57.46 2wyo s SER 469 Cb -0.02 -2.11 0.18 0.00 -1.71 0.00 0.00 66.02 62.35 2wyo s SER 469 CO 0.21 0.22 0.82 -0.60 1.20 0.00 0.00 173.24 175.09 2wyo s ARG 470 N -1.84 3.47 -0.03 5.44 3.52 -0.46 -4.82 118.95 124.23 2wyo s ARG 470 Ca 0.30 -2.08 -0.24 0.00 -0.13 0.00 0.00 55.73 53.58 2wyo s ARG 470 Cb -0.13 -4.51 -0.04 0.00 -1.56 0.00 0.00 34.95 28.71 2wyo s ARG 470 CO 0.17 -1.44 0.72 0.42 -0.81 0.00 0.00 175.30 174.36 2wyo s ILE 471 N 1.22 4.95 -0.55 4.11 1.01 -1.26 -4.94 121.20 125.73 2wyo s ILE 471 Ca 0.19 1.50 -0.23 0.00 0.00 0.00 0.00 60.65 62.11 2wyo s ILE 471 Cb -0.13 -4.06 0.05 0.00 0.01 0.00 0.00 42.46 38.33 2wyo s ILE 471 CO -0.06 0.29 0.90 -1.10 0.00 0.00 0.00 174.94 174.98 2wyo s GLN 472 N 0.50 3.29 0.25 2.79 -0.21 -1.26 -5.03 119.66 119.99 2wyo s GLN 472 Ca 0.38 -0.38 -0.22 0.00 0.02 0.00 0.00 55.36 55.16 2wyo s GLN 472 Cb -0.19 -4.07 -0.09 0.00 1.00 0.00 0.00 33.01 29.67 2wyo s GLN 472 CO 0.20 -1.48 0.80 -0.06 -2.12 0.00 0.00 175.29 172.63 2wyo s PHE 473 N 3.80 3.70 0.13 0.91 0.08 -1.26 -1.28 117.98 124.06 2wyo s PHE 473 Ca 0.28 1.55 -0.31 0.00 0.12 0.00 0.00 56.93 58.56 2wyo s PHE 473 Cb -0.14 -2.74 -0.11 0.00 -0.57 0.00 0.00 43.02 39.47 2wyo s PHE 473 CO 0.18 0.32 1.84 1.58 -0.10 0.00 0.00 175.22 179.04 2wyo n HIS 474 N 0.80 2.63 -3.90 0.36 -0.00 -0.20 -4.62 115.22 110.29 2wyo n HIS 474 Ca -0.01 -0.15 -0.35 0.00 -0.00 0.00 0.00 57.72 57.21 2wyo n HIS 474 Cb 0.50 -2.73 -0.10 0.00 -0.00 0.00 0.00 29.99 27.66 2wyo n HIS 474 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2wyo s VAL 475 N 2.69 4.85 0.38 3.57 1.01 -1.26 -4.55 120.40 127.09 2wyo s VAL 475 Ca 0.82 -0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.83 2wyo s VAL 475 Cb -0.48 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 2wyo s VAL 475 CO 0.37 0.42 0.14 -1.54 0.00 0.00 0.00 175.10 174.49 2wyo n SER 476 N 3.87 1.19 -4.65 3.32 3.41 -0.16 -4.89 113.62 115.71 2wyo n SER 476 Ca -0.16 -3.05 -0.28 0.00 -0.26 0.00 0.00 58.87 55.12 2wyo n SER 476 Cb 0.52 0.98 -0.08 0.00 -0.26 0.00 0.00 64.21 65.37 2wyo n SER 476 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2wyo s THR 477 N -3.00 3.70 -0.07 6.66 2.01 -1.26 -1.45 115.64 122.23 2wyo s THR 477 Ca 0.20 -1.31 -0.31 0.00 0.31 0.00 0.00 61.69 60.57 2wyo s THR 477 Cb 0.01 -2.82 0.12 0.00 0.01 0.00 0.00 72.50 69.82 2wyo s THR 477 CO 0.14 -0.02 1.38 -0.83 -0.69 0.00 0.00 174.62 174.59 2wyo s GLY 478 N -2.68 -0.34 0.13 4.40 0.00 -0.76 -4.52 107.32 103.55 2wyo s GLY 478 Ca 0.26 0.53 0.07 0.00 0.00 0.00 0.00 44.72 45.58 2wyo s GLY 478 CO 0.18 3.16 -0.16 -0.56 0.00 0.00 0.00 173.10 175.72 2wyo s SER 479 N -3.43 2.20 0.10 1.64 0.01 -1.26 0.17 113.70 113.13 2wyo s SER 479 Ca 0.23 -0.80 -0.05 0.00 1.31 0.00 0.00 55.95 56.64 2wyo s SER 479 Cb 0.04 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.15 2wyo s SER 479 CO -0.04 -0.10 0.12 -1.48 0.41 0.00 0.00 173.24 172.15 2wyo s LEU 480 N -2.42 1.71 -0.34 2.44 0.05 0.77 -2.01 118.68 118.88 2wyo s LEU 480 Ca 0.10 -0.93 -0.05 0.00 0.05 0.00 0.00 54.13 53.29 2wyo s LEU 480 Cb -0.06 0.65 0.05 0.00 -2.05 0.00 0.00 46.19 44.78 2wyo s LEU 480 CO 0.04 -0.73 0.09 -0.22 -0.55 0.00 0.00 176.35 174.99 2wyo s LEU 481 N -2.95 4.30 0.04 1.48 2.96 0.24 -0.21 118.68 124.55 2wyo s LEU 481 Ca 0.13 -1.21 0.03 0.00 -0.22 0.00 0.00 54.13 52.86 2wyo s LEU 481 Cb 0.06 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 2wyo s LEU 481 CO -0.05 -0.33 -0.10 0.00 -1.32 0.00 0.00 176.35 174.54 2wyo s ALA 482 N 1.36 0.84 -0.65 5.97 0.00 -0.84 -2.29 121.76 126.16 2wyo s ALA 482 Ca -0.02 -0.72 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 2wyo s ALA 482 Cb -0.20 -0.08 0.05 0.00 0.00 0.00 0.00 23.12 22.88 2wyo s ALA 482 CO 0.02 0.11 0.16 0.54 0.00 0.00 0.00 175.76 176.59 2wyo n ARG 483 N 1.87 -2.58 -1.01 0.00 1.74 -1.26 -0.89 116.66 114.54 2wyo n ARG 483 Ca -0.19 0.19 -0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2wyo n ARG 483 Cb 0.55 -4.75 -0.00 0.00 -1.02 0.00 0.00 32.46 27.24 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 -0.73 0.47 3.35 -0.13 0.00 -1.26 -5.02 105.19 101.86 2wyo n GLY 484 Ca -0.01 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.32 2.87 -0.32 1.61 1.01 -0.07 -5.06 116.67 114.39 2wyo s ASP 485 Ca 0.00 -0.82 -0.11 0.00 0.71 0.00 0.00 52.55 52.33 2wyo s ASP 485 Cb 0.00 -0.18 -0.01 0.00 1.01 0.00 0.00 42.92 43.74 2wyo s ASP 485 CO 0.00 0.03 0.18 -0.69 0.21 0.00 0.00 175.17 174.90 2wyo s VAL 486 N -1.72 4.77 -0.24 -1.27 1.01 -1.26 -1.99 120.40 119.70 2wyo s VAL 486 Ca 0.15 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.63 2wyo s VAL 486 Cb -0.07 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 2wyo s VAL 486 CO 0.07 0.02 0.10 -0.69 0.00 0.00 0.00 175.10 174.59 2wyo s VAL 487 N 1.63 4.64 -0.14 2.92 1.01 0.71 -4.95 120.40 126.23 2wyo s VAL 487 Ca 0.05 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 61.85 2wyo s VAL 487 Cb -0.17 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 2wyo s VAL 487 CO 0.07 0.34 0.22 -1.58 0.00 0.00 0.00 175.10 174.16 2wyo s GLN 488 N 1.39 4.00 -0.38 2.72 2.00 -1.26 -0.16 119.66 127.97 2wyo s GLN 488 Ca 0.06 -0.02 0.04 0.00 -2.00 0.00 0.00 55.36 53.44 2wyo s GLN 488 Cb -0.15 -3.34 0.11 0.00 0.80 0.00 0.00 33.01 30.42 2wyo s GLN 488 CO 0.05 0.44 0.10 -0.51 -0.50 0.00 0.00 175.29 174.87 2wyo s LEU 489 N -0.09 4.71 -0.27 3.68 1.43 0.13 -4.99 118.68 123.27 2wyo s LEU 489 Ca 0.14 -2.33 -0.28 0.00 -1.03 0.00 0.00 54.13 50.64 2wyo s LEU 489 Cb -0.13 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.46 2wyo s LEU 489 CO 0.03 -0.36 1.00 -1.61 0.23 0.00 0.00 176.35 175.64 2wyo s GLU 490 N 0.67 4.15 -1.21 1.70 2.02 -1.26 -1.83 118.70 122.94 2wyo s GLU 490 Ca 0.12 1.12 -0.34 0.00 0.02 0.00 0.00 54.97 55.89 2wyo s GLU 490 Cb -0.21 -3.68 0.04 0.00 0.10 0.00 0.00 34.13 30.38 2wyo s GLU 490 CO -0.06 -0.71 0.69 0.54 0.02 0.00 0.00 175.26 175.73 2wyo n ARG 491 N 6.46 -0.33 -1.85 1.61 5.12 -1.26 -4.85 116.66 121.55 2wyo n ARG 491 Ca 0.10 0.11 -0.03 0.00 -1.93 0.00 0.00 57.85 56.10 2wyo n ARG 491 Cb 0.47 -2.68 0.04 0.00 -1.16 0.00 0.00 32.46 29.14 2wyo n ARG 491 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2wyo n ASN 492 N -2.20 -1.00 -3.66 0.55 5.15 -1.08 -4.91 115.26 108.11 2wyo n ASN 492 Ca -0.11 -1.79 -0.20 0.00 -0.60 0.00 0.00 54.58 51.88 2wyo n ASN 492 Cb 0.57 0.42 -0.17 0.00 -0.53 0.00 0.00 39.78 40.06 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 0.06 -0.04 -0.00 1.20 1.75 -0.53 -2.61 119.30 119.13 2wyo s MET 493 Ca 0.04 0.36 0.02 0.00 -1.25 0.00 0.00 55.69 54.87 2wyo s MET 493 Cb 0.22 -0.61 -0.03 0.00 2.84 0.00 0.00 34.83 37.25 2wyo s MET 493 CO -0.06 -0.36 -0.04 0.00 -0.65 0.00 0.00 175.02 173.90 2wyo s SER 495 N -1.46 3.88 -0.34 0.00 0.01 -1.26 -2.00 113.70 112.53 2wyo s SER 495 Ca 0.18 -0.64 -0.00 0.00 1.31 0.00 0.00 55.95 56.80 2wyo s SER 495 Cb -0.11 -0.52 0.11 0.00 0.21 0.00 0.00 66.02 65.71 2wyo s SER 495 CO 0.08 0.14 0.14 -0.70 0.41 0.00 0.00 173.24 173.31 2wyo s GLU 496 N -2.46 0.77 -0.06 12.44 2.12 0.11 -4.66 118.70 126.96 2wyo s GLU 496 Ca 0.20 -1.23 -0.30 0.00 0.36 0.00 0.00 54.97 54.01 2wyo s GLU 496 Cb -0.09 -1.93 -0.03 0.00 0.26 0.00 0.00 34.13 32.33 2wyo s GLU 496 CO 0.11 -1.04 1.21 0.08 -0.54 0.00 0.00 175.26 175.08 2wyo s VAL 497 N 1.37 4.25 -0.33 3.70 1.01 -0.68 -2.74 120.40 126.99 2wyo s VAL 497 Ca 0.12 1.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.64 2wyo s VAL 497 Cb -0.19 -4.01 0.06 0.00 0.00 0.00 0.00 36.38 32.24 2wyo s VAL 497 CO -0.19 -0.01 0.06 -0.83 0.00 0.00 0.00 175.10 174.13 2wyo s GLY 498 N 1.51 1.82 -0.21 4.51 0.00 0.21 -0.47 107.32 114.69 2wyo s GLY 498 Ca 0.56 -1.88 -0.22 0.00 0.00 0.00 0.00 44.72 43.18 2wyo s GLY 498 CO 0.22 0.77 0.70 -0.42 0.00 0.00 0.00 173.10 174.37 2wyo s ILE 499 N 1.28 4.96 0.52 0.90 -1.09 -0.23 -0.20 121.20 127.34 2wyo s ILE 499 Ca -0.02 1.33 -0.13 0.00 -2.23 0.00 0.00 60.65 59.60 2wyo s ILE 499 Cb -0.20 -4.01 -0.06 0.00 -1.58 0.00 0.00 42.46 36.61 2wyo s ILE 499 CO -0.00 0.06 0.95 -0.36 -1.23 0.00 0.00 174.94 174.35 2wyo s PHE 500 N 2.17 3.52 0.03 3.97 0.08 -0.45 -1.47 117.98 125.82 2wyo s PHE 500 Ca 0.31 1.29 -0.10 0.00 0.12 0.00 0.00 56.93 58.56 2wyo s PHE 500 Cb -0.16 -2.67 0.01 0.00 -0.57 0.00 0.00 43.02 39.62 2wyo s PHE 500 CO 0.10 -0.41 0.20 0.20 -0.10 0.00 0.00 175.22 175.21 2wyo s GLY 501 N -3.49 0.02 0.07 4.36 0.00 -0.25 -1.40 107.32 106.63 2wyo s GLY 501 Ca 0.56 -0.19 0.07 0.00 0.00 0.00 0.00 44.72 45.16 2wyo s GLY 501 CO 0.39 -0.36 -0.18 -1.34 0.00 0.00 0.00 173.10 171.61 2wyo s VAL 502 N -2.19 1.49 -0.06 1.40 -7.23 -1.00 -0.72 120.40 112.09 2wyo s VAL 502 Ca -0.08 -1.31 -0.12 0.00 -1.81 0.00 0.00 61.98 58.66 2wyo s VAL 502 Cb -0.03 -1.34 0.02 0.00 0.56 0.00 0.00 36.38 35.59 2wyo s VAL 502 CO -0.02 -0.01 0.28 -0.51 -0.31 0.00 0.00 175.10 174.53 2wyo s ILE 503 N -1.03 0.03 -0.04 -0.62 2.07 0.26 -3.18 121.20 118.70 2wyo s ILE 503 Ca 0.04 -0.28 -0.02 0.00 -1.41 0.00 0.00 60.65 58.99 2wyo s ILE 503 Cb -0.09 -0.50 0.03 0.00 0.13 0.00 0.00 42.46 42.03 2wyo s ILE 503 CO 0.03 -0.15 0.05 -0.22 -1.91 0.00 0.00 174.94 172.73 2wyo s LEU 504 N -0.64 0.33 0.06 8.50 2.96 -0.86 0.15 118.68 129.19 2wyo s LEU 504 Ca -0.07 0.07 -0.09 0.00 -0.22 0.00 0.00 54.13 53.81 2wyo s LEU 504 Cb -0.04 -0.14 0.00 0.00 0.50 0.00 0.00 46.19 46.52 2wyo s LEU 504 CO 0.02 -0.22 0.20 -0.94 -1.32 0.00 0.00 176.35 174.09 2wyo s SER 505 N 1.95 0.06 0.00 3.68 1.04 -0.87 -0.56 113.70 119.00 2wyo s SER 505 Ca 0.02 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.96 2wyo s SER 505 Cb -0.12 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2wyo s SER 505 CO -0.03 -0.65 0.00 0.00 0.98 0.00 0.00 173.24 173.54 2wyo n ALA 506 N 0.31 0.00 -0.83 5.32 0.00 0.26 -1.22 120.51 124.36 2wyo n ALA 506 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.95 2wyo n ALA 506 Cb 0.61 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.21 2wyo n ALA 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wyo s ALA 507 N -2.00 1.58 0.24 0.00 0.00 -1.26 -4.88 121.76 115.45 2wyo s ALA 507 Ca 0.00 0.69 -0.05 0.00 0.00 0.00 0.00 51.96 52.61 2wyo s ALA 507 Cb 0.00 -3.47 0.38 0.00 0.00 0.00 0.00 23.12 20.03 2wyo s ALA 507 CO 0.00 -2.63 1.81 0.87 0.00 0.00 0.00 175.76 175.82 2wyo h LYS 508 N -1.56 0.78 -0.36 0.00 1.57 -1.95 -2.50 116.57 112.55 2wyo h LYS 508 Ca -0.44 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.25 2wyo h LYS 508 Cb 1.28 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.39 2wyo h LYS 508 CO 0.43 0.52 0.02 0.41 -0.57 0.00 0.00 179.45 180.26 2wyo n GLY 509 N -1.32 3.95 3.94 3.86 0.00 -1.26 -4.75 105.19 109.61 2wyo n GLY 509 Ca 0.13 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.75 3.52 -0.21 1.61 1.04 -0.94 -4.97 113.70 112.00 2wyo s SER 510 Ca 0.46 0.26 0.09 0.00 0.48 0.00 0.00 55.95 57.23 2wyo s SER 510 Cb 0.37 -0.43 -0.19 0.00 0.10 0.00 0.00 66.02 65.87 2wyo s SER 510 CO 0.09 -2.47 -0.07 -0.24 0.98 0.00 0.00 173.24 171.53 2wyo n SER 511 N -3.55 1.29 -4.59 7.02 2.88 -1.26 -3.47 113.62 111.94 2wyo n SER 511 Ca 0.14 -0.06 -0.46 0.00 -1.33 0.00 0.00 58.87 57.15 2wyo n SER 511 Cb 0.60 0.28 -0.03 0.00 -0.75 0.00 0.00 64.21 64.32 2wyo n SER 511 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 2wyo n VAL 512 N -2.94 1.48 0.00 2.46 3.14 -1.26 -4.17 118.33 117.04 2wyo n VAL 512 Ca -0.36 -0.37 0.00 0.00 -2.96 0.00 0.00 64.34 60.65 2wyo n VAL 512 Cb 1.03 -0.96 0.00 0.00 -1.06 0.00 0.00 33.84 32.85 2wyo n VAL 512 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wyo n GLY 513 N 1.62 1.42 3.74 7.55 0.00 -1.23 -3.70 105.19 114.59 2wyo n GLY 513 Ca 0.12 -2.13 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 2wyo n GLY 513 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wyo s THR 514 N -1.62 4.36 -1.48 2.61 -4.23 -0.48 -3.82 115.64 110.97 2wyo s THR 514 Ca 0.00 2.01 -0.11 0.00 -1.18 0.00 0.00 61.69 62.41 2wyo s THR 514 Cb 0.00 -4.29 0.07 0.00 1.34 0.00 0.00 72.50 69.61 2wyo s THR 514 CO 0.00 0.40 0.96 0.59 -0.54 0.00 0.00 174.62 176.04 2wyo n ASN 515 N 2.23 -4.41 0.00 3.99 4.13 -1.26 -2.10 115.26 117.83 2wyo n ASN 515 Ca -0.00 -0.76 0.00 0.00 1.68 0.00 0.00 54.58 55.50 2wyo n ASN 515 Cb 0.48 -4.03 0.00 0.00 -1.54 0.00 0.00 39.78 34.69 2wyo n ASN 515 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wyo n GLY 516 N -1.71 2.95 3.80 7.41 0.00 -1.25 -5.01 105.19 111.39 2wyo n GLY 516 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2wyo n GLY 516 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wyo s SER 517 N -2.93 6.37 0.00 1.61 1.04 -0.89 -4.33 113.70 114.57 2wyo s SER 517 Ca 0.00 1.90 0.00 0.00 0.48 0.00 0.00 55.95 58.33 2wyo s SER 517 Cb 0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.56 2wyo s SER 517 CO 0.00 -0.76 0.45 -1.54 0.98 0.00 0.00 173.24 172.37 2wyo n SER 518 N -0.98 0.11 -4.24 7.02 3.41 -1.23 -3.47 113.62 114.25 2wyo n SER 518 Ca 0.09 -1.01 -0.35 0.00 -0.26 0.00 0.00 58.87 57.34 2wyo n SER 518 Cb 0.53 -0.06 -0.14 0.00 -0.26 0.00 0.00 64.21 64.28 2wyo n SER 518 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2wyo s VAL 519 N -1.77 3.07 0.01 -3.33 1.01 -1.24 0.92 120.40 119.06 2wyo s VAL 519 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 60.97 2wyo s VAL 519 Cb 0.00 -2.49 -0.31 0.00 0.00 0.00 0.00 36.38 33.58 2wyo s VAL 519 CO 0.00 0.28 1.01 -0.07 0.00 0.00 0.00 175.10 176.32 2wyo h LEU 520 N 8.06 0.70 -7.16 3.92 4.07 -1.09 -1.28 115.31 122.52 2wyo h LEU 520 Ca -0.36 -0.88 -0.05 0.00 0.08 0.00 0.00 57.88 56.67 2wyo h LEU 520 Cb 1.13 -0.22 -0.14 0.00 1.08 0.00 0.00 40.66 42.50 2wyo h LEU 520 CO 0.59 1.52 0.08 0.72 -1.08 0.00 0.00 178.44 180.27 2wyo s PHE 521 N -2.73 -0.43 -0.32 1.13 -0.12 -1.05 -4.64 117.98 109.83 2wyo s PHE 521 Ca -0.11 0.34 0.06 0.00 -0.05 0.00 0.00 56.93 57.17 2wyo s PHE 521 Cb 0.03 0.40 0.19 0.00 -0.63 0.00 0.00 43.02 43.01 2wyo s PHE 521 CO 0.89 -0.72 0.58 1.21 -0.05 0.00 0.00 175.22 177.13 2wyo s ASN 522 N -2.35 -1.42 0.15 1.98 3.84 -1.26 -2.03 114.94 113.85 2wyo s ASN 522 Ca -0.02 -0.10 0.06 0.00 0.21 0.00 0.00 52.86 53.01 2wyo s ASN 522 Cb -0.00 1.93 -0.04 0.00 -0.55 0.00 0.00 41.25 42.58 2wyo s ASN 522 CO -0.07 -0.27 -0.14 0.42 -2.79 0.00 0.00 177.10 174.25 2wyo s THR 523 N 2.57 1.44 0.31 -5.21 -4.23 -1.19 -4.87 115.64 104.45 2wyo s THR 523 Ca 0.11 -1.92 -0.30 0.00 -1.18 0.00 0.00 61.69 58.41 2wyo s THR 523 Cb -0.09 -1.74 -0.11 0.00 1.34 0.00 0.00 72.50 71.90 2wyo s THR 523 CO -0.22 -0.51 1.59 0.12 -0.54 0.00 0.00 174.62 175.06 2wyo s PHE 524 N -2.55 2.70 -0.33 3.99 5.36 -1.26 -2.39 117.98 123.50 2wyo s PHE 524 Ca 0.14 0.82 0.06 0.00 -0.96 0.00 0.00 56.93 56.99 2wyo s PHE 524 Cb -0.03 -4.09 0.45 0.00 -0.34 0.00 0.00 43.02 39.02 2wyo s PHE 524 CO 0.04 -3.59 1.18 0.00 -1.46 0.00 0.00 175.22 171.39 2wyo n ALA 525 N 1.90 5.04 -0.15 11.12 0.00 -0.49 -4.87 120.51 133.07 2wyo n ALA 525 Ca 0.07 -3.93 0.00 0.00 0.00 0.00 0.00 53.44 49.58 2wyo n ALA 525 Cb 0.37 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 -0.65 -1.13 3.58 0.00 0.00 -1.26 -3.17 105.19 102.56 2wyo n GLY 526 Ca 0.43 -1.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.35 0.05 1.61 -0.85 -1.26 -1.34 117.35 115.21 2wyo s TYR 527 Ca 0.00 0.10 -0.01 0.00 -0.52 0.00 0.00 57.07 56.64 2wyo s TYR 527 Cb 0.00 0.60 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 2wyo s TYR 527 CO 0.00 -0.83 -0.03 -0.08 -1.52 0.00 0.00 175.55 173.08 2wyo s THR 528 N -3.53 0.25 -0.04 -3.49 -1.32 0.72 -4.66 115.64 103.57 2wyo s THR 528 Ca 0.06 -1.72 0.03 0.00 -1.21 0.00 0.00 61.69 58.85 2wyo s THR 528 Cb -0.02 -1.39 0.00 0.00 -1.51 0.00 0.00 72.50 69.58 2wyo s THR 528 CO -0.06 -0.93 -0.11 -0.69 -2.21 0.00 0.00 174.62 170.62 2wyo s VAL 529 N -3.61 0.99 -0.07 5.08 1.01 -1.25 0.66 120.40 123.22 2wyo s VAL 529 Ca 0.05 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.62 2wyo s VAL 529 Cb 0.06 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.56 2wyo s VAL 529 CO -0.08 0.30 -0.20 -0.13 0.00 0.00 0.00 175.10 174.98 2wyo s ARG 530 N 0.28 2.39 0.21 2.72 0.52 -1.11 -1.37 118.95 122.60 2wyo s ARG 530 Ca -0.06 -0.74 0.07 0.00 -0.52 0.00 0.00 55.73 54.49 2wyo s ARG 530 Cb -0.11 -1.93 -0.05 0.00 0.52 0.00 0.00 34.95 33.38 2wyo s ARG 530 CO 0.01 0.21 -0.12 -1.12 0.02 0.00 0.00 175.30 174.31 2wyo s SER 531 N 0.21 2.50 -0.07 0.23 0.01 -0.40 0.09 113.70 116.27 2wyo s SER 531 Ca -0.11 -1.06 -0.30 0.00 1.31 0.00 0.00 55.95 55.79 2wyo s SER 531 Cb -0.15 -0.12 0.09 0.00 0.21 0.00 0.00 66.02 66.05 2wyo s SER 531 CO 0.05 -0.23 0.79 -0.75 0.41 0.00 0.00 173.24 173.51 2wyo s LYS 532 N -3.68 0.90 0.27 12.44 2.20 -0.85 -0.06 119.74 130.97 2wyo s LYS 532 Ca 0.24 0.13 -0.30 0.00 -0.36 0.00 0.00 55.97 55.68 2wyo s LYS 532 Cb 0.01 0.42 -0.10 0.00 -1.51 0.00 0.00 37.83 36.65 2wyo s LYS 532 CO 0.07 -0.30 1.48 -2.14 -0.36 0.00 0.00 175.35 174.10 2wyo s PRO 533 N -1.47 4.22 0.13 4.03 0.02 -1.26 -1.86 135.00 138.81 2wyo s PRO 533 Ca -0.06 2.39 -0.16 0.00 0.02 0.00 0.00 61.00 63.19 2wyo s PRO 533 Cb -0.00 -3.07 -0.01 0.00 0.02 0.00 0.00 34.50 31.43 2wyo s PRO 533 CO 0.04 -0.48 1.67 0.00 -0.33 0.00 0.00 177.00 177.91 2wyo h ALA 534 N 4.77 0.49 0.00 -1.55 0.00 -1.84 -1.43 119.26 119.71 2wyo h ALA 534 Ca -0.47 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2wyo h ALA 534 Cb 1.22 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2wyo h ALA 534 CO 0.77 0.09 0.00 -0.40 0.00 0.00 0.00 179.25 179.71 2wyo n ASP 535 N -4.66 0.00 -4.75 0.00 3.85 -1.26 -4.86 116.55 104.86 2wyo n ASP 535 Ca -0.01 0.04 -0.30 0.00 -0.71 0.00 0.00 54.79 53.81 2wyo n ASP 535 Cb 0.14 -0.21 0.11 0.00 -1.35 0.00 0.00 41.12 39.82 2wyo n ASP 535 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2wyo s ALA 536 N -2.41 1.96 0.67 2.12 0.00 -0.54 -5.04 121.76 118.51 2wyo s ALA 536 Ca 0.09 0.13 -0.11 0.00 0.00 0.00 0.00 51.96 52.07 2wyo s ALA 536 Cb 0.06 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 2wyo s ALA 536 CO 0.12 -2.02 1.06 -0.51 0.00 0.00 0.00 175.76 174.42 2wyo s ASP 537 N -3.40 5.80 0.42 0.00 1.11 -1.26 -4.97 116.67 114.36 2wyo s ASP 537 Ca 0.62 1.30 -0.24 0.00 0.18 0.00 0.00 52.55 54.41 2wyo s ASP 537 Cb -0.17 -2.23 -0.11 0.00 1.07 0.00 0.00 42.92 41.48 2wyo s ASP 537 CO 0.56 -1.14 1.01 0.47 1.18 0.00 0.00 175.17 177.26 2wyo n ASP 538 N -2.90 1.26 0.00 0.27 8.00 -1.26 -4.90 116.55 117.02 2wyo n ASP 538 Ca 0.06 1.03 0.00 0.00 0.71 0.00 0.00 54.79 56.60 2wyo n ASP 538 Cb 0.55 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 2wyo n ASP 538 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wyo n GLY 539 N 1.18 -1.82 0.00 0.44 0.00 -1.26 -5.00 105.19 98.74 2wyo n GLY 539 Ca 0.09 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 0.00 0.77 0.26 -0.02 0.00 -1.26 -4.54 105.19 100.41 2wyo n GLY 540 Ca 0.00 -1.90 -0.08 0.00 0.00 0.00 0.00 46.02 44.03 2wyo n GLY 540 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wyo h VAL 541 N -0.17 1.24 -0.77 1.61 2.07 -1.93 -2.68 116.25 115.63 2wyo h VAL 541 Ca 0.00 -0.87 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 2wyo h VAL 541 Cb 0.00 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2wyo h VAL 541 CO 0.00 0.32 0.36 0.24 0.02 0.00 0.00 177.57 178.51 2wyo h MET 542 N 0.78 1.11 -0.03 1.57 2.86 -1.95 -0.62 114.93 118.64 2wyo h MET 542 Ca 0.17 -0.17 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2wyo h MET 542 Cb 0.33 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2wyo h MET 542 CO 0.00 0.87 0.16 0.00 1.06 0.00 0.00 176.91 179.00 2wyo h ALA 543 N 1.18 1.27 0.00 6.32 0.00 -1.89 -3.45 119.26 122.69 2wyo h ALA 543 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2wyo h ALA 543 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2wyo h ALA 543 CO -0.03 -0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.45 2wyo n GLY 544 N -1.19 0.72 0.02 0.00 0.00 -0.24 -4.95 105.19 99.55 2wyo n GLY 544 Ca -0.02 -0.33 0.02 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.49 0.23 -4.11 1.61 0.31 -1.08 -5.04 118.33 107.76 2wyo n VAL 545 Ca 0.00 -0.31 -0.23 0.00 -0.01 0.00 0.00 64.34 63.79 2wyo n VAL 545 Cb 0.00 -0.08 -0.06 0.00 -0.91 0.00 0.00 33.84 32.79 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 -2.59 3.47 0.27 3.52 0.00 -1.03 -4.50 121.76 120.91 2wyo s ALA 546 Ca -0.04 -1.75 0.11 0.00 0.00 0.00 0.00 51.96 50.28 2wyo s ALA 546 Cb 0.06 -0.82 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 2wyo s ALA 546 CO 0.44 0.09 -0.19 0.00 0.00 0.00 0.00 175.76 176.11 2wyo s ALA 547 N -2.37 2.66 0.53 0.00 0.00 0.92 -4.39 121.76 119.11 2wyo s ALA 547 Ca 0.36 -1.86 -0.05 0.00 0.00 0.00 0.00 51.96 50.41 2wyo s ALA 547 Cb -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 2wyo s ALA 547 CO 0.23 0.24 0.83 -0.51 0.00 0.00 0.00 175.76 176.55 2wyo s LEU 548 N -3.49 3.43 0.00 0.00 1.43 0.20 -1.28 118.68 118.97 2wyo s LEU 548 Ca 0.29 0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 54.08 2wyo s LEU 548 Cb -0.04 -3.64 0.03 0.00 0.03 0.00 0.00 46.19 42.56 2wyo s LEU 548 CO 0.14 -0.84 0.37 -0.67 0.23 0.00 0.00 176.35 175.58 2wyo n ASP 549 N -2.41 -0.89 -3.63 2.29 -0.08 -0.47 -1.12 116.55 110.24 2wyo n ASP 549 Ca 0.03 -1.57 -0.15 0.00 -1.51 0.00 0.00 54.79 51.59 2wyo n ASP 549 Cb 0.57 1.46 -0.07 0.00 2.34 0.00 0.00 41.12 45.42 2wyo n ASP 549 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2wyo s SER 550 N -1.92 -0.64 0.45 1.67 0.15 -1.26 -3.79 113.70 108.36 2wyo s SER 550 Ca 0.08 1.07 -0.18 0.00 0.70 0.00 0.00 55.95 57.61 2wyo s SER 550 Cb -0.02 1.05 -0.09 0.00 -1.71 0.00 0.00 66.02 65.25 2wyo s SER 550 CO 0.04 -0.34 0.93 -0.76 1.20 0.00 0.00 173.24 174.31 2wyo s LEU 551 N -0.18 3.82 -0.10 3.45 2.01 -1.26 0.66 118.68 127.09 2wyo s LEU 551 Ca -0.04 1.57 -0.01 0.00 0.01 0.00 0.00 54.13 55.66 2wyo s LEU 551 Cb -0.03 -4.45 0.03 0.00 0.01 0.00 0.00 46.19 41.75 2wyo s LEU 551 CO 0.04 -0.43 -0.06 0.00 1.01 0.00 0.00 176.35 176.91 2wyo s ALA 552 N -2.34 1.15 -0.22 4.21 0.00 0.14 -3.48 121.76 121.22 2wyo s ALA 552 Ca 0.59 -0.43 -0.14 0.00 0.00 0.00 0.00 51.96 51.99 2wyo s ALA 552 Cb -0.10 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 2wyo s ALA 552 CO 0.22 -0.42 0.32 0.08 0.00 0.00 0.00 175.76 175.96 2wyo s VAL 553 N 1.76 5.25 -0.24 0.00 1.01 -0.51 -1.99 120.40 125.68 2wyo s VAL 553 Ca 0.05 0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.52 2wyo s VAL 553 Cb -0.13 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.63 2wyo s VAL 553 CO -0.07 0.27 -0.07 0.68 0.00 0.00 0.00 175.10 175.92 2wyo s VAL 554 N 1.31 2.90 -0.92 2.92 -7.23 0.73 -2.63 120.40 117.47 2wyo s VAL 554 Ca 0.15 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 2wyo s VAL 554 Cb -0.14 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2wyo s VAL 554 CO 0.07 0.24 0.23 -2.65 -0.31 0.00 0.00 175.10 172.68