#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ith n ILE 2 N 0.00 2.27 -1.67 4.25 5.41 -1.26 -3.49 119.36 124.87 3ith n ILE 2 Ca 0.00 -5.17 -0.48 0.00 1.00 0.00 0.00 62.75 58.09 3ith n ILE 2 Cb 0.00 -2.12 -0.05 0.00 -0.71 0.00 0.00 39.64 36.77 3ith n ILE 2 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3ith n SER 3 N 1.03 3.00 -4.53 4.38 2.88 -1.22 -4.79 113.62 114.37 3ith n SER 3 Ca 0.28 1.05 -0.15 0.00 -1.33 0.00 0.00 58.87 58.73 3ith n SER 3 Cb 0.40 -1.36 -0.11 0.00 -0.75 0.00 0.00 64.21 62.39 3ith n SER 3 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3ith n PRO 4 N 4.52 0.37 -4.38 -1.46 -0.02 -1.26 -4.69 135.00 128.07 3ith n PRO 4 Ca 0.20 -0.73 -0.22 0.00 -2.02 0.00 0.00 63.50 60.72 3ith n PRO 4 Cb 0.27 -3.03 -0.13 0.00 -0.02 0.00 0.00 33.50 30.58 3ith n PRO 4 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3ith s ILE 5 N 11.35 1.44 0.15 4.25 1.01 -1.26 -5.11 121.20 133.02 3ith s ILE 5 Ca 0.97 -1.26 -0.31 0.00 0.00 0.00 0.00 60.65 60.05 3ith s ILE 5 Cb -0.28 -1.30 -0.10 0.00 0.01 0.00 0.00 42.46 40.79 3ith s ILE 5 CO 0.20 0.00 1.69 -1.61 0.00 0.00 0.00 174.94 175.22 3ith s GLU 6 N -1.47 4.17 -0.06 2.79 0.41 -1.26 -4.84 118.70 118.44 3ith s GLU 6 Ca 0.04 2.48 -0.29 0.00 -0.41 0.00 0.00 54.97 56.79 3ith s GLU 6 Cb -0.09 -3.33 -0.07 0.00 -1.78 0.00 0.00 34.13 28.85 3ith s GLU 6 CO 0.02 -0.73 2.06 0.95 -0.49 0.00 0.00 175.26 177.08 3ith s THR 7 N 1.85 3.02 -0.21 3.63 -4.23 -1.26 -4.91 115.64 113.51 3ith s THR 7 Ca 0.75 0.02 -0.29 0.00 -1.18 0.00 0.00 61.69 60.99 3ith s THR 7 Cb -0.45 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.34 3ith s THR 7 CO 0.33 -0.00 1.86 -0.69 -0.54 0.00 0.00 174.62 175.57 3ith s VAL 8 N 5.91 3.38 0.58 2.29 1.01 -1.26 -4.88 120.40 127.42 3ith s VAL 8 Ca 0.93 0.41 -0.20 0.00 0.00 0.00 0.00 61.98 63.12 3ith s VAL 8 Cb -0.39 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 3ith s VAL 8 CO 0.39 -0.21 1.26 -2.16 0.00 0.00 0.00 175.10 174.38 3ith s PRO 9 N 5.31 3.01 -0.05 2.72 0.04 -1.26 -4.41 135.00 140.36 3ith s PRO 9 Ca 0.83 1.97 -0.08 0.00 0.04 0.00 0.00 61.00 63.76 3ith s PRO 9 Cb -0.29 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.22 3ith s PRO 9 CO 0.33 -1.21 0.21 0.54 0.04 0.00 0.00 177.00 176.91 3ith s VAL 10 N -1.47 0.03 -0.04 -0.36 0.11 -1.26 -5.07 120.40 112.34 3ith s VAL 10 Ca 0.76 -0.25 -0.02 0.00 -2.93 0.00 0.00 61.98 59.54 3ith s VAL 10 Cb -0.34 -0.38 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 3ith s VAL 10 CO 0.38 -0.14 0.05 -0.54 -3.33 0.00 0.00 175.10 171.52 3ith s LYS 11 N -0.48 -0.03 1.02 1.54 1.02 -1.26 -4.77 119.74 116.78 3ith s LYS 11 Ca -0.06 0.33 -0.22 0.00 0.02 0.00 0.00 55.97 56.05 3ith s LYS 11 Cb -0.04 -0.50 -0.10 0.00 -0.52 0.00 0.00 37.83 36.67 3ith s LYS 11 CO 0.01 -0.30 -0.85 1.28 -0.92 0.00 0.00 175.35 174.57 3ith n LEU 12 N 5.12 -3.36 -4.62 3.17 4.77 -1.26 -4.89 117.00 115.92 3ith n LEU 12 Ca -0.07 0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.61 3ith n LEU 12 Cb 0.50 -0.73 0.09 0.00 -2.33 0.00 0.00 43.42 40.95 3ith n LEU 12 CO 0.09 -3.66 0.56 0.29 -1.33 0.00 0.00 177.39 173.34 3ith n LYS 13 N 1.14 0.49 -2.54 3.23 5.02 -1.14 -4.95 118.16 119.42 3ith n LYS 13 Ca -0.01 0.23 -0.38 0.00 -2.02 0.00 0.00 58.31 56.13 3ith n LYS 13 Cb 0.66 -2.25 -0.04 0.00 -0.02 0.00 0.00 35.03 33.38 3ith n LYS 13 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3ith s PRO 14 N -3.40 4.39 0.00 1.97 0.04 -1.26 -3.04 135.00 133.70 3ith s PRO 14 Ca 0.73 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.39 3ith s PRO 14 Cb -0.34 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.37 3ith s PRO 14 CO 0.50 0.04 0.00 0.41 0.04 0.00 0.00 177.00 177.99 3ith n GLY 15 N 0.73 2.67 3.88 0.56 0.00 -1.26 -5.03 105.19 106.74 3ith n GLY 15 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 3ith n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ith s MET 16 N -0.36 3.39 0.24 1.61 -1.94 -1.17 -5.11 119.30 115.95 3ith s MET 16 Ca 0.00 -0.31 0.04 0.00 -1.71 0.00 0.00 55.69 53.71 3ith s MET 16 Cb 0.00 -3.08 -0.03 0.00 2.01 0.00 0.00 34.83 33.73 3ith s MET 16 CO 0.00 0.69 0.36 0.34 -0.01 0.00 0.00 175.02 176.40 3ith s ASP 17 N -1.74 6.32 1.09 3.03 2.15 -1.26 -4.85 116.67 121.41 3ith s ASP 17 Ca 0.24 0.11 -0.14 0.00 0.43 0.00 0.00 52.55 53.19 3ith s ASP 17 Cb -0.12 -1.88 0.23 0.00 -0.30 0.00 0.00 42.92 40.85 3ith s ASP 17 CO 0.15 -0.07 1.08 -0.83 -0.17 0.00 0.00 175.17 175.34 3ith s GLY 18 N -3.89 1.56 0.67 2.66 0.00 -1.26 -4.98 107.32 102.08 3ith s GLY 18 Ca 0.34 -0.51 -0.16 0.00 0.00 0.00 0.00 44.72 44.39 3ith s GLY 18 CO 0.29 0.20 1.17 2.56 0.00 0.00 0.00 173.10 177.32 3ith s PRO 19 N -5.02 2.56 -0.35 2.90 0.04 -1.26 -4.98 135.00 128.90 3ith s PRO 19 Ca 0.67 1.65 0.15 0.00 0.04 0.00 0.00 61.00 63.51 3ith s PRO 19 Cb -0.17 -1.90 0.43 0.00 0.04 0.00 0.00 34.50 32.91 3ith s PRO 19 CO 0.58 -1.48 1.20 1.63 0.04 0.00 0.00 177.00 178.97 3ith n LYS 20 N -2.34 1.26 -2.87 4.56 5.02 -1.23 -2.53 118.16 120.04 3ith n LYS 20 Ca 0.12 -2.48 -0.42 0.00 -2.02 0.00 0.00 58.31 53.52 3ith n LYS 20 Cb 0.51 -0.62 -0.04 0.00 -0.02 0.00 0.00 35.03 34.86 3ith n LYS 20 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ith s VAL 21 N -1.52 4.86 0.72 -0.18 1.01 -0.98 -4.85 120.40 119.47 3ith s VAL 21 Ca 0.23 1.67 -0.16 0.00 0.00 0.00 0.00 61.98 63.72 3ith s VAL 21 Cb 0.42 -4.15 0.03 0.00 0.00 0.00 0.00 36.38 32.68 3ith s VAL 21 CO -0.04 0.00 1.25 -0.54 0.00 0.00 0.00 175.10 175.77 3ith s LYS 22 N 2.29 2.10 -0.15 2.72 1.02 -1.26 -4.08 119.74 122.38 3ith s LYS 22 Ca 0.39 1.92 -0.15 0.00 0.02 0.00 0.00 55.97 58.14 3ith s LYS 22 Cb -0.16 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.29 3ith s LYS 22 CO 0.12 -1.90 0.36 -1.14 -0.92 0.00 0.00 175.35 171.87 3ith s GLN 23 N -3.74 4.28 0.46 1.68 2.00 -1.26 -4.60 119.66 118.48 3ith s GLN 23 Ca 0.78 0.22 -0.21 0.00 -2.00 0.00 0.00 55.36 54.15 3ith s GLN 23 Cb -0.33 -3.44 -0.09 0.00 0.80 0.00 0.00 33.01 29.95 3ith s GLN 23 CO 0.45 0.19 1.04 -1.58 -0.50 0.00 0.00 175.29 174.89 3ith s TRP 24 N 0.58 3.07 0.43 1.67 0.51 -1.26 -5.01 118.94 118.92 3ith s TRP 24 Ca 0.20 1.59 -0.24 0.00 -2.12 0.00 0.00 56.10 55.53 3ith s TRP 24 Cb -0.14 -3.09 -0.08 0.00 -0.81 0.00 0.00 33.47 29.36 3ith s TRP 24 CO 0.06 -0.79 1.19 -1.25 -0.51 0.00 0.00 176.95 175.65 3ith s PRO 25 N -3.02 3.89 0.24 4.98 0.04 -1.26 -4.92 135.00 134.94 3ith s PRO 25 Ca 0.65 1.85 0.11 0.00 0.04 0.00 0.00 61.00 63.65 3ith s PRO 25 Cb -0.18 -2.55 -0.05 0.00 0.04 0.00 0.00 34.50 31.76 3ith s PRO 25 CO 0.22 -0.47 -0.19 -0.51 0.04 0.00 0.00 177.00 176.10 3ith s LEU 26 N -2.76 2.62 0.80 -3.56 1.43 -1.26 -5.13 118.68 110.82 3ith s LEU 26 Ca 0.60 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.69 3ith s LEU 26 Cb -0.31 -1.22 0.07 0.00 0.03 0.00 0.00 46.19 44.76 3ith s LEU 26 CO 0.38 0.07 1.09 0.42 0.23 0.00 0.00 176.35 178.54 3ith s THR 27 N -2.14 3.16 0.12 5.49 -4.23 -1.26 -4.83 115.64 111.96 3ith s THR 27 Ca 0.26 0.38 -0.15 0.00 -1.18 0.00 0.00 61.69 61.00 3ith s THR 27 Cb -0.06 -3.02 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 3ith s THR 27 CO 0.14 -0.49 1.57 -0.08 -0.54 0.00 0.00 174.62 175.22 3ith h GLU 28 N -1.15 0.70 -1.02 3.99 4.81 -2.00 -1.77 114.58 118.15 3ith h GLU 28 Ca -0.47 -0.22 0.25 0.00 -0.13 0.00 0.00 59.36 58.80 3ith h GLU 28 Cb 1.26 -0.07 -0.12 0.00 0.63 0.00 0.00 28.75 30.46 3ith h GLU 28 CO 0.57 0.79 0.62 1.49 -0.73 0.00 0.00 179.01 181.74 3ith h GLU 29 N 0.53 0.52 0.06 1.92 4.81 -2.01 -1.54 114.58 118.87 3ith h GLU 29 Ca 0.11 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.12 3ith h GLU 29 Cb 0.47 -0.12 0.02 0.00 0.63 0.00 0.00 28.75 29.75 3ith h GLU 29 CO 0.02 0.34 -0.79 0.87 -0.73 0.00 0.00 179.01 178.72 3ith h LYS 30 N 0.53 0.43 -0.82 1.92 1.57 -1.71 -3.00 116.57 115.48 3ith h LYS 30 Ca 0.63 -0.54 0.06 0.00 -1.87 0.00 0.00 60.65 58.93 3ith h LYS 30 Cb 1.31 0.17 -0.05 0.00 0.08 0.00 0.00 32.23 33.74 3ith h LYS 30 CO -0.42 1.20 0.54 0.82 -0.57 0.00 0.00 179.45 181.01 3ith h ILE 31 N -0.10 1.04 -0.13 1.86 2.04 -0.72 -0.48 117.51 121.03 3ith h ILE 31 Ca -0.12 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 3ith h ILE 31 Cb 1.53 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3ith h ILE 31 CO 0.15 0.16 0.06 0.11 0.00 0.00 0.00 178.15 178.64 3ith h LYS 32 N 0.90 0.19 -0.54 2.37 1.57 -1.35 -1.88 116.57 117.83 3ith h LYS 32 Ca 0.35 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.18 3ith h LYS 32 Cb 0.23 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 3ith h LYS 32 CO -0.13 0.25 0.21 0.00 -0.57 0.00 0.00 179.45 179.21 3ith h ALA 33 N 0.93 0.68 0.00 3.86 0.00 -1.16 -1.62 119.26 121.94 3ith h ALA 33 Ca 0.05 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ith h ALA 33 Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3ith h ALA 33 CO -0.01 -0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.34 3ith n LEU 34 N -4.98 0.64 -0.00 0.00 4.77 -0.28 -1.79 117.00 115.37 3ith n LEU 34 Ca 0.06 0.62 -0.22 0.00 -0.03 0.00 0.00 56.01 56.45 3ith n LEU 34 Cb 0.21 -0.50 -0.14 0.00 -2.33 0.00 0.00 43.42 40.67 3ith n LEU 34 CO 0.24 -0.42 -0.67 0.58 -1.33 0.00 0.00 177.39 175.80 3ith h VAL 35 N 0.00 0.77 0.12 4.08 2.07 -0.48 -2.82 116.25 119.99 3ith h VAL 35 Ca 0.00 -2.35 -0.00 0.00 0.82 0.00 0.00 66.70 65.17 3ith h VAL 35 Cb 0.47 2.53 -0.00 0.00 -1.52 0.00 0.00 31.29 32.77 3ith h VAL 35 CO 0.00 0.78 -0.08 -0.08 0.02 0.00 0.00 177.57 178.21 3ith h GLU 36 N -0.14 -0.18 -0.98 1.57 4.81 -1.30 -1.47 114.58 116.88 3ith h GLU 36 Ca -0.38 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 58.99 3ith h GLU 36 Cb 1.90 0.04 -0.15 0.00 0.63 0.00 0.00 28.75 31.17 3ith h GLU 36 CO 0.05 -0.12 -0.44 0.82 -0.73 0.00 0.00 179.01 178.59 3ith h ILE 37 N -0.19 0.01 -0.26 2.32 2.04 -1.52 0.55 117.51 120.45 3ith h ILE 37 Ca -0.02 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 3ith h ILE 37 Cb 0.16 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.23 3ith h ILE 37 CO 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 178.15 178.10 3ith h THR 39 N 0.40 1.08 -0.06 0.00 2.02 0.12 0.23 112.91 116.70 3ith h THR 39 Ca 0.08 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 3ith h THR 39 Cb 0.36 0.29 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3ith h THR 39 CO 0.02 0.13 0.02 -0.33 0.37 0.00 0.00 175.52 175.73 3ith h GLU 40 N 0.72 0.09 -0.49 6.66 4.39 -0.83 -2.30 114.58 122.81 3ith h GLU 40 Ca 0.24 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.99 3ith h GLU 40 Cb 0.01 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 3ith h GLU 40 CO -0.09 0.23 0.33 0.52 -1.16 0.00 0.00 179.01 178.84 3ith h MET 41 N -0.08 0.38 0.01 2.33 2.86 -0.56 -0.76 114.93 119.11 3ith h MET 41 Ca 0.02 -0.02 -0.21 0.00 -2.06 0.00 0.00 59.70 57.42 3ith h MET 41 Cb 0.18 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 3ith h MET 41 CO -0.00 0.25 -0.93 1.49 1.06 0.00 0.00 176.91 178.78 3ith h GLU 42 N 0.39 0.27 -0.51 1.72 4.81 -0.34 -1.87 114.58 119.05 3ith h GLU 42 Ca 0.22 -0.30 0.07 0.00 -0.13 0.00 0.00 59.36 59.22 3ith h GLU 42 Cb 0.36 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.77 3ith h GLU 42 CO -0.05 1.02 0.16 -0.22 -0.73 0.00 0.00 179.01 179.19 3ith h LYS 43 N 0.14 0.32 -0.48 1.92 3.64 -0.60 -2.53 116.57 118.98 3ith h LYS 43 Ca -0.06 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3ith h LYS 43 Cb 1.57 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.31 3ith h LYS 43 CO 0.15 0.21 0.00 0.39 -2.27 0.00 0.00 179.45 177.93 3ith n GLU 44 N -5.03 1.72 -0.47 1.90 1.02 -0.75 -4.89 120.64 114.14 3ith n GLU 44 Ca 0.06 -0.79 0.00 0.00 -0.02 0.00 0.00 57.16 56.40 3ith n GLU 44 Cb 0.22 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3ith n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ith n GLY 45 N 0.56 1.31 0.34 0.62 0.00 -0.95 -4.88 105.19 102.19 3ith n GLY 45 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.11 3ith n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ith h LYS 46 N 1.78 0.83 -4.61 1.61 1.57 -1.59 -3.42 116.57 112.74 3ith h LYS 46 Ca 0.00 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.49 3ith h LYS 46 Cb 0.00 -0.19 -0.15 0.00 0.08 0.00 0.00 32.23 31.97 3ith h LYS 46 CO 0.00 0.55 -0.64 0.96 -0.57 0.00 0.00 179.45 179.75 3ith s ILE 47 N -5.73 0.27 0.05 1.86 -4.36 -1.19 -1.23 121.20 110.87 3ith s ILE 47 Ca -0.10 -1.96 0.02 0.00 -0.26 0.00 0.00 60.65 58.35 3ith s ILE 47 Cb 0.18 -2.25 -0.03 0.00 1.25 0.00 0.00 42.46 41.61 3ith s ILE 47 CO 0.77 -0.29 -0.08 -0.44 0.24 0.00 0.00 174.94 175.13 3ith s SER 48 N -3.14 0.94 0.27 4.36 0.01 -0.24 -4.44 113.70 111.46 3ith s SER 48 Ca 0.29 -0.59 -0.29 0.00 1.31 0.00 0.00 55.95 56.67 3ith s SER 48 Cb 0.07 0.03 -0.09 0.00 0.21 0.00 0.00 66.02 66.24 3ith s SER 48 CO 0.06 -0.21 1.13 -0.54 0.41 0.00 0.00 173.24 174.09 3ith s LYS 49 N -1.75 4.60 0.22 12.44 1.02 -1.26 -1.18 119.74 133.83 3ith s LYS 49 Ca -0.08 1.84 0.07 0.00 0.02 0.00 0.00 55.97 57.82 3ith s LYS 49 Cb -0.09 -3.19 -0.05 0.00 -0.52 0.00 0.00 37.83 33.98 3ith s LYS 49 CO 0.00 0.14 -0.11 0.96 -0.92 0.00 0.00 175.35 175.43 3ith s ILE 50 N -0.99 1.60 0.13 2.17 -4.36 -0.91 -4.85 121.20 113.99 3ith s ILE 50 Ca 0.46 -2.16 0.02 0.00 -0.26 0.00 0.00 60.65 58.71 3ith s ILE 50 Cb -0.32 -2.14 0.02 0.00 1.25 0.00 0.00 42.46 41.26 3ith s ILE 50 CO 0.41 -0.52 0.18 0.61 0.24 0.00 0.00 174.94 175.86 3ith n GLY 51 N -0.41 1.73 0.47 6.27 0.00 -1.26 -4.60 105.19 107.38 3ith n GLY 51 Ca -0.07 -2.12 0.03 0.00 0.00 0.00 0.00 46.02 43.85 3ith n GLY 51 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ith n PRO 52 N -1.30 1.57 0.00 1.61 -0.04 -1.26 -3.10 135.00 132.49 3ith n PRO 52 Ca 0.04 -0.72 0.10 0.00 -0.04 0.00 0.00 63.50 62.87 3ith n PRO 52 Cb 0.13 -1.27 0.48 0.00 -0.04 0.00 0.00 33.50 32.80 3ith n PRO 52 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3ith n GLU 53 N 0.09 0.14 -3.45 0.54 4.71 -1.26 -4.50 120.64 116.91 3ith n GLU 53 Ca 0.07 0.12 -0.43 0.00 -0.01 0.00 0.00 57.16 56.91 3ith n GLU 53 Cb 0.24 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 29.09 3ith n GLU 53 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 3ith s ASN 54 N -2.80 5.97 0.00 1.62 3.84 -1.18 -4.94 114.94 117.45 3ith s ASN 54 Ca 0.14 -1.54 0.22 0.00 0.21 0.00 0.00 52.86 51.89 3ith s ASN 54 Cb 0.14 -2.12 1.18 0.00 -0.55 0.00 0.00 41.25 39.89 3ith s ASN 54 CO 0.35 -0.67 1.69 -0.81 -2.79 0.00 0.00 177.10 174.86 3ith n PRO 55 N 5.10 0.47 -3.72 0.43 -0.04 -1.26 -4.84 135.00 131.14 3ith n PRO 55 Ca -0.12 0.05 -0.35 0.00 -0.04 0.00 0.00 63.50 63.05 3ith n PRO 55 Cb 0.42 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.33 3ith n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3ith s TYR 56 N -2.33 3.59 0.14 0.54 2.02 -1.26 -4.79 117.35 115.26 3ith s TYR 56 Ca 0.26 0.63 -0.11 0.00 -0.37 0.00 0.00 57.07 57.48 3ith s TYR 56 Cb 0.15 -2.04 0.00 0.00 -0.40 0.00 0.00 41.96 39.67 3ith s TYR 56 CO 0.29 0.60 0.31 1.21 -1.57 0.00 0.00 175.55 176.40 3ith s ASN 57 N -1.65 -0.02 -0.18 2.29 3.84 -1.05 -4.45 114.94 113.73 3ith s ASN 57 Ca 0.28 -0.69 -0.09 0.00 0.21 0.00 0.00 52.86 52.57 3ith s ASN 57 Cb -0.13 0.44 0.07 0.00 -0.55 0.00 0.00 41.25 41.07 3ith s ASN 57 CO 0.16 -0.87 0.41 -0.89 -2.79 0.00 0.00 177.10 173.12 3ith s THR 58 N -3.91 -0.18 0.57 -5.21 2.01 -0.58 -2.31 115.64 106.02 3ith s THR 58 Ca 0.11 0.11 -0.20 0.00 0.31 0.00 0.00 61.69 62.03 3ith s THR 58 Cb 0.03 -0.63 -0.06 0.00 0.01 0.00 0.00 72.50 71.85 3ith s THR 58 CO -0.05 0.05 1.02 -2.65 -0.69 0.00 0.00 174.62 172.30 3ith n PRO 59 N 4.55 1.07 -4.39 4.92 -0.02 -1.26 -4.26 135.00 135.61 3ith n PRO 59 Ca -0.20 0.41 -0.26 0.00 -2.02 0.00 0.00 63.50 61.43 3ith n PRO 59 Cb 0.54 -2.20 -0.12 0.00 -0.02 0.00 0.00 33.50 31.70 3ith n PRO 59 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ith s VAL 60 N -1.45 2.20 0.00 -1.45 1.01 -1.26 -2.10 120.40 117.35 3ith s VAL 60 Ca 0.73 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.76 3ith s VAL 60 Cb -0.44 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 33.92 3ith s VAL 60 CO 0.49 -0.12 0.00 2.22 0.00 0.00 0.00 175.10 177.69 3ith n PHE 61 N 0.40 -0.78 -3.98 5.22 -1.74 -0.61 -4.89 117.46 111.08 3ith n PHE 61 Ca -0.14 0.00 -0.15 0.00 -0.56 0.00 0.00 57.45 56.61 3ith n PHE 61 Cb 0.56 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.41 3ith n PHE 61 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3ith s ALA 62 N -1.00 0.24 0.31 1.98 0.00 -1.26 -0.71 121.76 121.32 3ith s ALA 62 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 51.96 51.99 3ith s ALA 62 Cb 0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 3ith s ALA 62 CO 0.00 0.02 -0.01 0.96 0.00 0.00 0.00 175.76 176.73 3ith s ILE 63 N 0.26 1.53 -0.34 0.00 -4.36 -0.78 -4.94 121.20 112.57 3ith s ILE 63 Ca -0.02 -2.06 0.06 0.00 -0.26 0.00 0.00 60.65 58.37 3ith s ILE 63 Cb -0.05 -2.65 0.45 0.00 1.25 0.00 0.00 42.46 41.46 3ith s ILE 63 CO -0.01 -0.15 1.19 1.17 0.24 0.00 0.00 174.94 177.39 3ith n LYS 64 N -0.67 3.54 0.00 0.37 4.81 -1.26 -1.44 118.16 123.50 3ith n LYS 64 Ca -0.04 -4.24 0.00 0.00 -0.87 0.00 0.00 58.31 53.16 3ith n LYS 64 Cb 0.65 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.43 3ith n LYS 64 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 3ith n LYS 65 N -0.65 0.00 -2.98 1.64 3.00 -1.26 -3.78 118.16 114.13 3ith n LYS 65 Ca 0.43 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 58.34 3ith n LYS 65 Cb 0.87 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.85 3ith n LYS 65 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.40 177.61 3ith s LYS 66 N -0.51 4.50 -0.81 1.64 2.20 -1.26 -4.13 119.74 121.36 3ith s LYS 66 Ca 0.00 1.07 -0.02 0.00 -0.36 0.00 0.00 55.97 56.67 3ith s LYS 66 Cb 0.00 -3.36 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 3ith s LYS 66 CO 0.00 0.29 0.69 -0.25 -0.36 0.00 0.00 175.35 175.72 3ith n ASP 67 N 2.76 -6.69 -1.06 1.43 8.00 -1.26 -4.81 116.55 114.91 3ith n ASP 67 Ca -0.02 -0.44 0.11 0.00 0.71 0.00 0.00 54.79 55.14 3ith n ASP 67 Cb 0.50 -4.09 -0.04 0.00 -0.02 0.00 0.00 41.12 37.47 3ith n ASP 67 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3ith n SER 68 N -2.16 -4.89 0.00 -2.24 7.64 -1.26 -5.08 113.62 105.63 3ith n SER 68 Ca -0.11 0.67 0.00 0.00 1.01 0.00 0.00 58.87 60.45 3ith n SER 68 Cb 0.57 -3.42 0.00 0.00 -1.01 0.00 0.00 64.21 60.35 3ith n SER 68 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3ith n THR 69 N -3.47 0.00 -3.69 0.44 -2.24 -1.25 -4.80 114.28 99.28 3ith n THR 69 Ca -0.03 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.63 3ith n THR 69 Cb 0.55 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.68 3ith n THR 69 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ith s LYS 70 N 0.00 0.54 0.45 -0.78 1.02 -1.26 -5.07 119.74 114.65 3ith s LYS 70 Ca 0.00 0.81 -0.12 0.00 0.02 0.00 0.00 55.97 56.68 3ith s LYS 70 Cb 0.00 0.17 -0.10 0.00 -0.52 0.00 0.00 37.83 37.38 3ith s LYS 70 CO 0.00 -0.11 -0.24 0.91 -0.92 0.00 0.00 175.35 174.99 3ith n TRP 71 N 3.49 -2.48 -3.82 3.18 7.02 -1.26 -4.86 117.44 118.71 3ith n TRP 71 Ca -0.18 0.19 -0.12 0.00 -1.02 0.00 0.00 57.50 56.37 3ith n TRP 71 Cb 0.56 -1.07 -0.11 0.00 -2.42 0.00 0.00 31.31 28.27 3ith n TRP 71 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 3ith s ARG 72 N -0.90 0.36 0.70 -0.99 3.52 -0.52 -5.00 118.95 116.11 3ith s ARG 72 Ca 0.34 0.01 -0.11 0.00 -0.13 0.00 0.00 55.73 55.84 3ith s ARG 72 Cb -0.26 0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.30 3ith s ARG 72 CO 0.48 -0.07 1.06 0.21 -0.81 0.00 0.00 175.30 176.17 3ith s LYS 73 N -0.52 2.94 -0.29 5.12 2.20 -1.26 -1.87 119.74 126.06 3ith s LYS 73 Ca -0.06 0.90 -0.08 0.00 -0.36 0.00 0.00 55.97 56.37 3ith s LYS 73 Cb -0.04 -1.99 0.14 0.00 -1.51 0.00 0.00 37.83 34.43 3ith s LYS 73 CO 0.01 -1.08 0.61 -1.17 -0.36 0.00 0.00 175.35 173.36 3ith s LEU 74 N -5.52 -1.14 -0.24 5.43 2.96 0.11 -4.79 118.68 115.48 3ith s LEU 74 Ca 0.58 1.34 -0.08 0.00 -0.22 0.00 0.00 54.13 55.74 3ith s LEU 74 Cb -0.14 2.16 -0.04 0.00 0.50 0.00 0.00 46.19 48.68 3ith s LEU 74 CO 0.55 -0.23 0.10 -0.69 -1.32 0.00 0.00 176.35 174.76 3ith s VAL 75 N 2.86 4.70 -1.32 1.68 1.01 -1.26 -1.57 120.40 126.50 3ith s VAL 75 Ca 0.01 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.77 3ith s VAL 75 Cb -0.13 -3.19 0.07 0.00 0.00 0.00 0.00 36.38 33.13 3ith s VAL 75 CO -0.19 0.34 1.79 -0.67 0.00 0.00 0.00 175.10 176.37 3ith n ASP 76 N 4.68 4.82 0.00 3.32 2.03 -0.89 -4.70 116.55 125.80 3ith n ASP 76 Ca -0.16 -2.92 0.08 0.00 0.52 0.00 0.00 54.79 52.32 3ith n ASP 76 Cb 0.52 -1.72 0.47 0.00 -0.72 0.00 0.00 41.12 39.66 3ith n ASP 76 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3ith n PHE 77 N 7.82 0.00 -0.19 -0.67 3.72 -1.26 -4.34 117.46 122.54 3ith n PHE 77 Ca 0.48 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.83 3ith n PHE 77 Cb 0.45 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.94 3ith n PHE 77 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3ith n ARG 78 N -0.77 -0.20 -0.31 -1.08 1.74 -1.26 -0.23 116.66 114.54 3ith n ARG 78 Ca 0.12 0.93 0.04 0.00 -0.77 0.00 0.00 57.85 58.17 3ith n ARG 78 Cb 0.05 -1.37 0.24 0.00 -1.02 0.00 0.00 32.46 30.36 3ith n ARG 78 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 3ith h GLU 79 N 0.00 1.00 0.00 5.56 4.57 -2.00 -1.95 114.58 121.76 3ith h GLU 79 Ca 0.07 -0.06 -0.15 0.00 -1.18 0.00 0.00 59.36 58.04 3ith h GLU 79 Cb 0.19 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 3ith h GLU 79 CO -0.43 0.66 -0.72 1.25 -1.18 0.00 0.00 179.01 178.59 3ith h LEU 80 N 1.03 0.00 0.45 1.64 5.85 -0.92 -3.05 115.31 120.31 3ith h LEU 80 Ca 0.41 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.10 3ith h LEU 80 Cb 0.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3ith h LEU 80 CO -0.16 0.72 -0.22 0.78 -0.34 0.00 0.00 178.44 179.22 3ith h ASN 81 N 0.00 -0.51 0.00 1.25 2.35 -0.02 -2.81 115.58 115.84 3ith h ASN 81 Ca -0.01 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 3ith h ASN 81 Cb 1.33 0.13 0.00 0.00 0.05 0.00 0.00 38.32 39.83 3ith h ASN 81 CO 0.09 -0.19 0.00 2.29 -1.65 0.00 0.00 177.43 177.97 3ith n LYS 82 N -5.26 0.44 -0.02 0.81 2.85 -0.84 0.44 118.16 116.58 3ith n LYS 82 Ca -0.11 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.21 3ith n LYS 82 Cb 0.30 -1.38 0.06 0.00 -0.65 0.00 0.00 35.03 33.35 3ith n LYS 82 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 3ith n ARG 83 N -0.88 0.77 0.00 -1.58 3.00 -1.08 -4.43 116.66 112.46 3ith n ARG 83 Ca 0.08 -1.25 0.00 0.00 -0.00 0.00 0.00 57.85 56.68 3ith n ARG 83 Cb 0.04 -1.21 0.00 0.00 0.00 0.00 0.00 32.46 31.28 3ith n ARG 83 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 3ith n THR 84 N 0.60 0.00 -2.41 5.15 5.66 0.14 -2.90 114.28 120.52 3ith n THR 84 Ca 0.07 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.66 3ith n THR 84 Cb 0.29 1.07 -0.04 0.00 -1.55 0.00 0.00 70.33 70.10 3ith n THR 84 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3ith s GLN 85 N 0.00 4.52 -0.03 1.09 -1.52 0.17 -4.20 119.66 119.69 3ith s GLN 85 Ca 0.00 1.84 -0.02 0.00 -1.95 0.00 0.00 55.36 55.24 3ith s GLN 85 Cb 0.00 -3.24 0.01 0.00 -0.22 0.00 0.00 33.01 29.55 3ith s GLN 85 CO 0.00 -0.04 0.03 -0.25 -0.25 0.00 0.00 175.29 174.78 3ith n ASP 86 N 2.40 -6.62 -4.35 5.90 10.43 -1.26 -5.01 116.55 118.05 3ith n ASP 86 Ca 0.04 0.97 -0.36 0.00 2.57 0.00 0.00 54.79 58.01 3ith n ASP 86 Cb 0.45 -2.08 -0.14 0.00 1.84 0.00 0.00 41.12 41.19 3ith n ASP 86 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3ith s PHE 87 N -0.19 3.01 0.00 1.24 0.08 -1.26 -5.04 117.98 115.82 3ith s PHE 87 Ca -0.04 -0.81 0.00 0.00 0.12 0.00 0.00 56.93 56.20 3ith s PHE 87 Cb 0.00 -2.15 0.00 0.00 -0.57 0.00 0.00 43.02 40.30 3ith s PHE 87 CO 0.12 -0.50 0.00 0.91 -0.10 0.00 0.00 175.22 175.65 3ith n TRP 88 N 4.83 0.00 -0.32 0.36 5.03 -1.26 -4.58 117.44 121.51 3ith n TRP 88 Ca -0.17 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.36 3ith n TRP 88 Cb 0.51 0.01 0.00 0.00 -1.03 0.00 0.00 31.31 30.80 3ith n TRP 88 CO 0.00 0.00 0.00 -0.85 -0.03 0.00 0.00 177.69 176.81 3ith n GLU 89 N 14.00 3.08 0.00 -0.99 0.28 -1.26 -4.50 120.64 131.25 3ith n GLU 89 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3ith n GLU 89 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 3ith n GLU 89 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 3ith n VAL 90 N 0.00 0.00 -1.65 3.84 0.31 -1.26 -4.90 118.33 114.67 3ith n VAL 90 Ca 0.00 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 63.87 3ith n VAL 90 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 3ith n VAL 90 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ith n GLN 91 N -1.89 1.83 -3.11 5.55 6.02 -1.26 -3.96 117.38 120.55 3ith n GLN 91 Ca 0.00 0.65 0.00 0.00 -0.01 0.00 0.00 57.00 57.64 3ith n GLN 91 Cb 0.00 -2.29 0.00 0.00 1.02 0.00 0.00 30.24 28.97 3ith n GLN 91 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3ith n LEU 92 N 2.29 0.00 0.00 1.08 4.77 -1.26 -4.43 117.00 119.45 3ith n LEU 92 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3ith n LEU 92 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3ith n LEU 92 CO 0.62 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3ith n GLY 93 N -0.84 0.12 3.93 -0.72 0.00 -1.25 -4.13 105.19 102.30 3ith n GLY 93 Ca 0.00 0.04 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 3ith n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ith s ILE 94 N 0.00 5.25 0.00 -0.61 -0.00 -1.26 -4.96 121.20 119.61 3ith s ILE 94 Ca 0.00 -0.69 -0.01 0.00 -0.00 0.00 0.00 60.65 59.95 3ith s ILE 94 Cb 0.00 -3.68 -0.03 0.00 -0.00 0.00 0.00 42.46 38.74 3ith s ILE 94 CO 0.00 -0.07 0.81 -0.81 -0.00 0.00 0.00 174.94 174.87 3ith n PRO 95 N -0.44 0.27 -1.92 0.37 -0.04 -1.26 -4.74 135.00 127.25 3ith n PRO 95 Ca -0.07 -0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 3ith n PRO 95 Cb 0.54 -1.53 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 3ith n PRO 95 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3ith n HIS 96 N 2.64 -4.78 -1.64 0.54 -0.00 -1.26 -4.66 115.22 106.06 3ith n HIS 96 Ca 0.05 2.69 -0.33 0.00 -0.00 0.00 0.00 57.72 60.13 3ith n HIS 96 Cb 0.13 -3.65 -0.04 0.00 -0.00 0.00 0.00 29.99 26.44 3ith n HIS 96 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 3ith s PRO 97 N -1.43 2.10 0.00 1.57 0.04 -1.26 -4.79 135.00 131.23 3ith s PRO 97 Ca 0.00 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.17 3ith s PRO 97 Cb 0.00 -4.60 0.00 0.00 0.04 0.00 0.00 34.50 29.94 3ith s PRO 97 CO 0.00 -3.38 0.95 0.00 0.04 0.00 0.00 177.00 174.61 3ith n ALA 98 N 15.86 0.95 -0.08 8.56 0.00 -1.26 -2.30 120.51 142.23 3ith n ALA 98 Ca 0.36 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.66 3ith n ALA 98 Cb 0.53 -0.93 -0.11 0.00 0.00 0.00 0.00 19.45 18.94 3ith n ALA 98 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3ith h GLY 99 N 0.00 0.00 -0.54 0.00 0.00 -1.96 -3.39 103.07 97.19 3ith h GLY 99 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 3ith h GLY 99 CO 0.00 0.00 0.14 -0.10 0.00 0.00 0.00 176.54 176.58 3ith n LEU 100 N -4.59 0.05 0.19 3.11 7.94 -0.97 0.14 117.00 122.86 3ith n LEU 100 Ca -0.14 0.90 0.13 0.00 -1.11 0.00 0.00 56.01 55.79 3ith n LEU 100 Cb 0.46 -0.38 0.67 0.00 0.53 0.00 0.00 43.42 44.70 3ith n LEU 100 CO 0.26 -0.96 0.88 0.07 -1.11 0.00 0.00 177.39 176.53 3ith h LYS 101 N 0.00 0.00 0.00 1.96 2.10 -1.75 -2.22 116.57 116.65 3ith h LYS 101 Ca 0.39 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.96 3ith h LYS 101 Cb 0.92 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.23 3ith h LYS 101 CO -0.46 0.00 -1.49 1.63 -2.00 0.00 0.00 179.45 177.13 3ith n LYS 102 N -2.37 0.63 -1.96 0.07 5.02 0.37 -3.84 118.16 116.09 3ith n LYS 102 Ca -0.02 0.05 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 3ith n LYS 102 Cb 0.05 -1.72 0.04 0.00 -0.02 0.00 0.00 35.03 33.37 3ith n LYS 102 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3ith s LYS 103 N -3.22 2.99 0.05 1.97 -0.14 -0.84 -4.65 119.74 115.90 3ith s LYS 103 Ca -0.04 1.91 -0.24 0.00 -1.36 0.00 0.00 55.97 56.24 3ith s LYS 103 Cb 0.10 -1.99 -0.17 0.00 -1.68 0.00 0.00 37.83 34.09 3ith s LYS 103 CO 0.83 -1.22 1.57 -0.22 -0.76 0.00 0.00 175.35 175.55 3ith h LYS 104 N 0.99 -0.02 -6.21 1.68 3.64 -1.61 -3.38 116.57 111.66 3ith h LYS 104 Ca -0.51 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.30 3ith h LYS 104 Cb 1.30 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.95 3ith h LYS 104 CO 0.55 0.15 -0.79 -1.54 -2.27 0.00 0.00 179.45 175.56 3ith s SER 105 N -5.35 3.09 -0.02 4.20 1.04 -0.94 -4.19 113.70 111.54 3ith s SER 105 Ca -0.14 -0.90 0.01 0.00 0.48 0.00 0.00 55.95 55.40 3ith s SER 105 Cb 0.04 -0.21 0.01 0.00 0.10 0.00 0.00 66.02 65.96 3ith s SER 105 CO 0.66 0.03 -0.03 -0.69 0.98 0.00 0.00 173.24 174.19 3ith s VAL 106 N -2.02 0.31 0.16 5.02 1.01 -0.79 -1.76 120.40 122.34 3ith s VAL 106 Ca 0.20 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 62.21 3ith s VAL 106 Cb -0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 3ith s VAL 106 CO 0.09 0.14 -0.23 -0.89 0.00 0.00 0.00 175.10 174.20 3ith s THR 107 N 0.49 2.44 -0.10 3.92 2.01 0.12 -3.43 115.64 121.09 3ith s THR 107 Ca -0.05 -1.83 0.01 0.00 0.31 0.00 0.00 61.69 60.13 3ith s THR 107 Cb -0.08 -2.13 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 3ith s THR 107 CO -0.01 -0.01 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.09 3ith s VAL 108 N -1.37 3.06 0.26 3.82 1.01 -1.15 -0.85 120.40 125.19 3ith s VAL 108 Ca 0.18 -0.68 0.12 0.00 0.00 0.00 0.00 61.98 61.59 3ith s VAL 108 Cb -0.09 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 3ith s VAL 108 CO 0.09 0.55 -0.20 -0.76 0.00 0.00 0.00 175.10 174.78 3ith s LEU 109 N -0.03 2.57 -0.92 3.92 1.43 -0.86 -4.51 118.68 120.28 3ith s LEU 109 Ca -0.03 -1.01 -0.02 0.00 -1.03 0.00 0.00 54.13 52.04 3ith s LEU 109 Cb -0.14 -1.07 0.25 0.00 0.03 0.00 0.00 46.19 45.26 3ith s LEU 109 CO 0.04 0.03 0.94 -0.67 0.23 0.00 0.00 176.35 176.92 3ith n ASP 110 N -0.51 4.69 -0.16 2.29 -0.08 -1.26 -1.96 116.55 119.56 3ith n ASP 110 Ca -0.06 -3.21 0.00 0.00 -1.51 0.00 0.00 54.79 50.01 3ith n ASP 110 Cb 0.60 -1.08 0.00 0.00 2.34 0.00 0.00 41.12 42.98 3ith n ASP 110 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 3ith n VAL 111 N 1.97 0.00 0.13 5.18 0.24 -0.53 -4.00 118.33 121.32 3ith n VAL 111 Ca 0.24 0.00 0.19 0.00 -2.04 0.00 0.00 64.34 62.73 3ith n VAL 111 Cb 0.37 -0.20 0.77 0.00 -1.47 0.00 0.00 33.84 33.31 3ith n VAL 111 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3ith h GLY 112 N 4.43 0.00 0.55 7.63 0.00 -1.87 -1.18 103.07 112.63 3ith h GLY 112 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 3ith h GLY 112 CO 0.00 0.00 0.53 -0.55 0.00 0.00 0.00 176.54 176.52 3ith h ASP 113 N 0.00 0.32 -0.25 0.19 5.19 -1.82 -3.38 116.42 116.66 3ith h ASP 113 Ca 0.15 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 3ith h ASP 113 Cb 0.81 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.28 3ith h ASP 113 CO -0.00 0.15 0.00 0.00 -3.12 0.00 0.00 179.24 176.27 3ith n ALA 114 N -2.55 0.00 0.00 3.45 0.00 -0.45 -3.63 120.51 117.33 3ith n ALA 114 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3ith n ALA 114 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 3ith n ALA 114 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ith n TYR 115 N -1.50 0.00 0.99 0.00 4.01 -1.26 -4.48 117.16 114.92 3ith n TYR 115 Ca 0.00 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.84 3ith n TYR 115 Cb 0.00 0.00 0.53 0.00 -0.31 0.00 0.00 39.34 39.56 3ith n TYR 115 CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 3ith n PHE 116 N 0.00 0.00 -0.04 -0.72 -0.00 -1.24 -1.72 117.46 113.74 3ith n PHE 116 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3ith n PHE 116 Cb 0.00 -0.29 -0.00 0.00 -0.00 0.00 0.00 39.48 39.19 3ith n PHE 116 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3ith h SER 117 N 0.00 -0.01 -2.64 5.98 4.64 -1.78 -3.43 113.55 116.32 3ith h SER 117 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 3ith h SER 117 Cb 0.20 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.35 3ith h SER 117 CO 0.00 0.45 1.03 -0.69 -0.87 0.00 0.00 176.83 176.76 3ith s VAL 118 N -1.55 2.25 0.94 0.95 1.01 -1.21 -3.44 120.40 119.34 3ith s VAL 118 Ca -0.00 0.07 -0.12 0.00 0.00 0.00 0.00 61.98 61.93 3ith s VAL 118 Cb 0.00 -3.04 0.16 0.00 0.00 0.00 0.00 36.38 33.49 3ith s VAL 118 CO 0.01 0.00 1.09 -2.16 0.00 0.00 0.00 175.10 174.04 3ith s PRO 119 N 1.69 0.86 -0.01 2.72 0.04 -1.26 -2.16 135.00 136.89 3ith s PRO 119 Ca 0.76 0.86 0.03 0.00 0.04 0.00 0.00 61.00 62.70 3ith s PRO 119 Cb -0.48 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 3ith s PRO 119 CO 0.33 -2.52 -0.08 -1.17 0.04 0.00 0.00 177.00 173.60 3ith s LEU 120 N -6.41 3.13 -0.01 -3.56 2.96 0.14 -4.47 118.68 110.46 3ith s LEU 120 Ca 0.65 -0.14 -0.37 0.00 -0.22 0.00 0.00 54.13 54.05 3ith s LEU 120 Cb -0.19 -1.78 -0.15 0.00 0.50 0.00 0.00 46.19 44.57 3ith s LEU 120 CO 0.58 0.29 1.57 -0.67 -1.32 0.00 0.00 176.35 176.80 3ith n ASP 121 N 1.67 2.40 -0.35 3.68 2.03 -1.26 -4.83 116.55 119.89 3ith n ASP 121 Ca -0.16 1.08 -0.05 0.00 0.52 0.00 0.00 54.79 56.18 3ith n ASP 121 Cb 0.53 -1.26 -0.03 0.00 -0.72 0.00 0.00 41.12 39.64 3ith n ASP 121 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 3ith n GLU 122 N 3.99 -0.30 0.00 -0.67 4.07 -1.26 -1.53 120.64 124.94 3ith n GLU 122 Ca 0.21 1.32 0.14 0.00 -0.06 0.00 0.00 57.16 58.77 3ith n GLU 122 Cb 0.21 -1.95 0.79 0.00 -0.06 0.00 0.00 31.44 30.43 3ith n GLU 122 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3ith n ASP 123 N -5.18 0.00 -0.06 4.31 8.00 -1.26 -2.18 116.55 120.19 3ith n ASP 123 Ca 0.05 -0.60 -0.03 0.00 0.71 0.00 0.00 54.79 54.92 3ith n ASP 123 Cb 0.28 -0.11 -0.13 0.00 -0.02 0.00 0.00 41.12 41.15 3ith n ASP 123 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3ith n PHE 124 N -1.11 0.00 -0.30 1.24 7.35 -0.58 -4.63 117.46 119.43 3ith n PHE 124 Ca 0.18 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 57.00 3ith n PHE 124 Cb 0.14 -0.66 0.27 0.00 0.35 0.00 0.00 39.48 39.59 3ith n PHE 124 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3ith h ARG 125 N 0.00 0.14 -0.43 -4.13 3.08 -1.06 0.37 114.38 112.35 3ith h ARG 125 Ca -0.30 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 59.86 3ith h ARG 125 Cb 1.62 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.62 3ith h ARG 125 CO 0.02 0.09 0.31 1.57 -1.07 0.00 0.00 179.97 180.88 3ith h LYS 126 N 0.14 0.05 0.00 0.04 2.10 -1.82 0.22 116.57 117.30 3ith h LYS 126 Ca 0.55 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.19 3ith h LYS 126 Cb 1.10 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 3ith h LYS 126 CO -0.72 0.03 0.00 0.66 -2.00 0.00 0.00 179.45 177.43 3ith n TYR 127 N -4.42 0.00 -1.01 0.07 4.01 0.13 -3.05 117.16 112.89 3ith n TYR 127 Ca 0.07 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.86 3ith n TYR 127 Cb 0.47 -0.08 0.31 0.00 -0.31 0.00 0.00 39.34 39.73 3ith n TYR 127 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3ith n THR 128 N -1.08 2.58 -2.04 -0.72 -2.24 0.78 -4.62 114.28 106.94 3ith n THR 128 Ca 0.14 -1.74 -0.38 0.00 -2.27 0.00 0.00 64.05 59.81 3ith n THR 128 Cb 0.10 -0.29 0.01 0.00 -2.10 0.00 0.00 70.33 68.06 3ith n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ith s ALA 129 N -2.87 2.91 -0.09 6.98 0.00 -1.17 -4.22 121.76 123.29 3ith s ALA 129 Ca 0.49 1.12 -0.22 0.00 0.00 0.00 0.00 51.96 53.35 3ith s ALA 129 Cb 0.39 -3.47 0.05 0.00 0.00 0.00 0.00 23.12 20.09 3ith s ALA 129 CO 0.11 -0.98 0.53 -0.59 0.00 0.00 0.00 175.76 174.84 3ith s PHE 130 N -1.43 -0.51 -0.18 0.00 -0.71 -0.29 -1.53 117.98 113.33 3ith s PHE 130 Ca 0.67 1.01 -0.02 0.00 -1.04 0.00 0.00 56.93 57.55 3ith s PHE 130 Cb -0.34 0.25 0.06 0.00 -1.21 0.00 0.00 43.02 41.78 3ith s PHE 130 CO 0.41 -0.44 0.02 0.99 -1.34 0.00 0.00 175.22 174.86 3ith s THR 131 N -0.72 0.67 0.02 -4.49 2.01 -1.26 -1.13 115.64 110.74 3ith s THR 131 Ca -0.08 -0.57 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 3ith s THR 131 Cb -0.03 -1.09 -0.06 0.00 0.01 0.00 0.00 72.50 71.33 3ith s THR 131 CO 0.05 -0.13 1.39 -0.63 -0.69 0.00 0.00 174.62 174.62 3ith s ILE 132 N 1.80 3.68 1.04 1.82 1.01 -0.72 -4.74 121.20 125.09 3ith s ILE 132 Ca -0.01 1.09 -0.18 0.00 0.00 0.00 0.00 60.65 61.55 3ith s ILE 132 Cb -0.17 -3.70 0.25 0.00 0.01 0.00 0.00 42.46 38.85 3ith s ILE 132 CO -0.07 0.01 1.26 -0.81 0.00 0.00 0.00 174.94 175.32 3ith n PRO 133 N 5.16 -1.80 -4.99 2.79 -0.04 -1.26 -2.38 135.00 132.48 3ith n PRO 133 Ca 0.13 -1.96 -0.29 0.00 -0.04 0.00 0.00 63.50 61.34 3ith n PRO 133 Cb 0.44 -1.44 -0.17 0.00 -0.04 0.00 0.00 33.50 32.29 3ith n PRO 133 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3ith s SER 134 N -5.45 2.57 0.18 3.54 1.04 -1.26 -4.80 113.70 109.51 3ith s SER 134 Ca 0.74 -0.45 -0.32 0.00 0.48 0.00 0.00 55.95 56.40 3ith s SER 134 Cb -0.03 -1.03 -0.11 0.00 0.10 0.00 0.00 66.02 64.95 3ith s SER 134 CO 0.53 0.14 1.63 -0.63 0.98 0.00 0.00 173.24 175.88 3ith s ILE 135 N 0.30 2.41 -1.14 -1.02 1.01 -1.26 -1.49 121.20 120.01 3ith s ILE 135 Ca -0.13 0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.81 3ith s ILE 135 Cb -0.16 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.13 3ith s ILE 135 CO 0.06 0.02 0.00 -3.20 0.00 0.00 0.00 174.94 171.82 3ith n ASN 136 N 4.01 -3.07 -2.01 3.58 5.15 -1.26 -2.87 115.26 118.79 3ith n ASN 136 Ca 0.15 0.27 -0.21 0.00 -0.60 0.00 0.00 54.58 54.18 3ith n ASN 136 Cb 0.37 -2.88 -0.05 0.00 -0.53 0.00 0.00 39.78 36.70 3ith n ASN 136 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3ith n ASN 137 N -0.56 -5.73 0.23 1.20 3.02 -0.56 -4.92 115.26 107.94 3ith n ASN 137 Ca -0.12 0.24 -0.09 0.00 -0.03 0.00 0.00 54.58 54.58 3ith n ASN 137 Cb 0.41 -4.89 -0.04 0.00 -0.61 0.00 0.00 39.78 34.64 3ith n ASN 137 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 3ith h GLU 138 N 0.00 -0.57 -6.84 3.52 4.11 -1.76 -3.42 114.58 109.61 3ith h GLU 138 Ca -0.46 0.04 -0.49 0.00 0.07 0.00 0.00 59.36 58.51 3ith h GLU 138 Cb 1.36 0.13 0.02 0.00 0.50 0.00 0.00 28.75 30.77 3ith h GLU 138 CO 0.61 -0.38 0.07 -0.08 0.07 0.00 0.00 179.01 179.30 3ith s THR 139 N -4.00 4.89 1.04 -1.06 -1.32 -1.26 -5.08 115.64 108.85 3ith s THR 139 Ca -0.09 0.28 -0.12 0.00 -1.21 0.00 0.00 61.69 60.55 3ith s THR 139 Cb 0.01 -3.81 0.21 0.00 -1.51 0.00 0.00 72.50 67.40 3ith s THR 139 CO 0.26 -0.69 1.08 -2.84 -2.21 0.00 0.00 174.62 170.22 3ith s PRO 140 N -4.34 0.09 0.56 7.08 0.02 -1.26 -4.65 135.00 132.50 3ith s PRO 140 Ca 0.48 0.63 -0.21 0.00 0.02 0.00 0.00 61.00 61.92 3ith s PRO 140 Cb -0.10 -1.69 -0.04 0.00 0.02 0.00 0.00 34.50 32.68 3ith s PRO 140 CO 0.39 -2.99 1.29 0.20 -0.33 0.00 0.00 177.00 175.56 3ith s GLY 141 N -3.19 2.84 -0.47 0.52 0.00 -1.26 -4.76 107.32 101.00 3ith s GLY 141 Ca 0.66 1.19 -0.18 0.00 0.00 0.00 0.00 44.72 46.39 3ith s GLY 141 CO 0.59 1.66 0.52 -0.42 0.00 0.00 0.00 173.10 175.45 3ith s ILE 142 N -1.41 5.02 -0.16 0.90 1.01 -1.00 -4.93 121.20 120.62 3ith s ILE 142 Ca 0.73 -0.55 -0.19 0.00 0.00 0.00 0.00 60.65 60.64 3ith s ILE 142 Cb -0.36 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 37.90 3ith s ILE 142 CO 0.41 -0.63 0.54 -0.13 0.00 0.00 0.00 174.94 175.13 3ith s ARG 143 N 2.27 4.27 0.10 2.79 0.52 -1.26 -1.76 118.95 125.88 3ith s ARG 143 Ca 0.12 0.51 0.10 0.00 -0.52 0.00 0.00 55.73 55.93 3ith s ARG 143 Cb -0.19 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.73 3ith s ARG 143 CO 0.12 -0.04 -0.23 0.71 0.02 0.00 0.00 175.30 175.88 3ith s TYR 144 N 1.25 2.40 0.32 -0.53 2.02 -0.28 -2.14 117.35 120.39 3ith s TYR 144 Ca 0.27 -0.34 0.09 0.00 -0.37 0.00 0.00 57.07 56.71 3ith s TYR 144 Cb -0.16 -1.33 -0.04 0.00 -0.40 0.00 0.00 41.96 40.03 3ith s TYR 144 CO 0.11 0.30 0.10 1.14 -1.57 0.00 0.00 175.55 175.62 3ith s GLN 145 N -1.83 2.35 0.32 -0.62 -2.07 -0.33 -1.14 119.66 116.34 3ith s GLN 145 Ca 0.15 -1.52 -0.17 0.00 -1.82 0.00 0.00 55.36 52.00 3ith s GLN 145 Cb -0.10 -2.16 -0.09 0.00 -1.09 0.00 0.00 33.01 29.56 3ith s GLN 145 CO 0.06 0.18 0.76 0.71 -1.32 0.00 0.00 175.29 175.69 3ith s TYR 146 N -2.40 3.41 -0.03 9.60 1.51 -1.26 -1.08 117.35 127.11 3ith s TYR 146 Ca 0.36 1.30 0.07 0.00 -1.01 0.00 0.00 57.07 57.79 3ith s TYR 146 Cb -0.03 -2.59 -0.11 0.00 -0.11 0.00 0.00 41.96 39.11 3ith s TYR 146 CO 0.22 0.11 0.12 0.09 -1.11 0.00 0.00 175.55 174.98 3ith n ASN 147 N -0.22 3.27 -4.82 2.29 3.02 -0.36 -4.71 115.26 113.73 3ith n ASN 147 Ca 0.03 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.31 3ith n ASN 147 Cb 0.53 1.14 -0.04 0.00 -0.61 0.00 0.00 39.78 40.80 3ith n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3ith s VAL 148 N -2.42 1.73 0.22 2.41 -7.23 -1.21 0.28 120.40 114.19 3ith s VAL 148 Ca -0.03 -1.67 -0.31 0.00 -1.81 0.00 0.00 61.98 58.16 3ith s VAL 148 Cb 0.04 -2.41 -0.10 0.00 0.56 0.00 0.00 36.38 34.47 3ith s VAL 148 CO 0.31 0.00 1.53 -0.76 -0.31 0.00 0.00 175.10 175.86 3ith s LEU 149 N -4.07 4.37 0.32 1.32 1.43 -0.70 -4.58 118.68 116.77 3ith s LEU 149 Ca 0.29 2.70 -0.12 0.00 -1.03 0.00 0.00 54.13 55.97 3ith s LEU 149 Cb 0.00 -3.61 -0.08 0.00 0.03 0.00 0.00 46.19 42.53 3ith s LEU 149 CO 0.17 -0.79 0.69 -2.84 0.23 0.00 0.00 176.35 173.81 3ith s PRO 150 N 0.28 3.88 0.35 1.29 0.02 -1.26 -4.06 135.00 135.51 3ith s PRO 150 Ca 0.65 0.50 0.02 0.00 0.02 0.00 0.00 61.00 62.19 3ith s PRO 150 Cb -0.44 -2.48 0.64 0.00 0.02 0.00 0.00 34.50 32.24 3ith s PRO 150 CO 0.39 0.15 2.00 1.96 -0.33 0.00 0.00 177.00 181.17 3ith h GLN 151 N 2.05 0.80 -0.45 5.54 4.20 -1.92 -3.07 115.11 122.25 3ith h GLN 151 Ca -0.47 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.18 3ith h GLN 151 Cb 1.18 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.78 3ith h GLN 151 CO 0.66 0.55 0.00 0.41 -0.67 0.00 0.00 178.83 179.77 3ith n GLY 152 N -1.40 3.32 0.07 3.46 0.00 -1.26 -4.67 105.19 104.70 3ith n GLY 152 Ca 0.06 -0.91 0.14 0.00 0.00 0.00 0.00 46.02 45.31 3ith n GLY 152 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 3ith n TRP 153 N 0.30 0.00 0.00 1.61 -0.00 -1.16 -4.63 117.44 113.56 3ith n TRP 153 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.74 3ith n TRP 153 Cb 0.95 -0.25 0.00 0.00 -0.00 0.00 0.00 31.31 32.01 3ith n TRP 153 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 3ith n LYS 154 N -1.15 0.00 0.00 5.87 5.02 -1.26 -4.23 118.16 122.41 3ith n LYS 154 Ca 0.12 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.55 3ith n LYS 154 Cb 0.29 -0.86 0.76 0.00 -0.02 0.00 0.00 35.03 35.19 3ith n LYS 154 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ith n GLY 155 N 0.00 -1.01 0.09 0.72 0.00 -1.26 -3.68 105.19 100.05 3ith n GLY 155 Ca 0.00 -0.15 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 3ith n GLY 155 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ith n SER 156 N -1.13 1.83 0.21 1.61 7.64 -1.26 -2.48 113.62 120.04 3ith n SER 156 Ca 0.17 0.54 0.12 0.00 1.01 0.00 0.00 58.87 60.72 3ith n SER 156 Cb 0.15 -0.91 0.71 0.00 -1.01 0.00 0.00 64.21 63.15 3ith n SER 156 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3ith h PRO 157 N -1.00 0.00 0.61 1.43 0.13 -1.76 -0.74 132.00 130.67 3ith h PRO 157 Ca -0.15 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.95 3ith h PRO 157 Cb 0.85 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.99 3ith h PRO 157 CO -0.09 0.00 -0.29 0.00 -0.23 0.00 0.00 178.00 177.38 3ith h ALA 158 N 1.93 -1.13 -0.40 -0.56 0.00 -1.68 -0.96 119.26 116.45 3ith h ALA 158 Ca 0.06 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.86 3ith h ALA 158 Cb 0.24 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3ith h ALA 158 CO -0.00 -1.07 0.28 0.82 0.00 0.00 0.00 179.25 179.28 3ith h ILE 159 N -0.89 0.91 0.00 0.00 2.04 -1.11 -2.49 117.51 115.96 3ith h ILE 159 Ca -0.08 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3ith h ILE 159 Cb 0.63 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3ith h ILE 159 CO 0.14 0.04 -0.63 0.33 0.00 0.00 0.00 178.15 178.02 3ith n PHE 160 N -4.47 0.47 -0.34 1.37 7.35 -0.33 -4.29 117.46 117.23 3ith n PHE 160 Ca 0.06 0.14 0.20 0.00 -0.76 0.00 0.00 57.45 57.08 3ith n PHE 160 Cb 0.32 -0.60 0.45 0.00 0.35 0.00 0.00 39.48 40.00 3ith n PHE 160 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 3ith h GLN 161 N 0.00 0.48 0.27 -4.13 4.15 -0.69 -0.70 115.11 114.49 3ith h GLN 161 Ca 0.00 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.40 3ith h GLN 161 Cb 0.72 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.26 3ith h GLN 161 CO 0.00 0.32 -0.41 0.77 -1.93 0.00 0.00 178.83 177.57 3ith h SER 162 N 0.49 -1.17 -0.70 -0.69 0.02 -1.78 -2.29 113.55 107.43 3ith h SER 162 Ca 0.62 0.11 0.03 0.00 -0.84 0.00 0.00 61.79 61.71 3ith h SER 162 Cb 1.36 0.42 -0.04 0.00 0.14 0.00 0.00 62.40 64.28 3ith h SER 162 CO -0.38 -0.52 0.46 0.28 -1.14 0.00 0.00 176.83 175.53 3ith h SER 163 N -0.74 0.75 0.11 3.07 0.02 -1.46 -2.37 113.55 112.93 3ith h SER 163 Ca -0.01 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.80 3ith h SER 163 Cb 0.71 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3ith h SER 163 CO -0.15 0.53 -0.45 -0.03 -1.14 0.00 0.00 176.83 175.58 3ith h MET 164 N 0.88 0.41 -0.66 3.45 -1.53 -1.24 -1.73 114.93 114.50 3ith h MET 164 Ca 0.27 -0.22 -0.00 0.00 -3.44 0.00 0.00 59.70 56.31 3ith h MET 164 Cb 0.01 0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 31.04 3ith h MET 164 CO -0.07 0.78 0.41 1.15 0.14 0.00 0.00 176.91 179.32 3ith h THR 165 N 0.33 1.19 0.50 -0.77 2.02 -0.90 -1.37 112.91 113.91 3ith h THR 165 Ca 0.02 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 3ith h THR 165 Cb 0.92 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3ith h THR 165 CO 0.08 0.19 -0.24 0.11 0.37 0.00 0.00 175.52 176.03 3ith h LYS 166 N 0.90 -0.65 -0.96 6.66 1.79 -1.21 0.21 116.57 123.31 3ith h LYS 166 Ca 0.24 0.04 0.38 0.00 -2.18 0.00 0.00 60.65 59.13 3ith h LYS 166 Cb -0.04 0.15 -0.17 0.00 -1.58 0.00 0.00 32.23 30.58 3ith h LYS 166 CO -0.05 -0.44 0.43 -0.89 -1.08 0.00 0.00 179.45 177.43 3ith n ILE 167 N -3.83 -0.40 0.04 1.86 5.41 -0.68 -1.02 119.36 120.73 3ith n ILE 167 Ca -0.08 1.97 -0.02 0.00 1.00 0.00 0.00 62.75 65.62 3ith n ILE 167 Cb 0.27 -3.14 -0.08 0.00 -0.71 0.00 0.00 39.64 35.97 3ith n ILE 167 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 3ith h LEU 168 N 0.00 0.00 -0.99 1.39 3.38 -1.01 -3.40 115.31 114.68 3ith h LEU 168 Ca 0.77 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.85 3ith h LEU 168 Cb 1.99 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 42.60 3ith h LEU 168 CO -0.76 0.67 -0.51 1.21 0.09 0.00 0.00 178.44 179.13 3ith n GLU 169 N -2.98 -0.36 -0.33 1.13 0.00 0.73 0.06 120.64 118.89 3ith n GLU 169 Ca -0.09 1.51 0.10 0.00 0.00 0.00 0.00 57.16 58.68 3ith n GLU 169 Cb 0.87 -2.22 0.28 0.00 0.00 0.00 0.00 31.44 30.36 3ith n GLU 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3ith h PRO 170 N 0.00 0.67 -0.25 5.31 0.11 -1.77 -1.69 132.00 134.38 3ith h PRO 170 Ca 0.23 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 3ith h PRO 170 Cb 0.47 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 3ith h PRO 170 CO -0.95 0.44 -0.15 0.35 -0.21 0.00 0.00 178.00 177.48 3ith h PHE 171 N 0.69 0.63 0.00 0.65 3.04 -0.62 -2.58 116.94 118.75 3ith h PHE 171 Ca 0.53 -0.17 -0.02 0.00 3.98 0.00 0.00 57.97 62.29 3ith h PHE 171 Cb 0.80 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.16 3ith h PHE 171 CO -0.05 0.82 -0.09 0.87 -2.02 0.00 0.00 178.31 177.84 3ith h LYS 172 N 0.25 0.00 0.35 1.11 1.57 -0.71 -2.05 116.57 117.09 3ith h LYS 172 Ca 0.05 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 3ith h LYS 172 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 3ith h LYS 172 CO 0.04 0.09 -0.17 -0.22 -0.57 0.00 0.00 179.45 178.62 3ith h LYS 173 N 0.00 -0.46 0.00 3.15 3.64 -1.24 -2.72 116.57 118.94 3ith h LYS 173 Ca -0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3ith h LYS 173 Cb 0.41 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3ith h LYS 173 CO 0.01 -0.28 0.00 1.04 -2.27 0.00 0.00 179.45 177.95 3ith n GLN 174 N -5.09 0.06 -2.82 1.90 1.13 -0.98 -3.63 117.38 107.95 3ith n GLN 174 Ca -0.06 0.08 -0.08 0.00 -1.94 0.00 0.00 57.00 54.99 3ith n GLN 174 Cb 0.20 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 29.06 3ith n GLN 174 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3ith n ASN 175 N -1.08 -2.82 -0.10 1.08 3.02 -0.79 -4.99 115.26 109.57 3ith n ASN 175 Ca 0.02 -3.04 0.14 0.00 -0.03 0.00 0.00 54.58 51.67 3ith n ASN 175 Cb 0.01 1.50 0.64 0.00 -0.61 0.00 0.00 39.78 41.33 3ith n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3ith n PRO 176 N 2.29 0.68 0.03 3.52 -0.04 -1.03 -3.19 135.00 137.26 3ith n PRO 176 Ca 0.15 -0.20 -0.11 0.00 -0.04 0.00 0.00 63.50 63.30 3ith n PRO 176 Cb 0.58 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 3ith n PRO 176 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3ith h ASP 177 N 0.50 -0.14 -2.66 3.54 3.32 -1.93 -3.46 116.42 115.59 3ith h ASP 177 Ca 0.00 -0.41 -0.53 0.00 0.02 0.00 0.00 57.03 56.10 3ith h ASP 177 Cb 0.33 0.04 0.02 0.00 0.22 0.00 0.00 39.33 39.95 3ith h ASP 177 CO 0.00 0.45 1.02 -0.63 -1.72 0.00 0.00 179.24 178.36 3ith s ILE 178 N -3.29 2.94 -0.06 0.35 1.01 -1.19 -4.94 121.20 116.01 3ith s ILE 178 Ca -0.13 0.40 -0.15 0.00 0.00 0.00 0.00 60.65 60.77 3ith s ILE 178 Cb 0.00 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.16 3ith s ILE 178 CO 0.49 -0.00 0.38 -0.69 0.00 0.00 0.00 174.94 175.12 3ith s VAL 179 N 2.65 5.14 -0.21 2.92 1.01 -0.84 -4.96 120.40 126.11 3ith s VAL 179 Ca 0.75 0.76 -0.02 0.00 0.00 0.00 0.00 61.98 63.48 3ith s VAL 179 Cb -0.41 -3.69 0.06 0.00 0.00 0.00 0.00 36.38 32.34 3ith s VAL 179 CO 0.33 0.51 0.01 -0.63 0.00 0.00 0.00 175.10 175.32 3ith s ILE 180 N -0.53 0.82 -0.17 2.22 1.01 -1.26 -1.53 121.20 121.76 3ith s ILE 180 Ca 0.22 -0.78 -0.00 0.00 0.00 0.00 0.00 60.65 60.09 3ith s ILE 180 Cb -0.15 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.05 3ith s ILE 180 CO 0.11 -0.20 -0.14 -0.47 0.00 0.00 0.00 174.94 174.23 3ith s TYR 181 N 1.72 2.82 -0.29 3.97 5.04 0.01 -4.96 117.35 125.66 3ith s TYR 181 Ca -0.02 -1.16 -0.18 0.00 -2.44 0.00 0.00 57.07 53.28 3ith s TYR 181 Cb -0.18 -1.94 -0.02 0.00 0.35 0.00 0.00 41.96 40.17 3ith s TYR 181 CO -0.08 -0.57 0.49 -1.14 -1.34 0.00 0.00 175.55 172.92 3ith s GLN 182 N 1.06 3.91 -0.18 4.97 0.74 -1.26 0.18 119.66 129.08 3ith s GLN 182 Ca -0.01 0.12 0.00 0.00 0.05 0.00 0.00 55.36 55.53 3ith s GLN 182 Cb -0.15 -3.71 0.04 0.00 1.10 0.00 0.00 33.01 30.30 3ith s GLN 182 CO -0.04 -0.44 -0.09 -0.47 -0.55 0.00 0.00 175.29 173.70 3ith s TYR 183 N 2.31 2.16 0.00 1.67 5.04 -0.54 -4.94 117.35 123.05 3ith s TYR 183 Ca 0.19 -1.39 0.00 0.00 -2.44 0.00 0.00 57.07 53.43 3ith s TYR 183 Cb -0.16 -1.53 0.00 0.00 0.35 0.00 0.00 41.96 40.62 3ith s TYR 183 CO 0.11 -0.70 0.00 -1.33 -1.34 0.00 0.00 175.55 172.29 3ith n MET 184 N 4.75 0.00 0.00 4.97 2.81 -1.26 -1.65 117.12 126.74 3ith n MET 184 Ca -0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.75 3ith n MET 184 Cb 0.47 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.98 3ith n MET 184 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3ith n ASP 185 N 2.07 0.04 -4.57 7.83 9.92 -1.26 -4.37 116.55 126.21 3ith n ASP 185 Ca 0.00 -0.51 -0.24 0.00 -0.53 0.00 0.00 54.79 53.51 3ith n ASP 185 Cb 0.00 0.05 -0.09 0.00 -0.64 0.00 0.00 41.12 40.44 3ith n ASP 185 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 3ith s ASP 186 N -0.05 4.08 -0.15 -2.24 1.01 -0.66 -1.45 116.67 117.23 3ith s ASP 186 Ca 0.00 -0.86 -0.01 0.00 0.71 0.00 0.00 52.55 52.39 3ith s ASP 186 Cb 0.00 -0.57 -0.01 0.00 1.01 0.00 0.00 42.92 43.35 3ith s ASP 186 CO 0.00 -0.02 -0.11 -0.76 0.21 0.00 0.00 175.17 174.49 3ith s LEU 187 N -3.61 2.79 -0.19 1.23 1.43 -0.83 -1.47 118.68 118.04 3ith s LEU 187 Ca 0.31 -0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 52.95 3ith s LEU 187 Cb -0.05 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 3ith s LEU 187 CO 0.18 0.14 0.34 -0.31 0.23 0.00 0.00 176.35 176.92 3ith s TYR 188 N 0.51 3.40 -0.24 0.29 1.51 0.48 -2.02 117.35 121.29 3ith s TYR 188 Ca -0.08 0.58 0.01 0.00 -1.01 0.00 0.00 57.07 56.57 3ith s TYR 188 Cb -0.15 -2.43 0.06 0.00 -0.11 0.00 0.00 41.96 39.32 3ith s TYR 188 CO 0.04 0.09 -0.04 0.08 -1.11 0.00 0.00 175.55 174.61 3ith s VAL 189 N 0.95 1.52 -0.17 0.71 1.01 -0.03 -0.81 120.40 123.59 3ith s VAL 189 Ca 0.17 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 60.91 3ith s VAL 189 Cb -0.14 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.45 3ith s VAL 189 CO 0.06 -0.14 -0.20 -0.83 0.00 0.00 0.00 175.10 173.99 3ith s GLY 190 N 1.39 1.34 0.37 4.51 0.00 -0.58 0.16 107.32 114.51 3ith s GLY 190 Ca -0.05 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 43.55 3ith s GLY 190 CO -0.07 0.25 0.18 -1.14 0.00 0.00 0.00 173.10 172.32 3ith n SER 191 N 4.52 2.46 -0.07 1.64 3.41 -0.72 -1.99 113.62 122.87 3ith n SER 191 Ca -0.20 -2.37 0.02 0.00 -0.26 0.00 0.00 58.87 56.05 3ith n SER 191 Cb 0.50 0.07 -0.00 0.00 -0.26 0.00 0.00 64.21 64.52 3ith n SER 191 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3ith n ASP 192 N -1.65 0.71 -3.90 4.04 8.00 -1.26 -1.60 116.55 120.88 3ith n ASP 192 Ca -0.06 -0.85 -0.30 0.00 0.71 0.00 0.00 54.79 54.29 3ith n ASP 192 Cb 0.43 0.52 0.25 0.00 -0.02 0.00 0.00 41.12 42.30 3ith n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ith s LEU 193 N -1.26 0.22 0.37 0.64 1.43 -1.26 -4.82 118.68 114.00 3ith s LEU 193 Ca 0.03 0.90 -0.24 0.00 -1.03 0.00 0.00 54.13 53.79 3ith s LEU 193 Cb 0.03 -2.61 -0.10 0.00 0.03 0.00 0.00 46.19 43.54 3ith s LEU 193 CO 0.09 -4.44 0.95 -1.61 0.23 0.00 0.00 176.35 171.57 3ith s GLU 194 N -5.10 4.42 0.12 1.70 0.41 -1.26 -4.65 118.70 114.33 3ith s GLU 194 Ca 0.69 1.24 -0.23 0.00 -0.41 0.00 0.00 54.97 56.26 3ith s GLU 194 Cb -0.14 -2.52 -0.05 0.00 -1.78 0.00 0.00 34.13 29.64 3ith s GLU 194 CO 0.58 0.13 1.19 1.51 -0.49 0.00 0.00 175.26 178.18 3ith n ILE 195 N 0.01 -0.50 -0.34 -1.63 3.06 -1.26 -0.08 119.36 118.62 3ith n ILE 195 Ca 0.04 1.86 0.10 0.00 -2.50 0.00 0.00 62.75 62.25 3ith n ILE 195 Cb 0.52 -2.31 0.27 0.00 0.54 0.00 0.00 39.64 38.66 3ith n ILE 195 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 3ith h GLY 196 N 0.00 1.66 0.22 4.50 0.00 -1.98 0.18 103.07 107.65 3ith h GLY 196 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 3ith h GLY 196 CO -0.69 0.02 -0.11 1.46 0.00 0.00 0.00 176.54 177.22 3ith h GLN 197 N 0.81 -0.29 -0.97 4.80 4.20 -0.85 -2.75 115.11 120.06 3ith h GLN 197 Ca 0.53 0.02 0.20 0.00 0.06 0.00 0.00 58.65 59.46 3ith h GLN 197 Cb 0.71 0.07 -0.18 0.00 0.30 0.00 0.00 27.48 28.37 3ith h GLN 197 CO -0.34 -0.19 -0.22 1.25 -0.67 0.00 0.00 178.83 178.66 3ith h HIS 198 N -0.40 -0.47 0.00 2.96 2.76 -0.85 1.24 115.15 120.39 3ith h HIS 198 Ca -0.03 0.09 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 3ith h HIS 198 Cb 0.23 0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.55 3ith h HIS 198 CO 0.11 -0.42 0.00 0.00 -1.30 0.00 0.00 177.93 176.32 3ith h ARG 199 N 0.00 0.00 0.06 5.26 3.08 -0.72 -1.86 114.38 120.21 3ith h ARG 199 Ca 0.48 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.53 3ith h ARG 199 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.81 3ith h ARG 199 CO -0.99 0.00 -0.03 1.15 -1.07 0.00 0.00 179.97 179.02 3ith h THR 200 N 0.00 1.03 0.00 2.04 2.02 0.18 -3.23 112.91 114.95 3ith h THR 200 Ca 0.00 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 65.65 3ith h THR 200 Cb 0.30 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 3ith h THR 200 CO 0.00 0.32 0.00 0.29 0.37 0.00 0.00 175.52 176.50 3ith n LYS 201 N -4.78 0.00 -0.08 6.66 5.02 0.02 -1.36 118.16 123.64 3ith n LYS 201 Ca -0.07 0.08 -0.22 0.00 -2.02 0.00 0.00 58.31 56.08 3ith n LYS 201 Cb 0.29 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.67 3ith n LYS 201 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3ith h ILE 202 N 0.00 0.84 -0.34 -0.18 1.08 -1.39 -3.28 117.51 114.23 3ith h ILE 202 Ca 0.00 -2.22 0.00 0.00 -0.39 0.00 0.00 64.86 62.25 3ith h ILE 202 Cb 0.00 2.28 -0.02 0.00 -3.07 0.00 0.00 36.82 36.01 3ith h ILE 202 CO 0.00 0.45 0.22 -0.08 -0.69 0.00 0.00 178.15 178.05 3ith h GLU 203 N -0.75 0.46 -0.88 2.37 4.57 -1.23 0.18 114.58 119.30 3ith h GLU 203 Ca -0.37 -0.03 0.23 0.00 -1.18 0.00 0.00 59.36 58.01 3ith h GLU 203 Cb 1.48 -0.10 -0.15 0.00 -0.16 0.00 0.00 28.75 29.82 3ith h GLU 203 CO -0.14 0.33 0.12 0.93 -1.18 0.00 0.00 179.01 179.07 3ith h GLU 204 N 0.46 0.11 -0.06 1.92 5.08 -1.63 1.09 114.58 121.55 3ith h GLU 204 Ca 0.13 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 3ith h GLU 204 Cb -0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3ith h GLU 204 CO -0.03 0.08 -0.30 1.25 -1.00 0.00 0.00 179.01 179.01 3ith h LEU 205 N 0.12 0.11 -0.09 1.33 5.85 -1.21 0.84 115.31 122.27 3ith h LEU 205 Ca 0.53 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 59.18 3ith h LEU 205 Cb 1.06 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 3ith h LEU 205 CO -0.74 0.42 -0.11 0.03 -0.34 0.00 0.00 178.44 177.70 3ith h ARG 206 N 0.10 0.23 -0.57 1.25 3.08 0.29 -0.63 114.38 118.14 3ith h ARG 206 Ca 0.01 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 59.86 3ith h ARG 206 Cb 0.59 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 3ith h ARG 206 CO 0.04 0.67 0.06 1.96 -1.07 0.00 0.00 179.97 181.63 3ith h GLN 207 N -0.20 0.93 -0.70 0.04 1.08 -0.28 0.47 115.11 116.45 3ith h GLN 207 Ca 0.01 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 56.96 3ith h GLN 207 Cb 0.64 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.92 3ith h GLN 207 CO 0.03 0.88 0.40 1.25 -0.95 0.00 0.00 178.83 180.44 3ith h HIS 208 N 0.87 0.92 -0.12 2.96 2.76 0.78 0.19 115.15 123.51 3ith h HIS 208 Ca 0.17 -0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 58.19 3ith h HIS 208 Cb 0.43 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 3ith h HIS 208 CO 0.03 0.63 -0.57 -0.07 -1.30 0.00 0.00 177.93 176.65 3ith h LEU 209 N 0.96 0.41 -0.21 0.26 3.38 -0.32 -3.02 115.31 116.77 3ith h LEU 209 Ca 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3ith h LEU 209 Cb -0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3ith h LEU 209 CO -0.04 0.89 0.13 -0.07 0.09 0.00 0.00 178.44 179.44 3ith h LEU 210 N 0.28 0.24 -1.62 1.67 4.07 -0.24 -0.94 115.31 118.78 3ith h LEU 210 Ca 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3ith h LEU 210 Cb 1.08 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.76 3ith h LEU 210 CO 0.10 0.18 0.00 0.03 -1.08 0.00 0.00 178.44 177.67 3ith h ARG 211 N 0.27 0.00 -0.38 1.13 3.08 -0.86 0.46 114.38 118.07 3ith h ARG 211 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3ith h ARG 211 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3ith h ARG 211 CO -0.02 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.79 3ith n TRP 212 N -2.38 1.02 -2.95 3.04 8.01 -0.99 -5.02 117.44 118.17 3ith n TRP 212 Ca -0.01 -0.72 -0.08 0.00 -1.31 0.00 0.00 57.50 55.38 3ith n TRP 212 Cb 0.05 -0.24 0.01 0.00 -2.01 0.00 0.00 31.31 29.12 3ith n TRP 212 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3ith n GLY 213 N 0.17 -1.23 1.28 6.99 0.00 0.16 -5.01 105.19 107.55 3ith n GLY 213 Ca 0.20 1.04 0.00 0.00 0.00 0.00 0.00 46.02 47.26 3ith n GLY 213 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ith n LEU 214 N -0.73 0.22 -2.01 0.99 0.00 -0.39 -4.94 117.00 110.13 3ith n LEU 214 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.08 3ith n LEU 214 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.91 3ith n LEU 214 CO 0.50 -0.18 -0.48 0.35 0.00 0.00 0.00 177.39 177.58 3ith n THR 215 N -2.62-11.09 -3.97 1.96 -2.24 -1.26 -4.33 114.28 90.74 3ith n THR 215 Ca 0.00 3.21 0.00 0.00 -2.27 0.00 0.00 64.05 64.99 3ith n THR 215 Cb 0.24 -4.89 0.00 0.00 -2.10 0.00 0.00 70.33 63.58 3ith n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3ith n THR 216 N 1.45 0.00 0.09 4.28 -2.24 -1.26 -4.61 114.28 111.98 3ith n THR 216 Ca 0.00 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.62 3ith n THR 216 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 3ith n THR 216 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3ith h PRO 217 N 0.00 -0.68 -4.09 -0.78 0.13 -1.99 -3.52 132.00 121.08 3ith h PRO 217 Ca 0.00 0.05 -0.34 0.00 -0.87 0.00 0.00 66.00 64.84 3ith h PRO 217 Cb 0.00 0.15 0.07 0.00 0.13 0.00 0.00 31.00 31.35 3ith h PRO 217 CO 0.00 -0.45 -0.52 -3.47 -0.23 0.00 0.00 178.00 173.32 3ith n ASP 218 N -5.48 -5.49 0.00 1.44 4.64 -1.26 -5.22 116.55 105.19 3ith n ASP 218 Ca -0.08 -0.29 0.00 0.00 -1.38 0.00 0.00 54.79 53.05 3ith n ASP 218 Cb 0.40 -4.28 0.00 0.00 -1.04 0.00 0.00 41.12 36.21 3ith n ASP 218 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3ith n GLY 231 N -1.49 1.04 3.08 0.27 0.00 -1.26 -5.31 105.19 101.53 3ith n GLY 231 Ca -0.07 -1.09 0.02 0.00 0.00 0.00 0.00 46.02 44.88 3ith n GLY 231 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3ith n TYR 232 N 0.00 -0.32 -0.02 1.61 9.36 -1.26 -4.99 117.16 121.54 3ith n TYR 232 Ca 0.00 -0.55 0.05 0.00 3.32 0.00 0.00 57.90 60.72 3ith n TYR 232 Cb 0.00 0.25 -0.12 0.00 -0.63 0.00 0.00 39.34 38.84 3ith n TYR 232 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 3ith n GLU 233 N -0.71 0.69 -1.62 2.98 4.07 -1.26 -2.94 120.64 121.84 3ith n GLU 233 Ca 0.03 -0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 3ith n GLU 233 Cb 0.45 -1.37 0.00 0.00 -0.06 0.00 0.00 31.44 30.46 3ith n GLU 233 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 3ith n LEU 234 N -2.13 -1.41 -3.36 4.31 7.99 -1.22 -3.54 117.00 117.63 3ith n LEU 234 Ca -0.07 1.53 -0.26 0.00 -0.01 0.00 0.00 56.01 57.20 3ith n LEU 234 Cb 0.51 -1.89 -0.09 0.00 -0.11 0.00 0.00 43.42 41.84 3ith n LEU 234 CO 0.32 -0.45 -0.23 1.41 -1.51 0.00 0.00 177.39 176.93 3ith n HIS 235 N 1.03 0.35 -0.03 -1.77 8.25 -1.26 -1.88 115.22 119.90 3ith n HIS 235 Ca 0.00 -3.63 -0.14 0.00 -0.26 0.00 0.00 57.72 53.69 3ith n HIS 235 Cb 0.00 -0.20 -0.08 0.00 1.12 0.00 0.00 29.99 30.83 3ith n HIS 235 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3ith h PRO 236 N 4.72 -0.50 -6.41 -0.41 0.13 -1.76 -3.37 132.00 124.41 3ith h PRO 236 Ca 0.16 0.03 -0.63 0.00 -0.87 0.00 0.00 66.00 64.70 3ith h PRO 236 Cb 0.85 0.11 0.08 0.00 0.13 0.00 0.00 31.00 32.17 3ith h PRO 236 CO 0.51 -0.33 0.39 -0.40 -0.23 0.00 0.00 178.00 177.93 3ith n ASP 237 N -5.43 1.81 0.00 1.44 5.75 -1.25 -1.39 116.55 117.48 3ith n ASP 237 Ca -0.05 1.14 0.00 0.00 -0.01 0.00 0.00 54.79 55.87 3ith n ASP 237 Cb 0.37 -1.28 0.00 0.00 -1.03 0.00 0.00 41.12 39.18 3ith n ASP 237 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3ith n LYS 238 N 1.88 0.00 -3.32 0.11 4.01 -1.26 -5.00 118.16 114.58 3ith n LYS 238 Ca 0.14 0.14 -0.40 0.00 -0.51 0.00 0.00 58.31 57.68 3ith n LYS 238 Cb 0.27 -1.16 -0.02 0.00 -0.51 0.00 0.00 35.03 33.61 3ith n LYS 238 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 3ith n TRP 239 N -2.28 3.94 -2.79 2.13 8.01 -0.48 -5.05 117.44 120.91 3ith n TRP 239 Ca 0.00 -3.58 -0.42 0.00 -1.31 0.00 0.00 57.50 52.18 3ith n TRP 239 Cb 0.00 -1.32 -0.03 0.00 -2.01 0.00 0.00 31.31 27.95 3ith n TRP 239 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3ith s THR 240 N -1.89 4.78 0.62 -0.99 -4.23 -1.26 -5.03 115.64 107.63 3ith s THR 240 Ca 0.31 1.78 -0.18 0.00 -1.18 0.00 0.00 61.69 62.42 3ith s THR 240 Cb -0.02 -4.20 -0.04 0.00 1.34 0.00 0.00 72.50 69.58 3ith s THR 240 CO -0.03 -0.10 1.07 1.33 -0.54 0.00 0.00 174.62 176.36 3ith n VAL 241 N 5.18 4.11 -3.56 2.29 0.24 -1.26 -4.85 118.33 120.48 3ith n VAL 241 Ca 0.08 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.47 3ith n VAL 241 Cb 0.47 -1.26 -0.10 0.00 -1.47 0.00 0.00 33.84 31.48 3ith n VAL 241 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3ith s GLN 242 N -2.96 2.73 0.18 7.34 0.74 -0.54 -5.01 119.66 122.14 3ith s GLN 242 Ca 0.78 -1.34 -0.30 0.00 0.05 0.00 0.00 55.36 54.55 3ith s GLN 242 Cb -0.40 -3.83 -0.08 0.00 1.10 0.00 0.00 33.01 29.80 3ith s GLN 242 CO 0.45 -0.90 1.13 -1.25 -0.55 0.00 0.00 175.29 174.17 3ith s PRO 243 N 1.50 4.56 0.27 1.67 0.04 -1.26 -4.83 135.00 136.95 3ith s PRO 243 Ca 0.03 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 3ith s PRO 243 Cb -0.22 -3.27 -0.10 0.00 0.04 0.00 0.00 34.50 30.95 3ith s PRO 243 CO 0.04 0.02 1.48 0.42 0.04 0.00 0.00 177.00 179.01 3ith s ILE 244 N -0.17 2.47 0.03 0.56 1.01 -1.26 -5.01 121.20 118.83 3ith s ILE 244 Ca 0.50 0.40 0.02 0.00 0.00 0.00 0.00 60.65 61.58 3ith s ILE 244 Cb -0.30 -3.26 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 3ith s ILE 244 CO 0.35 0.07 -0.08 0.54 0.00 0.00 0.00 174.94 175.82 3ith s VAL 245 N -0.07 0.56 0.08 2.92 0.11 -1.26 -4.71 120.40 118.03 3ith s VAL 245 Ca 0.60 -0.86 0.02 0.00 -2.93 0.00 0.00 61.98 58.81 3ith s VAL 245 Cb -0.44 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 33.80 3ith s VAL 245 CO 0.45 -0.23 0.17 -0.76 -3.33 0.00 0.00 175.10 171.41 3ith s LEU 246 N -1.18 4.14 0.49 2.54 1.43 -1.26 -4.88 118.68 119.95 3ith s LEU 246 Ca -0.06 0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 52.96 3ith s LEU 246 Cb -0.08 -2.76 -0.08 0.00 0.03 0.00 0.00 46.19 43.30 3ith s LEU 246 CO 0.00 0.15 1.05 -0.81 0.23 0.00 0.00 176.35 176.97 3ith n PRO 247 N 0.21 1.32 -0.08 1.29 -0.04 -1.26 -4.98 135.00 131.46 3ith n PRO 247 Ca -0.07 0.48 -0.09 0.00 -0.04 0.00 0.00 63.50 63.78 3ith n PRO 247 Cb 0.52 -2.16 -0.10 0.00 -0.04 0.00 0.00 33.50 31.72 3ith n PRO 247 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3ith n GLU 248 N -0.29 1.19 -1.54 0.54 2.13 -1.26 -5.01 120.64 116.40 3ith n GLU 248 Ca 0.10 0.04 -0.53 0.00 0.66 0.00 0.00 57.16 57.43 3ith n GLU 248 Cb 0.42 -1.36 -0.06 0.00 0.27 0.00 0.00 31.44 30.71 3ith n GLU 248 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3ith n LYS 249 N -2.73 0.71 -3.73 5.31 5.02 -1.26 -4.96 118.16 116.52 3ith n LYS 249 Ca -0.27 0.25 -0.37 0.00 -2.02 0.00 0.00 58.31 55.90 3ith n LYS 249 Cb 0.91 -1.76 -0.12 0.00 -0.02 0.00 0.00 35.03 34.04 3ith n LYS 249 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ith s ASP 250 N 0.08 5.22 0.00 4.39 1.11 -1.26 -4.70 116.67 121.50 3ith s ASP 250 Ca 0.82 -0.40 0.00 0.00 0.18 0.00 0.00 52.55 53.15 3ith s ASP 250 Cb -1.02 -1.93 0.00 0.00 1.07 0.00 0.00 42.92 41.04 3ith s ASP 250 CO 0.52 -0.11 0.00 -0.24 1.18 0.00 0.00 175.17 176.52 3ith n SER 251 N 4.92 0.00 -4.67 0.27 2.88 -1.26 -5.15 113.62 110.61 3ith n SER 251 Ca -0.15 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 56.96 3ith n SER 251 Cb 0.50 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.94 3ith n SER 251 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3ith s TRP 252 N 0.00 3.22 0.67 0.66 0.52 -1.26 -4.97 118.94 117.77 3ith s TRP 252 Ca 0.00 1.32 -0.01 0.00 0.02 0.00 0.00 56.10 57.43 3ith s TRP 252 Cb 0.00 -3.35 0.09 0.00 -1.15 0.00 0.00 33.47 29.07 3ith s TRP 252 CO 0.00 -0.94 0.93 0.95 0.02 0.00 0.00 176.95 177.91 3ith s THR 253 N 2.76 2.30 0.47 2.01 -4.23 -1.26 -0.71 115.64 116.99 3ith s THR 253 Ca 0.51 -0.58 0.25 0.00 -1.18 0.00 0.00 61.69 60.69 3ith s THR 253 Cb -0.20 -2.72 0.29 0.00 1.34 0.00 0.00 72.50 71.20 3ith s THR 253 CO 0.15 0.00 2.11 0.58 -0.54 0.00 0.00 174.62 176.92 3ith h VAL 254 N -0.37 0.68 0.23 2.29 2.07 -0.99 -1.69 116.25 118.48 3ith h VAL 254 Ca -0.39 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 3ith h VAL 254 Cb 1.28 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3ith h VAL 254 CO 0.45 0.09 -0.11 -1.13 0.02 0.00 0.00 177.57 176.90 3ith h ASN 255 N 0.00 -0.26 -0.98 0.57 -1.24 -1.79 -2.35 115.58 109.53 3ith h ASN 255 Ca -0.00 0.01 0.29 0.00 0.71 0.00 0.00 56.30 57.31 3ith h ASN 255 Cb 0.23 0.07 -0.18 0.00 0.73 0.00 0.00 38.32 39.17 3ith h ASN 255 CO 0.01 -0.10 0.13 0.44 -1.29 0.00 0.00 177.43 176.62 3ith h ASP 256 N -0.48 -0.31 -0.05 1.15 3.32 -1.83 1.44 116.42 119.66 3ith h ASP 256 Ca -0.03 0.27 -0.07 0.00 0.02 0.00 0.00 57.03 57.22 3ith h ASP 256 Cb 0.24 0.43 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 3ith h ASP 256 CO 0.05 -0.35 -0.16 0.40 -1.72 0.00 0.00 179.24 177.46 3ith h ILE 257 N 0.03 1.23 -0.23 0.35 2.04 -1.38 -0.30 117.51 119.24 3ith h ILE 257 Ca 0.63 -1.02 -0.17 0.00 1.00 0.00 0.00 64.86 65.31 3ith h ILE 257 Cb 1.38 1.23 -0.00 0.00 -0.74 0.00 0.00 36.82 38.68 3ith h ILE 257 CO -0.87 0.32 -0.54 1.56 0.00 0.00 0.00 178.15 178.62 3ith h GLN 258 N 0.36 0.67 0.42 2.37 4.20 0.25 0.11 115.11 123.50 3ith h GLN 258 Ca 0.07 -0.42 -0.02 0.00 0.06 0.00 0.00 58.65 58.34 3ith h GLN 258 Cb 0.50 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.33 3ith h GLN 258 CO 0.03 1.04 -0.20 0.87 -0.67 0.00 0.00 178.83 179.90 3ith h LYS 259 N 0.52 -0.55 -0.94 1.46 1.79 -0.94 -2.21 116.57 115.71 3ith h LYS 259 Ca 0.01 0.04 0.14 0.00 -2.18 0.00 0.00 60.65 58.66 3ith h LYS 259 Cb 1.10 0.12 -0.15 0.00 -1.58 0.00 0.00 32.23 31.73 3ith h LYS 259 CO 0.11 -0.24 -0.39 -0.11 -1.08 0.00 0.00 179.45 177.74 3ith n LEU 260 N -5.20 -0.66 -0.29 2.94 7.94 -0.14 -0.51 117.00 121.08 3ith n LEU 260 Ca -0.10 1.65 -0.03 0.00 -1.11 0.00 0.00 56.01 56.42 3ith n LEU 260 Cb 0.29 -0.36 0.12 0.00 0.53 0.00 0.00 43.42 44.01 3ith n LEU 260 CO 0.29 -1.46 1.15 0.58 -1.11 0.00 0.00 177.39 176.84 3ith h VAL 261 N 0.00 1.25 -0.59 1.96 2.07 -0.72 -1.58 116.25 118.64 3ith h VAL 261 Ca 0.31 -0.63 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 3ith h VAL 261 Cb 0.54 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3ith h VAL 261 CO -0.93 0.28 0.08 1.23 0.02 0.00 0.00 177.57 178.25 3ith h GLY 262 N 1.19 1.06 0.73 2.17 0.00 -0.15 0.13 103.07 108.20 3ith h GLY 262 Ca 0.29 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 3ith h GLY 262 CO -0.04 0.67 -0.12 1.70 0.00 0.00 0.00 176.54 178.74 3ith h LYS 263 N 0.88 -0.34 -0.55 4.80 3.64 -1.07 -1.77 116.57 122.16 3ith h LYS 263 Ca 0.18 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3ith h LYS 263 Cb 0.45 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 3ith h LYS 263 CO 0.01 -0.04 0.37 -0.07 -2.27 0.00 0.00 179.45 177.45 3ith h LEU 264 N -0.62 0.62 -0.70 5.20 3.38 -1.22 0.38 115.31 122.35 3ith h LEU 264 Ca -0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 3ith h LEU 264 Cb 0.45 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3ith h LEU 264 CO 0.06 0.45 0.26 -1.13 0.09 0.00 0.00 178.44 178.17 3ith h ASN 265 N 0.74 0.99 0.04 -0.43 -1.24 -0.51 0.18 115.58 115.34 3ith h ASN 265 Ca 0.20 -0.18 -0.00 0.00 0.71 0.00 0.00 56.30 57.03 3ith h ASN 265 Cb -0.07 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 38.73 3ith h ASN 265 CO -0.05 0.90 -0.02 -0.25 -1.29 0.00 0.00 177.43 176.73 3ith h TRP 266 N 1.01 -0.05 0.00 0.67 7.01 -0.48 -3.06 115.95 121.05 3ith h TRP 266 Ca 0.23 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.23 3ith h TRP 266 Cb 0.24 0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.32 3ith h TRP 266 CO 0.02 0.33 0.00 0.00 -2.79 0.00 0.00 178.44 176.00 3ith n ALA 267 N -2.32 1.27 1.47 2.65 0.00 0.13 -0.25 120.51 123.45 3ith n ALA 267 Ca -0.08 -0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.49 3ith n ALA 267 Cb 0.21 -1.06 0.67 0.00 0.00 0.00 0.00 19.45 19.28 3ith n ALA 267 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3ith n SER 268 N -1.39 0.35 0.12 0.00 3.41 0.03 -2.13 113.62 114.01 3ith n SER 268 Ca 0.01 -0.54 0.05 0.00 -0.26 0.00 0.00 58.87 58.13 3ith n SER 268 Cb 0.04 -0.11 0.01 0.00 -0.26 0.00 0.00 64.21 63.89 3ith n SER 268 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3ith h GLN 269 N 0.43 0.00 0.04 4.33 4.20 -0.78 -3.34 115.11 119.99 3ith h GLN 269 Ca 0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.47 3ith h GLN 269 Cb 0.31 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.07 3ith h GLN 269 CO 0.00 0.29 -1.32 0.82 -0.67 0.00 0.00 178.83 177.96 3ith h ILE 270 N 0.00 0.94 -3.65 2.54 2.04 -1.67 -3.45 117.51 114.26 3ith h ILE 270 Ca -0.05 -2.24 -0.68 0.00 1.00 0.00 0.00 64.86 62.89 3ith h ILE 270 Cb 1.33 2.40 -0.35 0.00 -0.74 0.00 0.00 36.82 39.46 3ith h ILE 270 CO 0.04 0.48 -0.65 -0.31 0.00 0.00 0.00 178.15 177.71 3ith s TYR 271 N -2.40 3.48 -1.55 1.37 1.51 -0.91 -5.00 117.35 113.86 3ith s TYR 271 Ca -0.26 -2.31 0.16 0.00 -1.01 0.00 0.00 57.07 53.65 3ith s TYR 271 Cb 0.05 -2.69 0.81 0.00 -0.11 0.00 0.00 41.96 40.02 3ith s TYR 271 CO 0.65 -0.90 1.42 -0.35 -1.11 0.00 0.00 175.55 175.26 3ith n PRO 272 N 4.54 0.28 0.00 -1.71 -0.04 -1.25 -2.98 135.00 133.83 3ith n PRO 272 Ca -0.06 0.11 0.14 0.00 -0.04 0.00 0.00 63.50 63.65 3ith n PRO 272 Cb 0.42 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.82 3ith n PRO 272 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ith n GLY 273 N 0.02 -0.06 3.72 0.55 0.00 -1.26 -4.95 105.19 103.20 3ith n GLY 273 Ca 0.08 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 3ith n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ith s ILE 274 N -2.13 4.33 0.12 -0.61 1.01 -1.16 -5.03 121.20 117.73 3ith s ILE 274 Ca 0.33 1.79 0.10 0.00 0.00 0.00 0.00 60.65 62.87 3ith s ILE 274 Cb 0.20 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 3ith s ILE 274 CO 0.38 0.20 -0.22 -0.54 0.00 0.00 0.00 174.94 174.76 3ith s LYS 275 N 0.51 1.62 0.00 2.79 1.02 -1.26 -4.96 119.74 119.46 3ith s LYS 275 Ca 0.52 -1.25 0.00 0.00 0.02 0.00 0.00 55.97 55.27 3ith s LYS 275 Cb -0.26 -2.01 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 3ith s LYS 275 CO 0.30 0.47 0.00 1.33 -0.92 0.00 0.00 175.35 176.53 3ith n VAL 276 N 0.91 0.00 -0.12 3.17 0.24 -1.26 -4.86 118.33 116.41 3ith n VAL 276 Ca -0.17 -0.03 0.14 0.00 -2.04 0.00 0.00 64.34 62.25 3ith n VAL 276 Cb 0.53 0.42 0.52 0.00 -1.47 0.00 0.00 33.84 33.84 3ith n VAL 276 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 3ith h ARG 277 N 0.00 0.37 0.00 7.34 0.11 -1.99 0.31 114.38 120.52 3ith h ARG 277 Ca 0.00 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.06 3ith h ARG 277 Cb 0.00 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.00 3ith h ARG 277 CO 0.00 0.25 0.00 1.04 0.10 0.00 0.00 179.97 181.36 3ith n GLN 278 N -4.47 0.23 -0.03 0.08 1.13 -1.26 -1.05 117.38 112.01 3ith n GLN 278 Ca 0.12 0.36 -0.07 0.00 -1.94 0.00 0.00 57.00 55.47 3ith n GLN 278 Cb 0.47 -1.86 -0.14 0.00 0.11 0.00 0.00 30.24 28.82 3ith n GLN 278 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3ith n LEU 279 N -2.28 0.60 0.15 1.08 4.77 0.10 -3.73 117.00 117.69 3ith n LEU 279 Ca 0.03 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3ith n LEU 279 Cb 0.30 0.24 0.19 0.00 -2.33 0.00 0.00 43.42 41.83 3ith n LEU 279 CO 0.24 0.37 0.52 0.00 -1.33 0.00 0.00 177.39 177.19 3ith h LYS 281 N 0.00 0.89 0.00 0.00 1.57 -1.21 -1.82 116.57 116.00 3ith h LYS 281 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3ith h LYS 281 Cb 1.10 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.20 3ith h LYS 281 CO 0.07 0.59 0.00 1.28 -0.57 0.00 0.00 179.45 180.83 3ith n LEU 282 N -4.63 0.00 -0.18 2.94 4.77 -1.14 -2.97 117.00 115.79 3ith n LEU 282 Ca 0.08 0.48 0.02 0.00 -0.03 0.00 0.00 56.01 56.56 3ith n LEU 282 Cb 0.09 -0.48 0.03 0.00 -2.33 0.00 0.00 43.42 40.72 3ith n LEU 282 CO 0.33 -0.35 0.39 0.18 -1.33 0.00 0.00 177.39 176.61 3ith n LEU 283 N -1.48 1.67 -4.62 2.23 4.77 -0.70 -5.04 117.00 113.83 3ith n LEU 283 Ca 0.02 -1.35 -0.42 0.00 -0.03 0.00 0.00 56.01 54.23 3ith n LEU 283 Cb 0.09 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 3ith n LEU 283 CO 0.07 0.39 0.64 0.54 -1.33 0.00 0.00 177.39 177.71 3ith n ARG 284 N 0.09 1.48 0.00 3.23 1.74 -1.10 -4.75 116.66 117.35 3ith n ARG 284 Ca 0.03 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.64 3ith n ARG 284 Cb 0.17 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 29.54 3ith n ARG 284 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ith n GLY 285 N 1.11 -0.44 2.75 -0.13 0.00 -1.26 -4.78 105.19 102.45 3ith n GLY 285 Ca 0.09 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 3ith n GLY 285 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ith n THR 286 N -0.47 5.24 -2.06 2.61 -1.04 -1.26 -5.05 114.28 112.24 3ith n THR 286 Ca 0.00 -5.87 -0.32 0.00 -2.04 0.00 0.00 64.05 55.82 3ith n THR 286 Cb 0.00 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 66.83 3ith n THR 286 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3ith s LYS 287 N -3.75 3.55 0.50 -2.82 1.02 -1.26 -5.06 119.74 111.92 3ith s LYS 287 Ca 0.39 0.98 -0.17 0.00 0.02 0.00 0.00 55.97 57.19 3ith s LYS 287 Cb 0.17 -2.07 -0.08 0.00 -0.52 0.00 0.00 37.83 35.32 3ith s LYS 287 CO -0.07 -0.61 0.98 0.00 -0.92 0.00 0.00 175.35 174.73 3ith s ALA 288 N -2.76 3.07 0.11 5.17 0.00 -1.26 -5.00 121.76 121.09 3ith s ALA 288 Ca 0.59 0.21 -0.26 0.00 0.00 0.00 0.00 51.96 52.50 3ith s ALA 288 Cb -0.12 -3.12 -0.09 0.00 0.00 0.00 0.00 23.12 19.79 3ith s ALA 288 CO 0.41 -0.18 1.66 -0.07 0.00 0.00 0.00 175.76 177.59 3ith h LEU 289 N 1.06 -0.52 -1.54 0.00 3.38 -1.97 -2.64 115.31 113.08 3ith h LEU 289 Ca -0.47 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3ith h LEU 289 Cb 1.18 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3ith h LEU 289 CO 0.61 -0.27 0.22 0.74 0.09 0.00 0.00 178.44 179.84 3ith h THR 290 N -0.36 0.00 -3.02 0.22 2.02 -1.96 -2.36 112.91 107.44 3ith h THR 290 Ca 0.02 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.64 3ith h THR 290 Cb 0.38 0.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 3ith h THR 290 CO -0.10 0.00 0.99 -0.70 0.37 0.00 0.00 175.52 176.08 3ith s GLU 291 N -3.69 3.94 0.12 6.66 2.12 -1.00 -4.71 118.70 122.15 3ith s GLU 291 Ca -0.03 1.41 -0.31 0.00 0.36 0.00 0.00 54.97 56.40 3ith s GLU 291 Cb 0.07 -3.90 -0.09 0.00 0.26 0.00 0.00 34.13 30.47 3ith s GLU 291 CO 0.21 -1.09 1.63 0.08 -0.54 0.00 0.00 175.26 175.55 3ith s VAL 292 N 4.40 2.77 -0.17 3.70 1.01 -1.26 -2.26 120.40 128.59 3ith s VAL 292 Ca 0.59 0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.98 3ith s VAL 292 Cb -0.19 -3.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 3ith s VAL 292 CO 0.23 0.02 -0.10 -0.63 0.00 0.00 0.00 175.10 174.61 3ith s ILE 293 N 1.88 3.10 -0.06 2.22 1.01 0.12 -4.96 121.20 124.51 3ith s ILE 293 Ca 0.73 -0.62 -0.30 0.00 0.00 0.00 0.00 60.65 60.46 3ith s ILE 293 Cb -0.42 -2.34 -0.06 0.00 0.01 0.00 0.00 42.46 39.64 3ith s ILE 293 CO 0.32 0.49 1.80 -2.16 0.00 0.00 0.00 174.94 175.39 3ith s PRO 294 N 0.82 4.04 -0.49 2.79 0.04 -1.26 -4.49 135.00 136.45 3ith s PRO 294 Ca -0.03 2.26 -0.27 0.00 0.04 0.00 0.00 61.00 62.99 3ith s PRO 294 Cb -0.15 -4.08 -0.02 0.00 0.04 0.00 0.00 34.50 30.29 3ith s PRO 294 CO 0.01 -1.04 1.78 -1.17 0.04 0.00 0.00 177.00 176.61 3ith s LEU 295 N 4.66 3.40 0.80 -3.56 2.96 -1.26 -4.98 118.68 120.71 3ith s LEU 295 Ca 0.80 0.73 -0.12 0.00 -0.22 0.00 0.00 54.13 55.32 3ith s LEU 295 Cb -0.35 -3.00 0.08 0.00 0.50 0.00 0.00 46.19 43.42 3ith s LEU 295 CO 0.34 -2.02 1.15 0.42 -1.32 0.00 0.00 176.35 174.92 3ith s THR 296 N 7.82 2.49 0.04 3.68 -4.23 -1.26 -4.78 115.64 119.41 3ith s THR 296 Ca 0.70 0.19 -0.18 0.00 -1.18 0.00 0.00 61.69 61.23 3ith s THR 296 Cb -0.16 -2.53 -0.09 0.00 1.34 0.00 0.00 72.50 71.07 3ith s THR 296 CO 0.27 -0.18 1.28 -0.33 -0.54 0.00 0.00 174.62 175.12 3ith h GLU 297 N -1.06 -0.48 -1.13 3.99 5.08 -1.98 -1.07 114.58 117.93 3ith h GLU 297 Ca -0.45 0.03 0.44 0.00 -1.00 0.00 0.00 59.36 58.38 3ith h GLU 297 Cb 1.27 0.11 -0.17 0.00 0.50 0.00 0.00 28.75 30.46 3ith h GLU 297 CO 0.47 -0.32 0.65 0.93 -1.00 0.00 0.00 179.01 179.74 3ith h GLU 298 N -0.50 0.00 0.35 2.33 3.07 -1.97 0.71 114.58 118.57 3ith h GLU 298 Ca -0.03 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 3ith h GLU 298 Cb 0.44 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 3ith h GLU 298 CO -0.04 0.00 -0.17 0.00 -1.40 0.00 0.00 179.01 177.41 3ith h ALA 299 N 1.87 -0.46 0.00 3.43 0.00 -1.69 -2.18 119.26 120.23 3ith h ALA 299 Ca 0.86 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.59 3ith h ALA 299 Cb 2.44 0.18 0.00 0.00 0.00 0.00 0.00 17.79 20.41 3ith h ALA 299 CO -0.67 -0.60 0.02 0.93 0.00 0.00 0.00 179.25 178.93 3ith h GLU 300 N -0.79 0.00 0.26 0.00 5.08 0.16 0.32 114.58 119.61 3ith h GLU 300 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3ith h GLU 300 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3ith h GLU 300 CO 0.08 0.00 -0.13 1.25 -1.00 0.00 0.00 179.01 179.21 3ith h LEU 301 N 0.00 -0.30 -1.63 1.33 5.85 -0.73 -2.41 115.31 117.42 3ith h LEU 301 Ca 0.00 0.01 0.24 0.00 0.84 0.00 0.00 57.88 58.97 3ith h LEU 301 Cb 0.03 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 3ith h LEU 301 CO 0.00 0.13 0.64 -0.08 -0.34 0.00 0.00 178.44 178.79 3ith h GLU 302 N -1.03 0.27 0.12 1.25 4.81 -0.38 0.82 114.58 120.43 3ith h GLU 302 Ca -0.04 -0.02 -0.26 0.00 -0.13 0.00 0.00 59.36 58.92 3ith h GLU 302 Cb 0.27 -0.06 0.03 0.00 0.63 0.00 0.00 28.75 29.62 3ith h GLU 302 CO 0.06 0.18 -1.08 1.25 -0.73 0.00 0.00 179.01 178.69 3ith h LEU 303 N 0.28 0.74 -0.55 1.64 5.85 -0.55 0.11 115.31 122.84 3ith h LEU 303 Ca 0.49 -0.85 -0.13 0.00 0.84 0.00 0.00 57.88 58.24 3ith h LEU 303 Cb 1.45 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3ith h LEU 303 CO -0.15 1.52 -0.21 0.00 -0.34 0.00 0.00 178.44 179.26 3ith h ALA 304 N 0.24 0.74 0.52 1.25 0.00 -0.76 0.21 119.26 121.46 3ith h ALA 304 Ca -0.17 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 3ith h ALA 304 Cb 1.79 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.39 3ith h ALA 304 CO 0.21 0.67 -0.46 1.49 0.00 0.00 0.00 179.25 181.15 3ith h GLU 305 N 0.82 -0.93 -0.47 0.00 4.57 0.60 -2.50 114.58 116.68 3ith h GLU 305 Ca 0.11 0.06 0.07 0.00 -1.18 0.00 0.00 59.36 58.43 3ith h GLU 305 Cb 0.77 0.21 -0.06 0.00 -0.16 0.00 0.00 28.75 29.51 3ith h GLU 305 CO 0.06 -0.62 0.11 -0.91 -1.18 0.00 0.00 179.01 176.48 3ith h ASN 306 N -0.96 0.05 -0.91 1.04 -0.26 -0.80 -1.72 115.58 112.02 3ith h ASN 306 Ca -0.07 0.08 0.25 0.00 -0.56 0.00 0.00 56.30 56.00 3ith h ASN 306 Cb 0.82 0.09 -0.04 0.00 -1.06 0.00 0.00 38.32 38.13 3ith h ASN 306 CO -0.02 0.06 0.64 -0.09 -1.06 0.00 0.00 177.43 176.95 3ith h ARG 307 N 0.26 0.08 -0.02 0.81 2.43 -0.48 -0.94 114.38 116.51 3ith h ARG 307 Ca 0.23 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3ith h ARG 307 Cb 0.29 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3ith h ARG 307 CO -0.28 0.05 -0.05 -1.91 -1.51 0.00 0.00 179.97 176.27 3ith n GLU 308 N -4.32 2.00 0.01 0.20 2.13 -0.66 -3.52 120.64 116.48 3ith n GLU 308 Ca 0.19 -1.54 -0.21 0.00 0.66 0.00 0.00 57.16 56.26 3ith n GLU 308 Cb 0.92 -1.47 -0.14 0.00 0.27 0.00 0.00 31.44 31.02 3ith n GLU 308 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3ith h ILE 309 N 3.76 0.67 0.00 6.31 1.08 -0.99 -3.35 117.51 124.98 3ith h ILE 309 Ca 0.00 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 3ith h ILE 309 Cb 0.83 2.54 0.00 0.00 -3.07 0.00 0.00 36.82 37.12 3ith h ILE 309 CO 0.00 0.89 0.00 0.18 -0.69 0.00 0.00 178.15 178.53 3ith n LEU 310 N -3.48 0.00 -0.00 1.44 7.99 -1.03 -3.29 117.00 118.63 3ith n LEU 310 Ca -0.31 0.32 -0.00 0.00 -0.01 0.00 0.00 56.01 56.02 3ith n LEU 310 Cb 1.05 -0.32 -0.00 0.00 -0.11 0.00 0.00 43.42 44.04 3ith n LEU 310 CO 0.44 -0.28 -0.00 0.11 -1.51 0.00 0.00 177.39 176.15 3ith h LYS 311 N 0.00 0.00 -6.63 3.23 6.56 -1.70 -3.37 116.57 114.67 3ith h LYS 311 Ca 0.00 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.04 3ith h LYS 311 Cb 0.04 0.00 0.07 0.00 -0.57 0.00 0.00 32.23 31.77 3ith h LYS 311 CO 0.00 0.00 0.86 -0.85 -2.06 0.00 0.00 179.45 177.40 3ith n GLU 312 N -2.20 2.45 -0.57 3.15 0.28 -1.21 -4.97 120.64 117.59 3ith n GLU 312 Ca -0.00 0.88 -0.30 0.00 -0.16 0.00 0.00 57.16 57.58 3ith n GLU 312 Cb 0.00 -2.66 0.22 0.00 1.43 0.00 0.00 31.44 30.43 3ith n GLU 312 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 3ith n PRO 313 N 3.13 -2.02 -2.38 3.44 -0.04 -1.26 -5.00 135.00 130.87 3ith n PRO 313 Ca 0.14 -0.56 -0.27 0.00 -0.04 0.00 0.00 63.50 62.77 3ith n PRO 313 Cb 0.33 -1.98 0.03 0.00 -0.04 0.00 0.00 33.50 31.83 3ith n PRO 313 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3ith s VAL 314 N -2.35 3.93 0.15 0.52 1.01 -1.26 -5.11 120.40 117.29 3ith s VAL 314 Ca 0.63 0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.81 3ith s VAL 314 Cb -0.20 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 3ith s VAL 314 CO 0.65 -0.58 -0.20 -1.00 0.00 0.00 0.00 175.10 173.97 3ith s HIS 315 N -2.98 1.89 0.00 5.22 3.76 -1.26 -4.80 115.29 117.12 3ith s HIS 315 Ca 0.53 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 55.00 3ith s HIS 315 Cb -0.11 -0.98 0.00 0.00 1.11 0.00 0.00 32.58 32.61 3ith s HIS 315 CO 0.46 0.31 0.00 0.41 -0.85 0.00 0.00 174.74 175.07 3ith n GLY 316 N 0.57 0.89 3.06 -2.22 0.00 -1.26 -5.06 105.19 101.18 3ith n GLY 316 Ca -0.15 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 3ith n GLY 316 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ith s VAL 317 N -2.00 3.05 -0.06 1.61 -7.23 -1.26 -5.07 120.40 109.44 3ith s VAL 317 Ca 0.00 -2.53 0.05 0.00 -1.81 0.00 0.00 61.98 57.68 3ith s VAL 317 Cb 0.00 -3.10 -0.00 0.00 0.56 0.00 0.00 36.38 33.84 3ith s VAL 317 CO 0.00 -0.73 -0.21 -0.31 -0.31 0.00 0.00 175.10 173.54 3ith s TYR 318 N 0.58 2.11 0.20 2.82 2.02 -1.26 -5.00 117.35 118.82 3ith s TYR 318 Ca 0.12 -0.68 -0.32 0.00 -0.37 0.00 0.00 57.07 55.82 3ith s TYR 318 Cb -0.22 -1.41 -0.15 0.00 -0.40 0.00 0.00 41.96 39.78 3ith s TYR 318 CO -0.04 -0.24 1.25 0.98 -1.57 0.00 0.00 175.55 175.93 3ith n TYR 319 N 3.20 1.63 -3.93 2.71 9.36 -1.26 -4.97 117.16 123.90 3ith n TYR 319 Ca -0.18 0.58 -0.35 0.00 3.32 0.00 0.00 57.90 61.27 3ith n TYR 319 Cb 0.52 -2.35 -0.14 0.00 -0.63 0.00 0.00 39.34 36.75 3ith n TYR 319 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3ith s ASP 320 N 0.09 4.53 0.30 2.98 -1.08 -1.26 -5.03 116.67 117.20 3ith s ASP 320 Ca 0.71 -0.95 0.01 0.00 -0.52 0.00 0.00 52.55 51.80 3ith s ASP 320 Cb -0.77 -1.70 0.47 0.00 -1.46 0.00 0.00 42.92 39.47 3ith s ASP 320 CO 0.51 -0.16 1.85 -0.65 0.52 0.00 0.00 175.17 177.24 3ith h PRO 321 N 8.03 0.74 -0.02 4.34 0.11 -2.01 -2.95 132.00 140.24 3ith h PRO 321 Ca -0.30 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ith h PRO 321 Cb 1.10 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3ith h PRO 321 CO 0.57 0.68 0.00 -1.13 -0.21 0.00 0.00 178.00 177.91 3ith n SER 322 N -4.29 0.20 -4.56 -2.05 3.41 -1.26 -4.86 113.62 100.22 3ith n SER 322 Ca 0.03 -1.35 -0.33 0.00 -0.26 0.00 0.00 58.87 56.97 3ith n SER 322 Cb 0.22 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.05 3ith n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3ith s LYS 323 N -1.98 2.58 0.51 4.33 1.02 -1.12 -5.11 119.74 119.96 3ith s LYS 323 Ca 0.33 -0.67 -0.23 0.00 0.02 0.00 0.00 55.97 55.42 3ith s LYS 323 Cb 0.16 -2.48 -0.06 0.00 -0.52 0.00 0.00 37.83 34.92 3ith s LYS 323 CO 0.26 0.62 1.30 -0.51 -0.92 0.00 0.00 175.35 176.11 3ith s ASP 324 N -1.06 5.63 -0.07 2.83 1.01 -1.26 -4.91 116.67 118.83 3ith s ASP 324 Ca 0.14 2.64 -0.20 0.00 0.71 0.00 0.00 52.55 55.84 3ith s ASP 324 Cb -0.11 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.15 3ith s ASP 324 CO 0.04 -1.32 0.56 -0.76 0.21 0.00 0.00 175.17 173.90 3ith s LEU 325 N -3.26 4.32 0.28 1.23 1.43 -1.26 -4.66 118.68 116.77 3ith s LEU 325 Ca 0.68 1.00 0.07 0.00 -1.03 0.00 0.00 54.13 54.85 3ith s LEU 325 Cb -0.37 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 3ith s LEU 325 CO 0.45 0.00 0.24 -0.63 0.23 0.00 0.00 176.35 176.64 3ith s ILE 326 N 0.43 4.11 -0.20 -0.59 1.01 -0.06 -0.21 121.20 125.69 3ith s ILE 326 Ca 0.30 -1.38 -0.07 0.00 0.00 0.00 0.00 60.65 59.50 3ith s ILE 326 Cb -0.17 -3.33 0.09 0.00 0.01 0.00 0.00 42.46 39.07 3ith s ILE 326 CO 0.14 -0.28 0.43 0.00 0.00 0.00 0.00 174.94 175.23 3ith s ALA 327 N -2.20 -1.21 0.02 9.38 0.00 -1.04 -2.49 121.76 124.23 3ith s ALA 327 Ca 0.36 1.56 0.02 0.00 0.00 0.00 0.00 51.96 53.90 3ith s ALA 327 Cb -0.07 -1.33 -0.04 0.00 0.00 0.00 0.00 23.12 21.68 3ith s ALA 327 CO 0.26 -0.74 0.04 -1.21 0.00 0.00 0.00 175.76 174.10 3ith s GLU 328 N 2.56 2.85 0.02 0.00 2.02 -0.21 -0.86 118.70 125.07 3ith s GLU 328 Ca -0.02 -0.61 0.07 0.00 0.02 0.00 0.00 54.97 54.42 3ith s GLU 328 Cb -0.12 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.37 3ith s GLU 328 CO -0.13 0.61 -0.21 0.42 0.02 0.00 0.00 175.26 175.97 3ith s ILE 329 N -1.19 1.68 -0.03 -1.63 1.01 -1.24 -1.36 121.20 118.43 3ith s ILE 329 Ca 0.23 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 59.83 3ith s ILE 329 Cb -0.12 -1.43 0.00 0.00 0.01 0.00 0.00 42.46 40.93 3ith s ILE 329 CO 0.14 0.33 -0.11 -1.10 0.00 0.00 0.00 174.94 174.20 3ith s GLN 330 N -0.88 1.22 -0.00 2.79 1.11 0.11 -4.43 119.66 119.58 3ith s GLN 330 Ca 0.08 -0.37 -0.30 0.00 0.01 0.00 0.00 55.36 54.77 3ith s GLN 330 Cb -0.08 -1.10 -0.04 0.00 -1.01 0.00 0.00 33.01 30.78 3ith s GLN 330 CO 0.01 0.12 1.17 0.21 0.01 0.00 0.00 175.29 176.81 3ith s LYS 331 N 0.25 4.41 0.00 2.91 2.20 -1.26 -1.50 119.74 126.75 3ith s LYS 331 Ca -0.05 1.68 0.11 0.00 -0.36 0.00 0.00 55.97 57.35 3ith s LYS 331 Cb -0.10 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.71 3ith s LYS 331 CO 0.01 -0.32 0.61 1.04 -0.36 0.00 0.00 175.35 176.33 3ith n GLN 332 N 4.54 2.48 0.00 4.03 1.13 -0.15 -4.94 117.38 124.46 3ith n GLN 332 Ca 0.10 -0.43 0.00 0.00 -1.94 0.00 0.00 57.00 54.73 3ith n GLN 332 Cb 0.47 -1.09 0.00 0.00 0.11 0.00 0.00 30.24 29.73 3ith n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ith n GLY 333 N 1.06 2.09 2.07 1.08 0.00 -1.20 -4.81 105.19 105.48 3ith n GLY 333 Ca 0.04 -0.71 -0.05 0.00 0.00 0.00 0.00 46.02 45.30 3ith n GLY 333 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ith n GLN 334 N 0.00 1.01 -1.19 1.61 1.13 -1.26 -4.09 117.38 114.59 3ith n GLN 334 Ca 0.00 -0.43 -0.07 0.00 -1.94 0.00 0.00 57.00 54.57 3ith n GLN 334 Cb 0.00 -1.63 -0.03 0.00 0.11 0.00 0.00 30.24 28.69 3ith n GLN 334 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ith n GLY 335 N 2.44 0.87 3.74 1.08 0.00 -1.26 -4.76 105.19 107.29 3ith n GLY 335 Ca 0.18 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 3ith n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ith s GLN 336 N -2.25 2.98 -0.04 1.61 -0.21 -1.26 -4.15 119.66 116.33 3ith s GLN 336 Ca 0.00 -0.50 0.00 0.00 0.02 0.00 0.00 55.36 54.88 3ith s GLN 336 Cb 0.00 -2.80 0.03 0.00 1.00 0.00 0.00 33.01 31.23 3ith s GLN 336 CO 0.00 0.65 -0.01 -1.58 -2.12 0.00 0.00 175.29 172.24 3ith s TRP 337 N -1.11 0.46 0.05 0.91 0.52 -0.22 -0.98 118.94 118.57 3ith s TRP 337 Ca 0.20 -0.06 0.02 0.00 0.02 0.00 0.00 56.10 56.28 3ith s TRP 337 Cb -0.12 -0.54 -0.04 0.00 -1.15 0.00 0.00 33.47 31.63 3ith s TRP 337 CO 0.11 -0.18 0.07 0.95 0.02 0.00 0.00 176.95 177.91 3ith s THR 338 N 1.22 4.51 0.03 2.01 -4.23 -0.56 -0.75 115.64 117.87 3ith s THR 338 Ca -0.07 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 59.75 3ith s THR 338 Cb -0.13 -3.13 -0.02 0.00 1.34 0.00 0.00 72.50 70.56 3ith s THR 338 CO -0.02 0.21 0.01 -0.72 -0.54 0.00 0.00 174.62 173.56 3ith s TYR 339 N -1.30 0.32 -0.00 3.99 -0.85 -0.79 -0.71 117.35 118.00 3ith s TYR 339 Ca 0.26 -0.67 0.02 0.00 -0.52 0.00 0.00 57.07 56.16 3ith s TYR 339 Cb -0.12 -0.23 -0.01 0.00 0.38 0.00 0.00 41.96 41.98 3ith s TYR 339 CO 0.18 -0.29 -0.07 -0.65 -1.52 0.00 0.00 175.55 173.20 3ith s GLN 340 N -2.48 0.56 -0.15 -3.49 1.11 -0.47 -1.75 119.66 112.99 3ith s GLN 340 Ca -0.06 -0.27 -0.01 0.00 0.01 0.00 0.00 55.36 55.02 3ith s GLN 340 Cb -0.02 -0.54 -0.01 0.00 -1.01 0.00 0.00 33.01 31.43 3ith s GLN 340 CO -0.05 0.15 -0.11 0.42 0.01 0.00 0.00 175.29 175.72 3ith s ILE 341 N -0.22 3.16 0.23 1.08 1.01 -0.41 -1.05 121.20 125.01 3ith s ILE 341 Ca 0.02 -0.61 -0.18 0.00 0.00 0.00 0.00 60.65 59.89 3ith s ILE 341 Cb -0.03 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 40.10 3ith s ILE 341 CO -0.00 0.50 0.58 -0.72 0.00 0.00 0.00 174.94 175.30 3ith s TYR 342 N 0.64 -0.05 0.00 3.97 -0.85 -1.04 -0.47 117.35 119.56 3ith s TYR 342 Ca -0.06 -0.33 0.00 0.00 -0.52 0.00 0.00 57.07 56.16 3ith s TYR 342 Cb -0.15 0.46 0.00 0.00 0.38 0.00 0.00 41.96 42.65 3ith s TYR 342 CO 0.03 -1.04 0.00 1.04 -1.52 0.00 0.00 175.55 174.06 3ith n GLN 343 N -0.39 2.93 -4.31 -3.49 6.02 -1.26 -0.88 117.38 115.99 3ith n GLN 343 Ca -0.06 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.68 3ith n GLN 343 Cb 0.61 -0.99 -0.12 0.00 1.02 0.00 0.00 30.24 30.76 3ith n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3ith s GLU 344 N -1.98 1.19 0.06 -1.09 0.41 -1.26 -4.90 118.70 111.14 3ith s GLU 344 Ca 0.00 -1.24 -0.36 0.00 -0.41 0.00 0.00 54.97 52.96 3ith s GLU 344 Cb 0.00 -1.45 -0.15 0.00 -1.78 0.00 0.00 34.13 30.75 3ith s GLU 344 CO 0.00 0.33 1.48 -0.35 -0.49 0.00 0.00 175.26 176.23 3ith n PRO 345 N 0.90 1.50 -1.00 0.39 -0.04 -1.26 -2.37 135.00 133.13 3ith n PRO 345 Ca -0.18 0.54 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 3ith n PRO 345 Cb 0.54 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 3ith n PRO 345 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3ith n PHE 346 N 3.28 0.00 -3.82 0.54 3.72 -1.26 -4.97 117.46 114.95 3ith n PHE 346 Ca 0.19 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.31 3ith n PHE 346 Cb 0.22 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.64 3ith n PHE 346 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3ith s LYS 347 N -0.00 2.20 -0.12 -1.08 1.02 -1.00 -4.66 119.74 116.10 3ith s LYS 347 Ca 0.00 -3.14 -0.29 0.00 0.02 0.00 0.00 55.97 52.56 3ith s LYS 347 Cb 0.00 -3.09 -0.01 0.00 -0.52 0.00 0.00 37.83 34.21 3ith s LYS 347 CO 0.00 -1.30 1.01 -0.80 -0.92 0.00 0.00 175.35 173.34 3ith s ASN 348 N -1.20 7.22 0.17 2.83 0.01 -1.26 -4.16 114.94 118.55 3ith s ASN 348 Ca 0.26 1.50 0.02 0.00 -0.71 0.00 0.00 52.86 53.93 3ith s ASN 348 Cb -0.03 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 39.08 3ith s ASN 348 CO -0.17 -0.48 1.39 -0.07 -1.51 0.00 0.00 177.10 176.26 3ith h LEU 349 N 8.23 0.29 -7.49 0.60 3.38 -1.14 -3.47 115.31 115.70 3ith h LEU 349 Ca -0.29 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.40 3ith h LEU 349 Cb 1.13 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.67 3ith h LEU 349 CO 0.87 1.01 -0.09 -0.75 0.09 0.00 0.00 178.44 179.57 3ith s LYS 350 N -3.28 1.09 -0.17 1.13 2.20 -1.01 -5.01 119.74 114.70 3ith s LYS 350 Ca -0.03 -0.77 -0.14 0.00 -0.36 0.00 0.00 55.97 54.67 3ith s LYS 350 Cb 0.10 0.46 0.05 0.00 -1.51 0.00 0.00 37.83 36.93 3ith s LYS 350 CO 0.83 -0.43 0.43 0.95 -0.36 0.00 0.00 175.35 176.78 3ith s THR 351 N -3.82 -0.01 0.31 3.43 -4.23 -1.26 -1.28 115.64 108.78 3ith s THR 351 Ca 0.05 0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.51 3ith s THR 351 Cb 0.02 -0.61 0.00 0.00 1.34 0.00 0.00 72.50 73.25 3ith s THR 351 CO -0.10 0.01 0.49 -0.83 -0.54 0.00 0.00 174.62 173.65 3ith s GLY 352 N 0.50 1.08 0.45 3.99 0.00 -0.72 -1.47 107.32 111.14 3ith s GLY 352 Ca -0.02 -1.25 0.04 0.00 0.00 0.00 0.00 44.72 43.49 3ith s GLY 352 CO -0.03 -0.83 0.02 -1.59 0.00 0.00 0.00 173.10 170.67 3ith s LYS 353 N -3.32 2.04 -0.16 2.90 -2.85 -1.26 -1.89 119.74 115.20 3ith s LYS 353 Ca 0.27 -2.23 -0.09 0.00 -1.00 0.00 0.00 55.97 52.92 3ith s LYS 353 Cb -0.01 -1.49 0.06 0.00 -2.06 0.00 0.00 37.83 34.33 3ith s LYS 353 CO 0.16 -0.22 0.39 -0.47 0.10 0.00 0.00 175.35 175.31 3ith s TYR 354 N -2.85 -0.57 0.00 1.78 5.04 0.07 -4.94 117.35 115.88 3ith s TYR 354 Ca 0.22 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 56.08 3ith s TYR 354 Cb 0.06 0.24 0.00 0.00 0.35 0.00 0.00 41.96 42.61 3ith s TYR 354 CO 0.11 -0.33 0.00 0.00 -1.34 0.00 0.00 175.55 173.99 3ith n ALA 355 N 4.28 0.00 0.00 3.97 0.00 -1.26 -1.05 120.51 126.45 3ith n ALA 355 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3ith n ALA 355 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 3ith n ALA 355 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3ith n ARG 356 N 0.00 0.00 -4.25 0.00 0.63 -1.26 -5.02 116.66 106.77 3ith n ARG 356 Ca 0.00 0.00 -0.17 0.00 -0.92 0.00 0.00 57.85 56.76 3ith n ARG 356 Cb 0.00 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 32.77 3ith n ARG 356 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 3ith s MET 357 N 0.71 0.57 -0.21 -0.14 -1.94 -1.26 -5.10 119.30 111.92 3ith s MET 357 Ca 0.00 -0.28 -0.31 0.00 -1.71 0.00 0.00 55.69 53.39 3ith s MET 357 Cb 0.00 -0.54 0.16 0.00 2.01 0.00 0.00 34.83 36.46 3ith s MET 357 CO 0.00 0.15 1.19 -0.98 -0.01 0.00 0.00 175.02 175.37 3ith s ARG 358 N -0.25 0.32 1.62 2.03 1.70 -1.26 -4.76 118.95 118.33 3ith s ARG 358 Ca 0.02 0.02 0.00 0.00 -0.47 0.00 0.00 55.73 55.30 3ith s ARG 358 Cb -0.03 0.15 0.00 0.00 -0.57 0.00 0.00 34.95 34.50 3ith s ARG 358 CO -0.00 -0.11 0.00 0.41 -1.08 0.00 0.00 175.30 174.52 3ith n GLY 359 N 0.43 0.27 2.75 3.88 0.00 -1.26 -3.54 105.19 107.72 3ith n GLY 359 Ca -0.04 0.54 -0.42 0.00 0.00 0.00 0.00 46.02 46.11 3ith n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ith n ALA 360 N 5.96 5.81 0.00 4.61 0.00 -1.26 -4.05 120.51 131.58 3ith n ALA 360 Ca 0.00 -4.67 0.00 0.00 0.00 0.00 0.00 53.44 48.77 3ith n ALA 360 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.20 3ith n ALA 360 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3ith n HIS 361 N 0.40 0.00 -1.77 0.00 -0.00 -1.23 -5.12 115.22 107.50 3ith n HIS 361 Ca 0.41 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.70 3ith n HIS 361 Cb 0.28 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.24 3ith n HIS 361 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3ith s THR 362 N -0.12 3.20 0.00 3.57 2.01 -1.26 -4.71 115.64 118.33 3ith s THR 362 Ca 0.00 0.22 0.00 0.00 0.31 0.00 0.00 61.69 62.22 3ith s THR 362 Cb 0.00 -3.20 0.00 0.00 0.01 0.00 0.00 72.50 69.31 3ith s THR 362 CO 0.00 -0.09 0.00 -3.20 -0.69 0.00 0.00 174.62 170.64 3ith n ASN 363 N 9.51 0.00 -0.16 3.53 2.85 -1.26 -5.04 115.26 124.69 3ith n ASN 363 Ca 0.24 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.66 3ith n ASN 363 Cb 0.44 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.42 3ith n ASN 363 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3ith n ASP 364 N 0.00 -0.41 -0.23 1.20 9.92 -1.26 -0.64 116.55 125.12 3ith n ASP 364 Ca 0.00 0.90 0.04 0.00 -0.53 0.00 0.00 54.79 55.20 3ith n ASP 364 Cb 0.00 -0.20 0.16 0.00 -0.64 0.00 0.00 41.12 40.44 3ith n ASP 364 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 3ith h VAL 365 N 0.00 0.61 0.02 2.53 2.07 -1.97 0.13 116.25 119.63 3ith h VAL 365 Ca 0.06 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 3ith h VAL 365 Cb 0.16 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 3ith h VAL 365 CO -0.36 0.06 -0.01 0.50 0.02 0.00 0.00 177.57 177.78 3ith h LYS 366 N 0.33 -0.02 -0.89 1.57 3.64 -1.22 0.32 116.57 120.30 3ith h LYS 366 Ca 0.38 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.74 3ith h LYS 366 Cb 0.59 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 3ith h LYS 366 CO -0.43 -0.02 0.47 1.96 -2.27 0.00 0.00 179.45 179.16 3ith h GLN 367 N -0.02 1.25 -0.09 1.90 4.20 -0.85 0.63 115.11 122.12 3ith h GLN 367 Ca -0.00 -0.16 -0.11 0.00 0.06 0.00 0.00 58.65 58.45 3ith h GLN 367 Cb 0.02 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.55 3ith h GLN 367 CO 0.00 0.92 -0.43 1.25 -0.67 0.00 0.00 178.83 179.90 3ith h LEU 368 N 1.25 0.21 -0.16 1.46 5.85 -0.60 0.25 115.31 123.57 3ith h LEU 368 Ca 0.31 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 3ith h LEU 368 Cb 0.05 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 3ith h LEU 368 CO -0.05 0.62 -0.18 0.74 -0.34 0.00 0.00 178.44 179.24 3ith h THR 369 N 0.17 1.35 -0.20 1.05 2.02 -0.29 -1.61 112.91 115.40 3ith h THR 369 Ca 0.01 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 65.82 3ith h THR 369 Cb 0.84 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 3ith h THR 369 CO 0.07 0.40 0.11 -0.33 0.37 0.00 0.00 175.52 176.14 3ith h GLU 370 N 0.03 0.27 -0.97 6.66 5.08 -0.59 -2.56 114.58 122.49 3ith h GLU 370 Ca 0.02 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3ith h GLU 370 Cb 0.73 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.86 3ith h GLU 370 CO 0.04 0.24 0.63 0.00 -1.00 0.00 0.00 179.01 178.93 3ith h ALA 371 N 1.01 1.39 -0.14 3.43 0.00 -0.50 -1.08 119.26 123.38 3ith h ALA 371 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3ith h ALA 371 Cb 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3ith h ALA 371 CO -0.01 0.50 -0.07 0.28 0.00 0.00 0.00 179.25 179.95 3ith h VAL 372 N 1.20 1.14 0.01 0.00 2.07 -1.08 0.84 116.25 120.42 3ith h VAL 372 Ca 0.39 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 3ith h VAL 372 Cb 0.05 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3ith h VAL 372 CO -0.13 0.18 -0.19 1.56 0.02 0.00 0.00 177.57 179.01 3ith h GLN 373 N 0.20 0.12 -0.66 1.57 4.20 -0.88 -2.70 115.11 116.95 3ith h GLN 373 Ca 0.05 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 3ith h GLN 373 Cb 0.26 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 3ith h GLN 373 CO 0.01 0.91 0.34 -0.22 -0.67 0.00 0.00 178.83 179.20 3ith h LYS 374 N -0.62 0.94 -0.97 1.46 3.64 -0.93 0.15 116.57 120.23 3ith h LYS 374 Ca -0.03 -0.13 0.03 0.00 -1.27 0.00 0.00 60.65 59.26 3ith h LYS 374 Cb 0.99 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 32.58 3ith h LYS 374 CO 0.04 0.73 0.64 0.82 -2.27 0.00 0.00 179.45 179.41 3ith h ILE 375 N 0.91 1.19 -0.17 2.00 2.04 -0.94 -1.26 117.51 121.29 3ith h ILE 375 Ca 0.23 -0.43 -0.15 0.00 1.00 0.00 0.00 64.86 65.51 3ith h ILE 375 Cb 0.09 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 35.99 3ith h ILE 375 CO -0.03 0.23 -0.52 0.74 0.00 0.00 0.00 178.15 178.57 3ith h THR 376 N 1.25 1.33 0.00 -0.27 2.02 -0.78 -1.89 112.91 114.57 3ith h THR 376 Ca 0.38 -1.76 0.00 0.00 0.77 0.00 0.00 66.41 65.79 3ith h THR 376 Cb -0.04 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 3ith h THR 376 CO -0.11 0.54 0.00 0.71 0.37 0.00 0.00 175.52 177.04 3ith h THR 377 N 0.37 0.00 -0.35 3.16 1.35 -0.69 -1.80 112.91 114.96 3ith h THR 377 Ca 0.01 -0.86 -0.05 0.00 -0.55 0.00 0.00 66.41 64.97 3ith h THR 377 Cb 1.04 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.30 3ith h THR 377 CO 0.09 0.00 0.02 -0.33 -0.25 0.00 0.00 175.52 175.06 3ith h GLU 378 N 0.00 0.60 -0.52 4.72 5.08 -0.81 -2.76 114.58 120.88 3ith h GLU 378 Ca 0.00 -0.18 -0.11 0.00 -1.00 0.00 0.00 59.36 58.07 3ith h GLU 378 Cb 0.90 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 3ith h GLU 378 CO 0.00 0.70 -0.10 0.77 -1.00 0.00 0.00 179.01 179.38 3ith h SER 379 N 0.41 0.96 -0.37 1.42 0.02 -1.02 -0.30 113.55 114.68 3ith h SER 379 Ca 0.10 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 60.74 3ith h SER 379 Cb 0.41 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3ith h SER 379 CO 0.01 1.07 0.22 0.40 -1.14 0.00 0.00 176.83 177.40 3ith h ILE 380 N 0.86 1.12 -0.45 3.27 2.04 -1.36 -0.15 117.51 122.85 3ith h ILE 380 Ca 0.14 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 3ith h ILE 380 Cb 0.65 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3ith h ILE 380 CO 0.04 0.12 -0.02 0.58 0.00 0.00 0.00 178.15 178.88 3ith h VAL 381 N 0.48 1.24 0.00 1.67 2.07 -1.22 0.83 116.25 121.32 3ith h VAL 381 Ca 0.13 -1.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.51 3ith h VAL 381 Cb 0.01 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3ith h VAL 381 CO -0.02 0.35 -1.19 0.40 0.02 0.00 0.00 177.57 177.13 3ith h ILE 382 N 0.70 0.51 0.00 4.57 2.04 -0.78 -3.38 117.51 121.18 3ith h ILE 382 Ca 0.14 -1.93 0.00 0.00 1.00 0.00 0.00 64.86 64.07 3ith h ILE 382 Cb 0.46 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 3ith h ILE 382 CO 0.02 0.29 0.00 0.79 0.00 0.00 0.00 178.15 179.25 3ith n TRP 383 N -2.93 0.00 -2.75 1.37 8.01 -0.10 -5.01 117.44 116.02 3ith n TRP 383 Ca -0.06 0.00 -0.16 0.00 -1.31 0.00 0.00 57.50 55.97 3ith n TRP 383 Cb 0.79 0.00 0.02 0.00 -2.01 0.00 0.00 31.31 30.11 3ith n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3ith n GLY 384 N 0.00 -0.18 3.13 6.99 0.00 0.28 -4.93 105.19 110.48 3ith n GLY 384 Ca 0.00 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 3ith n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ith s LYS 385 N -5.30 0.44 0.15 1.61 2.20 -1.23 -4.95 119.74 112.65 3ith s LYS 385 Ca 0.20 -0.10 -0.10 0.00 -0.36 0.00 0.00 55.97 55.60 3ith s LYS 385 Cb -0.09 0.19 -0.07 0.00 -1.51 0.00 0.00 37.83 36.36 3ith s LYS 385 CO 0.24 -0.10 0.49 0.95 -0.36 0.00 0.00 175.35 176.57 3ith s THR 386 N -0.82 4.99 0.16 3.43 -4.23 -1.26 -3.62 115.64 114.28 3ith s THR 386 Ca -0.09 0.51 -0.15 0.00 -1.18 0.00 0.00 61.69 60.77 3ith s THR 386 Cb -0.05 -3.66 -0.07 0.00 1.34 0.00 0.00 72.50 70.06 3ith s THR 386 CO 0.02 0.13 0.59 -2.16 -0.54 0.00 0.00 174.62 172.65 3ith s PRO 387 N -2.31 4.03 -0.33 3.99 0.04 -1.26 -4.61 135.00 134.54 3ith s PRO 387 Ca 0.40 0.57 -0.29 0.00 0.04 0.00 0.00 61.00 61.72 3ith s PRO 387 Cb -0.13 -2.92 0.01 0.00 0.04 0.00 0.00 34.50 31.50 3ith s PRO 387 CO 0.20 0.46 1.29 0.21 0.04 0.00 0.00 177.00 179.20 3ith s LYS 388 N -1.97 3.85 0.31 4.56 2.20 0.71 -4.28 119.74 125.12 3ith s LYS 388 Ca 0.39 1.13 -0.21 0.00 -0.36 0.00 0.00 55.97 56.92 3ith s LYS 388 Cb -0.15 -3.90 -0.09 0.00 -1.51 0.00 0.00 37.83 32.18 3ith s LYS 388 CO 0.19 -1.20 0.82 -0.06 -0.36 0.00 0.00 175.35 174.75 3ith s PHE 389 N 4.51 3.55 -0.68 4.03 0.40 -0.35 -2.50 117.98 126.94 3ith s PHE 389 Ca 0.56 1.50 -0.10 0.00 -0.60 0.00 0.00 56.93 58.29 3ith s PHE 389 Cb -0.15 -2.72 0.18 0.00 0.51 0.00 0.00 43.02 40.83 3ith s PHE 389 CO 0.25 0.18 0.57 0.15 0.70 0.00 0.00 175.22 177.07 3ith s LYS 390 N -2.40 3.03 -0.09 0.44 -0.14 -0.04 0.00 119.74 120.53 3ith s LYS 390 Ca 0.50 -2.31 -0.22 0.00 -1.36 0.00 0.00 55.97 52.59 3ith s LYS 390 Cb -0.15 -4.11 -0.04 0.00 -1.68 0.00 0.00 37.83 31.86 3ith s LYS 390 CO 0.20 -1.24 0.63 -0.51 -0.76 0.00 0.00 175.35 173.67 3ith s LEU 391 N 0.40 4.29 -1.47 3.17 1.43 -0.26 -3.63 118.68 122.62 3ith s LEU 391 Ca 0.14 1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 54.20 3ith s LEU 391 Cb -0.18 -2.96 -0.09 0.00 0.03 0.00 0.00 46.19 43.00 3ith s LEU 391 CO -0.05 -0.10 2.98 -0.81 0.23 0.00 0.00 176.35 178.60 3ith n PRO 392 N 3.89 3.63 -4.05 1.29 -0.04 -1.26 -2.07 135.00 136.38 3ith n PRO 392 Ca -0.03 -2.20 -0.12 0.00 -0.04 0.00 0.00 63.50 61.11 3ith n PRO 392 Cb 0.51 -2.72 -0.04 0.00 -0.04 0.00 0.00 33.50 31.21 3ith n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3ith s ILE 393 N 1.80 0.00 -0.19 0.52 2.07 -1.25 -4.92 121.20 119.22 3ith s ILE 393 Ca 0.69 -1.53 -0.07 0.00 -1.41 0.00 0.00 60.65 58.33 3ith s ILE 393 Cb 0.19 -2.51 -0.04 0.00 0.13 0.00 0.00 42.46 40.24 3ith s ILE 393 CO -0.06 0.00 0.05 -1.10 -1.91 0.00 0.00 174.94 171.92 3ith s GLN 394 N -3.40 3.87 0.05 3.50 -1.52 -1.26 -4.36 119.66 116.55 3ith s GLN 394 Ca 0.27 -0.39 -0.07 0.00 -1.95 0.00 0.00 55.36 53.22 3ith s GLN 394 Cb -0.00 -3.19 0.02 0.00 -0.22 0.00 0.00 33.01 29.62 3ith s GLN 394 CO 0.15 0.19 0.45 1.17 -0.25 0.00 0.00 175.29 177.00 3ith n LYS 395 N 3.78 -0.10 0.41 2.91 4.81 -1.26 -1.25 118.16 127.46 3ith n LYS 395 Ca -0.17 0.44 -0.18 0.00 -0.87 0.00 0.00 58.31 57.53 3ith n LYS 395 Cb 0.52 -0.65 -0.09 0.00 0.02 0.00 0.00 35.03 34.83 3ith n LYS 395 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 3ith h GLU 396 N 0.00 -0.99 -0.52 1.64 3.07 -1.98 0.25 114.58 116.06 3ith h GLU 396 Ca 0.07 0.07 0.05 0.00 -0.50 0.00 0.00 59.36 59.05 3ith h GLU 396 Cb 0.14 0.22 -0.08 0.00 -0.84 0.00 0.00 28.75 28.20 3ith h GLU 396 CO -0.28 -0.65 -0.47 1.15 -1.40 0.00 0.00 179.01 177.36 3ith h THR 397 N -1.07 0.00 -0.23 1.13 2.02 -1.59 0.10 112.91 113.27 3ith h THR 397 Ca -0.10 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.09 3ith h THR 397 Cb 0.80 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 3ith h THR 397 CO 0.17 0.00 0.13 -0.25 0.37 0.00 0.00 175.52 175.94 3ith h TRP 398 N -0.21 0.24 0.00 3.16 2.91 -1.01 0.01 115.95 121.04 3ith h TRP 398 Ca 0.09 0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.09 3ith h TRP 398 Cb 0.44 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 29.01 3ith h TRP 398 CO -0.82 0.14 -0.12 0.93 -1.03 0.00 0.00 178.44 177.54 3ith h GLU 399 N 0.27 0.00 0.00 2.65 5.08 -0.29 -2.17 114.58 120.12 3ith h GLU 399 Ca 0.09 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 3ith h GLU 399 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3ith h GLU 399 CO -0.05 0.12 -0.49 1.15 -1.00 0.00 0.00 179.01 178.74 3ith h THR 400 N 0.00 1.17 0.00 1.13 2.02 0.12 -3.39 112.91 113.95 3ith h THR 400 Ca -0.00 -1.81 0.00 0.00 0.77 0.00 0.00 66.41 65.37 3ith h THR 400 Cb 0.35 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 3ith h THR 400 CO 0.02 0.48 0.00 0.79 0.37 0.00 0.00 175.52 177.18 3ith n TRP 401 N -3.68 0.00 -0.15 3.16 7.02 -0.93 -4.90 117.44 117.96 3ith n TRP 401 Ca -0.01 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.36 3ith n TRP 401 Cb 0.56 0.00 -0.01 0.00 -2.42 0.00 0.00 31.31 29.44 3ith n TRP 401 CO 0.00 0.00 0.00 0.11 -2.02 0.00 0.00 177.69 175.78 3ith h TRP 402 N 0.00 1.10 0.00 -5.99 5.08 -1.62 -2.69 115.95 111.83 3ith h TRP 402 Ca 0.00 -0.27 0.00 0.00 1.08 0.00 0.00 58.89 59.70 3ith h TRP 402 Cb 0.13 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 26.04 3ith h TRP 402 CO 0.00 1.08 0.00 0.25 -1.28 0.00 0.00 178.44 178.49 3ith n THR 403 N -4.15 0.41 0.75 0.12 -2.24 -1.26 -1.65 114.28 106.26 3ith n THR 403 Ca -0.00 0.10 0.13 0.00 -2.27 0.00 0.00 64.05 62.01 3ith n THR 403 Cb 0.45 -0.94 0.38 0.00 -2.10 0.00 0.00 70.33 68.13 3ith n THR 403 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ith n GLU 404 N -1.15 0.18 0.00 -0.78 -0.58 -1.01 -4.13 120.64 113.16 3ith n GLU 404 Ca 0.06 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 3ith n GLU 404 Cb 0.06 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.26 3ith n GLU 404 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 3ith n TYR 405 N -1.95 0.00 -2.10 -0.32 4.02 -0.66 -5.04 117.16 111.11 3ith n TYR 405 Ca 0.05 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.53 3ith n TYR 405 Cb 0.40 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.70 3ith n TYR 405 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 3ith s TRP 406 N -0.41 3.09 -0.01 -0.72 -0.11 -1.10 -4.87 118.94 114.82 3ith s TRP 406 Ca 0.00 1.20 0.01 0.00 1.22 0.00 0.00 56.10 58.53 3ith s TRP 406 Cb 0.00 -3.72 0.01 0.00 -1.50 0.00 0.00 33.47 28.27 3ith s TRP 406 CO 0.00 -2.19 1.00 1.04 -4.62 0.00 0.00 176.95 172.18 3ith n GLN 407 N 1.92 0.06 -4.40 5.86 6.02 -1.26 -4.54 117.38 121.05 3ith n GLN 407 Ca 0.04 -1.07 -0.26 0.00 -0.01 0.00 0.00 57.00 55.70 3ith n GLN 407 Cb 0.41 -0.55 -0.12 0.00 1.02 0.00 0.00 30.24 31.01 3ith n GLN 407 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ith s ALA 408 N -0.14 2.39 -0.58 -1.58 0.00 -1.26 -4.47 121.76 116.12 3ith s ALA 408 Ca 0.02 -1.58 0.24 0.00 0.00 0.00 0.00 51.96 50.64 3ith s ALA 408 Cb 0.01 -0.31 0.40 0.00 0.00 0.00 0.00 23.12 23.23 3ith s ALA 408 CO 0.00 0.40 1.42 1.79 0.00 0.00 0.00 175.76 179.37 3ith h THR 409 N 3.32 0.00 -1.89 0.00 1.35 -1.99 -3.45 112.91 110.24 3ith h THR 409 Ca -0.46 -0.62 -0.44 0.00 -0.55 0.00 0.00 66.41 64.34 3ith h THR 409 Cb 1.20 1.34 0.04 0.00 -1.73 0.00 0.00 68.15 69.00 3ith h THR 409 CO 0.47 0.00 -0.10 -1.66 -0.25 0.00 0.00 175.52 173.98 3ith s TRP 410 N -3.19 2.52 -0.15 4.73 1.48 -1.26 -4.84 118.94 118.23 3ith s TRP 410 Ca 0.06 -0.26 -0.04 0.00 -1.06 0.00 0.00 56.10 54.80 3ith s TRP 410 Cb 0.12 -2.59 0.07 0.00 -1.16 0.00 0.00 33.47 29.91 3ith s TRP 410 CO 0.70 -0.85 0.22 0.42 -4.06 0.00 0.00 176.95 173.37 3ith s ILE 411 N -2.65 -0.33 0.82 0.66 1.01 -1.26 -5.05 121.20 114.40 3ith s ILE 411 Ca 0.58 0.14 -0.11 0.00 0.00 0.00 0.00 60.65 61.26 3ith s ILE 411 Cb -0.09 -0.50 0.08 0.00 0.01 0.00 0.00 42.46 41.96 3ith s ILE 411 CO 0.37 -0.01 1.09 -2.16 0.00 0.00 0.00 174.94 174.23 3ith s PRO 412 N 2.34 1.87 0.71 2.79 0.04 -1.26 -4.87 135.00 136.62 3ith s PRO 412 Ca 0.04 1.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.00 3ith s PRO 412 Cb -0.14 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.56 3ith s PRO 412 CO -0.09 -1.88 1.09 -1.21 0.04 0.00 0.00 177.00 174.95 3ith s GLU 413 N -4.92 2.83 0.15 4.56 2.02 -1.26 -4.96 118.70 117.11 3ith s GLU 413 Ca 0.62 0.53 -0.22 0.00 0.02 0.00 0.00 54.97 55.92 3ith s GLU 413 Cb -0.17 -2.01 0.06 0.00 0.10 0.00 0.00 34.13 32.11 3ith s GLU 413 CO 0.56 -1.07 0.57 1.67 0.02 0.00 0.00 175.26 177.01 3ith s TRP 414 N -3.30 -0.49 0.26 1.61 -2.14 -1.26 -1.21 118.94 112.40 3ith s TRP 414 Ca 0.58 0.30 0.04 0.00 2.66 0.00 0.00 56.10 59.68 3ith s TRP 414 Cb -0.12 0.51 -0.06 0.00 -3.10 0.00 0.00 33.47 30.70 3ith s TRP 414 CO 0.52 -0.82 -0.01 -1.21 -2.66 0.00 0.00 176.95 172.78 3ith s GLU 415 N -3.64 1.46 -0.13 3.25 0.41 0.10 -4.87 118.70 115.28 3ith s GLU 415 Ca 0.01 -1.75 0.01 0.00 -0.41 0.00 0.00 54.97 52.82 3ith s GLU 415 Cb -0.01 -0.82 -0.01 0.00 -1.78 0.00 0.00 34.13 31.51 3ith s GLU 415 CO -0.12 -0.07 -0.16 -0.06 -0.49 0.00 0.00 175.26 174.36 3ith s PHE 416 N -3.27 2.75 0.11 1.61 0.08 -1.26 -1.10 117.98 116.89 3ith s PHE 416 Ca 0.30 -0.86 0.01 0.00 0.12 0.00 0.00 56.93 56.50 3ith s PHE 416 Cb 0.06 -1.83 -0.04 0.00 -0.57 0.00 0.00 43.02 40.63 3ith s PHE 416 CO 0.11 -0.35 -0.03 0.14 -0.10 0.00 0.00 175.22 174.99 3ith s VAL 417 N 0.52 0.53 -0.46 -0.44 -7.23 -0.88 -4.93 120.40 107.51 3ith s VAL 417 Ca -0.11 -1.92 -0.20 0.00 -1.81 0.00 0.00 61.98 57.94 3ith s VAL 417 Cb -0.16 -1.79 0.03 0.00 0.56 0.00 0.00 36.38 35.02 3ith s VAL 417 CO 0.04 -0.77 0.65 0.20 -0.31 0.00 0.00 175.10 174.91 3ith s ASN 418 N -3.05 6.30 -0.01 4.85 0.02 -1.26 -3.90 114.94 117.89 3ith s ASN 418 Ca 0.15 -0.47 -0.37 0.00 -1.02 0.00 0.00 52.86 51.16 3ith s ASN 418 Cb 0.06 -2.32 -0.15 0.00 0.02 0.00 0.00 41.25 38.86 3ith s ASN 418 CO -0.03 -0.82 1.55 0.41 0.02 0.00 0.00 177.10 178.24 3ith n THR 419 N 5.81 0.15 -0.95 1.60 -1.04 -1.26 -4.96 114.28 113.62 3ith n THR 419 Ca -0.03 -0.03 -0.30 0.00 -2.04 0.00 0.00 64.05 61.66 3ith n THR 419 Cb 0.47 -1.20 0.24 0.00 -1.82 0.00 0.00 70.33 68.03 3ith n THR 419 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3ith s PRO 420 N 1.76 -1.32 -0.78 -2.82 0.02 -1.26 -4.88 135.00 125.72 3ith s PRO 420 Ca 0.88 0.07 -0.06 0.00 0.02 0.00 0.00 61.00 61.91 3ith s PRO 420 Cb -0.89 -1.57 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 3ith s PRO 420 CO 0.50 -3.80 1.95 -2.30 -0.33 0.00 0.00 177.00 173.02 3ith n PRO 421 N -4.85 1.77 0.00 5.54 -0.02 -1.26 -3.60 135.00 132.58 3ith n PRO 421 Ca 0.12 -1.34 0.00 0.00 -2.02 0.00 0.00 63.50 60.26 3ith n PRO 421 Cb 0.59 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 3ith n PRO 421 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 3ith n LEU 422 N 4.45 0.47 -0.33 2.45 -0.00 -1.26 -4.59 117.00 118.18 3ith n LEU 422 Ca 0.38 -0.47 0.13 0.00 -0.00 0.00 0.00 56.01 56.06 3ith n LEU 422 Cb 0.12 0.00 0.35 0.00 -0.00 0.00 0.00 43.42 43.89 3ith n LEU 422 CO 0.69 0.12 1.21 1.62 -0.00 0.00 0.00 177.39 181.02 3ith h VAL 423 N 0.68 0.74 -0.18 1.47 3.04 -1.94 -2.36 116.25 117.69 3ith h VAL 423 Ca 0.00 -0.25 -0.01 0.00 -1.01 0.00 0.00 66.70 65.43 3ith h VAL 423 Cb 0.33 -0.06 -0.01 0.00 -2.01 0.00 0.00 31.29 29.54 3ith h VAL 423 CO 0.00 0.13 0.08 0.11 -1.01 0.00 0.00 177.57 176.88 3ith h LYS 424 N 0.73 0.27 0.00 4.17 1.57 -1.89 -3.06 116.57 118.36 3ith h LYS 424 Ca 0.54 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 3ith h LYS 424 Cb 0.88 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3ith h LYS 424 CO -0.32 0.34 0.00 1.28 -0.57 0.00 0.00 179.45 180.18 3ith n LEU 425 N -4.85 0.00 -3.79 2.94 7.99 -0.89 -3.89 117.00 114.51 3ith n LEU 425 Ca -0.04 0.37 -0.28 0.00 -0.01 0.00 0.00 56.01 56.05 3ith n LEU 425 Cb 0.12 -0.37 -0.12 0.00 -0.11 0.00 0.00 43.42 42.94 3ith n LEU 425 CO 0.35 -0.32 -0.10 0.26 -1.51 0.00 0.00 177.39 176.07 3ith s TRP 426 N -2.74 3.01 0.00 -1.77 0.52 -1.16 -4.93 118.94 111.88 3ith s TRP 426 Ca 0.03 -3.11 0.00 0.00 0.02 0.00 0.00 56.10 53.04 3ith s TRP 426 Cb 0.03 -2.31 0.00 0.00 -1.15 0.00 0.00 33.47 30.04 3ith s TRP 426 CO 0.06 -0.61 0.00 2.48 0.02 0.00 0.00 176.95 178.91