#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qa1 n ARG 0 N 0.00 2.59 0.00 -1.40 1.74 -1.26 -4.65 116.66 113.68 2qa1 n ARG 0 Ca 0.00 0.91 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 2qa1 n ARG 0 Cb 0.00 -2.64 0.00 0.00 -1.02 0.00 0.00 32.46 28.80 2qa1 n ARG 0 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qa1 n SER 1 N 1.08 0.00 -3.89 0.55 2.88 -1.26 -5.03 113.62 107.95 2qa1 n SER 1 Ca 0.04 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.47 2qa1 n SER 1 Cb 0.37 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.73 2qa1 n SER 1 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2qa1 s ASP 2 N -0.41 0.04 0.25 -3.46 1.01 -1.26 -2.52 116.67 110.32 2qa1 s ASP 2 Ca 0.00 -0.16 -0.15 0.00 0.71 0.00 0.00 52.55 52.96 2qa1 s ASP 2 Cb 0.00 0.19 0.00 0.00 1.01 0.00 0.00 42.92 44.12 2qa1 s ASP 2 CO 0.00 -0.27 0.52 0.00 0.21 0.00 0.00 175.17 175.64 2qa1 s ALA 3 N -1.02 -0.46 -0.03 5.23 0.00 -1.16 -4.99 121.76 119.33 2qa1 s ALA 3 Ca -0.11 -0.74 -0.21 0.00 0.00 0.00 0.00 51.96 50.90 2qa1 s ALA 3 Cb -0.06 1.01 -0.27 0.00 0.00 0.00 0.00 23.12 23.80 2qa1 s ALA 3 CO 0.01 -0.88 0.99 0.00 0.00 0.00 0.00 175.76 175.87 2qa1 h ALA 4 N 2.21 -0.01 -3.61 0.00 0.00 -1.74 -3.36 119.26 112.75 2qa1 h ALA 4 Ca -0.25 -0.62 -0.45 0.00 0.00 0.00 0.00 54.91 53.59 2qa1 h ALA 4 Cb 1.25 0.06 -0.32 0.00 0.00 0.00 0.00 17.79 18.78 2qa1 h ALA 4 CO 0.33 0.33 -0.79 0.08 0.00 0.00 0.00 179.25 179.20 2qa1 s VAL 5 N -2.80 0.82 -0.19 0.00 1.01 -1.01 -1.68 120.40 116.55 2qa1 s VAL 5 Ca -0.14 -0.33 -0.07 0.00 0.00 0.00 0.00 61.98 61.44 2qa1 s VAL 5 Cb 0.02 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 2qa1 s VAL 5 CO 0.82 0.27 0.05 -0.63 0.00 0.00 0.00 175.10 175.61 2qa1 s ILE 6 N 0.51 4.60 -0.17 2.22 1.01 -0.48 -2.06 121.20 126.82 2qa1 s ILE 6 Ca -0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.43 2qa1 s ILE 6 Cb -0.12 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.25 2qa1 s ILE 6 CO 0.01 0.45 -0.04 -0.69 0.00 0.00 0.00 174.94 174.67 2qa1 s VAL 7 N 0.56 3.76 -0.32 2.92 1.01 0.12 -0.40 120.40 128.03 2qa1 s VAL 7 Ca 0.02 -0.39 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 2qa1 s VAL 7 Cb -0.13 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 2qa1 s VAL 7 CO 0.01 0.47 0.31 -0.69 0.00 0.00 0.00 175.10 175.20 2qa1 s VAL 8 N 0.70 5.21 0.00 2.92 1.01 -0.00 -0.53 120.40 129.71 2qa1 s VAL 8 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2qa1 s VAL 8 Cb -0.14 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2qa1 s VAL 8 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2qa1 n GLY 9 N 4.97 2.44 2.16 4.51 0.00 0.90 -0.65 105.19 119.51 2qa1 n GLY 9 Ca -0.10 -1.40 -0.26 0.00 0.00 0.00 0.00 46.02 44.25 2qa1 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qa1 n ALA 10 N 1.94 5.16 -1.00 4.61 0.00 -1.26 -4.16 120.51 125.79 2qa1 n ALA 10 Ca 0.00 -3.89 0.00 0.00 0.00 0.00 0.00 53.44 49.55 2qa1 n ALA 10 Cb 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2qa1 n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa1 n GLY 11 N -0.67 -1.47 0.37 0.00 0.00 -1.26 -4.68 105.19 97.47 2qa1 n GLY 11 Ca 0.45 -1.61 0.04 0.00 0.00 0.00 0.00 46.02 44.89 2qa1 n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qa1 h PRO 12 N 0.00 1.05 0.09 1.61 0.13 -1.94 -0.90 132.00 132.05 2qa1 h PRO 12 Ca 0.00 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2qa1 h PRO 12 Cb 0.00 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 30.89 2qa1 h PRO 12 CO 0.00 0.69 -0.05 0.00 -0.23 0.00 0.00 178.00 178.42 2qa1 h ALA 13 N 1.49 -0.13 -0.77 -0.56 0.00 -1.91 -1.21 119.26 116.18 2qa1 h ALA 13 Ca 0.41 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2qa1 h ALA 13 Cb 0.20 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2qa1 h ALA 13 CO -0.16 -0.45 0.29 0.78 0.00 0.00 0.00 179.25 179.71 2qa1 h GLY 14 N -0.37 1.24 0.97 0.00 0.00 -1.67 -0.04 103.07 103.21 2qa1 h GLY 14 Ca -0.01 -0.69 -0.16 0.00 0.00 0.00 0.00 47.33 46.47 2qa1 h GLY 14 CO 0.02 0.65 -0.50 -0.33 0.00 0.00 0.00 176.54 176.38 2qa1 h MET 15 N 1.12 0.63 -0.60 4.80 2.86 -1.17 0.18 114.93 122.76 2qa1 h MET 15 Ca 0.25 -0.46 -0.00 0.00 -2.06 0.00 0.00 59.70 57.43 2qa1 h MET 15 Cb 0.24 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 2qa1 h MET 15 CO -0.02 1.08 0.37 1.98 1.06 0.00 0.00 176.91 181.38 2qa1 h MET 16 N 0.30 0.81 -0.44 1.72 -1.53 -1.14 -2.12 114.93 112.54 2qa1 h MET 16 Ca -0.02 -0.07 0.01 0.00 -3.44 0.00 0.00 59.70 56.18 2qa1 h MET 16 Cb 1.12 -0.17 -0.02 0.00 -0.55 0.00 0.00 31.60 31.98 2qa1 h MET 16 CO 0.11 0.58 0.29 1.25 0.14 0.00 0.00 176.91 179.27 2qa1 h LEU 17 N 0.81 0.49 -0.54 3.39 5.85 -0.92 -0.77 115.31 123.63 2qa1 h LEU 17 Ca 0.22 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.95 2qa1 h LEU 17 Cb -0.03 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2qa1 h LEU 17 CO -0.04 0.36 0.32 0.00 -0.34 0.00 0.00 178.44 178.74 2qa1 h ALA 18 N 1.17 0.70 -0.38 1.25 0.00 -0.76 0.09 119.26 121.32 2qa1 h ALA 18 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2qa1 h ALA 18 Cb -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2qa1 h ALA 18 CO -0.04 0.03 0.13 0.78 0.00 0.00 0.00 179.25 180.15 2qa1 h GLY 19 N 0.64 0.63 0.96 0.00 0.00 -1.11 -1.51 103.07 102.68 2qa1 h GLY 19 Ca 0.22 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 47.21 2qa1 h GLY 19 CO -0.10 0.34 0.62 0.83 0.00 0.00 0.00 176.54 178.23 2qa1 h GLU 20 N 0.47 1.21 -0.57 4.80 4.39 -0.77 -0.96 114.58 123.15 2qa1 h GLU 20 Ca 0.13 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.67 2qa1 h GLU 20 Cb 0.23 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2qa1 h GLU 20 CO -0.01 0.80 0.05 -0.07 -1.16 0.00 0.00 179.01 178.62 2qa1 h LEU 21 N 1.24 0.95 -1.02 1.33 3.38 -0.79 -2.30 115.31 118.11 2qa1 h LEU 21 Ca 0.36 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 58.07 2qa1 h LEU 21 Cb -0.09 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.35 2qa1 h LEU 21 CO -0.09 1.00 0.66 0.03 0.09 0.00 0.00 178.44 180.13 2qa1 h ARG 22 N 0.87 1.26 -0.01 1.13 2.47 -0.87 -1.01 114.38 118.21 2qa1 h ARG 22 Ca 0.17 -0.08 -0.04 0.00 -1.26 0.00 0.00 59.98 58.77 2qa1 h ARG 22 Cb 0.49 -0.28 -0.01 0.00 -1.65 0.00 0.00 29.97 28.52 2qa1 h ARG 22 CO 0.02 0.83 -0.17 -0.07 0.56 0.00 0.00 179.97 181.14 2qa1 h LEU 23 N 1.29 0.02 -0.12 3.04 3.38 -0.77 0.11 115.31 122.26 2qa1 h LEU 23 Ca 0.39 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2qa1 h LEU 23 Cb -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2qa1 h LEU 23 CO -0.11 0.19 -0.01 0.00 0.09 0.00 0.00 178.44 178.60 2qa1 n ALA 24 N -2.50 2.66 -1.15 1.53 0.00 -0.62 -4.89 120.51 115.53 2qa1 n ALA 24 Ca -0.02 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2qa1 n ALA 24 Cb 0.24 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2qa1 n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa1 n GLY 25 N 1.08 0.41 3.75 0.00 0.00 0.39 -4.92 105.19 105.90 2qa1 n GLY 25 Ca 0.22 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.85 2qa1 n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qa1 s VAL 26 N -2.00 5.23 -0.16 1.61 1.01 -0.48 -5.00 120.40 120.61 2qa1 s VAL 26 Ca 0.00 0.69 -0.29 0.00 0.00 0.00 0.00 61.98 62.37 2qa1 s VAL 26 Cb 0.00 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2qa1 s VAL 26 CO 0.00 0.42 1.36 -1.61 0.00 0.00 0.00 175.10 175.28 2qa1 s GLU 27 N 0.14 4.16 -0.06 2.72 0.41 -1.26 -4.17 118.70 120.64 2qa1 s GLU 27 Ca 0.20 1.72 0.02 0.00 -0.41 0.00 0.00 54.97 56.51 2qa1 s GLU 27 Cb -0.14 -3.84 0.01 0.00 -1.78 0.00 0.00 34.13 28.38 2qa1 s GLU 27 CO 0.07 -0.81 -0.12 0.54 -0.49 0.00 0.00 175.26 174.45 2qa1 s VAL 28 N 3.80 1.09 -0.15 2.63 0.11 -1.26 -2.05 120.40 124.56 2qa1 s VAL 28 Ca 0.60 -0.47 -0.03 0.00 -2.93 0.00 0.00 61.98 59.15 2qa1 s VAL 28 Cb -0.24 -0.99 -0.02 0.00 -1.53 0.00 0.00 36.38 33.60 2qa1 s VAL 28 CO 0.19 0.34 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.55 2qa1 s VAL 29 N 0.57 3.69 -0.18 2.04 1.01 -0.88 -1.57 120.40 125.09 2qa1 s VAL 29 Ca -0.12 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 2qa1 s VAL 29 Cb -0.15 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 2qa1 s VAL 29 CO 0.03 0.50 0.01 -0.69 0.00 0.00 0.00 175.10 174.95 2qa1 s VAL 30 N 0.37 4.27 -0.28 2.92 1.01 0.88 -0.71 120.40 128.86 2qa1 s VAL 30 Ca -0.06 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.64 2qa1 s VAL 30 Cb -0.15 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.33 2qa1 s VAL 30 CO 0.04 0.46 0.05 -0.76 0.00 0.00 0.00 175.10 174.89 2qa1 s LEU 31 N 0.50 3.65 -0.10 3.92 1.43 0.30 0.30 118.68 128.68 2qa1 s LEU 31 Ca -0.00 -0.64 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2qa1 s LEU 31 Cb -0.14 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2qa1 s LEU 31 CO 0.02 -0.15 -0.18 -0.70 0.23 0.00 0.00 176.35 175.57 2qa1 s GLU 32 N 1.49 2.44 0.24 1.70 2.56 -0.55 -0.07 118.70 126.50 2qa1 s GLU 32 Ca 0.03 -0.65 -0.03 0.00 0.00 0.00 0.00 54.97 54.32 2qa1 s GLU 32 Cb -0.17 -1.98 0.26 0.00 2.00 0.00 0.00 34.13 34.24 2qa1 s GLU 32 CO 0.01 0.01 1.68 0.07 -0.56 0.00 0.00 175.26 176.48 2qa1 h ARG 33 N 7.17 0.75 -6.71 4.30 0.11 -1.73 0.34 114.38 118.61 2qa1 h ARG 33 Ca -0.29 -0.26 -0.52 0.00 0.10 0.00 0.00 59.98 59.01 2qa1 h ARG 33 Cb 1.19 -0.05 0.02 0.00 1.11 0.00 0.00 29.97 32.24 2qa1 h ARG 33 CO 0.49 0.86 0.54 -0.51 0.10 0.00 0.00 179.97 181.45 2qa1 s LEU 34 N -8.96 4.47 0.20 0.08 1.43 -1.26 -3.12 118.68 111.52 2qa1 s LEU 34 Ca -0.09 2.26 0.08 0.00 -1.03 0.00 0.00 54.13 55.35 2qa1 s LEU 34 Cb 0.14 -3.61 0.10 0.00 0.03 0.00 0.00 46.19 42.84 2qa1 s LEU 34 CO 0.82 -0.32 1.46 0.58 0.23 0.00 0.00 176.35 179.12 2qa1 h VAL 35 N 3.56 1.55 -3.73 -1.59 2.07 -1.90 -2.90 116.25 113.32 2qa1 h VAL 35 Ca -0.45 -2.67 -0.26 0.00 0.82 0.00 0.00 66.70 64.14 2qa1 h VAL 35 Cb 1.21 2.44 -0.29 0.00 -1.52 0.00 0.00 31.29 33.14 2qa1 h VAL 35 CO 0.72 0.76 -0.73 -0.70 0.02 0.00 0.00 177.57 177.65 2qa1 s GLU 36 N -3.23 0.08 0.24 1.57 2.12 -1.26 -4.79 118.70 113.43 2qa1 s GLU 36 Ca -0.01 -0.01 -0.31 0.00 0.36 0.00 0.00 54.97 55.00 2qa1 s GLU 36 Cb 0.11 -0.12 -0.13 0.00 0.26 0.00 0.00 34.13 34.26 2qa1 s GLU 36 CO 0.79 -0.00 1.56 -2.13 -0.54 0.00 0.00 175.26 174.94 2qa1 n ARG 37 N 3.22 2.43 0.12 4.30 0.63 -1.26 -4.83 116.66 121.26 2qa1 n ARG 37 Ca -0.14 0.87 0.20 0.00 -0.92 0.00 0.00 57.85 57.85 2qa1 n ARG 37 Cb 0.58 -2.63 0.75 0.00 0.45 0.00 0.00 32.46 31.61 2qa1 n ARG 37 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qa1 h THR 38 N 3.40 0.33 -2.04 5.15 1.03 -1.99 -3.45 112.91 115.34 2qa1 h THR 38 Ca -0.45 0.00 -0.16 0.00 -0.01 0.00 0.00 66.41 65.79 2qa1 h THR 38 Cb 1.24 0.64 0.02 0.00 -1.07 0.00 0.00 68.15 68.98 2qa1 h THR 38 CO 0.83 0.00 -0.24 0.61 -0.01 0.00 0.00 175.52 176.72 2qa1 n GLY 39 N -1.46 0.21 0.00 2.99 0.00 -1.26 -4.99 105.19 100.68 2qa1 n GLY 39 Ca 0.06 -0.43 -0.00 0.00 0.00 0.00 0.00 46.02 45.65 2qa1 n GLY 39 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qa1 h GLU 40 N -0.54 0.00 -5.68 1.61 5.08 -1.96 -3.49 114.58 109.61 2qa1 h GLU 40 Ca -0.21 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 2qa1 h GLU 40 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2qa1 h GLU 40 CO 0.22 0.00 -0.25 0.43 -1.00 0.00 0.00 179.01 178.41 2qa1 n SER 41 N -2.32 -7.15 0.20 1.42 7.64 -1.26 -4.84 113.62 107.31 2qa1 n SER 41 Ca -0.00 -0.27 -0.14 0.00 1.01 0.00 0.00 58.87 59.47 2qa1 n SER 41 Cb 0.01 -4.51 -0.08 0.00 -1.01 0.00 0.00 64.21 58.62 2qa1 n SER 41 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 2qa1 h ARG 42 N 0.30 -0.49 -7.04 1.43 0.11 -1.97 -3.44 114.38 103.28 2qa1 h ARG 42 Ca -0.14 0.03 -0.48 0.00 0.10 0.00 0.00 59.98 59.49 2qa1 h ARG 42 Cb 1.09 0.11 0.03 0.00 1.11 0.00 0.00 29.97 32.31 2qa1 h ARG 42 CO 0.31 -0.21 0.40 0.20 0.10 0.00 0.00 179.97 180.78 2qa1 s GLY 43 N -2.52 2.60 -0.08 0.08 0.00 -1.26 -4.92 107.32 101.22 2qa1 s GLY 43 Ca -0.15 0.68 0.02 0.00 0.00 0.00 0.00 44.72 45.27 2qa1 s GLY 43 CO 0.56 1.04 -0.14 1.08 0.00 0.00 0.00 173.10 175.64 2qa1 s LEU 44 N -3.27 1.69 0.00 0.66 1.43 -1.26 -0.69 118.68 117.23 2qa1 s LEU 44 Ca 0.65 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 2qa1 s LEU 44 Cb -0.19 -0.93 0.00 0.00 0.03 0.00 0.00 46.19 45.09 2qa1 s LEU 44 CO 0.24 0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.47 2qa1 n GLY 45 N 3.87 -1.98 3.58 -3.19 0.00 0.47 -4.71 105.19 103.23 2qa1 n GLY 45 Ca -0.22 -1.37 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 2qa1 n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qa1 s PHE 46 N -0.70 -0.03 0.81 1.61 -0.12 -0.54 -4.78 117.98 114.24 2qa1 s PHE 46 Ca 0.00 -0.34 -0.12 0.00 -0.05 0.00 0.00 56.93 56.43 2qa1 s PHE 46 Cb 0.00 0.39 0.08 0.00 -0.63 0.00 0.00 43.02 42.86 2qa1 s PHE 46 CO 0.00 -0.97 1.13 0.95 -0.05 0.00 0.00 175.22 176.28 2qa1 s THR 47 N -3.91 2.59 0.24 -4.49 -4.23 -1.26 -1.06 115.64 103.52 2qa1 s THR 47 Ca 0.12 0.19 -0.06 0.00 -1.18 0.00 0.00 61.69 60.76 2qa1 s THR 47 Cb -0.02 -3.05 0.23 0.00 1.34 0.00 0.00 72.50 71.01 2qa1 s THR 47 CO 0.01 -0.25 1.90 0.00 -0.54 0.00 0.00 174.62 175.74 2qa1 h ALA 48 N -1.11 1.22 -0.51 3.99 0.00 -1.80 -1.31 119.26 119.75 2qa1 h ALA 48 Ca -0.47 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 2qa1 h ALA 48 Cb 1.30 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 2qa1 h ALA 48 CO 0.63 0.50 -0.09 -0.09 0.00 0.00 0.00 179.25 180.20 2qa1 h ARG 49 N 1.20 0.96 -0.73 0.00 9.65 -1.87 -1.70 114.38 121.90 2qa1 h ARG 49 Ca 0.37 -0.35 0.03 0.00 -1.10 0.00 0.00 59.98 58.93 2qa1 h ARG 49 Cb -0.03 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.44 2qa1 h ARG 49 CO -0.11 1.02 0.45 1.15 2.80 0.00 0.00 179.97 185.28 2qa1 h THR 50 N 0.82 1.09 -0.67 0.20 2.02 -1.73 -0.30 112.91 114.34 2qa1 h THR 50 Ca 0.13 -0.30 0.08 0.00 0.77 0.00 0.00 66.41 67.09 2qa1 h THR 50 Cb 0.65 0.13 -0.06 0.00 -1.74 0.00 0.00 68.15 67.13 2qa1 h THR 50 CO 0.04 0.16 0.34 -0.03 0.37 0.00 0.00 175.52 176.41 2qa1 h MET 51 N 0.88 0.59 -0.59 6.66 1.85 -0.81 -1.42 114.93 122.08 2qa1 h MET 51 Ca 0.29 -0.04 -0.05 0.00 -0.61 0.00 0.00 59.70 59.30 2qa1 h MET 51 Cb 0.04 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 31.91 2qa1 h MET 51 CO -0.12 0.39 0.17 0.93 -0.40 0.00 0.00 176.91 177.88 2qa1 h GLU 52 N 0.61 0.94 0.00 0.39 5.08 -0.53 0.06 114.58 121.12 2qa1 h GLU 52 Ca 0.32 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 2qa1 h GLU 52 Cb 0.29 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2qa1 h GLU 52 CO -0.23 0.85 -0.38 -0.39 -1.00 0.00 0.00 179.01 177.86 2qa1 h VAL 53 N 0.85 1.11 -0.04 3.13 -1.51 -0.59 -0.72 116.25 118.47 2qa1 h VAL 53 Ca 0.19 -1.37 -0.01 0.00 -1.23 0.00 0.00 66.70 64.27 2qa1 h VAL 53 Cb 0.32 1.78 -0.00 0.00 -2.13 0.00 0.00 31.29 31.25 2qa1 h VAL 53 CO -0.00 0.37 -0.02 -0.26 -1.23 0.00 0.00 177.57 176.43 2qa1 h PHE 54 N 0.00 0.10 -0.71 5.19 0.05 -1.00 -3.30 116.94 117.26 2qa1 h PHE 54 Ca -0.00 -0.02 0.05 0.00 3.82 0.00 0.00 57.97 61.82 2qa1 h PHE 54 Cb 0.75 -0.02 -0.05 0.00 2.00 0.00 0.00 35.95 38.62 2qa1 h PHE 54 CO 0.00 0.46 0.42 0.22 -0.18 0.00 0.00 178.31 179.23 2qa1 h ASP 55 N -0.29 0.64 0.15 2.17 3.58 -0.54 -1.74 116.42 120.38 2qa1 h ASP 55 Ca 0.01 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2qa1 h ASP 55 Cb 0.43 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.38 2qa1 h ASP 55 CO 0.01 0.42 0.00 0.00 -2.88 0.00 0.00 179.24 176.78 2qa1 n GLN 56 N -4.73 0.44 -0.05 0.28 10.64 -0.32 -0.90 117.38 122.73 2qa1 n GLN 56 Ca 0.09 0.05 0.04 0.00 -1.83 0.00 0.00 57.00 55.35 2qa1 n GLN 56 Cb 0.16 -1.50 0.06 0.00 -0.86 0.00 0.00 30.24 28.10 2qa1 n GLN 56 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 2qa1 n ARG 57 N -1.13 1.20 -1.64 2.61 5.12 -0.71 -2.31 116.66 119.80 2qa1 n ARG 57 Ca 0.11 -1.33 -0.11 0.00 -1.93 0.00 0.00 57.85 54.60 2qa1 n ARG 57 Cb 0.10 -1.17 -0.03 0.00 -1.16 0.00 0.00 32.46 30.20 2qa1 n ARG 57 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qa1 n GLY 58 N 0.35 0.74 0.15 -0.13 0.00 -0.08 -4.91 105.19 101.31 2qa1 n GLY 58 Ca 0.06 -0.49 0.02 0.00 0.00 0.00 0.00 46.02 45.61 2qa1 n GLY 58 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qa1 h ILE 59 N 0.00 1.01 -0.56 -0.61 2.04 -1.64 -3.39 117.51 114.36 2qa1 h ILE 59 Ca -0.24 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.54 2qa1 h ILE 59 Cb 0.89 2.27 -0.03 0.00 -0.74 0.00 0.00 36.82 39.20 2qa1 h ILE 59 CO 0.32 0.51 0.36 -0.07 0.00 0.00 0.00 178.15 179.27 2qa1 h LEU 60 N 0.00 0.64 -2.01 1.44 3.38 -1.88 -2.00 115.31 114.87 2qa1 h LEU 60 Ca -0.01 -0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.10 2qa1 h LEU 60 Cb 1.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2qa1 h LEU 60 CO 0.07 0.47 0.43 -0.65 0.09 0.00 0.00 178.44 178.85 2qa1 h PRO 61 N 0.76 0.00 -0.64 1.13 0.11 -1.90 0.53 132.00 131.98 2qa1 h PRO 61 Ca 0.20 0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.43 2qa1 h PRO 61 Cb -0.08 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 2qa1 h PRO 61 CO -0.04 0.00 0.43 0.00 -0.21 0.00 0.00 178.00 178.18 2qa1 h ARG 62 N 0.00 0.39 0.00 1.05 3.08 -1.67 -2.05 114.38 115.18 2qa1 h ARG 62 Ca 0.26 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2qa1 h ARG 62 Cb 1.11 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.08 2qa1 h ARG 62 CO -0.00 0.26 -0.06 0.74 -1.07 0.00 0.00 179.97 179.84 2qa1 h PHE 63 N 0.41 0.00 0.00 3.04 -1.00 -1.06 -3.50 116.94 114.83 2qa1 h PHE 63 Ca 0.30 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.08 2qa1 h PHE 63 Cb 0.63 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.19 2qa1 h PHE 63 CO -0.00 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.11 2qa1 n GLY 64 N 1.28 0.81 3.70 -1.45 0.00 -0.77 -4.62 105.19 104.14 2qa1 n GLY 64 Ca 0.05 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 2qa1 n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qa1 s GLU 65 N 0.00 4.48 -0.13 1.61 2.12 -1.26 -4.88 118.70 120.64 2qa1 s GLU 65 Ca 0.00 1.38 0.03 0.00 0.36 0.00 0.00 54.97 56.74 2qa1 s GLU 65 Cb 0.00 -3.51 0.01 0.00 0.26 0.00 0.00 34.13 30.89 2qa1 s GLU 65 CO 0.00 -0.19 -0.21 0.08 -0.54 0.00 0.00 175.26 174.40 2qa1 s VAL 66 N 1.56 1.94 0.10 3.70 1.01 -1.26 -5.10 120.40 122.34 2qa1 s VAL 66 Ca 0.49 -0.91 -0.31 0.00 0.00 0.00 0.00 61.98 61.25 2qa1 s VAL 66 Cb -0.19 -1.71 -0.08 0.00 0.00 0.00 0.00 36.38 34.40 2qa1 s VAL 66 CO 0.22 0.53 1.37 -0.70 0.00 0.00 0.00 175.10 176.52 2qa1 s GLU 67 N 0.78 4.33 0.35 2.72 2.12 -1.26 -4.98 118.70 122.76 2qa1 s GLU 67 Ca -0.09 2.04 0.08 0.00 0.36 0.00 0.00 54.97 57.37 2qa1 s GLU 67 Cb -0.16 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.91 2qa1 s GLU 67 CO -0.00 -0.43 0.11 0.95 -0.54 0.00 0.00 175.26 175.35 2qa1 s THR 68 N 1.18 2.81 -0.09 -1.70 -4.23 -1.26 -1.24 115.64 111.12 2qa1 s THR 68 Ca 0.64 -1.77 -0.22 0.00 -1.18 0.00 0.00 61.69 59.17 2qa1 s THR 68 Cb -0.36 -2.93 0.05 0.00 1.34 0.00 0.00 72.50 70.60 2qa1 s THR 68 CO 0.30 -0.16 0.51 -0.55 -0.54 0.00 0.00 174.62 174.18 2qa1 s SER 69 N -3.82 -0.47 0.00 3.99 0.15 -0.67 -4.80 113.70 108.08 2qa1 s SER 69 Ca 0.37 0.62 0.23 0.00 0.70 0.00 0.00 55.95 57.87 2qa1 s SER 69 Cb -0.01 0.64 0.09 0.00 -1.71 0.00 0.00 66.02 65.03 2qa1 s SER 69 CO 0.22 -0.42 1.16 0.35 1.20 0.00 0.00 173.24 175.74 2qa1 n THR 70 N 1.62 0.00 -2.50 6.45 -2.24 -1.26 -4.33 114.28 112.02 2qa1 n THR 70 Ca -0.18 -0.39 -0.43 0.00 -2.27 0.00 0.00 64.05 60.78 2qa1 n THR 70 Cb 0.56 1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 70.15 2qa1 n THR 70 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qa1 s GLN 71 N -2.16 3.84 0.23 -0.78 -0.21 -1.26 -0.16 119.66 119.16 2qa1 s GLN 71 Ca 0.23 0.99 0.01 0.00 0.02 0.00 0.00 55.36 56.60 2qa1 s GLN 71 Cb 0.19 -3.88 -0.00 0.00 1.00 0.00 0.00 33.01 30.31 2qa1 s GLN 71 CO 0.41 -1.22 0.02 0.41 -2.12 0.00 0.00 175.29 172.80 2qa1 n GLY 72 N 4.48 3.85 3.57 3.09 0.00 0.37 -4.91 105.19 115.64 2qa1 n GLY 72 Ca 0.14 -2.21 -0.09 0.00 0.00 0.00 0.00 46.02 43.85 2qa1 n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2qa1 s HIS 73 N -1.97 -0.09 -0.17 1.61 -3.43 -1.26 -1.03 115.29 108.95 2qa1 s HIS 73 Ca 0.03 -0.26 -0.02 0.00 -0.80 0.00 0.00 55.06 54.00 2qa1 s HIS 73 Cb 0.00 0.42 0.05 0.00 -1.43 0.00 0.00 32.58 31.62 2qa1 s HIS 73 CO 0.02 -0.97 0.02 0.12 -2.00 0.00 0.00 174.74 171.93 2qa1 s PHE 74 N -3.89 1.02 -1.70 0.38 5.36 -0.04 -4.81 117.98 114.31 2qa1 s PHE 74 Ca 0.11 -0.76 0.00 0.00 -0.96 0.00 0.00 56.93 55.32 2qa1 s PHE 74 Cb -0.02 -1.01 0.00 0.00 -0.34 0.00 0.00 43.02 41.65 2qa1 s PHE 74 CO -0.01 -0.56 0.00 0.41 -1.46 0.00 0.00 175.22 173.60 2qa1 n GLY 75 N 5.05 0.24 1.93 13.12 0.00 -1.26 -1.34 105.19 122.92 2qa1 n GLY 75 Ca -0.09 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2qa1 n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa1 n GLY 76 N -0.92 1.03 3.63 -0.02 0.00 -1.26 -3.75 105.19 103.89 2qa1 n GLY 76 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 2qa1 n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qa1 s LEU 77 N 0.00 4.07 0.33 0.99 1.43 -0.45 -4.88 118.68 120.16 2qa1 s LEU 77 Ca 0.00 0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 53.67 2qa1 s LEU 77 Cb 0.00 -3.18 -0.10 0.00 0.03 0.00 0.00 46.19 42.94 2qa1 s LEU 77 CO 0.00 -0.61 1.27 -2.16 0.23 0.00 0.00 176.35 175.08 2qa1 s PRO 78 N 3.01 4.39 -0.02 1.29 0.04 -1.26 -0.86 135.00 141.59 2qa1 s PRO 78 Ca 0.35 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.54 2qa1 s PRO 78 Cb -0.14 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.33 2qa1 s PRO 78 CO 0.11 -0.13 0.00 0.42 0.04 0.00 0.00 177.00 177.44 2qa1 s ILE 79 N -1.15 0.10 -0.63 0.56 1.01 -0.20 -4.88 121.20 116.01 2qa1 s ILE 79 Ca 0.48 0.07 -0.28 0.00 0.00 0.00 0.00 60.65 60.92 2qa1 s ILE 79 Cb -0.38 -0.17 0.03 0.00 0.01 0.00 0.00 42.46 41.95 2qa1 s ILE 79 CO 0.51 0.09 1.24 -0.62 0.00 0.00 0.00 174.94 176.16 2qa1 s ASP 80 N 0.67 6.33 0.00 3.58 2.15 -1.26 -0.48 116.67 127.66 2qa1 s ASP 80 Ca -0.06 -0.05 0.18 0.00 0.43 0.00 0.00 52.55 53.05 2qa1 s ASP 80 Cb -0.09 -2.56 0.83 0.00 -0.30 0.00 0.00 42.92 40.81 2qa1 s ASP 80 CO -0.01 -1.62 1.57 0.49 -0.17 0.00 0.00 175.17 175.42 2qa1 n PHE 81 N 8.85 0.00 0.18 -5.34 3.01 0.78 -2.94 117.46 122.00 2qa1 n PHE 81 Ca 0.07 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.62 2qa1 n PHE 81 Cb 0.49 -0.41 0.45 0.00 -0.01 0.00 0.00 39.48 40.00 2qa1 n PHE 81 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qa1 n GLY 82 N 0.32 -0.85 0.17 1.37 0.00 -1.24 -1.44 105.19 103.50 2qa1 n GLY 82 Ca 0.06 0.13 0.13 0.00 0.00 0.00 0.00 46.02 46.35 2qa1 n GLY 82 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2qa1 h VAL 83 N 0.00 0.00 -3.53 1.61 -1.51 -1.91 -3.41 116.25 107.50 2qa1 h VAL 83 Ca 0.00 -0.31 -0.66 0.00 -1.23 0.00 0.00 66.70 64.51 2qa1 h VAL 83 Cb 0.06 1.11 -0.25 0.00 -2.13 0.00 0.00 31.29 30.08 2qa1 h VAL 83 CO 0.00 0.00 -0.67 -0.22 -1.23 0.00 0.00 177.57 175.45 2qa1 s LEU 84 N -4.89 3.21 0.19 4.19 2.96 -0.52 -4.90 118.68 118.92 2qa1 s LEU 84 Ca 0.04 -0.33 -0.33 0.00 -0.22 0.00 0.00 54.13 53.29 2qa1 s LEU 84 Cb 0.09 -1.83 -0.14 0.00 0.50 0.00 0.00 46.19 44.81 2qa1 s LEU 84 CO 0.43 -0.04 1.37 1.21 -1.32 0.00 0.00 176.35 178.00 2qa1 n GLU 85 N 4.86 1.72 0.00 1.98 2.13 -1.26 -1.57 120.64 128.50 2qa1 n GLU 85 Ca -0.17 0.62 0.00 0.00 0.66 0.00 0.00 57.16 58.27 2qa1 n GLU 85 Cb 0.51 -2.25 0.00 0.00 0.27 0.00 0.00 31.44 29.97 2qa1 n GLU 85 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qa1 n GLY 86 N 2.41 2.42 0.25 8.31 0.00 -1.26 -4.86 105.19 112.46 2qa1 n GLY 86 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 2qa1 n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qa1 h ALA 87 N 0.00 1.07 0.00 4.61 0.00 -1.54 -2.76 119.26 120.64 2qa1 h ALA 87 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qa1 h ALA 87 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2qa1 h ALA 87 CO 0.00 0.15 0.34 0.11 0.00 0.00 0.00 179.25 179.85 2qa1 h TRP 88 N 0.00 0.00 0.00 0.00 5.08 -1.81 -2.86 115.95 116.35 2qa1 h TRP 88 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2qa1 h TRP 88 Cb 0.55 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.71 2qa1 h TRP 88 CO 0.00 0.00 0.00 1.04 -1.28 0.00 0.00 178.44 178.20 2qa1 n GLN 89 N -2.75 0.72 -1.71 0.12 6.02 -1.04 -3.64 117.38 115.09 2qa1 n GLN 89 Ca -0.02 0.01 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 2qa1 n GLN 89 Cb 0.38 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.11 2qa1 n GLN 89 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qa1 n ALA 90 N -1.10 2.64 -2.54 -1.58 0.00 -1.08 -4.53 120.51 112.32 2qa1 n ALA 90 Ca 0.19 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.60 2qa1 n ALA 90 Cb 0.14 -2.52 -0.03 0.00 0.00 0.00 0.00 19.45 17.05 2qa1 n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qa1 s ALA 91 N 1.35 3.40 0.01 0.00 0.00 -0.22 -1.68 121.76 124.62 2qa1 s ALA 91 Ca 0.76 0.59 -0.18 0.00 0.00 0.00 0.00 51.96 53.14 2qa1 s ALA 91 Cb -0.52 -3.46 -0.32 0.00 0.00 0.00 0.00 23.12 18.83 2qa1 s ALA 91 CO 0.33 -0.58 0.99 -0.22 0.00 0.00 0.00 175.76 176.28 2qa1 h LYS 92 N 7.15 0.47 0.00 0.00 3.64 -1.45 -1.43 116.57 124.95 2qa1 h LYS 92 Ca -0.36 -0.73 0.00 0.00 -1.27 0.00 0.00 60.65 58.29 2qa1 h LYS 92 Cb 1.18 0.26 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 2qa1 h LYS 92 CO 0.84 1.34 0.00 0.25 -2.27 0.00 0.00 179.45 179.61 2qa1 n THR 93 N -3.92 0.00 -1.67 1.00 -2.24 -1.26 -4.09 114.28 102.10 2qa1 n THR 93 Ca -0.15 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 60.93 2qa1 n THR 93 Cb 0.95 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 70.22 2qa1 n THR 93 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2qa1 n VAL 94 N -0.48 0.64 -1.95 2.28 0.31 -1.26 -3.91 118.33 113.96 2qa1 n VAL 94 Ca 0.00 -0.11 -0.37 0.00 -0.01 0.00 0.00 64.34 63.84 2qa1 n VAL 94 Cb 0.02 -2.25 0.03 0.00 -0.91 0.00 0.00 33.84 30.73 2qa1 n VAL 94 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2qa1 s PRO 95 N 3.89 3.18 0.32 5.55 0.02 -1.26 0.18 135.00 146.87 2qa1 s PRO 95 Ca 0.87 2.00 0.02 0.00 0.02 0.00 0.00 61.00 63.91 2qa1 s PRO 95 Cb -0.45 -2.16 0.60 0.00 0.02 0.00 0.00 34.50 32.51 2qa1 s PRO 95 CO 0.41 -1.09 1.93 0.37 -0.33 0.00 0.00 177.00 178.29 2qa1 h GLN 96 N 1.35 0.90 -0.41 5.54 4.15 -1.20 -2.04 115.11 123.40 2qa1 h GLN 96 Ca -0.50 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 58.87 2qa1 h GLN 96 Cb 1.29 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 28.76 2qa1 h GLN 96 CO 0.57 0.60 0.27 0.66 -1.93 0.00 0.00 178.83 179.00 2qa1 h SER 97 N 0.93 0.46 -0.04 -0.69 4.64 -1.88 0.32 113.55 117.28 2qa1 h SER 97 Ca 0.35 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.64 2qa1 h SER 97 Cb 0.19 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2qa1 h SER 97 CO -0.12 0.33 -0.06 0.58 -0.87 0.00 0.00 176.83 176.68 2qa1 h VAL 98 N 0.54 1.40 -0.47 0.95 2.07 -1.75 -1.65 116.25 117.34 2qa1 h VAL 98 Ca 0.15 -1.29 0.07 0.00 0.82 0.00 0.00 66.70 66.45 2qa1 h VAL 98 Cb -0.03 2.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 2qa1 h VAL 98 CO -0.03 0.35 0.15 0.74 0.02 0.00 0.00 177.57 178.80 2qa1 h THR 99 N -0.36 0.82 -0.71 2.57 2.02 -1.15 -1.35 112.91 114.75 2qa1 h THR 99 Ca 0.01 -0.11 0.04 0.00 0.77 0.00 0.00 66.41 67.12 2qa1 h THR 99 Cb 0.60 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 2qa1 h THR 99 CO 0.01 0.06 0.43 -0.33 0.37 0.00 0.00 175.52 176.06 2qa1 h GLU 100 N 0.31 0.81 -0.28 6.66 5.08 -0.94 -1.37 114.58 124.85 2qa1 h GLU 100 Ca 0.23 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2qa1 h GLU 100 Cb 0.25 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2qa1 h GLU 100 CO -0.24 0.53 0.13 1.15 -1.00 0.00 0.00 179.01 179.58 2qa1 h THR 101 N 0.83 0.98 -0.57 1.13 2.02 -0.51 0.35 112.91 117.15 2qa1 h THR 101 Ca 0.29 -0.09 -0.08 0.00 0.77 0.00 0.00 66.41 67.30 2qa1 h THR 101 Cb 0.07 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 2qa1 h THR 101 CO -0.13 0.05 0.05 0.45 0.37 0.00 0.00 175.52 176.31 2qa1 h HIS 102 N 0.27 1.04 -0.71 3.16 3.86 -0.89 -0.45 115.15 121.43 2qa1 h HIS 102 Ca 0.12 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 2qa1 h HIS 102 Cb 0.05 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.21 2qa1 h HIS 102 CO -0.10 0.92 0.41 -0.07 0.86 0.00 0.00 177.93 179.95 2qa1 h LEU 103 N 0.86 0.87 -0.45 2.43 3.38 -1.06 0.10 115.31 121.43 2qa1 h LEU 103 Ca 0.17 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2qa1 h LEU 103 Cb 0.48 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2qa1 h LEU 103 CO 0.02 0.69 0.18 -0.08 0.09 0.00 0.00 178.44 179.34 2qa1 h GLU 104 N 0.97 0.68 -0.61 1.13 4.81 -0.67 -0.84 114.58 120.05 2qa1 h GLU 104 Ca 0.25 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2qa1 h GLU 104 Cb -0.00 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2qa1 h GLU 104 CO -0.04 0.63 0.13 1.96 -0.73 0.00 0.00 179.01 180.95 2qa1 h GLN 105 N 0.59 1.00 0.34 1.92 4.20 -0.87 -0.24 115.11 122.05 2qa1 h GLN 105 Ca 0.15 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2qa1 h GLN 105 Cb 0.20 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2qa1 h GLN 105 CO -0.01 0.92 -0.26 2.35 -0.67 0.00 0.00 178.83 181.16 2qa1 h TRP 106 N 0.91 -0.68 -0.50 2.96 7.01 -0.87 0.06 115.95 124.83 2qa1 h TRP 106 Ca 0.19 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.19 2qa1 h TRP 106 Cb 0.38 0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 27.67 2qa1 h TRP 106 CO 0.03 -0.39 0.33 0.00 -2.79 0.00 0.00 178.44 175.62 2qa1 h ALA 107 N -0.01 0.64 -0.26 2.65 0.00 -1.01 -1.43 119.26 119.84 2qa1 h ALA 107 Ca -0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qa1 h ALA 107 Cb 0.52 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2qa1 h ALA 107 CO 0.00 0.08 0.15 1.15 0.00 0.00 0.00 179.25 180.63 2qa1 h THR 108 N 0.68 1.11 -0.89 0.00 2.02 -0.97 -1.56 112.91 113.29 2qa1 h THR 108 Ca 0.18 -0.27 0.14 0.00 0.77 0.00 0.00 66.41 67.24 2qa1 h THR 108 Cb -0.08 0.82 -0.07 0.00 -1.74 0.00 0.00 68.15 67.08 2qa1 h THR 108 CO -0.04 0.10 0.58 1.23 0.37 0.00 0.00 175.52 177.76 2qa1 h GLY 109 N 0.31 1.21 1.60 2.16 0.00 -0.55 0.32 103.07 108.11 2qa1 h GLY 109 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.12 2qa1 h GLY 109 CO -0.02 0.09 0.00 1.04 0.00 0.00 0.00 176.54 177.65 2qa1 n LEU 110 N -4.56 0.00 0.00 3.11 4.77 -0.58 -4.90 117.00 114.84 2qa1 n LEU 110 Ca 0.17 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2qa1 n LEU 110 Cb 0.47 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2qa1 n LEU 110 CO 0.29 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 2qa1 n GLY 111 N 0.84 1.06 3.77 -0.72 0.00 0.10 -4.91 105.19 105.33 2qa1 n GLY 111 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2qa1 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qa1 s ALA 112 N -2.00 3.59 -0.72 4.61 0.00 -0.63 -4.82 121.76 121.79 2qa1 s ALA 112 Ca 0.00 1.48 -0.16 0.00 0.00 0.00 0.00 51.96 53.29 2qa1 s ALA 112 Cb 0.00 -3.58 0.17 0.00 0.00 0.00 0.00 23.12 19.71 2qa1 s ALA 112 CO 0.00 -0.93 0.70 0.34 0.00 0.00 0.00 175.76 175.87 2qa1 s ASP 113 N -0.07 6.51 -0.24 0.00 3.68 -0.61 -4.57 116.67 121.38 2qa1 s ASP 113 Ca 0.54 -2.22 -0.12 0.00 2.13 0.00 0.00 52.55 52.88 2qa1 s ASP 113 Cb -0.45 -2.23 -0.05 0.00 -1.45 0.00 0.00 42.92 38.74 2qa1 s ASP 113 CO 0.57 -0.76 0.24 -0.63 0.13 0.00 0.00 175.17 174.72 2qa1 s ILE 114 N 1.07 5.29 -0.41 4.11 1.01 -1.26 -0.09 121.20 130.93 2qa1 s ILE 114 Ca 0.13 0.35 0.03 0.00 0.00 0.00 0.00 60.65 61.16 2qa1 s ILE 114 Cb -0.18 -3.58 0.11 0.00 0.01 0.00 0.00 42.46 38.82 2qa1 s ILE 114 CO -0.03 0.29 0.15 -0.13 0.00 0.00 0.00 174.94 175.22 2qa1 s ARG 115 N 1.31 1.75 0.56 2.79 0.52 0.15 -4.93 118.95 121.09 2qa1 s ARG 115 Ca 0.11 -2.10 -0.15 0.00 -0.52 0.00 0.00 55.73 53.07 2qa1 s ARG 115 Cb -0.14 -3.33 -0.06 0.00 0.52 0.00 0.00 34.95 31.94 2qa1 s ARG 115 CO 0.07 -1.02 1.01 1.03 0.02 0.00 0.00 175.30 176.41 2qa1 s ARG 116 N 0.58 3.73 -1.05 3.54 0.52 -1.26 -1.48 118.95 123.52 2qa1 s ARG 116 Ca 0.12 0.96 0.00 0.00 -0.52 0.00 0.00 55.73 56.29 2qa1 s ARG 116 Cb -0.21 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 33.16 2qa1 s ARG 116 CO -0.05 -0.46 0.00 0.41 0.02 0.00 0.00 175.30 175.22 2qa1 n GLY 117 N -1.73 1.08 3.15 -3.53 0.00 0.11 -4.88 105.19 99.39 2qa1 n GLY 117 Ca 0.07 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 2qa1 n GLY 117 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qa1 s HIS 118 N -2.38 3.24 -0.25 1.61 3.76 -0.30 -3.95 115.29 117.01 2qa1 s HIS 118 Ca 0.00 -1.95 -0.10 0.00 -0.15 0.00 0.00 55.06 52.86 2qa1 s HIS 118 Cb 0.00 -2.06 -0.05 0.00 1.11 0.00 0.00 32.58 31.59 2qa1 s HIS 118 CO 0.00 -0.82 0.15 -2.00 -0.85 0.00 0.00 174.74 171.22 2qa1 s GLU 119 N 1.22 3.95 -0.31 1.40 2.12 -0.16 -2.20 118.70 124.71 2qa1 s GLU 119 Ca -0.06 -0.33 -0.29 0.00 0.36 0.00 0.00 54.97 54.65 2qa1 s GLU 119 Cb -0.19 -3.52 -0.01 0.00 0.26 0.00 0.00 34.13 30.67 2qa1 s GLU 119 CO -0.02 -0.05 1.49 0.08 -0.54 0.00 0.00 175.26 176.22 2qa1 s VAL 120 N 1.35 3.85 -0.18 3.70 1.01 -1.26 -0.41 120.40 128.47 2qa1 s VAL 120 Ca 0.07 0.93 0.20 0.00 0.00 0.00 0.00 61.98 63.18 2qa1 s VAL 120 Cb -0.15 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.19 2qa1 s VAL 120 CO 0.06 -0.49 0.90 0.18 0.00 0.00 0.00 175.10 175.76 2qa1 n LEU 121 N 8.55 0.77 -3.77 3.92 4.77 -0.50 -4.99 117.00 125.75 2qa1 n LEU 121 Ca 0.17 0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 56.45 2qa1 n LEU 121 Cb 0.47 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2qa1 n LEU 121 CO 0.66 -0.05 0.84 -0.94 -1.33 0.00 0.00 177.39 176.58 2qa1 s SER 122 N -5.44 -0.09 -0.02 -1.43 1.04 -1.20 -5.02 113.70 101.54 2qa1 s SER 122 Ca -0.02 -0.40 -0.28 0.00 0.48 0.00 0.00 55.95 55.73 2qa1 s SER 122 Cb 0.10 0.40 0.06 0.00 0.10 0.00 0.00 66.02 66.68 2qa1 s SER 122 CO 0.81 -0.76 0.62 -1.48 0.98 0.00 0.00 173.24 173.42 2qa1 s LEU 123 N -3.12 -0.46 -0.00 2.42 0.05 -1.26 -2.10 118.68 114.21 2qa1 s LEU 123 Ca 0.16 0.55 -0.02 0.00 0.05 0.00 0.00 54.13 54.87 2qa1 s LEU 123 Cb -0.00 2.39 -0.00 0.00 -2.05 0.00 0.00 46.19 46.52 2qa1 s LEU 123 CO 0.02 -0.64 0.03 -0.89 -0.55 0.00 0.00 176.35 174.32 2qa1 s THR 124 N -1.54 0.05 -0.17 5.48 2.01 0.14 -4.96 115.64 116.65 2qa1 s THR 124 Ca -0.10 -0.37 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 2qa1 s THR 124 Cb -0.01 -0.17 0.06 0.00 0.01 0.00 0.00 72.50 72.39 2qa1 s THR 124 CO 0.06 -0.20 0.05 -0.62 -0.69 0.00 0.00 174.62 173.22 2qa1 s ASP 125 N -0.62 2.52 0.07 3.53 -1.08 -1.26 -1.23 116.67 118.61 2qa1 s ASP 125 Ca -0.07 -0.65 0.07 0.00 -0.52 0.00 0.00 52.55 51.38 2qa1 s ASP 125 Cb -0.04 -0.44 -0.04 0.00 -1.46 0.00 0.00 42.92 40.94 2qa1 s ASP 125 CO -0.00 -0.31 -0.12 1.51 0.52 0.00 0.00 175.17 176.77 2qa1 s ASP 126 N 1.98 4.26 0.00 -0.34 1.47 -0.98 -5.00 116.67 118.06 2qa1 s ASP 126 Ca 0.01 -0.37 0.00 0.00 1.18 0.00 0.00 52.55 53.38 2qa1 s ASP 126 Cb -0.16 -0.80 0.03 0.00 -0.34 0.00 0.00 42.92 41.64 2qa1 s ASP 126 CO -0.08 0.21 0.25 0.61 0.68 0.00 0.00 175.17 176.84 2qa1 n GLY 127 N 1.05 -0.03 0.10 2.12 0.00 -1.26 0.12 105.19 107.30 2qa1 n GLY 127 Ca -0.15 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2qa1 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qa1 n ALA 128 N -0.70 1.31 -3.50 4.61 0.00 -1.26 -5.01 120.51 115.95 2qa1 n ALA 128 Ca 0.00 -0.81 0.07 0.00 0.00 0.00 0.00 53.44 52.70 2qa1 n ALA 128 Cb 0.00 -0.66 0.01 0.00 0.00 0.00 0.00 19.45 18.80 2qa1 n ALA 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa1 n GLY 129 N 1.77 0.66 2.93 0.00 0.00 0.34 -4.81 105.19 106.08 2qa1 n GLY 129 Ca -0.26 -0.99 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 2qa1 n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qa1 s VAL 130 N -2.19 1.13 -0.20 1.61 1.01 -0.29 -2.32 120.40 119.16 2qa1 s VAL 130 Ca 0.14 -0.36 -0.09 0.00 0.00 0.00 0.00 61.98 61.67 2qa1 s VAL 130 Cb -0.01 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 2qa1 s VAL 130 CO 0.01 0.38 0.09 -0.89 0.00 0.00 0.00 175.10 174.70 2qa1 s THR 131 N 1.61 5.00 -0.00 3.92 2.01 -0.36 -1.94 115.64 125.88 2qa1 s THR 131 Ca 0.04 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.12 2qa1 s THR 131 Cb -0.13 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.07 2qa1 s THR 131 CO -0.08 0.43 -0.08 0.68 -0.69 0.00 0.00 174.62 174.88 2qa1 s VAL 132 N 0.53 3.57 -0.07 3.82 -7.23 0.71 0.25 120.40 121.99 2qa1 s VAL 132 Ca 0.05 -0.78 -0.12 0.00 -1.81 0.00 0.00 61.98 59.32 2qa1 s VAL 132 Cb -0.12 -2.54 -0.05 0.00 0.56 0.00 0.00 36.38 34.23 2qa1 s VAL 132 CO 0.00 0.41 0.30 -1.83 -0.31 0.00 0.00 175.10 173.68 2qa1 s GLU 133 N -1.35 3.82 -0.01 4.82 -1.05 -0.89 -0.99 118.70 123.05 2qa1 s GLU 133 Ca 0.16 0.19 0.02 0.00 -0.15 0.00 0.00 54.97 55.19 2qa1 s GLU 133 Cb -0.11 -3.25 0.00 0.00 -0.44 0.00 0.00 34.13 30.33 2qa1 s GLU 133 CO 0.07 0.64 -0.06 0.08 0.95 0.00 0.00 175.26 176.94 2qa1 s VAL 134 N -0.79 0.49 -0.31 1.83 1.01 0.99 -1.41 120.40 122.21 2qa1 s VAL 134 Ca 0.20 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 2qa1 s VAL 134 Cb -0.15 -0.44 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 2qa1 s VAL 134 CO 0.09 0.16 0.15 -0.60 0.00 0.00 0.00 175.10 174.89 2qa1 s ARG 135 N 0.07 3.33 0.00 2.72 3.52 0.46 -0.71 118.95 128.34 2qa1 s ARG 135 Ca -0.00 -0.72 0.00 0.00 -0.13 0.00 0.00 55.73 54.88 2qa1 s ARG 135 Cb -0.05 -3.55 0.00 0.00 -1.56 0.00 0.00 34.95 29.79 2qa1 s ARG 135 CO -0.00 -0.41 0.00 0.41 -0.81 0.00 0.00 175.30 174.49 2qa1 n GLY 136 N 4.97 3.96 0.33 8.12 0.00 -0.19 -0.99 105.19 121.39 2qa1 n GLY 136 Ca -0.14 -2.20 0.15 0.00 0.00 0.00 0.00 46.02 43.84 2qa1 n GLY 136 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qa1 h PRO 137 N 0.00 0.00 -0.03 1.61 0.11 -1.91 -0.93 132.00 130.85 2qa1 h PRO 137 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2qa1 h PRO 137 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2qa1 h PRO 137 CO 0.00 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 176.94 2qa1 n GLU 138 N -4.30 1.15 0.00 1.05 0.00 -1.26 -5.02 120.64 112.26 2qa1 n GLU 138 Ca 0.03 -0.23 0.00 0.00 0.00 0.00 0.00 57.16 56.97 2qa1 n GLU 138 Cb 0.36 -1.36 0.00 0.00 0.00 0.00 0.00 31.44 30.44 2qa1 n GLU 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2qa1 n GLY 139 N 0.91 -0.65 3.80 -1.84 0.00 -0.36 -4.95 105.19 102.11 2qa1 n GLY 139 Ca 0.17 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 44.12 2qa1 n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qa1 s LYS 140 N 0.00 4.17 0.24 1.61 1.02 -1.26 -1.02 119.74 124.49 2qa1 s LYS 140 Ca 0.00 0.66 -0.18 0.00 0.02 0.00 0.00 55.97 56.46 2qa1 s LYS 140 Cb 0.00 -3.26 0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2qa1 s LYS 140 CO 0.00 0.59 0.60 -3.38 -0.92 0.00 0.00 175.35 172.23 2qa1 s HIS 141 N -0.88 -0.09 0.07 3.18 -3.43 0.11 -4.99 115.29 109.28 2qa1 s HIS 141 Ca 0.28 -0.30 0.08 0.00 -0.80 0.00 0.00 55.06 54.32 2qa1 s HIS 141 Cb -0.19 0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 31.42 2qa1 s HIS 141 CO 0.17 -1.06 -0.17 0.95 -2.00 0.00 0.00 174.74 172.64 2qa1 s THR 142 N -3.91 2.89 0.05 -5.38 -4.23 -1.26 -0.01 115.64 103.79 2qa1 s THR 142 Ca 0.12 -1.30 0.05 0.00 -1.18 0.00 0.00 61.69 59.37 2qa1 s THR 142 Cb -0.03 -2.27 -0.02 0.00 1.34 0.00 0.00 72.50 71.51 2qa1 s THR 142 CO 0.03 0.23 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.44 2qa1 s LEU 143 N -1.78 2.22 0.03 4.79 1.43 -0.16 -4.66 118.68 120.55 2qa1 s LEU 143 Ca 0.17 -0.53 0.04 0.00 -1.03 0.00 0.00 54.13 52.77 2qa1 s LEU 143 Cb -0.11 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.58 2qa1 s LEU 143 CO 0.08 -0.04 -0.12 -0.60 0.23 0.00 0.00 176.35 175.91 2qa1 s ARG 144 N -1.43 0.79 0.23 1.70 3.52 -1.05 -0.20 118.95 122.50 2qa1 s ARG 144 Ca -0.01 -0.66 -0.14 0.00 -0.13 0.00 0.00 55.73 54.78 2qa1 s ARG 144 Cb -0.09 -0.75 0.01 0.00 -1.56 0.00 0.00 34.95 32.56 2qa1 s ARG 144 CO 0.02 0.18 0.49 0.00 -0.81 0.00 0.00 175.30 175.18 2qa1 s ALA 145 N -0.82 -0.48 0.15 6.12 0.00 -0.82 -2.99 121.76 122.92 2qa1 s ALA 145 Ca -0.00 -0.65 -0.15 0.00 0.00 0.00 0.00 51.96 51.16 2qa1 s ALA 145 Cb -0.07 0.96 0.03 0.00 0.00 0.00 0.00 23.12 24.04 2qa1 s ALA 145 CO 0.01 -0.83 1.74 0.00 0.00 0.00 0.00 175.76 176.68 2qa1 h ALA 146 N 2.25 0.61 -3.37 0.00 0.00 -1.46 -0.76 119.26 116.53 2qa1 h ALA 146 Ca -0.27 -0.11 -0.35 0.00 0.00 0.00 0.00 54.91 54.19 2qa1 h ALA 146 Cb 1.25 -0.19 -0.22 0.00 0.00 0.00 0.00 17.79 18.63 2qa1 h ALA 146 CO 0.36 0.17 -0.76 0.71 0.00 0.00 0.00 179.25 179.73 2qa1 s TYR 147 N -5.75 0.91 -0.08 0.00 1.51 -1.14 -4.30 117.35 108.51 2qa1 s TYR 147 Ca -0.13 -0.44 0.04 0.00 -1.01 0.00 0.00 57.07 55.53 2qa1 s TYR 147 Cb 0.11 -0.53 0.00 0.00 -0.11 0.00 0.00 41.96 41.43 2qa1 s TYR 147 CO 0.76 -0.02 -0.21 -1.17 -1.11 0.00 0.00 175.55 173.80 2qa1 s LEU 148 N -1.49 1.99 -0.25 -1.29 2.96 -0.13 -1.38 118.68 119.09 2qa1 s LEU 148 Ca -0.05 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2qa1 s LEU 148 Cb -0.09 -1.25 0.02 0.00 0.50 0.00 0.00 46.19 45.37 2qa1 s LEU 148 CO 0.01 0.15 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.44 2qa1 s VAL 149 N 0.28 2.87 -0.69 1.68 1.01 0.46 -0.90 120.40 125.11 2qa1 s VAL 149 Ca -0.14 -1.00 -0.27 0.00 0.00 0.00 0.00 61.98 60.57 2qa1 s VAL 149 Cb -0.16 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.79 2qa1 s VAL 149 CO 0.06 0.22 1.44 -0.83 0.00 0.00 0.00 175.10 175.99 2qa1 s GLY 150 N 1.33 0.70 -0.53 4.51 0.00 0.89 -0.82 107.32 113.39 2qa1 s GLY 150 Ca 0.00 -1.14 0.02 0.00 0.00 0.00 0.00 44.72 43.61 2qa1 s GLY 150 CO -0.05 2.86 1.66 0.00 0.00 0.00 0.00 173.10 177.58 2qa1 n ASP 152 N -0.77 4.50 0.00 0.00 5.75 -0.99 -4.32 116.55 120.73 2qa1 n ASP 152 Ca 0.53 -3.22 0.00 0.00 -0.01 0.00 0.00 54.79 52.10 2qa1 n ASP 152 Cb 0.73 -0.69 0.00 0.00 -1.03 0.00 0.00 41.12 40.13 2qa1 n ASP 152 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qa1 n GLY 153 N -0.25 -2.74 0.31 6.12 0.00 -1.26 -4.05 105.19 103.31 2qa1 n GLY 153 Ca 0.35 -1.67 0.17 0.00 0.00 0.00 0.00 46.02 44.87 2qa1 n GLY 153 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2qa1 h GLY 154 N 0.00 0.00 -2.93 -0.02 0.00 -1.93 -0.81 103.07 97.38 2qa1 h GLY 154 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 46.98 2qa1 h GLY 154 CO 0.00 0.00 0.19 0.54 0.00 0.00 0.00 176.54 177.27 2qa1 n ARG 155 N -3.62 2.12 -1.41 4.80 1.74 -1.26 -4.85 116.66 114.17 2qa1 n ARG 155 Ca -0.03 -3.19 -0.57 0.00 -0.77 0.00 0.00 57.85 53.28 2qa1 n ARG 155 Cb 0.09 -2.00 -0.09 0.00 -1.02 0.00 0.00 32.46 29.44 2qa1 n ARG 155 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2qa1 n SER 156 N -1.10 0.95 -0.17 0.55 2.88 -0.32 -4.88 113.62 111.54 2qa1 n SER 156 Ca 0.45 0.92 -0.05 0.00 -1.33 0.00 0.00 58.87 58.87 2qa1 n SER 156 Cb 1.22 -0.77 0.14 0.00 -0.75 0.00 0.00 64.21 64.05 2qa1 n SER 156 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2qa1 h SER 157 N 5.22 0.87 -0.26 -3.46 0.02 -1.89 -2.88 113.55 111.16 2qa1 h SER 157 Ca -0.31 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.43 2qa1 h SER 157 Cb 1.20 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.50 2qa1 h SER 157 CO 0.88 0.86 0.02 0.58 -1.14 0.00 0.00 176.83 178.03 2qa1 h VAL 158 N 0.88 1.24 -0.18 2.27 2.07 -1.94 0.68 116.25 121.27 2qa1 h VAL 158 Ca 0.19 -0.85 0.03 0.00 0.82 0.00 0.00 66.70 66.88 2qa1 h VAL 158 Cb 0.35 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 2qa1 h VAL 158 CO 0.00 0.27 0.02 -0.09 0.02 0.00 0.00 177.57 177.79 2qa1 h ARG 159 N 0.25 0.09 -0.51 1.57 2.43 -1.91 0.30 114.38 116.60 2qa1 h ARG 159 Ca 0.08 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2qa1 h ARG 159 Cb 0.38 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2qa1 h ARG 159 CO 0.01 0.06 0.32 0.87 -1.51 0.00 0.00 179.97 179.71 2qa1 h LYS 160 N 0.09 0.68 -0.02 0.20 1.57 -1.36 -2.76 116.57 114.97 2qa1 h LYS 160 Ca 0.08 -0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.60 2qa1 h LYS 160 Cb 0.09 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 2qa1 h LYS 160 CO -0.13 0.48 -0.88 0.00 -0.57 0.00 0.00 179.45 178.35 2qa1 h ALA 161 N 1.16 0.43 -0.37 3.86 0.00 -0.67 -3.29 119.26 120.39 2qa1 h ALA 161 Ca 0.18 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2qa1 h ALA 161 Cb -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qa1 h ALA 161 CO -0.04 0.81 0.00 0.00 0.00 0.00 0.00 179.25 180.02 2qa1 n ALA 162 N -2.53 2.73 -1.93 0.00 0.00 0.10 -4.93 120.51 113.96 2qa1 n ALA 162 Ca -0.06 -0.82 -0.11 0.00 0.00 0.00 0.00 53.44 52.45 2qa1 n ALA 162 Cb 0.80 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.23 2qa1 n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qa1 n GLY 163 N 0.85 0.32 3.75 0.00 0.00 -1.16 -4.93 105.19 104.02 2qa1 n GLY 163 Ca 0.14 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 2qa1 n GLY 163 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qa1 s PHE 164 N -2.50 3.47 0.08 1.61 0.40 -1.05 -5.03 117.98 114.96 2qa1 s PHE 164 Ca 0.00 1.58 -0.28 0.00 -0.60 0.00 0.00 56.93 57.62 2qa1 s PHE 164 Cb 0.00 -3.37 -0.05 0.00 0.51 0.00 0.00 43.02 40.10 2qa1 s PHE 164 CO 0.00 -0.90 0.90 -0.51 0.70 0.00 0.00 175.22 175.41 2qa1 s ASP 165 N -0.49 7.39 -0.49 1.36 1.01 -1.26 -4.85 116.67 119.34 2qa1 s ASP 165 Ca 0.48 1.66 0.08 0.00 0.71 0.00 0.00 52.55 55.48 2qa1 s ASP 165 Cb -0.33 -2.55 0.30 0.00 1.01 0.00 0.00 42.92 41.35 2qa1 s ASP 165 CO 0.41 -0.06 0.74 0.33 0.21 0.00 0.00 175.17 176.79 2qa1 n PHE 166 N 2.93 1.87 -2.13 4.23 -0.00 -1.26 -2.21 117.46 120.89 2qa1 n PHE 166 Ca 0.01 -3.88 -0.32 0.00 -0.00 0.00 0.00 57.45 53.26 2qa1 n PHE 166 Cb 0.50 -0.45 -0.00 0.00 -0.00 0.00 0.00 39.48 39.52 2qa1 n PHE 166 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 2qa1 s PRO 167 N -2.40 3.55 0.00 -7.13 0.04 -1.24 -4.69 135.00 123.13 2qa1 s PRO 167 Ca 0.41 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2qa1 s PRO 167 Cb 0.24 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2qa1 s PRO 167 CO -0.09 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 176.75 2qa1 n GLY 168 N -1.40 -0.53 3.34 0.56 0.00 -1.26 -2.30 105.19 103.61 2qa1 n GLY 168 Ca 0.08 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 2qa1 n GLY 168 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qa1 s THR 169 N -3.66 2.21 0.60 2.61 -4.23 -0.19 -4.98 115.64 108.00 2qa1 s THR 169 Ca 0.00 -1.18 -0.17 0.00 -1.18 0.00 0.00 61.69 59.16 2qa1 s THR 169 Cb 0.00 -1.81 -0.03 0.00 1.34 0.00 0.00 72.50 71.99 2qa1 s THR 169 CO 0.00 0.49 1.11 0.00 -0.54 0.00 0.00 174.62 175.68 2qa1 s ALA 170 N -0.71 2.61 0.38 3.99 0.00 -1.26 -2.37 121.76 124.40 2qa1 s ALA 170 Ca 0.11 0.64 -0.27 0.00 0.00 0.00 0.00 51.96 52.44 2qa1 s ALA 170 Cb -0.10 -3.32 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 2qa1 s ALA 170 CO 0.01 -0.97 1.29 0.00 0.00 0.00 0.00 175.76 176.09 2qa1 n ALA 171 N -1.86 1.36 0.11 0.00 0.00 -1.26 -4.68 120.51 114.17 2qa1 n ALA 171 Ca 0.11 0.32 0.01 0.00 0.00 0.00 0.00 53.44 53.87 2qa1 n ALA 171 Cb 0.52 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.70 2qa1 n ALA 171 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qa1 n THR 172 N 0.10 0.00 -3.63 0.00 -2.24 -1.26 -4.91 114.28 102.34 2qa1 n THR 172 Ca 0.05 -0.49 -0.16 0.00 -2.27 0.00 0.00 64.05 61.19 2qa1 n THR 172 Cb 0.38 1.04 -0.07 0.00 -2.10 0.00 0.00 70.33 69.58 2qa1 n THR 172 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2qa1 s MET 173 N -0.47 0.86 -0.14 -0.78 -2.45 -1.26 -4.41 119.30 110.66 2qa1 s MET 173 Ca 0.03 0.17 -0.01 0.00 -1.25 0.00 0.00 55.69 54.62 2qa1 s MET 173 Cb 0.02 0.40 -0.02 0.00 1.25 0.00 0.00 34.83 36.49 2qa1 s MET 173 CO 0.05 -0.24 -0.11 -2.00 1.05 0.00 0.00 175.02 173.77 2qa1 s GLU 174 N -1.04 3.43 0.45 4.11 2.12 -1.21 -3.80 118.70 122.77 2qa1 s GLU 174 Ca -0.10 -0.65 0.06 0.00 0.36 0.00 0.00 54.97 54.64 2qa1 s GLU 174 Cb -0.02 -2.71 -0.03 0.00 0.26 0.00 0.00 34.13 31.63 2qa1 s GLU 174 CO 0.07 0.19 0.22 -1.64 -0.54 0.00 0.00 175.26 173.56 2qa1 s MET 175 N 0.43 2.25 0.09 4.30 -1.94 -0.14 -4.82 119.30 119.47 2qa1 s MET 175 Ca -0.09 -1.92 0.07 0.00 -1.71 0.00 0.00 55.69 52.05 2qa1 s MET 175 Cb -0.15 -1.98 -0.03 0.00 2.01 0.00 0.00 34.83 34.67 2qa1 s MET 175 CO 0.04 -0.25 -0.18 0.71 -0.01 0.00 0.00 175.02 175.34 2qa1 s TYR 176 N -2.65 1.52 0.06 -0.03 1.51 -0.68 -2.40 117.35 114.68 2qa1 s TYR 176 Ca 0.36 -0.44 0.04 0.00 -1.01 0.00 0.00 57.07 56.02 2qa1 s TYR 176 Cb 0.02 -0.84 -0.03 0.00 -0.11 0.00 0.00 41.96 41.00 2qa1 s TYR 176 CO 0.21 0.14 -0.11 -0.48 -1.11 0.00 0.00 175.55 174.20 2qa1 s LEU 177 N -1.83 2.29 -0.15 -1.29 2.34 -0.48 -1.06 118.68 118.49 2qa1 s LEU 177 Ca 0.03 -0.62 -0.07 0.00 0.06 0.00 0.00 54.13 53.52 2qa1 s LEU 177 Cb -0.10 -0.32 0.06 0.00 -0.56 0.00 0.00 46.19 45.27 2qa1 s LEU 177 CO 0.03 -0.16 0.36 0.00 -1.06 0.00 0.00 176.35 175.51 2qa1 s ALA 178 N -1.51 -0.89 -0.19 1.48 0.00 -0.81 -1.17 121.76 118.66 2qa1 s ALA 178 Ca -0.04 1.33 -0.18 0.00 0.00 0.00 0.00 51.96 53.08 2qa1 s ALA 178 Cb -0.09 -0.92 -0.04 0.00 0.00 0.00 0.00 23.12 22.08 2qa1 s ALA 178 CO 0.01 -0.35 0.47 -0.51 0.00 0.00 0.00 175.76 175.38 2qa1 s ASP 179 N 1.63 6.53 0.08 0.00 1.11 -0.33 -1.01 116.67 124.68 2qa1 s ASP 179 Ca -0.07 0.63 0.01 0.00 0.18 0.00 0.00 52.55 53.30 2qa1 s ASP 179 Cb -0.10 -2.27 -0.04 0.00 1.07 0.00 0.00 42.92 41.58 2qa1 s ASP 179 CO -0.11 -0.13 -0.06 0.27 1.18 0.00 0.00 175.17 176.32 2qa1 s ILE 180 N 1.45 0.58 0.35 0.77 -4.36 -0.01 -0.18 121.20 119.80 2qa1 s ILE 180 Ca 0.22 -1.82 0.08 0.00 -0.26 0.00 0.00 60.65 58.87 2qa1 s ILE 180 Cb -0.15 -1.54 -0.07 0.00 1.25 0.00 0.00 42.46 41.95 2qa1 s ILE 180 CO 0.09 -0.85 -0.05 -0.54 0.24 0.00 0.00 174.94 173.83 2qa1 s LYS 181 N -3.62 1.81 0.00 0.37 1.02 -0.34 -1.23 119.74 117.74 2qa1 s LYS 181 Ca 0.09 -1.96 0.00 0.00 0.02 0.00 0.00 55.97 54.11 2qa1 s LYS 181 Cb 0.04 -1.56 0.00 0.00 -0.52 0.00 0.00 37.83 35.79 2qa1 s LYS 181 CO -0.05 0.06 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 2qa1 n GLY 182 N -0.81 3.09 3.53 -3.33 0.00 -1.26 -1.65 105.19 104.76 2qa1 n GLY 182 Ca -0.05 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 2qa1 n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qa1 s VAL 183 N -0.61 3.46 -0.29 1.61 1.01 -1.26 -5.05 120.40 119.27 2qa1 s VAL 183 Ca 0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.27 2qa1 s VAL 183 Cb 0.00 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2qa1 s VAL 183 CO 0.00 0.58 0.36 -1.61 0.00 0.00 0.00 175.10 174.44 2qa1 s GLU 184 N -0.62 3.89 0.07 2.72 2.02 -1.26 -4.84 118.70 120.69 2qa1 s GLU 184 Ca 0.09 -0.10 0.08 0.00 0.02 0.00 0.00 54.97 55.07 2qa1 s GLU 184 Cb -0.11 -3.70 -0.04 0.00 0.10 0.00 0.00 34.13 30.38 2qa1 s GLU 184 CO 0.02 -0.34 -0.18 -0.51 0.02 0.00 0.00 175.26 174.26 2qa1 s LEU 185 N 2.05 2.63 -0.11 1.80 1.43 -1.26 -5.08 118.68 120.14 2qa1 s LEU 185 Ca 0.14 -0.49 -0.29 0.00 -1.03 0.00 0.00 54.13 52.46 2qa1 s LEU 185 Cb -0.16 -1.52 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 2qa1 s LEU 185 CO 0.11 0.22 1.80 -1.10 0.23 0.00 0.00 176.35 177.61 2qa1 s GLN 186 N -1.72 3.89 0.39 1.70 -0.21 -1.26 -4.93 119.66 117.52 2qa1 s GLN 186 Ca 0.16 2.09 -0.27 0.00 0.02 0.00 0.00 55.36 57.36 2qa1 s GLN 186 Cb -0.10 -4.10 -0.10 0.00 1.00 0.00 0.00 33.01 29.70 2qa1 s GLN 186 CO 0.07 -1.21 1.48 -2.30 -2.12 0.00 0.00 175.29 171.21 2qa1 n PRO 187 N 7.65 2.58 -3.45 2.91 -0.02 -1.26 -4.82 135.00 138.59 2qa1 n PRO 187 Ca 0.20 0.91 -0.27 0.00 -2.02 0.00 0.00 63.50 62.32 2qa1 n PRO 187 Cb 0.43 -2.66 -0.10 0.00 -0.02 0.00 0.00 33.50 31.15 2qa1 n PRO 187 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2qa1 s ARG 188 N -2.18 1.03 0.44 -0.52 1.81 0.97 -4.93 118.95 115.57 2qa1 s ARG 188 Ca 0.55 -2.18 0.20 0.00 -1.72 0.00 0.00 55.73 52.59 2qa1 s ARG 188 Cb -0.47 -1.60 1.03 0.00 -0.45 0.00 0.00 34.95 33.45 2qa1 s ARG 188 CO 0.62 -1.37 1.91 0.52 -0.68 0.00 0.00 175.30 176.31 2qa1 h MET 189 N 5.71 0.00 -0.23 3.54 2.86 -1.94 -2.56 114.93 122.30 2qa1 h MET 189 Ca 0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2qa1 h MET 189 Cb 0.90 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.56 2qa1 h MET 189 CO 0.40 0.25 0.00 0.44 1.06 0.00 0.00 176.91 179.06 2qa1 n ILE 190 N -3.78 0.64 0.00 -1.22 -5.35 -1.26 -4.96 119.36 103.43 2qa1 n ILE 190 Ca -0.01 -0.82 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 2qa1 n ILE 190 Cb 0.35 0.77 0.00 0.00 -1.74 0.00 0.00 39.64 39.02 2qa1 n ILE 190 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2qa1 n GLY 191 N 0.57 1.62 2.85 3.28 0.00 -0.99 -4.37 105.19 108.15 2qa1 n GLY 191 Ca 0.10 -2.03 -0.16 0.00 0.00 0.00 0.00 46.02 43.93 2qa1 n GLY 191 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qa1 s GLU 192 N -2.04 0.14 -0.16 1.61 2.56 0.89 -4.93 118.70 116.76 2qa1 s GLU 192 Ca 0.00 0.45 -0.29 0.00 0.00 0.00 0.00 54.97 55.13 2qa1 s GLU 192 Cb 0.00 -0.64 -0.02 0.00 2.00 0.00 0.00 34.13 35.48 2qa1 s GLU 192 CO 0.00 -0.46 1.30 0.99 -0.56 0.00 0.00 175.26 176.52 2qa1 s THR 193 N 2.35 4.22 0.28 -1.70 2.01 -1.26 -1.56 115.64 119.97 2qa1 s THR 193 Ca 0.04 1.46 0.09 0.00 0.31 0.00 0.00 61.69 63.60 2qa1 s THR 193 Cb -0.14 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2qa1 s THR 193 CO -0.10 -0.15 0.03 -0.76 -0.69 0.00 0.00 174.62 172.96 2qa1 s LEU 194 N 3.61 3.23 0.54 4.42 1.43 0.29 -5.00 118.68 127.20 2qa1 s LEU 194 Ca 0.56 -0.66 0.21 0.00 -1.03 0.00 0.00 54.13 53.22 2qa1 s LEU 194 Cb -0.22 -1.74 1.40 0.00 0.03 0.00 0.00 46.19 45.66 2qa1 s LEU 194 CO 0.16 -0.06 2.12 -0.65 0.23 0.00 0.00 176.35 178.16 2qa1 h PRO 195 N 1.80 0.00 -0.07 1.29 0.11 -1.96 -2.58 132.00 130.60 2qa1 h PRO 195 Ca -0.44 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 2qa1 h PRO 195 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2qa1 h PRO 195 CO 0.61 0.00 -0.12 0.41 -0.21 0.00 0.00 178.00 178.69 2qa1 n GLY 196 N -1.52 4.82 0.00 -0.55 0.00 -1.26 -4.76 105.19 101.92 2qa1 n GLY 196 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2qa1 n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa1 n GLY 197 N -1.20 -0.17 3.17 -0.02 0.00 -0.97 0.18 105.19 106.17 2qa1 n GLY 197 Ca 0.19 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 2qa1 n GLY 197 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2qa1 s MET 198 N -2.00 0.68 -0.05 1.61 0.23 -0.68 -0.55 119.30 118.53 2qa1 s MET 198 Ca 0.00 -0.63 -0.06 0.00 -1.03 0.00 0.00 55.69 53.97 2qa1 s MET 198 Cb 0.00 0.28 0.01 0.00 -1.53 0.00 0.00 34.83 33.59 2qa1 s MET 198 CO 0.00 -0.19 0.16 0.54 -2.03 0.00 0.00 175.02 173.50 2qa1 s VAL 199 N -2.51 0.01 0.01 5.16 0.11 -0.60 -2.38 120.40 120.20 2qa1 s VAL 199 Ca -0.05 -0.10 0.08 0.00 -2.93 0.00 0.00 61.98 58.97 2qa1 s VAL 199 Cb -0.01 -0.27 -0.02 0.00 -1.53 0.00 0.00 36.38 34.55 2qa1 s VAL 199 CO -0.04 -0.06 -0.23 -0.04 -3.33 0.00 0.00 175.10 171.40 2qa1 s MET 200 N -0.13 1.74 -0.07 1.54 -1.94 -0.79 -0.07 119.30 119.57 2qa1 s MET 200 Ca -0.02 -0.92 -0.05 0.00 -1.71 0.00 0.00 55.69 52.99 2qa1 s MET 200 Cb -0.02 -1.78 0.03 0.00 2.01 0.00 0.00 34.83 35.07 2qa1 s MET 200 CO 0.00 0.47 0.17 0.14 -0.01 0.00 0.00 175.02 175.80 2qa1 s VAL 201 N -0.66 -0.02 -0.12 -6.03 -7.23 -1.05 -1.06 120.40 104.23 2qa1 s VAL 201 Ca 0.09 0.07 -0.30 0.00 -1.81 0.00 0.00 61.98 60.04 2qa1 s VAL 201 Cb -0.09 -0.26 0.10 0.00 0.56 0.00 0.00 36.38 36.69 2qa1 s VAL 201 CO 0.00 0.03 0.86 -0.83 -0.31 0.00 0.00 175.10 174.85 2qa1 s GLY 202 N 0.58 -0.40 0.39 2.32 0.00 -0.70 -0.02 107.32 109.49 2qa1 s GLY 202 Ca -0.04 1.77 -0.14 0.00 0.00 0.00 0.00 44.72 46.31 2qa1 s GLY 202 CO -0.03 1.06 0.79 2.56 0.00 0.00 0.00 173.10 177.48 2qa1 s PRO 203 N -1.03 3.91 0.09 2.90 0.04 -1.26 0.19 135.00 139.84 2qa1 s PRO 203 Ca -0.05 0.64 0.02 0.00 0.04 0.00 0.00 61.00 61.65 2qa1 s PRO 203 Cb -0.01 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.13 2qa1 s PRO 203 CO 0.05 0.01 -0.07 -0.51 0.04 0.00 0.00 177.00 176.52 2qa1 s LEU 204 N -3.50 2.47 0.65 -3.56 1.43 0.22 -4.84 118.68 111.54 2qa1 s LEU 204 Ca 0.54 -0.93 -0.17 0.00 -1.03 0.00 0.00 54.13 52.54 2qa1 s LEU 204 Cb -0.10 -0.11 -0.02 0.00 0.03 0.00 0.00 46.19 45.99 2qa1 s LEU 204 CO 0.25 -0.41 1.07 -2.65 0.23 0.00 0.00 176.35 174.83 2qa1 n PRO 205 N 0.21 0.85 -1.15 1.29 -0.02 -1.26 -2.37 135.00 132.55 2qa1 n PRO 205 Ca -0.14 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2qa1 n PRO 205 Cb 0.60 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2qa1 n PRO 205 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qa1 n GLY 206 N 1.13 0.49 2.20 -1.23 0.00 -1.26 -3.87 105.19 102.65 2qa1 n GLY 206 Ca 0.14 -0.91 -0.05 0.00 0.00 0.00 0.00 46.02 45.21 2qa1 n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa1 n GLY 207 N -2.31 0.73 3.74 -0.02 0.00 -1.23 -5.01 105.19 101.10 2qa1 n GLY 207 Ca 0.00 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 2qa1 n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qa1 s ILE 208 N -2.11 4.81 -0.17 -0.61 1.01 -1.00 -4.60 121.20 118.53 2qa1 s ILE 208 Ca 0.00 1.60 -0.05 0.00 0.00 0.00 0.00 60.65 62.21 2qa1 s ILE 208 Cb 0.00 -4.11 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 2qa1 s ILE 208 CO 0.00 0.33 -0.01 -0.89 0.00 0.00 0.00 174.94 174.37 2qa1 s THR 209 N 0.19 4.09 -0.18 2.92 2.01 -0.37 0.69 115.64 124.99 2qa1 s THR 209 Ca 0.39 -0.28 -0.14 0.00 0.31 0.00 0.00 61.69 61.97 2qa1 s THR 209 Cb -0.20 -2.82 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 2qa1 s THR 209 CO 0.22 0.47 0.29 -0.60 -0.69 0.00 0.00 174.62 174.30 2qa1 s ARG 210 N 0.55 4.22 0.01 4.92 3.52 0.13 -0.83 118.95 131.46 2qa1 s ARG 210 Ca -0.01 0.05 0.07 0.00 -0.13 0.00 0.00 55.73 55.70 2qa1 s ARG 210 Cb -0.14 -3.46 -0.03 0.00 -1.56 0.00 0.00 34.95 29.76 2qa1 s ARG 210 CO 0.02 0.16 -0.19 0.96 -0.81 0.00 0.00 175.30 175.44 2qa1 s ILE 211 N 0.70 2.67 -0.17 4.11 -4.36 -0.18 -1.71 121.20 122.26 2qa1 s ILE 211 Ca 0.15 -1.09 0.01 0.00 -0.26 0.00 0.00 60.65 59.46 2qa1 s ILE 211 Cb -0.13 -2.07 0.02 0.00 1.25 0.00 0.00 42.46 41.53 2qa1 s ILE 211 CO 0.04 0.43 -0.17 -0.63 0.24 0.00 0.00 174.94 174.85 2qa1 s ILE 212 N -0.82 1.89 -0.29 8.37 1.01 -0.22 -1.93 121.20 129.20 2qa1 s ILE 212 Ca 0.13 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 59.95 2qa1 s ILE 212 Cb -0.10 -1.74 0.08 0.00 0.01 0.00 0.00 42.46 40.70 2qa1 s ILE 212 CO 0.03 0.48 -0.04 -0.69 0.00 0.00 0.00 174.94 174.72 2qa1 s VAL 213 N 1.35 2.16 -0.54 2.92 1.01 -0.23 -1.89 120.40 125.19 2qa1 s VAL 213 Ca 0.04 -1.90 0.04 0.00 0.00 0.00 0.00 61.98 60.16 2qa1 s VAL 213 Cb -0.13 -2.41 0.13 0.00 0.00 0.00 0.00 36.38 33.97 2qa1 s VAL 213 CO -0.12 -0.27 0.28 0.00 0.00 0.00 0.00 175.10 174.99 2qa1 s GLU 215 N -0.42 3.57 0.14 0.00 2.12 -1.26 -1.69 118.70 121.15 2qa1 s GLU 215 Ca 0.18 -0.02 -0.35 0.00 0.36 0.00 0.00 54.97 55.14 2qa1 s GLU 215 Cb -0.24 -3.17 -0.15 0.00 0.26 0.00 0.00 34.13 30.84 2qa1 s GLU 215 CO -0.02 0.73 1.52 2.89 -0.54 0.00 0.00 175.26 179.84 2qa1 n ARG 216 N 1.71 1.89 -0.89 4.30 1.85 0.13 -3.51 116.66 122.13 2qa1 n ARG 216 Ca -0.16 0.68 0.00 0.00 -1.00 0.00 0.00 57.85 57.37 2qa1 n ARG 216 Cb 0.54 -2.42 0.00 0.00 -1.05 0.00 0.00 32.46 29.53 2qa1 n ARG 216 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2qa1 n GLY 217 N 3.18 0.50 3.62 2.89 0.00 -1.26 -5.02 105.19 109.10 2qa1 n GLY 217 Ca 0.17 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 2qa1 n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qa1 s THR 218 N -2.00 4.63 0.44 2.61 2.01 -1.23 -5.03 115.64 117.06 2qa1 s THR 218 Ca 0.00 1.45 -0.24 0.00 0.31 0.00 0.00 61.69 63.21 2qa1 s THR 218 Cb 0.00 -4.30 -0.08 0.00 0.01 0.00 0.00 72.50 68.13 2qa1 s THR 218 CO 0.00 -0.40 1.23 -2.16 -0.69 0.00 0.00 174.62 172.60 2qa1 s PRO 219 N 3.36 3.84 0.05 4.92 0.04 -1.26 -3.31 135.00 142.64 2qa1 s PRO 219 Ca 0.39 1.96 -0.31 0.00 0.04 0.00 0.00 61.00 63.08 2qa1 s PRO 219 Cb -0.13 -2.57 -0.07 0.00 0.04 0.00 0.00 34.50 31.77 2qa1 s PRO 219 CO 0.15 -0.53 1.48 -1.25 0.04 0.00 0.00 177.00 176.88 2qa1 s PRO 220 N -2.46 4.26 0.05 0.56 0.04 -1.26 -4.08 135.00 132.10 2qa1 s PRO 220 Ca 0.60 2.11 -0.31 0.00 0.04 0.00 0.00 61.00 63.45 2qa1 s PRO 220 Cb -0.33 -3.49 -0.08 0.00 0.04 0.00 0.00 34.50 30.64 2qa1 s PRO 220 CO 0.41 -0.60 1.62 -1.25 0.04 0.00 0.00 177.00 177.22 2qa1 s PRO 226 N 2.14 4.21 0.15 0.56 0.04 -1.26 -4.89 135.00 135.95 2qa1 s PRO 226 Ca 0.67 2.27 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 2qa1 s PRO 226 Cb -0.36 -3.61 -0.07 0.00 0.04 0.00 0.00 34.50 30.50 2qa1 s PRO 226 CO 0.29 -0.72 0.99 -2.14 0.04 0.00 0.00 177.00 175.46 2qa1 s PRO 227 N 2.67 4.71 0.58 0.56 0.02 -1.26 -5.04 135.00 137.24 2qa1 s PRO 227 Ca 0.72 1.52 -0.19 0.00 0.02 0.00 0.00 61.00 63.08 2qa1 s PRO 227 Cb -0.38 -3.33 -0.04 0.00 0.02 0.00 0.00 34.50 30.76 2qa1 s PRO 227 CO 0.31 0.25 1.19 -1.54 -0.33 0.00 0.00 177.00 176.88 2qa1 s SER 228 N -0.27 5.30 0.32 2.53 1.04 -1.26 -4.82 113.70 116.53 2qa1 s SER 228 Ca 0.46 2.35 0.01 0.00 0.48 0.00 0.00 55.95 59.25 2qa1 s SER 228 Cb -0.25 -2.60 0.53 0.00 0.10 0.00 0.00 66.02 63.80 2qa1 s SER 228 CO 0.31 -1.52 1.91 -0.25 0.98 0.00 0.00 173.24 174.67 2qa1 h TRP 229 N 0.96 0.78 -0.01 5.02 -0.00 -1.99 -3.20 115.95 117.51 2qa1 h TRP 229 Ca -0.50 -0.04 -0.12 0.00 -0.00 0.00 0.00 58.89 58.23 2qa1 h TRP 229 Cb 1.29 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.16 30.19 2qa1 h TRP 229 CO 0.47 0.60 -0.58 0.45 -0.00 0.00 0.00 178.44 179.39 2qa1 h HIS 230 N 0.77 0.04 -0.57 2.65 -0.00 -1.94 0.19 115.15 116.29 2qa1 h HIS 230 Ca 0.19 -0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.45 2qa1 h HIS 230 Cb 0.14 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 2qa1 h HIS 230 CO 0.01 0.60 -0.01 1.05 -0.00 0.00 0.00 177.93 179.58 2qa1 h GLU 231 N 0.03 1.00 -0.53 2.45 4.11 -1.96 0.30 114.58 119.98 2qa1 h GLU 231 Ca -0.01 -0.31 -0.04 0.00 0.07 0.00 0.00 59.36 59.07 2qa1 h GLU 231 Cb 1.03 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2qa1 h GLU 231 CO 0.08 0.99 0.16 0.28 0.07 0.00 0.00 179.01 180.59 2qa1 h VAL 232 N 0.92 1.23 -0.49 -1.06 2.07 -1.46 0.67 116.25 118.14 2qa1 h VAL 232 Ca 0.16 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 2qa1 h VAL 232 Cb 0.55 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 2qa1 h VAL 232 CO 0.03 0.29 0.23 0.00 0.02 0.00 0.00 177.57 178.14 2qa1 h ALA 233 N 1.03 0.63 -0.87 1.67 0.00 -0.51 -1.04 119.26 120.16 2qa1 h ALA 233 Ca 0.17 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2qa1 h ALA 233 Cb 0.28 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2qa1 h ALA 233 CO -0.00 0.20 0.58 -0.44 0.00 0.00 0.00 179.25 179.59 2qa1 h ASP 234 N 0.65 0.98 -0.49 0.00 5.19 -0.21 0.30 116.42 122.84 2qa1 h ASP 234 Ca 0.17 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.53 2qa1 h ASP 234 Cb 0.13 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 2qa1 h ASP 234 CO -0.02 0.70 0.19 0.00 -3.12 0.00 0.00 179.24 176.99 2qa1 h ALA 235 N 1.47 0.64 -0.09 3.45 0.00 -0.62 -2.04 119.26 122.07 2qa1 h ALA 235 Ca 0.33 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2qa1 h ALA 235 Cb -0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2qa1 h ALA 235 CO -0.08 0.26 0.03 2.35 0.00 0.00 0.00 179.25 181.81 2qa1 h TRP 236 N 0.66 0.05 -0.74 0.00 2.91 -0.50 -1.83 115.95 116.50 2qa1 h TRP 236 Ca 0.16 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.21 2qa1 h TRP 236 Cb 0.21 -0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 28.81 2qa1 h TRP 236 CO 0.01 0.03 0.47 -0.22 -1.03 0.00 0.00 178.44 177.70 2qa1 h LYS 237 N 0.08 0.91 -0.45 2.65 3.64 -0.88 0.19 116.57 122.69 2qa1 h LYS 237 Ca 0.04 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 2qa1 h LYS 237 Cb 0.02 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2qa1 h LYS 237 CO -0.04 0.60 -0.13 0.00 -2.27 0.00 0.00 179.45 177.61 2qa1 h ARG 238 N 0.94 0.89 -0.07 1.90 3.08 -1.28 0.13 114.38 119.96 2qa1 h ARG 238 Ca 0.29 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 2qa1 h ARG 238 Cb -0.02 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 2qa1 h ARG 238 CO -0.09 1.00 -0.08 -0.07 -1.07 0.00 0.00 179.97 179.65 2qa1 h LEU 239 N 0.72 0.19 0.00 3.04 3.38 -0.88 -3.38 115.31 118.38 2qa1 h LEU 239 Ca 0.11 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2qa1 h LEU 239 Cb 0.68 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2qa1 h LEU 239 CO 0.05 0.65 -1.88 0.35 0.09 0.00 0.00 178.44 177.70 2qa1 n THR 240 N -4.70 0.00 -0.84 0.22 -2.24 0.61 -4.83 114.28 102.51 2qa1 n THR 240 Ca -0.07 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2qa1 n THR 240 Cb 0.31 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 2qa1 n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qa1 n GLY 241 N 1.38 1.21 3.63 3.38 0.00 0.44 -5.02 105.19 110.20 2qa1 n GLY 241 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2qa1 n GLY 241 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qa1 s ASP 242 N -3.11 5.65 -0.30 1.61 1.01 -1.25 -4.98 116.67 115.29 2qa1 s ASP 242 Ca 0.00 0.08 -0.25 0.00 0.71 0.00 0.00 52.55 53.08 2qa1 s ASP 242 Cb 0.00 -1.97 0.01 0.00 1.01 0.00 0.00 42.92 41.96 2qa1 s ASP 242 CO 0.00 0.16 0.89 -0.62 0.21 0.00 0.00 175.17 175.81 2qa1 s ASP 243 N 0.45 6.78 -0.06 0.27 2.15 -1.26 -3.54 116.67 121.46 2qa1 s ASP 243 Ca 0.03 0.84 0.08 0.00 0.43 0.00 0.00 52.55 53.93 2qa1 s ASP 243 Cb -0.12 -2.46 0.12 0.00 -0.30 0.00 0.00 42.92 40.16 2qa1 s ASP 243 CO 0.00 -0.69 1.04 2.30 -0.17 0.00 0.00 175.17 177.65 2qa1 n ILE 244 N 5.60 1.27 0.10 4.11 -5.35 -1.26 -4.82 119.36 119.01 2qa1 n ILE 244 Ca 0.07 -1.43 0.20 0.00 -0.27 0.00 0.00 62.75 61.31 2qa1 n ILE 244 Cb 0.48 0.21 0.76 0.00 -1.74 0.00 0.00 39.64 39.35 2qa1 n ILE 244 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qa1 h ALA 245 N 0.00 2.10 0.00 -1.28 0.00 -1.90 -0.57 119.26 117.61 2qa1 h ALA 245 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qa1 h ALA 245 Cb 0.79 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2qa1 h ALA 245 CO 0.00 -0.58 0.00 1.12 0.00 0.00 0.00 179.25 179.79 2qa1 h HIS 246 N 0.00 0.00 -3.96 0.00 2.07 -1.99 -3.47 115.15 107.81 2qa1 h HIS 246 Ca 0.18 0.00 -0.50 0.00 -2.85 0.00 0.00 60.37 57.19 2qa1 h HIS 246 Cb 0.94 0.00 0.21 0.00 2.57 0.00 0.00 27.41 31.13 2qa1 h HIS 246 CO 0.00 0.00 0.08 0.00 -3.07 0.00 0.00 177.93 174.94 2qa1 n ALA 247 N -1.98 -1.44 -2.62 6.11 0.00 -0.22 -4.99 120.51 115.36 2qa1 n ALA 247 Ca 0.02 -0.70 -0.41 0.00 0.00 0.00 0.00 53.44 52.35 2qa1 n ALA 247 Cb 0.31 -2.11 -0.11 0.00 0.00 0.00 0.00 19.45 17.54 2qa1 n ALA 247 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qa1 s GLU 248 N -4.48 3.18 -0.15 0.00 2.02 -0.66 -4.93 118.70 113.68 2qa1 s GLU 248 Ca 0.66 -0.85 -0.29 0.00 0.02 0.00 0.00 54.97 54.51 2qa1 s GLU 248 Cb -0.23 -3.81 -0.02 0.00 0.10 0.00 0.00 34.13 30.17 2qa1 s GLU 248 CO 0.60 -0.58 1.39 -1.25 0.02 0.00 0.00 175.26 175.44 2qa1 s PRO 249 N 1.66 4.17 -0.17 0.39 0.04 -1.26 -1.20 135.00 138.62 2qa1 s PRO 249 Ca 0.05 1.77 -0.16 0.00 0.04 0.00 0.00 61.00 62.69 2qa1 s PRO 249 Cb -0.18 -3.85 -0.13 0.00 0.04 0.00 0.00 34.50 30.38 2qa1 s PRO 249 CO 0.09 -0.81 0.13 0.28 0.04 0.00 0.00 177.00 176.73 2qa1 h VAL 250 N 5.59 0.63 -3.58 -0.36 2.07 -0.93 -3.47 116.25 116.19 2qa1 h VAL 250 Ca -0.30 -1.69 -0.34 0.00 0.82 0.00 0.00 66.70 65.19 2qa1 h VAL 250 Cb 1.12 1.41 -0.33 0.00 -1.52 0.00 0.00 31.29 31.98 2qa1 h VAL 250 CO 0.97 0.21 -0.75 0.86 0.02 0.00 0.00 177.57 178.89 2qa1 s TRP 251 N -2.22 0.38 -0.08 1.57 -0.00 -1.10 -4.99 118.94 112.50 2qa1 s TRP 251 Ca -0.20 -0.05 0.03 0.00 -0.00 0.00 0.00 56.10 55.89 2qa1 s TRP 251 Cb 0.03 -0.40 0.01 0.00 -0.00 0.00 0.00 33.47 33.11 2qa1 s TRP 251 CO 0.42 -0.11 -0.19 0.08 -0.00 0.00 0.00 176.95 177.16 2qa1 s VAL 252 N 0.72 1.64 0.04 5.86 1.01 -1.26 -1.18 120.40 127.22 2qa1 s VAL 252 Ca -0.08 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.13 2qa1 s VAL 252 Cb -0.11 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 2qa1 s VAL 252 CO -0.01 0.47 -0.05 -0.55 0.00 0.00 0.00 175.10 174.96 2qa1 s SER 253 N 0.45 0.55 0.08 3.32 0.15 -0.32 -4.66 113.70 113.28 2qa1 s SER 253 Ca -0.16 -0.62 0.08 0.00 0.70 0.00 0.00 55.95 55.94 2qa1 s SER 253 Cb -0.17 0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.20 2qa1 s SER 253 CO 0.06 -0.32 -0.16 0.00 1.20 0.00 0.00 173.24 174.02 2qa1 s ALA 254 N -1.93 2.70 0.16 5.45 0.00 -1.26 -1.39 121.76 125.49 2qa1 s ALA 254 Ca -0.09 -1.26 -0.09 0.00 0.00 0.00 0.00 51.96 50.52 2qa1 s ALA 254 Cb -0.06 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.31 2qa1 s ALA 254 CO -0.02 0.59 0.27 -0.59 0.00 0.00 0.00 175.76 176.02 2qa1 s PHE 255 N -1.06 0.38 0.12 0.00 -0.12 -1.01 -5.00 117.98 111.29 2qa1 s PHE 255 Ca 0.17 -0.75 0.01 0.00 -0.05 0.00 0.00 56.93 56.31 2qa1 s PHE 255 Cb -0.11 -0.06 -0.00 0.00 -0.63 0.00 0.00 43.02 42.22 2qa1 s PHE 255 CO 0.09 -0.70 0.03 0.41 -0.05 0.00 0.00 175.22 174.99 2qa1 n GLY 256 N -0.20 3.93 0.62 1.99 0.00 -1.26 -0.96 105.19 109.31 2qa1 n GLY 256 Ca -0.08 -2.06 0.05 0.00 0.00 0.00 0.00 46.02 43.93 2qa1 n GLY 256 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qa1 n ASN 257 N -1.65 1.85 -4.72 1.61 6.94 -1.25 -4.28 115.26 113.78 2qa1 n ASN 257 Ca -0.03 -3.83 -0.42 0.00 -0.02 0.00 0.00 54.58 50.28 2qa1 n ASN 257 Cb 0.17 -0.53 -0.03 0.00 -2.36 0.00 0.00 39.78 37.02 2qa1 n ASN 257 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qa1 s ALA 258 N -3.21 3.92 -0.23 -2.53 0.00 -1.26 -4.53 121.76 113.91 2qa1 s ALA 258 Ca 0.38 1.56 0.00 0.00 0.00 0.00 0.00 51.96 53.91 2qa1 s ALA 258 Cb 0.37 -3.69 0.06 0.00 0.00 0.00 0.00 23.12 19.86 2qa1 s ALA 258 CO -0.05 -0.92 -0.03 0.99 0.00 0.00 0.00 175.76 175.74 2qa1 s THR 259 N 1.25 1.36 0.02 0.00 2.01 -1.00 -2.41 115.64 116.88 2qa1 s THR 259 Ca 0.75 -1.13 -0.07 0.00 0.31 0.00 0.00 61.69 61.54 2qa1 s THR 259 Cb -0.49 -1.68 -0.00 0.00 0.01 0.00 0.00 72.50 70.34 2qa1 s THR 259 CO 0.32 -0.14 0.14 -0.13 -0.69 0.00 0.00 174.62 174.13 2qa1 s ARG 260 N 1.47 0.58 -0.10 4.92 0.52 -0.62 -1.02 118.95 124.69 2qa1 s ARG 260 Ca -0.05 -0.58 -0.07 0.00 -0.52 0.00 0.00 55.73 54.51 2qa1 s ARG 260 Cb -0.19 0.24 0.03 0.00 0.52 0.00 0.00 34.95 35.55 2qa1 s ARG 260 CO -0.07 -0.15 0.25 -1.14 0.02 0.00 0.00 175.30 174.21 2qa1 s GLN 261 N -2.12 0.26 0.47 3.54 0.74 -0.97 -1.12 119.66 120.46 2qa1 s GLN 261 Ca -0.09 0.43 -0.24 0.00 0.05 0.00 0.00 55.36 55.51 2qa1 s GLN 261 Cb -0.04 0.03 -0.07 0.00 1.10 0.00 0.00 33.01 34.04 2qa1 s GLN 261 CO -0.02 -0.09 1.34 0.14 -0.55 0.00 0.00 175.29 176.11 2qa1 s VAL 262 N 0.60 2.34 -0.22 1.34 -7.23 -0.48 -3.73 120.40 113.02 2qa1 s VAL 262 Ca -0.04 0.28 0.24 0.00 -1.81 0.00 0.00 61.98 60.66 2qa1 s VAL 262 Cb -0.05 -3.16 0.30 0.00 0.56 0.00 0.00 36.38 34.04 2qa1 s VAL 262 CO -0.03 0.02 1.69 0.71 -0.31 0.00 0.00 175.10 177.18 2qa1 h THR 263 N 2.02 0.17 -3.44 5.32 1.35 -1.81 -3.43 112.91 113.10 2qa1 h THR 263 Ca -0.50 -1.07 -0.41 0.00 -0.55 0.00 0.00 66.41 63.87 2qa1 h THR 263 Cb 1.27 1.93 -0.34 0.00 -1.73 0.00 0.00 68.15 69.27 2qa1 h THR 263 CO 0.60 0.09 -0.77 -1.61 -0.25 0.00 0.00 175.52 173.58 2qa1 s GLU 264 N -3.32 0.81 0.36 4.72 2.02 -1.26 -5.02 118.70 117.00 2qa1 s GLU 264 Ca 0.05 -0.08 0.24 0.00 0.02 0.00 0.00 54.97 55.20 2qa1 s GLU 264 Cb 0.07 -0.86 0.55 0.00 0.10 0.00 0.00 34.13 33.99 2qa1 s GLU 264 CO 0.65 -0.11 1.68 1.88 0.02 0.00 0.00 175.26 179.38 2qa1 h TYR 265 N 7.32 0.00 -3.60 1.61 -1.99 -1.89 -3.45 116.97 114.97 2qa1 h TYR 265 Ca -0.36 0.00 -0.35 0.00 2.00 0.00 0.00 58.73 60.02 2qa1 h TYR 265 Cb 1.15 0.00 -0.32 0.00 2.00 0.00 0.00 36.73 39.56 2qa1 h TYR 265 CO 0.50 0.00 -0.75 0.50 -0.00 0.00 0.00 178.16 178.40 2qa1 s ARG 266 N -3.19 0.45 -0.24 4.88 3.52 -1.26 -0.91 118.95 122.20 2qa1 s ARG 266 Ca 0.08 -0.04 0.01 0.00 -0.13 0.00 0.00 55.73 55.65 2qa1 s ARG 266 Cb 0.08 -0.53 0.06 0.00 -1.56 0.00 0.00 34.95 33.00 2qa1 s ARG 266 CO 0.63 -0.05 -0.06 1.03 -0.81 0.00 0.00 175.30 176.05 2qa1 s ARG 267 N 0.65 1.68 7.23 5.12 0.52 0.10 -5.01 118.95 129.24 2qa1 s ARG 267 Ca -0.07 -1.04 0.00 0.00 -0.52 0.00 0.00 55.73 54.10 2qa1 s ARG 267 Cb -0.10 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.74 2qa1 s ARG 267 CO -0.01 -0.60 0.00 0.41 0.02 0.00 0.00 175.30 175.12 2qa1 n GLY 268 N 4.64 3.05 1.32 -3.53 0.00 -1.26 -1.38 105.19 108.03 2qa1 n GLY 268 Ca -0.12 0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.15 2qa1 n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qa1 n ARG 269 N 8.44 3.41 -3.95 1.61 1.74 -1.26 -4.88 116.66 121.78 2qa1 n ARG 269 Ca 0.00 -2.73 -0.35 0.00 -0.77 0.00 0.00 57.85 54.01 2qa1 n ARG 269 Cb 0.00 -1.75 -0.14 0.00 -1.02 0.00 0.00 32.46 29.54 2qa1 n ARG 269 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qa1 s VAL 270 N -1.76 3.01 0.13 1.55 1.01 -0.48 -0.95 120.40 122.91 2qa1 s VAL 270 Ca 0.45 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.72 2qa1 s VAL 270 Cb 0.29 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2qa1 s VAL 270 CO 0.22 0.31 -0.20 -0.63 0.00 0.00 0.00 175.10 174.80 2qa1 s ILE 271 N 1.39 2.69 0.08 2.22 1.01 -0.08 -0.73 121.20 127.78 2qa1 s ILE 271 Ca 0.03 -1.61 0.10 0.00 0.00 0.00 0.00 60.65 59.17 2qa1 s ILE 271 Cb -0.15 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 2qa1 s ILE 271 CO -0.05 0.07 -0.25 -0.76 0.00 0.00 0.00 174.94 173.96 2qa1 s LEU 272 N -2.20 2.32 -0.07 2.97 1.43 -0.09 -0.08 118.68 122.96 2qa1 s LEU 272 Ca 0.18 -0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 52.60 2qa1 s LEU 272 Cb -0.10 -1.32 0.02 0.00 0.03 0.00 0.00 46.19 44.82 2qa1 s LEU 272 CO 0.09 0.23 0.17 0.00 0.23 0.00 0.00 176.35 177.08 2qa1 s ALA 273 N -0.93 -0.43 0.00 4.21 0.00 -0.99 -4.88 121.76 118.74 2qa1 s ALA 273 Ca 0.13 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2qa1 s ALA 273 Cb -0.10 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.72 2qa1 s ALA 273 CO 0.04 -0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.13 2qa1 n GLY 274 N 3.05 -0.67 0.33 0.00 0.00 -1.26 -4.17 105.19 102.48 2qa1 n GLY 274 Ca -0.13 -1.58 0.18 0.00 0.00 0.00 0.00 46.02 44.49 2qa1 n GLY 274 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qa1 h ASP 275 N 2.38 0.00 0.26 1.61 5.19 -1.87 -0.47 116.42 123.53 2qa1 h ASP 275 Ca 0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 2qa1 h ASP 275 Cb 0.00 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 2qa1 h ASP 275 CO 0.00 0.00 -0.12 0.77 -3.12 0.00 0.00 179.24 176.77 2qa1 h SER 276 N 0.00 0.00 0.38 6.45 4.64 -1.70 -2.42 113.55 120.90 2qa1 h SER 276 Ca 0.02 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.27 2qa1 h SER 276 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2qa1 h SER 276 CO -0.00 0.12 -1.69 0.00 -0.87 0.00 0.00 176.83 174.40 2qa1 n ALA 277 N -2.36 2.43 -3.66 5.18 0.00 -0.20 -4.82 120.51 117.08 2qa1 n ALA 277 Ca -0.02 -0.54 -0.07 0.00 0.00 0.00 0.00 53.44 52.80 2qa1 n ALA 277 Cb 0.22 -0.81 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 2qa1 n ALA 277 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2qa1 s HIS 278 N -3.26 -0.91 0.21 0.00 0.00 -0.91 -1.39 115.29 109.03 2qa1 s HIS 278 Ca -0.05 1.75 0.10 0.00 -3.00 0.00 0.00 55.06 53.85 2qa1 s HIS 278 Cb 0.11 0.46 -0.05 0.00 -4.00 0.00 0.00 32.58 29.11 2qa1 s HIS 278 CO 0.85 -0.49 -0.20 0.96 -1.00 0.00 0.00 174.74 174.87 2qa1 s ILE 279 N 2.09 2.12 0.02 -5.38 -4.36 -0.28 -4.22 121.20 111.20 2qa1 s ILE 279 Ca -0.07 -2.11 -0.29 0.00 -0.26 0.00 0.00 60.65 57.92 2qa1 s ILE 279 Cb -0.09 -2.06 0.11 0.00 1.25 0.00 0.00 42.46 41.66 2qa1 s ILE 279 CO -0.16 -0.32 1.20 -1.38 0.24 0.00 0.00 174.94 174.53 2qa1 s HIS 280 N -2.17 -0.07 0.23 1.37 -3.43 -1.01 -1.60 115.29 108.61 2qa1 s HIS 280 Ca 0.21 -0.09 -0.31 0.00 -0.80 0.00 0.00 55.06 54.08 2qa1 s HIS 280 Cb -0.06 0.57 -0.11 0.00 -1.43 0.00 0.00 32.58 31.55 2qa1 s HIS 280 CO 0.10 -0.41 1.64 -1.17 -2.00 0.00 0.00 174.74 172.89 2qa1 s LEU 281 N -2.95 4.36 -1.36 5.38 2.96 -1.26 -4.79 118.68 121.02 2qa1 s LEU 281 Ca 0.14 2.83 -0.16 0.00 -0.22 0.00 0.00 54.13 56.72 2qa1 s LEU 281 Cb 0.03 -3.61 0.07 0.00 0.50 0.00 0.00 46.19 43.18 2qa1 s LEU 281 CO -0.02 -0.91 1.92 -0.81 -1.32 0.00 0.00 176.35 175.21 2qa1 n PRO 282 N 3.34 3.10 -4.71 0.98 -0.04 -1.26 -4.86 135.00 131.54 2qa1 n PRO 282 Ca 0.13 -3.06 -0.33 0.00 -0.04 0.00 0.00 63.50 60.20 2qa1 n PRO 282 Cb 0.37 -3.35 -0.16 0.00 -0.04 0.00 0.00 33.50 30.32 2qa1 n PRO 282 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qa1 s ALA 283 N 3.43 2.41 0.00 0.55 0.00 -1.26 -4.72 121.76 122.17 2qa1 s ALA 283 Ca 0.50 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.44 2qa1 s ALA 283 Cb 0.08 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 22.09 2qa1 s ALA 283 CO 0.00 0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.24 2qa1 n GLY 284 N 3.89 0.86 3.48 0.00 0.00 -1.26 -4.55 105.19 107.60 2qa1 n GLY 284 Ca -0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 2qa1 n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qa1 n GLY 285 N -2.14 -0.86 0.02 -0.02 0.00 -1.26 -4.96 105.19 95.97 2qa1 n GLY 285 Ca 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 46.02 46.42 2qa1 n GLY 285 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qa1 n GLN 286 N -3.80 2.64 0.33 1.61 1.13 -1.26 -4.73 117.38 113.30 2qa1 n GLN 286 Ca -0.14 -0.01 -0.15 0.00 -1.94 0.00 0.00 57.00 54.75 2qa1 n GLN 286 Cb 0.63 -1.11 -0.08 0.00 0.11 0.00 0.00 30.24 29.80 2qa1 n GLN 286 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2qa1 h GLY 287 N 0.81 -0.88 0.66 1.08 0.00 -1.93 0.11 103.07 102.91 2qa1 h GLY 287 Ca -0.09 0.33 0.05 0.00 0.00 0.00 0.00 47.33 47.62 2qa1 h GLY 287 CO 0.00 -0.32 0.26 1.98 0.00 0.00 0.00 176.54 178.46 2qa1 h MET 288 N -1.08 0.48 -0.34 4.80 1.85 -1.99 -0.76 114.93 117.89 2qa1 h MET 288 Ca -0.09 -0.03 0.02 0.00 -0.61 0.00 0.00 59.70 59.00 2qa1 h MET 288 Cb 0.69 -0.11 -0.03 0.00 0.43 0.00 0.00 31.60 32.59 2qa1 h MET 288 CO 0.14 0.32 0.17 -0.91 -0.40 0.00 0.00 176.91 176.23 2qa1 h ASN 289 N 0.50 0.24 -0.31 1.39 2.35 -1.82 -0.16 115.58 117.77 2qa1 h ASN 289 Ca 0.24 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.94 2qa1 h ASN 289 Cb 0.18 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2qa1 h ASN 289 CO -0.19 0.18 -0.02 0.74 -1.65 0.00 0.00 177.43 176.50 2qa1 h THR 290 N 0.35 1.23 -0.16 2.81 2.02 -0.71 -1.63 112.91 116.81 2qa1 h THR 290 Ca 0.14 -0.95 -0.07 0.00 0.77 0.00 0.00 66.41 66.31 2qa1 h THR 290 Cb 0.06 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 2qa1 h THR 290 CO -0.10 0.33 -0.16 0.28 0.37 0.00 0.00 175.52 176.24 2qa1 h SER 291 N 0.63 0.42 -0.63 4.18 0.02 -0.60 0.32 113.55 117.90 2qa1 h SER 291 Ca 0.13 -0.48 0.06 0.00 -0.84 0.00 0.00 61.79 60.66 2qa1 h SER 291 Cb 0.42 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.79 2qa1 h SER 291 CO 0.02 0.81 0.33 0.40 -1.14 0.00 0.00 176.83 177.25 2qa1 h ILE 292 N 0.04 0.95 0.00 3.27 2.04 -1.02 -2.64 117.51 120.14 2qa1 h ILE 292 Ca 0.03 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.57 2qa1 h ILE 292 Cb 0.69 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 2qa1 h ILE 292 CO 0.04 0.11 -0.51 1.56 0.00 0.00 0.00 178.15 179.35 2qa1 h GLN 293 N 0.62 0.00 -0.24 2.37 4.20 -1.00 -1.94 115.11 119.12 2qa1 h GLN 293 Ca 0.28 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.03 2qa1 h GLN 293 Cb 0.19 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.94 2qa1 h GLN 293 CO -0.19 0.51 0.05 -0.44 -0.67 0.00 0.00 178.83 178.09 2qa1 h ASP 294 N 0.00 0.01 -0.69 1.46 3.32 -0.14 -1.64 116.42 118.74 2qa1 h ASP 294 Ca -0.01 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.10 2qa1 h ASP 294 Cb 0.94 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 2qa1 h ASP 294 CO 0.07 0.04 0.46 0.00 -1.72 0.00 0.00 179.24 178.08 2qa1 h ALA 295 N 1.18 1.54 -0.30 3.45 0.00 -1.11 -0.94 119.26 123.07 2qa1 h ALA 295 Ca 0.11 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2qa1 h ALA 295 Cb 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2qa1 h ALA 295 CO -0.15 0.42 -0.40 0.28 0.00 0.00 0.00 179.25 179.40 2qa1 h VAL 296 N 0.91 1.29 -0.67 0.00 2.07 -1.03 0.14 116.25 118.96 2qa1 h VAL 296 Ca 0.26 -1.58 -0.07 0.00 0.82 0.00 0.00 66.70 66.13 2qa1 h VAL 296 Cb -0.06 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 2qa1 h VAL 296 CO -0.06 0.51 0.13 -1.13 0.02 0.00 0.00 177.57 177.04 2qa1 h ASN 297 N 0.58 1.05 0.07 0.57 -0.73 -0.93 -3.36 115.58 112.83 2qa1 h ASN 297 Ca 0.05 -0.25 -0.11 0.00 1.87 0.00 0.00 56.30 57.86 2qa1 h ASN 297 Cb 0.94 -0.28 0.01 0.00 0.27 0.00 0.00 38.32 39.27 2qa1 h ASN 297 CO 0.09 1.03 -0.47 0.25 -0.37 0.00 0.00 177.43 177.95 2qa1 h LEU 298 N 1.02 0.30 -0.29 0.34 5.85 -0.85 -3.38 115.31 118.31 2qa1 h LEU 298 Ca 0.21 -0.92 0.07 0.00 0.84 0.00 0.00 57.88 58.07 2qa1 h LEU 298 Cb 0.41 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2qa1 h LEU 298 CO 0.01 1.20 -0.33 1.23 -0.34 0.00 0.00 178.44 180.20 2qa1 h GLY 299 N -0.56 -0.35 1.64 3.75 0.00 -1.12 0.31 103.07 106.75 2qa1 h GLY 299 Ca -0.08 0.41 -0.06 0.00 0.00 0.00 0.00 47.33 47.60 2qa1 h GLY 299 CO 0.09 -0.21 -0.11 0.11 0.00 0.00 0.00 176.54 176.42 2qa1 h TRP 300 N -0.32 0.46 0.09 5.60 5.08 -1.77 0.30 115.95 125.40 2qa1 h TRP 300 Ca 0.14 -0.06 -0.00 0.00 1.08 0.00 0.00 58.89 60.04 2qa1 h TRP 300 Cb 0.54 -0.13 0.00 0.00 -3.00 0.00 0.00 29.16 26.58 2qa1 h TRP 300 CO -0.49 0.54 -0.04 0.87 -1.28 0.00 0.00 178.44 178.04 2qa1 h LYS 301 N 0.41 -0.11 -0.97 0.12 1.57 -1.47 -1.19 116.57 114.93 2qa1 h LYS 301 Ca 0.08 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2qa1 h LYS 301 Cb 0.44 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 2qa1 h LYS 301 CO 0.02 0.34 0.64 1.25 -0.57 0.00 0.00 179.45 181.14 2qa1 h LEU 302 N -0.61 1.11 -0.40 2.94 5.85 -0.91 -1.47 115.31 121.81 2qa1 h LEU 302 Ca -0.01 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.70 2qa1 h LEU 302 Cb 0.50 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2qa1 h LEU 302 CO 0.02 0.80 0.22 1.23 -0.34 0.00 0.00 178.44 180.37 2qa1 h GLY 303 N 1.31 0.55 1.27 3.75 0.00 -0.90 -0.18 103.07 108.87 2qa1 h GLY 303 Ca 0.36 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 2qa1 h GLY 303 CO -0.08 0.13 0.25 0.00 0.00 0.00 0.00 176.54 176.84 2qa1 h ALA 304 N 1.19 1.24 -0.02 3.60 0.00 -0.72 0.35 119.26 124.90 2qa1 h ALA 304 Ca 0.16 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qa1 h ALA 304 Cb 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2qa1 h ALA 304 CO -0.09 0.56 0.00 0.28 0.00 0.00 0.00 179.25 180.00 2qa1 h VAL 305 N 0.92 1.24 -0.91 0.00 2.07 -0.97 -0.87 116.25 117.74 2qa1 h VAL 305 Ca 0.22 -0.73 0.08 0.00 0.82 0.00 0.00 66.70 67.09 2qa1 h VAL 305 Cb 0.19 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.59 2qa1 h VAL 305 CO -0.02 0.19 0.56 0.58 0.02 0.00 0.00 177.57 178.91 2qa1 h VAL 306 N -0.26 1.01 0.00 2.57 2.07 -0.87 -1.14 116.25 119.62 2qa1 h VAL 306 Ca 0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2qa1 h VAL 306 Cb 0.31 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2qa1 h VAL 306 CO 0.00 0.18 0.00 0.59 0.02 0.00 0.00 177.57 178.36 2qa1 n ASN 307 N -4.61 0.00 0.00 0.57 3.02 0.10 -4.90 115.26 109.44 2qa1 n ASN 307 Ca 0.14 -0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 2qa1 n ASN 307 Cb 0.22 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 2qa1 n ASN 307 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qa1 n GLY 308 N 0.56 0.47 0.08 7.41 0.00 -0.43 -4.89 105.19 108.38 2qa1 n GLY 308 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 2qa1 n GLY 308 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qa1 n THR 309 N -2.73 0.46 -4.26 2.61 -2.24 -0.40 -4.86 114.28 102.85 2qa1 n THR 309 Ca 0.00 -0.41 -0.22 0.00 -2.27 0.00 0.00 64.05 61.14 2qa1 n THR 309 Cb 0.07 -0.18 -0.12 0.00 -2.10 0.00 0.00 70.33 68.00 2qa1 n THR 309 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qa1 s ALA 310 N -3.28 1.68 0.69 6.98 0.00 -0.99 -4.17 121.76 122.66 2qa1 s ALA 310 Ca 0.02 -1.22 -0.05 0.00 0.00 0.00 0.00 51.96 50.71 2qa1 s ALA 310 Cb 0.12 -0.20 0.06 0.00 0.00 0.00 0.00 23.12 23.10 2qa1 s ALA 310 CO 0.77 0.30 0.98 0.95 0.00 0.00 0.00 175.76 178.76 2qa1 s THR 311 N -1.32 2.33 -1.20 0.00 -4.23 -1.26 -4.29 115.64 105.67 2qa1 s THR 311 Ca 0.06 -0.35 0.14 0.00 -1.18 0.00 0.00 61.69 60.36 2qa1 s THR 311 Cb -0.09 -2.98 0.18 0.00 1.34 0.00 0.00 72.50 70.95 2qa1 s THR 311 CO 0.04 0.00 1.43 -0.62 -0.54 0.00 0.00 174.62 174.93 2qa1 n GLU 312 N -2.84 0.10 -0.19 3.99 1.02 -1.26 -1.89 120.64 119.56 2qa1 n GLU 312 Ca 0.09 0.21 -0.02 0.00 -0.02 0.00 0.00 57.16 57.41 2qa1 n GLU 312 Cb 0.60 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.61 2qa1 n GLU 312 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2qa1 h GLU 313 N 0.00 0.43 -0.58 3.49 5.08 -1.99 0.28 114.58 121.29 2qa1 h GLU 313 Ca 0.00 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.40 2qa1 h GLU 313 Cb 0.19 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.29 2qa1 h GLU 313 CO 0.00 0.29 0.28 1.25 -1.00 0.00 0.00 179.01 179.83 2qa1 h LEU 314 N 0.45 0.37 -1.11 1.33 5.85 -1.69 -2.56 115.31 117.95 2qa1 h LEU 314 Ca 0.27 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 2qa1 h LEU 314 Cb 0.28 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 2qa1 h LEU 314 CO -0.24 0.24 0.24 0.25 -0.34 0.00 0.00 178.44 178.59 2qa1 h LEU 315 N 0.52 0.79 -2.36 2.25 5.85 -1.44 -1.82 115.31 119.11 2qa1 h LEU 315 Ca 0.27 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2qa1 h LEU 315 Cb 0.22 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 2qa1 h LEU 315 CO -0.21 0.71 -0.02 0.44 -0.34 0.00 0.00 178.44 179.02 2qa1 h ASP 316 N 0.86 0.00 1.13 1.25 3.32 -0.56 -1.89 116.42 120.53 2qa1 h ASP 316 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2qa1 h ASP 316 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2qa1 h ASP 316 CO -0.02 0.02 0.00 0.77 -1.72 0.00 0.00 179.24 178.29 2qa1 h SER 317 N 0.00 0.00 0.09 6.45 4.64 -1.14 -2.29 113.55 121.29 2qa1 h SER 317 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qa1 h SER 317 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2qa1 h SER 317 CO 0.00 0.00 -0.04 0.22 -0.87 0.00 0.00 176.83 176.14 2qa1 h TYR 318 N 0.00 -0.11 -0.06 4.77 3.20 -1.42 -1.94 116.97 121.41 2qa1 h TYR 318 Ca 0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 2qa1 h TYR 318 Cb 0.57 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.82 2qa1 h TYR 318 CO 0.00 0.27 -0.29 1.25 -1.64 0.00 0.00 178.16 177.75 2qa1 h HIS 319 N -0.51 -0.78 -0.55 -3.82 2.76 -1.61 -0.00 115.15 110.64 2qa1 h HIS 319 Ca -0.01 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 2qa1 h HIS 319 Cb 0.43 0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.72 2qa1 h HIS 319 CO 0.05 -0.37 0.08 0.66 -1.30 0.00 0.00 177.93 177.04 2qa1 h SER 320 N -0.40 0.88 -0.03 3.26 4.64 -1.44 0.17 113.55 120.63 2qa1 h SER 320 Ca 0.08 -0.27 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 2qa1 h SER 320 Cb 0.52 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2qa1 h SER 320 CO -0.29 0.93 -0.03 -0.33 -0.87 0.00 0.00 176.83 176.23 2qa1 h GLU 321 N 0.80 0.07 0.00 4.77 5.08 -1.32 -3.10 114.58 120.88 2qa1 h GLU 321 Ca 0.16 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.30 2qa1 h GLU 321 Cb 0.43 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2qa1 h GLU 321 CO 0.01 0.57 -0.94 0.00 -1.00 0.00 0.00 179.01 177.65 2qa1 h ARG 322 N -0.43 0.00 -1.00 2.33 2.47 -0.96 -2.51 114.38 114.28 2qa1 h ARG 322 Ca 0.00 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.73 2qa1 h ARG 322 Cb 0.56 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.83 2qa1 h ARG 322 CO 0.01 0.81 0.66 1.25 0.56 0.00 0.00 179.97 183.26 2qa1 h HIS 323 N 0.00 1.26 -0.49 3.04 2.76 -0.79 0.10 115.15 121.03 2qa1 h HIS 323 Ca -0.03 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 2qa1 h HIS 323 Cb 1.69 -0.43 -0.02 0.00 1.55 0.00 0.00 27.41 30.20 2qa1 h HIS 323 CO 0.00 0.80 0.16 0.00 -1.30 0.00 0.00 177.93 177.59 2qa1 h ALA 324 N 1.37 0.64 -0.60 5.26 0.00 -1.45 -0.56 119.26 123.93 2qa1 h ALA 324 Ca 0.37 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2qa1 h ALA 324 Cb -0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2qa1 h ALA 324 CO -0.08 0.29 0.17 0.28 0.00 0.00 0.00 179.25 179.90 2qa1 h VAL 325 N 0.66 1.25 -0.31 0.00 2.07 -1.18 -2.60 116.25 116.13 2qa1 h VAL 325 Ca 0.16 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.74 2qa1 h VAL 325 Cb 0.25 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 2qa1 h VAL 325 CO -0.01 0.33 -0.10 1.23 0.02 0.00 0.00 177.57 179.04 2qa1 h GLY 326 N 0.87 0.56 1.01 2.17 0.00 -0.49 0.23 103.07 107.41 2qa1 h GLY 326 Ca 0.19 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 2qa1 h GLY 326 CO -0.00 0.35 0.21 1.70 0.00 0.00 0.00 176.54 178.80 2qa1 h LYS 327 N 0.48 0.93 -0.53 4.80 3.64 -0.95 -1.88 116.57 123.06 2qa1 h LYS 327 Ca 0.09 -0.19 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 2qa1 h LYS 327 Cb 0.47 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2qa1 h LYS 327 CO 0.03 0.82 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.88 2qa1 h ARG 328 N 0.86 0.97 -0.50 1.90 2.43 -1.06 -2.15 114.38 116.82 2qa1 h ARG 328 Ca 0.20 -0.34 0.10 0.00 -0.81 0.00 0.00 59.98 59.13 2qa1 h ARG 328 Cb 0.26 -0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 29.65 2qa1 h ARG 328 CO -0.01 1.01 -0.01 1.25 -1.51 0.00 0.00 179.97 180.70 2qa1 h LEU 329 N 0.84 -0.23 -0.79 3.80 5.85 -0.74 0.15 115.31 124.19 2qa1 h LEU 329 Ca 0.14 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.94 2qa1 h LEU 329 Cb 0.60 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 2qa1 h LEU 329 CO 0.04 -0.08 0.30 -0.07 -0.34 0.00 0.00 178.44 178.29 2qa1 h LEU 330 N 0.11 1.10 -0.05 2.25 3.38 -1.01 -1.20 115.31 119.88 2qa1 h LEU 330 Ca 0.25 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2qa1 h LEU 330 Cb 0.38 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qa1 h LEU 330 CO -0.43 0.98 0.03 -0.03 0.09 0.00 0.00 178.44 179.08 2qa1 h MET 331 N 1.16 0.08 0.43 1.13 4.05 -0.96 -1.41 114.93 119.41 2qa1 h MET 331 Ca 0.26 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.66 2qa1 h MET 331 Cb 0.23 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.01 2qa1 h MET 331 CO -0.02 0.15 -0.31 -0.97 0.23 0.00 0.00 176.91 175.99 2qa1 h ASN 332 N -0.02 -0.81 -0.60 1.39 -1.24 -0.52 0.09 115.58 113.88 2qa1 h ASN 332 Ca 0.02 0.06 -0.07 0.00 0.71 0.00 0.00 56.30 57.02 2qa1 h ASN 332 Cb 0.10 0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.38 2qa1 h ASN 332 CO -0.00 -0.47 0.11 0.71 -1.29 0.00 0.00 177.43 176.48 2qa1 h THR 333 N -0.73 1.26 -0.65 -3.57 1.35 -1.28 -0.64 112.91 108.64 2qa1 h THR 333 Ca -0.04 -0.98 -0.05 0.00 -0.55 0.00 0.00 66.41 64.79 2qa1 h THR 333 Cb 0.62 0.73 -0.03 0.00 -1.73 0.00 0.00 68.15 67.75 2qa1 h THR 333 CO 0.01 0.36 0.23 1.56 -0.25 0.00 0.00 175.52 177.44 2qa1 h GLN 334 N 0.89 1.00 -0.18 4.72 4.20 -1.19 0.13 115.11 124.68 2qa1 h GLN 334 Ca 0.18 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2qa1 h GLN 334 Cb 0.41 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2qa1 h GLN 334 CO 0.01 0.86 0.08 0.00 -0.67 0.00 0.00 178.83 179.11 2qa1 h ALA 335 N 1.09 0.23 -0.76 3.87 0.00 -0.71 -0.29 119.26 122.70 2qa1 h ALA 335 Ca 0.21 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2qa1 h ALA 335 Cb 0.25 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2qa1 h ALA 335 CO -0.01 -0.21 0.33 1.96 0.00 0.00 0.00 179.25 181.32 2qa1 h GLN 336 N 0.16 1.12 -0.52 0.00 4.20 -1.00 -2.48 115.11 116.59 2qa1 h GLN 336 Ca 0.06 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 2qa1 h GLN 336 Cb 0.12 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2qa1 h GLN 336 CO -0.01 0.90 0.24 0.78 -0.67 0.00 0.00 178.83 180.08 2qa1 h GLY 337 N 1.09 0.81 0.67 3.46 0.00 -0.58 0.53 103.07 109.05 2qa1 h GLY 337 Ca 0.26 -0.41 0.06 0.00 0.00 0.00 0.00 47.33 47.24 2qa1 h GLY 337 CO -0.03 0.39 0.30 1.41 0.00 0.00 0.00 176.54 178.62 2qa1 h LEU 338 N 0.70 0.43 -0.57 3.11 3.38 -0.87 0.12 115.31 121.61 2qa1 h LEU 338 Ca 0.18 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 2qa1 h LEU 338 Cb 0.13 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2qa1 h LEU 338 CO -0.02 0.28 -0.06 -0.07 0.09 0.00 0.00 178.44 178.66 2qa1 h LEU 339 N 0.57 1.05 -0.20 1.67 3.38 -1.00 -2.71 115.31 118.07 2qa1 h LEU 339 Ca 0.27 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2qa1 h LEU 339 Cb 0.19 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2qa1 h LEU 339 CO -0.19 1.13 -0.01 -0.26 0.09 0.00 0.00 178.44 179.21 2qa1 h PHE 340 N 0.94 0.39 0.00 1.13 0.05 -0.66 -3.40 116.94 115.38 2qa1 h PHE 340 Ca 0.15 -0.07 0.00 0.00 3.82 0.00 0.00 57.97 61.87 2qa1 h PHE 340 Cb 0.63 -0.10 0.00 0.00 2.00 0.00 0.00 35.95 38.48 2qa1 h PHE 340 CO 0.04 0.56 -1.38 1.28 -0.18 0.00 0.00 178.31 178.63 2qa1 n LEU 341 N -4.69 0.24 -4.83 1.54 4.77 0.40 -4.60 117.00 109.83 2qa1 n LEU 341 Ca -0.04 -0.17 -0.31 0.00 -0.03 0.00 0.00 56.01 55.46 2qa1 n LEU 341 Cb 0.24 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.37 2qa1 n LEU 341 CO 0.37 0.06 0.71 -0.44 -1.33 0.00 0.00 177.39 176.76 2qa1 s SER 342 N -3.34 5.49 0.25 -1.43 0.01 -1.02 -4.87 113.70 108.79 2qa1 s SER 342 Ca -0.02 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.76 2qa1 s SER 342 Cb 0.10 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.92 2qa1 s SER 342 CO 0.64 -1.36 0.00 0.61 0.41 0.00 0.00 173.24 173.54 2qa1 n GLY 343 N -2.23 -1.69 0.38 3.44 0.00 -1.26 -4.78 105.19 99.06 2qa1 n GLY 343 Ca 0.07 -1.50 0.18 0.00 0.00 0.00 0.00 46.02 44.77 2qa1 n GLY 343 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qa1 h PRO 344 N 0.00 0.00 -1.01 1.61 0.11 -1.88 -2.49 132.00 128.34 2qa1 h PRO 344 Ca 0.00 0.00 0.23 0.00 0.11 0.00 0.00 66.00 66.34 2qa1 h PRO 344 Cb 0.00 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.00 2qa1 h PRO 344 CO 0.00 0.00 0.62 1.49 -0.21 0.00 0.00 178.00 179.90 2qa1 h GLU 345 N 0.00 0.54 -0.01 1.05 4.81 -2.00 -1.02 114.58 117.95 2qa1 h GLU 345 Ca 0.15 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2qa1 h GLU 345 Cb 1.23 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2qa1 h GLU 345 CO -0.00 0.36 -0.11 0.28 -0.73 0.00 0.00 179.01 178.80 2qa1 n VAL 346 N -4.74 0.00 -0.23 0.32 0.31 -0.94 -4.36 118.33 108.69 2qa1 n VAL 346 Ca 0.25 -0.22 0.03 0.00 -0.01 0.00 0.00 64.34 64.39 2qa1 n VAL 346 Cb 0.74 0.54 0.15 0.00 -0.91 0.00 0.00 33.84 34.36 2qa1 n VAL 346 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2qa1 h GLN 347 N 2.05 0.31 -0.96 5.55 5.75 -1.33 -1.24 115.11 125.24 2qa1 h GLN 347 Ca 0.00 -0.02 0.16 0.00 -0.15 0.00 0.00 58.65 58.64 2qa1 h GLN 347 Cb 0.54 -0.07 -0.10 0.00 1.07 0.00 0.00 27.48 28.92 2qa1 h GLN 347 CO 0.00 0.21 0.57 -1.35 -2.65 0.00 0.00 178.83 175.60 2qa1 h PRO 348 N 0.32 0.76 -0.21 -2.39 0.11 -1.79 0.19 132.00 129.01 2qa1 h PRO 348 Ca 0.37 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 66.27 2qa1 h PRO 348 Cb 0.57 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 2qa1 h PRO 348 CO -0.43 0.51 -0.55 -0.07 -0.21 0.00 0.00 178.00 177.25 2qa1 h LEU 349 N 0.79 0.69 -0.36 2.35 3.38 -1.57 -0.80 115.31 119.79 2qa1 h LEU 349 Ca 0.52 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2qa1 h LEU 349 Cb 0.72 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2qa1 h LEU 349 CO -0.34 1.10 0.15 0.03 0.09 0.00 0.00 178.44 179.47 2qa1 h ARG 350 N 0.47 0.31 -0.46 1.13 3.08 -0.47 -1.17 114.38 117.28 2qa1 h ARG 350 Ca 0.01 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2qa1 h ARG 350 Cb 1.11 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.07 2qa1 h ARG 350 CO 0.11 0.21 0.16 -0.44 -1.07 0.00 0.00 179.97 178.94 2qa1 h ASP 351 N 0.32 0.65 -0.34 7.04 3.32 -0.39 0.78 116.42 127.81 2qa1 h ASP 351 Ca 0.16 -0.19 0.01 0.00 0.02 0.00 0.00 57.03 57.02 2qa1 h ASP 351 Cb 0.10 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2qa1 h ASP 351 CO -0.14 0.67 0.22 0.58 -1.72 0.00 0.00 179.24 178.85 2qa1 h VAL 352 N 0.60 1.08 -0.61 -1.35 2.07 -1.04 -2.13 116.25 114.87 2qa1 h VAL 352 Ca 0.15 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 2qa1 h VAL 352 Cb 0.23 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2qa1 h VAL 352 CO -0.01 0.08 0.19 0.25 0.02 0.00 0.00 177.57 178.10 2qa1 h LEU 353 N 0.45 0.87 -0.52 2.57 5.85 -0.84 -1.51 115.31 122.18 2qa1 h LEU 353 Ca 0.13 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.73 2qa1 h LEU 353 Cb -0.04 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 2qa1 h LEU 353 CO -0.03 0.82 0.31 0.74 -0.34 0.00 0.00 178.44 179.93 2qa1 h THR 354 N 0.90 1.04 -0.64 1.05 2.02 -0.62 -0.09 112.91 116.58 2qa1 h THR 354 Ca 0.20 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 2qa1 h THR 354 Cb 0.27 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 2qa1 h THR 354 CO -0.01 0.11 0.38 -0.33 0.37 0.00 0.00 175.52 176.04 2qa1 h GLU 355 N 0.61 0.87 -0.25 6.66 5.08 -0.85 -2.87 114.58 123.82 2qa1 h GLU 355 Ca 0.21 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2qa1 h GLU 355 Cb 0.03 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2qa1 h GLU 355 CO -0.10 0.63 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.42 2qa1 h LEU 356 N 0.87 0.37 -2.31 1.33 3.38 -0.66 -2.53 115.31 115.76 2qa1 h LEU 356 Ca 0.23 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2qa1 h LEU 356 Cb -0.02 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2qa1 h LEU 356 CO -0.04 0.47 -0.04 0.40 0.09 0.00 0.00 178.44 179.32 2qa1 h ILE 357 N 0.38 0.26 0.00 1.22 2.04 -0.80 -0.94 117.51 119.67 2qa1 h ILE 357 Ca 0.08 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2qa1 h ILE 357 Cb 0.34 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 2qa1 h ILE 357 CO 0.01 0.04 0.00 0.00 0.00 0.00 0.00 178.15 178.20 2qa1 n GLN 358 N -3.37 0.17 -3.19 2.37 1.13 -0.95 -4.05 117.38 109.49 2qa1 n GLN 358 Ca -0.02 0.41 -0.39 0.00 -1.94 0.00 0.00 57.00 55.06 2qa1 n GLN 358 Cb 0.17 -1.83 -0.06 0.00 0.11 0.00 0.00 30.24 28.63 2qa1 n GLN 358 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2qa1 s TYR 359 N -3.29 3.66 0.22 1.08 1.51 -0.36 -4.99 117.35 115.19 2qa1 s TYR 359 Ca 0.04 1.19 -0.07 0.00 -1.01 0.00 0.00 57.07 57.22 2qa1 s TYR 359 Cb 0.09 -2.63 0.32 0.00 -0.11 0.00 0.00 41.96 39.63 2qa1 s TYR 359 CO 0.36 0.31 1.78 0.78 -1.11 0.00 0.00 175.55 177.67 2qa1 h GLY 360 N 5.85 1.05 0.70 0.71 0.00 -1.87 -1.69 103.07 107.82 2qa1 h GLY 360 Ca -0.44 -0.22 0.07 0.00 0.00 0.00 0.00 47.33 46.73 2qa1 h GLY 360 CO 0.71 0.07 0.53 0.83 0.00 0.00 0.00 176.54 178.68 2qa1 h GLU 361 N 0.61 0.94 0.05 4.80 5.08 -1.94 0.62 114.58 124.74 2qa1 h GLU 361 Ca 0.34 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2qa1 h GLU 361 Cb 0.35 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2qa1 h GLU 361 CO -0.26 0.62 -0.02 0.28 -1.00 0.00 0.00 179.01 178.63 2qa1 h VAL 362 N 0.97 1.23 -0.45 3.13 2.07 -1.64 0.11 116.25 121.67 2qa1 h VAL 362 Ca 0.38 -0.99 0.08 0.00 0.82 0.00 0.00 66.70 66.98 2qa1 h VAL 362 Cb 0.19 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 2qa1 h VAL 362 CO -0.18 0.25 0.07 0.00 0.02 0.00 0.00 177.57 177.72 2qa1 h ALA 363 N 0.39 0.47 -0.74 1.67 0.00 -1.14 -0.54 119.26 119.38 2qa1 h ALA 363 Ca -0.01 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2qa1 h ALA 363 Cb 0.46 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2qa1 h ALA 363 CO 0.01 -0.34 0.21 0.00 0.00 0.00 0.00 179.25 179.13 2qa1 h ARG 364 N 0.19 1.16 0.05 0.00 3.08 -0.84 -0.62 114.38 117.40 2qa1 h ARG 364 Ca 0.22 -0.26 0.01 0.00 0.07 0.00 0.00 59.98 60.02 2qa1 h ARG 364 Cb 0.30 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2qa1 h ARG 364 CO -0.31 1.00 -0.10 1.25 -1.07 0.00 0.00 179.97 180.74 2qa1 h HIS 365 N 1.11 -0.27 -0.46 3.04 2.76 -0.15 0.96 115.15 122.14 2qa1 h HIS 365 Ca 0.24 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.31 2qa1 h HIS 365 Cb 0.34 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.40 2qa1 h HIS 365 CO 0.03 -0.16 -0.10 -0.07 -1.30 0.00 0.00 177.93 176.32 2qa1 h LEU 366 N -0.20 0.89 -1.25 0.26 3.38 -1.06 -1.96 115.31 115.37 2qa1 h LEU 366 Ca 0.02 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.69 2qa1 h LEU 366 Cb 0.23 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2qa1 h LEU 366 CO -0.07 1.04 0.54 0.00 0.09 0.00 0.00 178.44 180.03 2qa1 h ALA 367 N 0.88 1.58 -0.56 1.53 0.00 -1.01 -0.79 119.26 120.89 2qa1 h ALA 367 Ca 0.12 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2qa1 h ALA 367 Cb 0.65 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2qa1 h ALA 367 CO 0.04 0.31 -0.02 0.78 0.00 0.00 0.00 179.25 180.36 2qa1 h GLY 368 N 0.93 1.07 0.71 0.00 0.00 -0.24 -0.89 103.07 104.64 2qa1 h GLY 368 Ca 0.35 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 2qa1 h GLY 368 CO -0.12 0.72 -0.02 -0.33 0.00 0.00 0.00 176.54 176.78 2qa1 h MET 369 N 0.90 0.19 -0.19 4.80 2.07 -0.87 -2.00 114.93 119.82 2qa1 h MET 369 Ca 0.16 -0.07 -0.12 0.00 -2.07 0.00 0.00 59.70 57.60 2qa1 h MET 369 Cb 0.56 -0.01 0.00 0.00 -1.87 0.00 0.00 31.60 30.28 2qa1 h MET 369 CO 0.03 0.50 -0.35 0.28 1.07 0.00 0.00 176.91 178.44 2qa1 h VAL 370 N -0.14 1.33 0.00 -2.22 2.07 -1.10 -3.20 116.25 112.99 2qa1 h VAL 370 Ca 0.02 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 2qa1 h VAL 370 Cb 0.44 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2qa1 h VAL 370 CO 0.01 0.49 -0.01 0.77 0.02 0.00 0.00 177.57 178.84 2qa1 h SER 371 N 0.24 0.00 0.00 0.57 4.64 -1.25 -3.47 113.55 114.28 2qa1 h SER 371 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2qa1 h SER 371 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2qa1 h SER 371 CO 0.08 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.66 2qa1 n GLY 372 N 0.50 1.08 0.23 -0.77 0.00 -0.82 -2.83 105.19 102.58 2qa1 n GLY 372 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 2qa1 n GLY 372 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qa1 h LEU 373 N 0.00 0.00 -0.91 0.99 3.38 -1.75 -2.67 115.31 114.35 2qa1 h LEU 373 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qa1 h LEU 373 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qa1 h LEU 373 CO 0.00 0.00 0.00 1.05 0.09 0.00 0.00 178.44 179.58 2qa1 h GLU 374 N 0.00 0.00 -6.44 1.13 4.11 -1.74 -3.45 114.58 108.20 2qa1 h GLU 374 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 58.90 2qa1 h GLU 374 Cb 0.31 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.58 2qa1 h GLU 374 CO 0.00 0.00 1.14 0.42 0.07 0.00 0.00 179.01 180.64 2qa1 s ILE 375 N -3.44 2.78 -0.07 -1.06 1.01 -1.01 -4.96 121.20 114.45 2qa1 s ILE 375 Ca 0.04 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.80 2qa1 s ILE 375 Cb 0.09 -3.07 0.02 0.00 0.01 0.00 0.00 42.46 39.52 2qa1 s ILE 375 CO 0.49 -0.00 -0.07 -0.89 0.00 0.00 0.00 174.94 174.46 2qa1 s THR 376 N 3.38 0.86 0.10 2.92 2.01 -1.26 -4.17 115.64 119.48 2qa1 s THR 376 Ca 0.83 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 62.59 2qa1 s THR 376 Cb -0.44 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.18 2qa1 s THR 376 CO 0.38 0.31 0.19 -0.31 -0.69 0.00 0.00 174.62 174.50 2qa1 s TYR 377 N 1.19 3.39 -0.53 4.92 2.02 -0.24 -4.98 117.35 123.11 2qa1 s TYR 377 Ca -0.06 0.14 -0.28 0.00 -0.37 0.00 0.00 57.07 56.50 2qa1 s TYR 377 Cb -0.14 -1.67 0.01 0.00 -0.40 0.00 0.00 41.96 39.76 2qa1 s TYR 377 CO -0.02 0.54 1.49 0.34 -1.57 0.00 0.00 175.55 176.33 2qa1 s ASP 378 N -2.77 6.05 -0.02 2.29 3.68 -1.26 -4.20 116.67 120.43 2qa1 s ASP 378 Ca 0.33 0.43 0.03 0.00 2.13 0.00 0.00 52.55 55.47 2qa1 s ASP 378 Cb -0.12 -2.54 0.05 0.00 -1.45 0.00 0.00 42.92 38.86 2qa1 s ASP 378 CO 0.26 -1.74 1.00 1.33 0.13 0.00 0.00 175.17 176.14 2qa1 n VAL 379 N 6.96 1.08 0.00 1.11 0.24 -1.26 -5.06 118.33 121.40 2qa1 n VAL 379 Ca 0.14 -1.14 0.00 0.00 -2.04 0.00 0.00 64.34 61.30 2qa1 n VAL 379 Cb 0.49 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 2qa1 n VAL 379 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qa1 n GLY 380 N -0.62 1.91 3.98 7.63 0.00 -1.26 -4.91 105.19 111.92 2qa1 n GLY 380 Ca 0.03 -2.07 -0.20 0.00 0.00 0.00 0.00 46.02 43.78 2qa1 n GLY 380 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qa1 s THR 381 N -2.02 3.63 0.00 2.61 -4.23 -1.26 -4.93 115.64 109.44 2qa1 s THR 381 Ca 0.00 -0.81 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 2qa1 s THR 381 Cb 0.00 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.55 2qa1 s THR 381 CO 0.00 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 2qa1 n GLY 382 N -1.91 2.28 0.17 3.99 0.00 -1.26 -0.87 105.19 107.59 2qa1 n GLY 382 Ca 0.03 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 45.15 2qa1 n GLY 382 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2qa1 h SER 383 N 0.00 0.00 -2.48 1.61 4.64 -1.34 -3.46 113.55 112.51 2qa1 h SER 383 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2qa1 h SER 383 Cb 0.00 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.13 2qa1 h SER 383 CO 0.00 0.28 1.10 1.57 -0.87 0.00 0.00 176.83 178.91 2qa1 n HIS 384 N -3.15 2.61 0.32 4.77 -0.00 0.01 -4.84 115.22 114.94 2qa1 n HIS 384 Ca 0.03 -0.13 0.21 0.00 -0.00 0.00 0.00 57.72 57.83 2qa1 n HIS 384 Cb 0.65 -2.72 1.08 0.00 -0.00 0.00 0.00 29.99 28.99 2qa1 n HIS 384 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2qa1 h PRO 385 N 8.44 0.00 -0.01 1.57 0.13 -1.89 -3.01 132.00 137.23 2qa1 h PRO 385 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2qa1 h PRO 385 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2qa1 h PRO 385 CO 0.95 0.00 -0.41 1.28 -0.23 0.00 0.00 178.00 179.59 2qa1 n LEU 386 N -3.00 1.17 -4.68 1.56 4.77 -1.26 -4.89 117.00 110.68 2qa1 n LEU 386 Ca -0.02 -0.35 -0.47 0.00 -0.03 0.00 0.00 56.01 55.14 2qa1 n LEU 386 Cb 0.11 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2qa1 n LEU 386 CO 0.20 0.23 1.39 0.18 -1.33 0.00 0.00 177.39 178.06 2qa1 n LEU 387 N -0.71 3.41 0.00 2.23 4.77 -1.14 -0.55 117.00 125.00 2qa1 n LEU 387 Ca 0.10 1.01 0.00 0.00 -0.03 0.00 0.00 56.01 57.09 2qa1 n LEU 387 Cb 0.37 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.05 2qa1 n LEU 387 CO 0.29 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 2qa1 n GLY 388 N 4.04 2.34 3.98 -0.72 0.00 0.33 -4.77 105.19 110.39 2qa1 n GLY 388 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 2qa1 n GLY 388 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qa1 s LYS 389 N -0.27 2.65 0.51 1.61 1.02 0.28 -1.08 119.74 124.46 2qa1 s LYS 389 Ca 0.00 -0.83 -0.22 0.00 0.02 0.00 0.00 55.97 54.95 2qa1 s LYS 389 Cb 0.00 -2.54 -0.06 0.00 -0.52 0.00 0.00 37.83 34.71 2qa1 s LYS 389 CO 0.00 -0.59 1.20 -0.98 -0.92 0.00 0.00 175.35 174.06 2qa1 s ARG 390 N -4.67 3.47 -0.27 1.68 1.04 -1.26 -0.38 118.95 118.57 2qa1 s ARG 390 Ca 0.56 1.84 -0.29 0.00 -1.04 0.00 0.00 55.73 56.80 2qa1 s ARG 390 Cb -0.10 -2.25 0.01 0.00 -2.04 0.00 0.00 34.95 30.57 2qa1 s ARG 390 CO 0.37 -0.81 1.05 1.41 -0.04 0.00 0.00 175.30 177.29 2qa1 s MET 391 N -2.92 4.18 0.62 3.89 -2.45 0.39 -4.77 119.30 118.23 2qa1 s MET 391 Ca 0.68 1.23 -0.18 0.00 -1.25 0.00 0.00 55.69 56.17 2qa1 s MET 391 Cb -0.30 -3.68 -0.02 0.00 1.25 0.00 0.00 34.83 32.08 2qa1 s MET 391 CO 0.35 -0.74 1.18 -2.14 1.05 0.00 0.00 175.02 174.73 2qa1 s PRO 392 N 3.38 2.86 0.13 4.11 0.02 -1.26 -4.91 135.00 139.33 2qa1 s PRO 392 Ca 0.44 1.72 -0.34 0.00 0.02 0.00 0.00 61.00 62.84 2qa1 s PRO 392 Cb -0.14 -1.93 -0.14 0.00 0.02 0.00 0.00 34.50 32.31 2qa1 s PRO 392 CO 0.10 -1.27 1.57 0.00 -0.33 0.00 0.00 177.00 177.08 2qa1 n ALA 393 N -1.86 1.05 -3.82 -1.55 0.00 -1.26 -4.92 120.51 108.15 2qa1 n ALA 393 Ca 0.13 0.44 -0.25 0.00 0.00 0.00 0.00 53.44 53.77 2qa1 n ALA 393 Cb 0.50 -2.33 -0.17 0.00 0.00 0.00 0.00 19.45 17.45 2qa1 n ALA 393 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2qa1 s LEU 394 N 1.11 0.85 0.41 0.00 2.96 -1.26 -4.99 118.68 117.76 2qa1 s LEU 394 Ca 0.81 -0.18 -0.25 0.00 -0.22 0.00 0.00 54.13 54.29 2qa1 s LEU 394 Cb -0.71 -0.61 -0.08 0.00 0.50 0.00 0.00 46.19 45.28 2qa1 s LEU 394 CO 0.40 -0.16 1.15 -1.61 -1.32 0.00 0.00 176.35 174.81 2qa1 s GLU 395 N 1.84 4.04 -0.05 1.98 0.41 -1.26 -0.97 118.70 124.68 2qa1 s GLU 395 Ca 0.05 1.78 -0.04 0.00 -0.41 0.00 0.00 54.97 56.35 2qa1 s GLU 395 Cb -0.12 -2.63 0.02 0.00 -1.78 0.00 0.00 34.13 29.62 2qa1 s GLU 395 CO -0.06 -0.32 0.12 -0.51 -0.49 0.00 0.00 175.26 174.00 2qa1 s LEU 396 N -2.57 1.36 -0.27 1.80 1.43 -0.67 -0.50 118.68 119.27 2qa1 s LEU 396 Ca 0.58 0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 53.91 2qa1 s LEU 396 Cb -0.29 0.37 0.04 0.00 0.03 0.00 0.00 46.19 46.34 2qa1 s LEU 396 CO 0.36 -0.07 -0.05 -0.89 0.23 0.00 0.00 176.35 175.94 2qa1 s THR 397 N 0.33 2.75 0.65 5.49 2.01 -0.48 -0.82 115.64 125.58 2qa1 s THR 397 Ca -0.02 -1.28 0.04 0.00 0.31 0.00 0.00 61.69 60.74 2qa1 s THR 397 Cb -0.04 -2.50 0.11 0.00 0.01 0.00 0.00 72.50 70.08 2qa1 s THR 397 CO -0.01 0.05 0.90 0.42 -0.69 0.00 0.00 174.62 175.29 2qa1 s THR 398 N 1.25 2.16 0.56 -0.82 -4.23 0.29 -0.79 115.64 114.06 2qa1 s THR 398 Ca -0.04 -0.77 0.26 0.00 -1.18 0.00 0.00 61.69 59.96 2qa1 s THR 398 Cb -0.18 -2.39 0.37 0.00 1.34 0.00 0.00 72.50 71.63 2qa1 s THR 398 CO -0.04 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.09 2qa1 h ALA 399 N -0.21 2.16 0.00 3.99 0.00 -2.01 -3.27 119.26 119.92 2qa1 h ALA 399 Ca -0.34 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2qa1 h ALA 399 Cb 1.28 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2qa1 h ALA 399 CO 0.40 -0.45 -1.12 0.25 0.00 0.00 0.00 179.25 178.33 2qa1 n THR 400 N -4.12 0.11 -4.02 0.00 -2.24 -1.26 -5.11 114.28 97.64 2qa1 n THR 400 Ca 0.05 -0.08 -0.09 0.00 -2.27 0.00 0.00 64.05 61.67 2qa1 n THR 400 Cb 0.45 -0.67 -0.08 0.00 -2.10 0.00 0.00 70.33 67.92 2qa1 n THR 400 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qa1 s ARG 401 N -2.07 0.92 -0.23 -0.78 1.70 -1.24 -5.13 118.95 112.14 2qa1 s ARG 401 Ca -0.01 -1.22 -0.12 0.00 -0.47 0.00 0.00 55.73 53.91 2qa1 s ARG 401 Cb 0.01 0.30 -0.05 0.00 -0.57 0.00 0.00 34.95 34.64 2qa1 s ARG 401 CO 0.08 -0.29 0.23 -1.21 -1.08 0.00 0.00 175.30 173.04 2qa1 s GLU 402 N -3.96 4.11 0.00 3.89 0.41 -1.26 -0.55 118.70 121.34 2qa1 s GLU 402 Ca 0.15 -0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.58 2qa1 s GLU 402 Cb 0.06 -3.53 0.00 0.00 -1.78 0.00 0.00 34.13 28.88 2qa1 s GLU 402 CO -0.04 0.04 0.00 -2.37 -0.49 0.00 0.00 175.26 172.41 2qa1 n THR 403 N 4.26 0.00 -3.46 3.63 5.66 -0.00 -5.02 114.28 119.35 2qa1 n THR 403 Ca -0.13 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.76 2qa1 n THR 403 Cb 0.52 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.28 2qa1 n THR 403 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2qa1 s SER 404 N 1.20 -0.49 0.24 1.09 1.04 -1.26 -1.67 113.70 113.85 2qa1 s SER 404 Ca 0.00 0.03 -0.04 0.00 0.48 0.00 0.00 55.95 56.42 2qa1 s SER 404 Cb 0.00 0.51 0.40 0.00 0.10 0.00 0.00 66.02 67.03 2qa1 s SER 404 CO 0.00 -0.82 1.80 0.77 0.98 0.00 0.00 173.24 175.98 2qa1 h SER 405 N 2.05 0.64 -0.18 7.02 4.64 -1.41 -1.03 113.55 125.27 2qa1 h SER 405 Ca -0.29 0.05 0.04 0.00 -0.47 0.00 0.00 61.79 61.12 2qa1 h SER 405 Cb 1.28 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 2qa1 h SER 405 CO 0.35 0.36 -0.05 0.74 -0.87 0.00 0.00 176.83 177.37 2qa1 h THR 406 N 0.76 0.82 -0.35 2.95 2.02 -1.91 -2.61 112.91 114.58 2qa1 h THR 406 Ca 0.39 -0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.46 2qa1 h THR 406 Cb 0.38 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2qa1 h THR 406 CO -0.26 0.00 -0.24 -0.08 0.37 0.00 0.00 175.52 175.32 2qa1 h GLU 407 N 0.00 0.69 0.00 6.66 4.81 -1.77 -2.71 114.58 122.27 2qa1 h GLU 407 Ca 0.09 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.04 2qa1 h GLU 407 Cb 0.13 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2qa1 h GLU 407 CO -0.19 0.87 0.00 -0.07 -0.73 0.00 0.00 179.01 178.89 2qa1 h LEU 408 N 0.60 0.00 -0.88 1.64 3.38 -0.84 -2.35 115.31 116.87 2qa1 h LEU 408 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qa1 h LEU 408 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2qa1 h LEU 408 CO 0.06 0.00 -0.08 0.18 0.09 0.00 0.00 178.44 178.68 2qa1 n LEU 409 N -2.63 1.46 0.04 1.67 4.77 -1.02 -4.49 117.00 116.79 2qa1 n LEU 409 Ca -0.00 -0.46 0.09 0.00 -0.03 0.00 0.00 56.01 55.60 2qa1 n LEU 409 Cb 0.16 -0.04 0.52 0.00 -2.33 0.00 0.00 43.42 41.74 2qa1 n LEU 409 CO 0.19 0.25 1.15 0.45 -1.33 0.00 0.00 177.39 178.10 2qa1 h HIS 410 N 2.16 0.32 -0.18 -1.77 3.86 -1.00 -1.28 115.15 117.25 2qa1 h HIS 410 Ca 0.00 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2qa1 h HIS 410 Cb 0.53 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2qa1 h HIS 410 CO 0.00 0.18 0.00 0.25 0.86 0.00 0.00 177.93 179.22 2qa1 n THR 411 N -4.48 0.23 -3.74 2.45 -2.24 -1.26 -4.72 114.28 100.51 2qa1 n THR 411 Ca 0.04 -0.39 -0.25 0.00 -2.27 0.00 0.00 64.05 61.19 2qa1 n THR 411 Cb 0.21 0.46 0.04 0.00 -2.10 0.00 0.00 70.33 68.94 2qa1 n THR 411 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qa1 n ALA 412 N 0.45 -1.64 -2.11 6.98 0.00 -0.48 -4.79 120.51 118.91 2qa1 n ALA 412 Ca 0.16 0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.48 2qa1 n ALA 412 Cb 0.36 -3.45 -0.01 0.00 0.00 0.00 0.00 19.45 16.36 2qa1 n ALA 412 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2qa1 s ARG 413 N -6.21 2.72 0.59 0.00 0.52 -1.26 -4.78 118.95 110.52 2qa1 s ARG 413 Ca 0.33 -1.35 -0.17 0.00 -0.52 0.00 0.00 55.73 54.02 2qa1 s ARG 413 Cb -0.16 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.67 2qa1 s ARG 413 CO 0.80 -0.23 1.08 0.20 0.02 0.00 0.00 175.30 177.18 2qa1 s GLY 414 N -4.25 2.26 -0.08 -3.53 0.00 -0.86 -3.87 107.32 96.98 2qa1 s GLY 414 Ca 0.52 0.53 -0.01 0.00 0.00 0.00 0.00 44.72 45.76 2qa1 s GLY 414 CO 0.31 0.87 -0.03 0.14 0.00 0.00 0.00 173.10 174.39 2qa1 s VAL 415 N -2.26 0.60 -0.28 1.40 1.01 -0.26 -0.45 120.40 120.16 2qa1 s VAL 415 Ca 0.66 -0.04 -0.06 0.00 0.00 0.00 0.00 61.98 62.54 2qa1 s VAL 415 Cb -0.19 -0.69 0.00 0.00 0.00 0.00 0.00 36.38 35.51 2qa1 s VAL 415 CO 0.35 0.29 0.05 -0.22 0.00 0.00 0.00 175.10 175.56 2qa1 s LEU 416 N 1.69 3.61 -0.26 3.92 2.96 0.19 -0.14 118.68 130.65 2qa1 s LEU 416 Ca 0.02 -0.64 -0.16 0.00 -0.22 0.00 0.00 54.13 53.13 2qa1 s LEU 416 Cb -0.13 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2qa1 s LEU 416 CO -0.05 -0.15 0.45 -0.76 -1.32 0.00 0.00 176.35 174.52 2qa1 s LEU 417 N 1.49 4.05 -0.70 -0.68 1.43 -0.26 -0.53 118.68 123.48 2qa1 s LEU 417 Ca 0.03 0.42 -0.14 0.00 -1.03 0.00 0.00 54.13 53.42 2qa1 s LEU 417 Cb -0.17 -2.55 0.18 0.00 0.03 0.00 0.00 46.19 43.68 2qa1 s LEU 417 CO 0.01 -0.23 0.63 -0.62 0.23 0.00 0.00 176.35 176.37 2qa1 s ASP 418 N 1.56 6.41 0.00 2.29 2.15 0.49 -2.39 116.67 127.18 2qa1 s ASP 418 Ca 0.18 -2.37 0.27 0.00 0.43 0.00 0.00 52.55 51.07 2qa1 s ASP 418 Cb -0.16 -2.17 0.94 0.00 -0.30 0.00 0.00 42.92 41.24 2qa1 s ASP 418 CO 0.09 -0.66 1.68 0.18 -0.17 0.00 0.00 175.17 176.30 2qa1 n LEU 419 N 4.40 1.50 -1.01 -1.34 4.77 -0.16 -1.44 117.00 123.72 2qa1 n LEU 419 Ca 0.03 -0.49 0.05 0.00 -0.03 0.00 0.00 56.01 55.57 2qa1 n LEU 419 Cb 0.44 -0.02 0.09 0.00 -2.33 0.00 0.00 43.42 41.60 2qa1 n LEU 419 CO 0.40 0.25 0.21 0.00 -1.33 0.00 0.00 177.39 176.93 2qa1 n ALA 420 N 0.09 2.79 -4.02 -1.18 0.00 -1.20 -4.65 120.51 112.34 2qa1 n ALA 420 Ca 0.17 -2.59 -0.40 0.00 0.00 0.00 0.00 53.44 50.62 2qa1 n ALA 420 Cb 0.37 -0.56 0.01 0.00 0.00 0.00 0.00 19.45 19.27 2qa1 n ALA 420 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qa1 n ASP 421 N -0.23 -3.50 -4.24 0.00 2.03 -1.26 -4.92 116.55 104.44 2qa1 n ASP 421 Ca 0.11 -1.22 -0.42 0.00 0.52 0.00 0.00 54.79 53.78 2qa1 n ASP 421 Cb 0.92 -2.12 -0.08 0.00 -0.72 0.00 0.00 41.12 39.12 2qa1 n ASP 421 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2qa1 s ASN 422 N -3.68 5.81 0.50 1.67 3.84 -1.26 -4.96 114.94 116.86 2qa1 s ASN 422 Ca 0.40 -1.86 0.25 0.00 0.21 0.00 0.00 52.86 51.86 2qa1 s ASN 422 Cb -0.20 -2.06 1.32 0.00 -0.55 0.00 0.00 41.25 39.77 2qa1 s ASN 422 CO 0.95 -0.72 2.03 1.55 -2.79 0.00 0.00 177.10 178.11 2qa1 h PRO 423 N 8.55 0.00 -0.65 0.43 0.13 -2.00 -2.18 132.00 136.28 2qa1 h PRO 423 Ca -0.23 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.81 2qa1 h PRO 423 Cb 1.08 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 2qa1 h PRO 423 CO 0.90 0.15 0.07 0.00 -0.23 0.00 0.00 178.00 178.89 2qa1 h ARG 424 N 0.00 1.10 -0.40 0.86 3.08 -1.99 -1.91 114.38 115.11 2qa1 h ARG 424 Ca -0.00 -0.31 0.05 0.00 0.07 0.00 0.00 59.98 59.78 2qa1 h ARG 424 Cb 0.39 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 2qa1 h ARG 424 CO 0.02 1.03 0.14 1.25 -1.07 0.00 0.00 179.97 181.34 2qa1 h LEU 425 N 1.01 0.14 -1.20 3.04 5.85 -1.82 -0.05 115.31 122.29 2qa1 h LEU 425 Ca 0.19 0.05 0.06 0.00 0.84 0.00 0.00 57.88 59.02 2qa1 h LEU 425 Cb 0.49 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 2qa1 h LEU 425 CO 0.02 0.12 0.56 0.03 -0.34 0.00 0.00 178.44 178.83 2qa1 h ARG 426 N 0.30 0.94 -0.02 1.25 3.08 -1.33 -2.63 114.38 115.98 2qa1 h ARG 426 Ca 0.19 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.97 2qa1 h ARG 426 Cb 0.17 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 2qa1 h ARG 426 CO -0.19 0.62 -0.89 0.00 -1.07 0.00 0.00 179.97 178.44 2qa1 h ALA 427 N 1.53 0.43 -0.21 0.04 0.00 -0.52 -2.67 119.26 117.85 2qa1 h ALA 427 Ca 0.37 -0.69 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2qa1 h ALA 427 Cb 0.20 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2qa1 h ALA 427 CO -0.13 0.82 -0.01 -0.09 0.00 0.00 0.00 179.25 179.83 2qa1 h ARG 428 N 0.23 0.32 -0.01 0.00 9.65 -0.68 -3.07 114.38 120.81 2qa1 h ARG 428 Ca -0.06 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 2qa1 h ARG 428 Cb 1.51 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 30.04 2qa1 h ARG 428 CO 0.15 0.35 -0.51 0.00 2.80 0.00 0.00 179.97 182.76 2qa1 n ALA 429 N -2.49 3.63 0.11 2.80 0.00 -1.08 -4.55 120.51 118.93 2qa1 n ALA 429 Ca 0.00 -0.61 0.12 0.00 0.00 0.00 0.00 53.44 52.95 2qa1 n ALA 429 Cb 0.20 -0.73 0.62 0.00 0.00 0.00 0.00 19.45 19.53 2qa1 n ALA 429 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qa1 h ALA 430 N 3.52 2.12 0.00 0.00 0.00 -1.37 0.17 119.26 123.69 2qa1 h ALA 430 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qa1 h ALA 430 Cb 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2qa1 h ALA 430 CO 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.07 2qa1 n ALA 431 N -2.56 1.26 -0.04 0.00 0.00 -1.26 -1.46 120.51 116.45 2qa1 n ALA 431 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.51 2qa1 n ALA 431 Cb 0.27 -1.12 0.09 0.00 0.00 0.00 0.00 19.45 18.69 2qa1 n ALA 431 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2qa1 n TRP 432 N -1.59 0.24 0.29 0.00 8.01 0.58 0.35 117.44 125.32 2qa1 n TRP 432 Ca 0.01 -0.40 0.17 0.00 -1.31 0.00 0.00 57.50 55.97 2qa1 n TRP 432 Cb 0.07 -0.03 0.84 0.00 -2.01 0.00 0.00 31.31 30.18 2qa1 n TRP 432 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 2qa1 h SER 433 N 1.34 0.00 0.67 -0.99 4.64 -1.22 0.10 113.55 118.09 2qa1 h SER 433 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2qa1 h SER 433 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 2qa1 h SER 433 CO 0.00 0.00 -0.21 -2.24 -0.87 0.00 0.00 176.83 173.51 2qa1 h ASP 434 N 0.00 0.00 0.00 4.97 2.03 -1.85 -3.30 116.42 118.27 2qa1 h ASP 434 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2qa1 h ASP 434 Cb 0.16 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.66 2qa1 h ASP 434 CO 0.00 0.21 -1.05 0.54 -1.03 0.00 0.00 179.24 177.91 2qa1 n ARG 435 N -3.53 1.48 -4.10 4.15 1.74 -0.12 -5.00 116.66 111.28 2qa1 n ARG 435 Ca -0.01 -0.05 -0.26 0.00 -0.77 0.00 0.00 57.85 56.76 2qa1 n ARG 435 Cb 0.36 -1.07 -0.17 0.00 -1.02 0.00 0.00 32.46 30.56 2qa1 n ARG 435 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2qa1 s VAL 436 N -2.26 1.05 -0.22 1.55 1.01 0.17 -2.03 120.40 119.68 2qa1 s VAL 436 Ca -0.01 -0.34 -0.28 0.00 0.00 0.00 0.00 61.98 61.34 2qa1 s VAL 436 Cb 0.05 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.39 2qa1 s VAL 436 CO 0.29 0.36 1.00 -1.81 0.00 0.00 0.00 175.10 174.95 2qa1 s ASP 437 N 1.40 7.07 -0.39 3.32 -0.00 0.40 -4.22 116.67 124.26 2qa1 s ASP 437 Ca -0.01 1.34 -0.14 0.00 -0.00 0.00 0.00 52.55 53.75 2qa1 s ASP 437 Cb -0.13 -2.52 0.01 0.00 -0.00 0.00 0.00 42.92 40.27 2qa1 s ASP 437 CO -0.05 -0.62 0.27 -0.63 -0.00 0.00 0.00 175.17 174.14 2qa1 s ILE 438 N 3.00 5.15 -0.19 0.77 1.01 -1.26 -0.64 121.20 129.04 2qa1 s ILE 438 Ca 0.43 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.50 2qa1 s ILE 438 Cb -0.15 -3.82 0.02 0.00 0.01 0.00 0.00 42.46 38.52 2qa1 s ILE 438 CO 0.08 -0.23 -0.19 -0.69 0.00 0.00 0.00 174.94 173.91 2qa1 s VAL 439 N 1.67 2.10 -0.18 2.92 1.01 0.31 -4.98 120.40 123.24 2qa1 s VAL 439 Ca 0.05 -1.01 -0.21 0.00 0.00 0.00 0.00 61.98 60.81 2qa1 s VAL 439 Cb -0.19 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2qa1 s VAL 439 CO 0.10 0.47 0.63 -0.89 0.00 0.00 0.00 175.10 175.41 2qa1 s THR 440 N 1.27 5.04 0.05 3.92 2.01 -1.26 -0.38 115.64 126.29 2qa1 s THR 440 Ca 0.03 1.20 -0.18 0.00 0.31 0.00 0.00 61.69 63.05 2qa1 s THR 440 Cb -0.14 -3.95 0.04 0.00 0.01 0.00 0.00 72.50 68.46 2qa1 s THR 440 CO -0.12 0.14 0.42 0.00 -0.69 0.00 0.00 174.62 174.37 2qa1 s ALA 441 N 1.69 -1.02 -0.25 7.40 0.00 -0.52 -4.40 121.76 124.65 2qa1 s ALA 441 Ca 0.30 0.30 -0.18 0.00 0.00 0.00 0.00 51.96 52.38 2qa1 s ALA 441 Cb -0.16 0.38 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 2qa1 s ALA 441 CO 0.11 -0.47 0.52 0.08 0.00 0.00 0.00 175.76 176.00 2qa1 s VAL 442 N -2.58 5.07 0.51 0.00 1.01 0.03 -4.17 120.40 120.27 2qa1 s VAL 442 Ca -0.05 0.91 -0.18 0.00 0.00 0.00 0.00 61.98 62.66 2qa1 s VAL 442 Cb -0.01 -3.84 -0.08 0.00 0.00 0.00 0.00 36.38 32.46 2qa1 s VAL 442 CO -0.03 0.09 1.01 -2.16 0.00 0.00 0.00 175.10 174.01 2qa1 s PRO 443 N 2.25 3.80 1.17 2.72 0.04 -1.26 -1.38 135.00 142.34 2qa1 s PRO 443 Ca 0.22 1.17 -0.19 0.00 0.04 0.00 0.00 61.00 62.23 2qa1 s PRO 443 Cb -0.16 -2.11 0.28 0.00 0.04 0.00 0.00 34.50 32.56 2qa1 s PRO 443 CO 0.09 -0.41 1.17 0.20 0.04 0.00 0.00 177.00 178.10 2qa1 s GLY 444 N -2.50 1.65 0.29 0.56 0.00 0.35 -4.93 107.32 102.73 2qa1 s GLY 444 Ca 0.63 -1.10 -0.30 0.00 0.00 0.00 0.00 44.72 43.95 2qa1 s GLY 444 CO 0.26 -0.21 1.46 -2.21 0.00 0.00 0.00 173.10 172.40 2qa1 n GLU 445 N -4.58 2.33 -4.39 2.90 2.13 -1.26 -4.92 120.64 112.85 2qa1 n GLU 445 Ca 0.15 0.83 -0.22 0.00 0.66 0.00 0.00 57.16 58.58 2qa1 n GLU 445 Cb 0.60 -2.52 -0.13 0.00 0.27 0.00 0.00 31.44 29.66 2qa1 n GLU 445 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2qa1 s VAL 446 N -0.30 1.35 0.66 6.31 -7.23 -1.26 -4.92 120.40 115.00 2qa1 s VAL 446 Ca 0.63 -1.17 -0.11 0.00 -1.81 0.00 0.00 61.98 59.52 2qa1 s VAL 446 Cb -0.57 -1.21 -0.02 0.00 0.56 0.00 0.00 36.38 35.14 2qa1 s VAL 446 CO 0.53 0.02 1.05 -0.94 -0.31 0.00 0.00 175.10 175.44 2qa1 s SER 447 N -1.34 5.77 0.35 4.85 1.04 -1.26 -4.88 113.70 118.22 2qa1 s SER 447 Ca 0.03 1.54 0.03 0.00 0.48 0.00 0.00 55.95 58.03 2qa1 s SER 447 Cb -0.09 -2.49 0.65 0.00 0.10 0.00 0.00 66.02 64.19 2qa1 s SER 447 CO 0.02 -1.18 1.99 0.00 0.98 0.00 0.00 173.24 175.05 2qa1 h ALA 448 N -0.49 1.53 -0.00 5.32 0.00 -2.02 -2.87 119.26 120.73 2qa1 h ALA 448 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2qa1 h ALA 448 Cb 1.20 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2qa1 h ALA 448 CO 0.59 0.41 -0.48 0.25 0.00 0.00 0.00 179.25 180.02 2qa1 n THR 449 N -4.42 0.00 0.25 0.00 -2.24 -1.26 -4.14 114.28 102.47 2qa1 n THR 449 Ca 0.05 -0.03 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 2qa1 n THR 449 Cb 0.07 0.34 0.68 0.00 -2.10 0.00 0.00 70.33 69.33 2qa1 n THR 449 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2qa1 h SER 450 N 0.30 0.00 0.00 3.42 4.64 -1.89 -3.46 113.55 116.56 2qa1 h SER 450 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qa1 h SER 450 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2qa1 h SER 450 CO 0.00 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 2qa1 n GLY 451 N -0.70 0.75 0.22 -0.77 0.00 -1.26 -4.86 105.19 98.56 2qa1 n GLY 451 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2qa1 n GLY 451 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qa1 n LEU 452 N 0.00 1.38 -4.74 0.99 4.77 -1.26 -4.66 117.00 113.48 2qa1 n LEU 452 Ca 0.00 -0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 55.02 2qa1 n LEU 452 Cb 0.00 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2qa1 n LEU 452 CO 0.00 0.29 1.11 0.54 -1.33 0.00 0.00 177.39 178.00 2qa1 n ARG 453 N -0.84 2.50 -1.96 3.23 5.12 -1.26 -2.48 116.66 120.97 2qa1 n ARG 453 Ca 0.07 0.88 -0.20 0.00 -1.93 0.00 0.00 57.85 56.67 2qa1 n ARG 453 Cb 0.39 -2.59 -0.05 0.00 -1.16 0.00 0.00 32.46 29.05 2qa1 n ARG 453 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2qa1 n ASP 454 N 1.29 -5.54 -4.68 0.55 8.00 -1.26 -4.96 116.55 109.94 2qa1 n ASP 454 Ca 0.06 0.27 -0.38 0.00 0.71 0.00 0.00 54.79 55.45 2qa1 n ASP 454 Cb 0.37 -4.77 -0.07 0.00 -0.02 0.00 0.00 41.12 36.62 2qa1 n ASP 454 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2qa1 s THR 455 N -2.85 5.22 -0.13 -3.53 2.01 -1.03 -4.43 115.64 110.90 2qa1 s THR 455 Ca 0.00 0.66 0.19 0.00 0.31 0.00 0.00 61.69 62.85 2qa1 s THR 455 Cb 0.00 -3.71 -0.19 0.00 0.01 0.00 0.00 72.50 68.61 2qa1 s THR 455 CO 0.00 0.28 0.61 0.35 -0.69 0.00 0.00 174.62 175.17 2qa1 n THR 456 N 4.20 0.90 -3.54 -0.82 -2.24 0.11 -4.84 114.28 108.05 2qa1 n THR 456 Ca -0.09 -0.67 -0.17 0.00 -2.27 0.00 0.00 64.05 60.85 2qa1 n THR 456 Cb 0.51 -0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 2qa1 n THR 456 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qa1 s ALA 457 N -3.02 -1.74 -0.05 6.98 0.00 -1.17 -0.99 121.76 121.77 2qa1 s ALA 457 Ca -0.05 1.36 -0.02 0.00 0.00 0.00 0.00 51.96 53.24 2qa1 s ALA 457 Cb 0.09 -0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.13 2qa1 s ALA 457 CO 0.84 -0.36 0.12 0.08 0.00 0.00 0.00 175.76 176.43 2qa1 s VAL 458 N -1.04 -0.04 -0.26 0.00 1.01 -1.01 -1.13 120.40 117.94 2qa1 s VAL 458 Ca -0.10 0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.93 2qa1 s VAL 458 Cb -0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 2qa1 s VAL 458 CO 0.09 0.06 0.18 -0.22 0.00 0.00 0.00 175.10 175.21 2qa1 s LEU 459 N 0.98 4.07 -0.17 3.92 2.96 0.30 -1.10 118.68 129.65 2qa1 s LEU 459 Ca -0.08 0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 2qa1 s LEU 459 Cb -0.10 -2.12 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 2qa1 s LEU 459 CO -0.05 0.01 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.26 2qa1 s ILE 460 N 1.38 3.10 0.80 6.68 1.01 0.80 -0.98 121.20 133.99 2qa1 s ILE 460 Ca 0.07 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 2qa1 s ILE 460 Cb -0.15 -2.34 0.07 0.00 0.01 0.00 0.00 42.46 40.05 2qa1 s ILE 460 CO 0.07 0.49 1.10 -0.13 0.00 0.00 0.00 174.94 176.47 2qa1 s ARG 461 N 0.81 2.04 0.61 2.79 0.52 0.23 -1.10 118.95 124.85 2qa1 s ARG 461 Ca -0.04 1.20 0.32 0.00 -0.52 0.00 0.00 55.73 56.69 2qa1 s ARG 461 Cb -0.15 -1.87 1.83 0.00 0.52 0.00 0.00 34.95 35.28 2qa1 s ARG 461 CO 0.01 -1.80 2.16 -1.35 0.02 0.00 0.00 175.30 174.33 2qa1 h PRO 462 N -1.25 0.00 -0.00 3.54 0.11 -1.87 0.11 132.00 132.64 2qa1 h PRO 462 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2qa1 h PRO 462 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2qa1 h PRO 462 CO 0.50 0.00 -0.02 -0.40 -0.21 0.00 0.00 178.00 177.87 2qa1 n ASP 463 N -3.56 0.51 0.00 -2.05 3.85 -1.26 -4.75 116.55 109.29 2qa1 n ASP 463 Ca -0.00 -1.02 0.00 0.00 -0.71 0.00 0.00 54.79 53.05 2qa1 n ASP 463 Cb 0.25 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 39.99 2qa1 n ASP 463 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qa1 n GLY 464 N 1.11 0.76 3.80 6.12 0.00 0.39 -5.00 105.19 112.38 2qa1 n GLY 464 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2qa1 n GLY 464 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qa1 s HIS 465 N -2.51 3.75 -0.22 1.61 3.76 -1.26 -0.46 115.29 119.96 2qa1 s HIS 465 Ca 0.00 1.50 -0.29 0.00 -0.15 0.00 0.00 55.06 56.12 2qa1 s HIS 465 Cb 0.00 -2.69 0.01 0.00 1.11 0.00 0.00 32.58 31.00 2qa1 s HIS 465 CO 0.00 0.39 1.05 0.08 -0.85 0.00 0.00 174.74 175.42 2qa1 s VAL 466 N -1.39 4.66 -0.13 -0.90 1.01 0.49 -0.60 120.40 123.54 2qa1 s VAL 466 Ca 0.41 2.00 0.18 0.00 0.00 0.00 0.00 61.98 64.57 2qa1 s VAL 466 Cb -0.19 -4.29 -0.20 0.00 0.00 0.00 0.00 36.38 31.70 2qa1 s VAL 466 CO 0.23 -0.17 0.56 0.00 0.00 0.00 0.00 175.10 175.73 2qa1 n ALA 467 N 6.27 2.01 -3.56 5.51 0.00 -0.15 -0.51 120.51 130.08 2qa1 n ALA 467 Ca 0.12 -0.73 -0.13 0.00 0.00 0.00 0.00 53.44 52.70 2qa1 n ALA 467 Cb 0.46 -0.72 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 2qa1 n ALA 467 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2qa1 s TRP 468 N -2.94 -0.48 0.04 0.00 -0.00 -1.22 -4.85 118.94 109.49 2qa1 s TRP 468 Ca -0.06 0.84 -0.17 0.00 -0.00 0.00 0.00 56.10 56.71 2qa1 s TRP 468 Cb 0.09 0.43 0.03 0.00 -0.00 0.00 0.00 33.47 34.02 2qa1 s TRP 468 CO 0.84 -0.42 0.39 0.00 -0.00 0.00 0.00 176.95 177.75 2qa1 s ALA 469 N -1.04 -0.95 -0.03 5.86 0.00 -1.26 -0.54 121.76 123.80 2qa1 s ALA 469 Ca -0.04 0.27 0.06 0.00 0.00 0.00 0.00 51.96 52.25 2qa1 s ALA 469 Cb -0.01 0.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.43 2qa1 s ALA 469 CO 0.04 -0.44 -0.23 0.00 0.00 0.00 0.00 175.76 175.13 2qa1 s ALA 470 N -2.41 1.93 0.74 0.00 0.00 -0.28 -3.33 121.76 118.40 2qa1 s ALA 470 Ca -0.06 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.86 2qa1 s ALA 470 Cb -0.01 -0.55 0.08 0.00 0.00 0.00 0.00 23.12 22.64 2qa1 s ALA 470 CO -0.02 0.42 1.07 -1.25 0.00 0.00 0.00 175.76 175.98 2qa1 s PRO 471 N -0.32 1.98 0.00 0.00 0.04 -1.26 -0.71 135.00 134.72 2qa1 s PRO 471 Ca 0.03 -0.28 0.00 0.00 0.04 0.00 0.00 61.00 60.79 2qa1 s PRO 471 Cb -0.11 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2qa1 s PRO 471 CO 0.01 -1.42 0.00 0.41 0.04 0.00 0.00 177.00 176.04 2qa1 n GLY 472 N -3.05 1.85 3.44 0.56 0.00 -1.26 -4.40 105.19 102.34 2qa1 n GLY 472 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2qa1 n GLY 472 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qa1 s SER 473 N -2.00 4.29 0.11 1.61 0.01 -1.21 -0.81 113.70 115.71 2qa1 s SER 473 Ca 0.00 -0.22 -0.12 0.00 1.31 0.00 0.00 55.95 56.91 2qa1 s SER 473 Cb 0.00 -1.50 -0.11 0.00 0.21 0.00 0.00 66.02 64.61 2qa1 s SER 473 CO 0.00 0.21 1.37 0.45 0.41 0.00 0.00 173.24 175.68 2qa1 h HIS 474 N 6.35 1.08 -4.09 2.43 3.86 -1.37 -3.44 115.15 119.97 2qa1 h HIS 474 Ca -0.32 -0.41 -0.46 0.00 -1.16 0.00 0.00 60.37 58.01 2qa1 h HIS 474 Cb 1.19 -0.19 0.02 0.00 1.06 0.00 0.00 27.41 29.49 2qa1 h HIS 474 CO 0.52 1.24 0.37 -3.38 0.86 0.00 0.00 177.93 177.54 2qa1 s HIS 475 N -4.02 3.12 0.57 2.45 0.00 -1.26 -5.06 115.29 111.10 2qa1 s HIS 475 Ca -0.11 1.57 -0.01 0.00 -3.00 0.00 0.00 55.06 53.51 2qa1 s HIS 475 Cb 0.09 -2.98 0.03 0.00 -4.00 0.00 0.00 32.58 25.73 2qa1 s HIS 475 CO 0.89 -0.63 0.82 0.16 -1.00 0.00 0.00 174.74 174.98 2qa1 s ASP 476 N -2.22 5.25 0.06 7.38 1.47 -1.26 -4.94 116.67 122.42 2qa1 s ASP 476 Ca 0.65 0.14 -0.25 0.00 1.18 0.00 0.00 52.55 54.27 2qa1 s ASP 476 Cb -0.14 -1.02 -0.17 0.00 -0.34 0.00 0.00 42.92 41.25 2qa1 s ASP 476 CO 0.21 -1.18 1.60 0.25 0.68 0.00 0.00 175.17 176.72 2qa1 h LEU 477 N -0.04 -0.09 -1.19 2.11 5.85 -1.97 -2.26 115.31 117.71 2qa1 h LEU 477 Ca -0.43 -0.11 0.15 0.00 0.84 0.00 0.00 57.88 58.33 2qa1 h LEU 477 Cb 1.29 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.27 2qa1 h LEU 477 CO 0.55 0.05 0.60 -0.65 -0.34 0.00 0.00 178.44 178.65 2qa1 h PRO 478 N -0.23 0.72 -0.41 5.25 0.11 -1.96 0.16 132.00 135.64 2qa1 h PRO 478 Ca -0.01 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 66.08 2qa1 h PRO 478 Cb 0.20 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 2qa1 h PRO 478 CO 0.02 0.48 0.22 0.52 -0.21 0.00 0.00 178.00 179.02 2qa1 h MET 479 N 0.74 0.43 -0.48 1.05 2.86 -1.84 0.12 114.93 117.82 2qa1 h MET 479 Ca 0.49 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 58.06 2qa1 h MET 479 Cb 0.75 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 2qa1 h MET 479 CO -0.25 0.28 0.12 0.00 1.06 0.00 0.00 176.91 178.12 2qa1 h ALA 480 N 1.21 0.63 -0.29 6.32 0.00 -0.74 -0.41 119.26 125.97 2qa1 h ALA 480 Ca 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2qa1 h ALA 480 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2qa1 h ALA 480 CO -0.11 0.31 0.14 -0.07 0.00 0.00 0.00 179.25 179.52 2qa1 h LEU 481 N 0.64 0.38 -0.48 0.00 3.38 -0.45 -2.16 115.31 116.63 2qa1 h LEU 481 Ca 0.15 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qa1 h LEU 481 Cb 0.32 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2qa1 h LEU 481 CO 0.00 0.40 0.30 -0.08 0.09 0.00 0.00 178.44 179.15 2qa1 h GLU 482 N 0.34 0.58 -0.84 1.13 4.22 -0.66 0.15 114.58 119.51 2qa1 h GLU 482 Ca 0.10 -0.04 0.01 0.00 0.08 0.00 0.00 59.36 59.52 2qa1 h GLU 482 Cb 0.12 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2qa1 h GLU 482 CO -0.01 0.39 0.55 -0.09 -2.18 0.00 0.00 179.01 177.67 2qa1 h ARG 483 N 0.60 1.09 0.00 1.92 2.43 -0.73 -1.18 114.38 118.51 2qa1 h ARG 483 Ca 0.19 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2qa1 h ARG 483 Cb -0.02 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.28 2qa1 h ARG 483 CO -0.07 0.72 -1.28 0.91 -1.51 0.00 0.00 179.97 178.75 2qa1 n TRP 484 N -4.51 0.00 0.00 2.20 7.02 -0.84 -4.63 117.44 116.68 2qa1 n TRP 484 Ca 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.57 2qa1 n TRP 484 Cb 0.02 -0.18 0.00 0.00 -2.42 0.00 0.00 31.31 28.73 2qa1 n TRP 484 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2qa1 n PHE 485 N -1.73 0.00 -1.18 -5.99 3.01 0.53 -5.05 117.46 107.05 2qa1 n PHE 485 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2qa1 n PHE 485 Cb 0.37 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.84 2qa1 n PHE 485 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qa1 n GLY 486 N 0.89 -1.70 3.77 1.37 0.00 -0.45 -4.65 105.19 104.41 2qa1 n GLY 486 Ca 0.00 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 2qa1 n GLY 486 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qa1 s ALA 487 N -1.70 3.26 0.63 4.61 0.00 -1.26 -4.10 121.76 123.20 2qa1 s ALA 487 Ca 0.00 1.14 -0.17 0.00 0.00 0.00 0.00 51.96 52.92 2qa1 s ALA 487 Cb 0.00 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2qa1 s ALA 487 CO 0.00 -0.67 1.17 -1.25 0.00 0.00 0.00 175.76 175.00 2qa1 s PRO 488 N -2.16 2.84 0.38 0.00 0.04 -1.26 -4.93 135.00 129.91 2qa1 s PRO 488 Ca 0.55 1.66 -0.27 0.00 0.04 0.00 0.00 61.00 62.98 2qa1 s PRO 488 Cb -0.36 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 2qa1 s PRO 488 CO 0.46 -1.27 1.25 -0.51 0.04 0.00 0.00 177.00 176.97 2qa1 s LEU 489 N -4.43 4.29 -0.27 -3.56 1.43 0.16 -4.99 118.68 111.30 2qa1 s LEU 489 Ca 0.73 2.55 -0.23 0.00 -1.03 0.00 0.00 54.13 56.15 2qa1 s LEU 489 Cb -0.26 -3.85 -0.01 0.00 0.03 0.00 0.00 46.19 42.10 2qa1 s LEU 489 CO 0.36 -0.67 0.76 -0.89 0.23 0.00 0.00 176.35 176.14 2qa1 s THR 490 N -1.27 4.86 -2.00 5.49 2.01 -1.26 -4.84 115.64 118.63 2qa1 s THR 490 Ca 0.54 1.32 0.25 0.00 0.31 0.00 0.00 61.69 64.10 2qa1 s THR 490 Cb -0.36 -4.08 0.70 0.00 0.01 0.00 0.00 72.50 68.77 2qa1 s THR 490 CO 0.46 -0.11 1.83 0.61 -0.69 0.00 0.00 174.62 176.72