#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wqa n GLY 2 N 0.00 -0.42 7.00 3.17 0.00 -1.25 -2.84 105.19 110.85 1wqa n GLY 2 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1wqa n GLY 2 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1wqa n LYS 3 N -4.50 0.00 0.00 1.61 3.00 -1.26 -4.18 118.16 112.83 1wqa n LYS 3 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 1wqa n LYS 3 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.62 1wqa n LYS 3 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1wqa n LEU 4 N 0.00 0.00 -4.81 3.14 -0.00 -1.24 -4.86 117.00 109.24 1wqa n LEU 4 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 1wqa n LEU 4 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.39 1wqa n LEU 4 CO 0.00 0.00 0.70 -0.36 -0.00 0.00 0.00 177.39 177.73 1wqa s PHE 5 N 0.00 3.08 0.00 1.96 0.40 -1.13 -4.09 117.98 118.20 1wqa s PHE 5 Ca 0.00 1.56 0.00 0.00 -0.60 0.00 0.00 56.93 57.89 1wqa s PHE 5 Cb 0.00 -3.00 0.00 0.00 0.51 0.00 0.00 43.02 40.53 1wqa s PHE 5 CO 0.00 -0.73 0.00 0.41 0.70 0.00 0.00 175.22 175.60 1wqa n GLY 6 N -0.56 1.65 0.32 4.36 0.00 0.55 -3.86 105.19 107.65 1wqa n GLY 6 Ca 0.09 -1.79 -0.05 0.00 0.00 0.00 0.00 46.02 44.26 1wqa n GLY 6 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1wqa h THR 7 N 0.00 1.25 -1.78 2.61 1.35 -1.97 -3.38 112.91 110.99 1wqa h THR 7 Ca 0.00 -0.91 -0.41 0.00 -0.55 0.00 0.00 66.41 64.54 1wqa h THR 7 Cb 0.00 0.58 -0.29 0.00 -1.73 0.00 0.00 68.15 66.71 1wqa h THR 7 CO 0.00 0.35 -0.78 0.33 -0.25 0.00 0.00 175.52 175.17 1wqa n PHE 8 N -4.25 -2.13 -0.17 4.73 -0.00 -1.26 -4.80 117.46 109.58 1wqa n PHE 8 Ca 0.05 -2.51 0.00 0.00 -0.00 0.00 0.00 57.45 54.99 1wqa n PHE 8 Cb 0.25 0.76 0.00 0.00 -0.00 0.00 0.00 39.48 40.49 1wqa n PHE 8 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1wqa n GLY 9 N 2.84 -3.24 3.14 7.13 0.00 -1.26 -4.82 105.19 108.99 1wqa n GLY 9 Ca 0.25 -2.03 -0.19 0.00 0.00 0.00 0.00 46.02 44.05 1wqa n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wqa s VAL 10 N -0.62 1.05 0.16 1.61 0.11 -0.35 -0.33 120.40 122.03 1wqa s VAL 10 Ca 0.00 -1.12 -0.04 0.00 -2.93 0.00 0.00 61.98 57.90 1wqa s VAL 10 Cb 0.00 -0.99 -0.03 0.00 -1.53 0.00 0.00 36.38 33.83 1wqa s VAL 10 CO 0.00 -0.12 0.16 0.00 -3.33 0.00 0.00 175.10 171.81 1wqa s ARG 11 N -1.40 1.09 0.00 1.54 3.03 -1.26 -0.79 118.95 121.15 1wqa s ARG 11 Ca -0.01 -1.40 0.00 0.00 2.03 0.00 0.00 55.73 56.35 1wqa s ARG 11 Cb -0.09 0.30 0.00 0.00 -1.03 0.00 0.00 34.95 34.13 1wqa s ARG 11 CO 0.02 -0.36 0.00 0.41 -1.13 0.00 0.00 175.30 174.24 1wqa n GLY 12 N -0.18 -1.41 3.73 3.88 0.00 -0.49 -4.96 105.19 105.76 1wqa n GLY 12 Ca -0.04 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 1wqa n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wqa s ILE 13 N -2.52 4.46 0.25 -0.61 1.01 -1.26 -1.51 121.20 121.02 1wqa s ILE 13 Ca 0.00 1.99 -0.31 0.00 0.00 0.00 0.00 60.65 62.33 1wqa s ILE 13 Cb 0.00 -4.27 -0.11 0.00 0.01 0.00 0.00 42.46 38.09 1wqa s ILE 13 CO 0.00 0.28 1.59 0.00 0.00 0.00 0.00 174.94 176.81 1wqa s ALA 14 N 0.17 3.77 -0.06 9.38 0.00 0.46 -1.86 121.76 133.63 1wqa s ALA 14 Ca 0.49 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.96 1wqa s ALA 14 Cb -0.24 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.24 1wqa s ALA 14 CO 0.30 -0.91 0.00 0.09 0.00 0.00 0.00 175.76 175.24 1wqa n ASN 15 N 2.81 -4.09 0.00 0.00 5.03 0.09 -4.85 115.26 114.25 1wqa n ASN 15 Ca 0.10 0.01 0.00 0.00 0.87 0.00 0.00 54.58 55.57 1wqa n ASN 15 Cb 0.37 -1.64 0.00 0.00 -1.02 0.00 0.00 39.78 37.49 1wqa n ASN 15 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1wqa n GLU 16 N -1.62 0.00 -0.02 3.52 1.02 -0.77 -4.86 120.64 117.90 1wqa n GLU 16 Ca -0.01 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.98 1wqa n GLU 16 Cb 0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.50 1wqa n GLU 16 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1wqa h LYS 17 N 0.00 0.26 -4.77 3.49 3.64 -1.83 -3.38 116.57 113.98 1wqa h LYS 17 Ca 0.00 -0.24 -0.74 0.00 -1.27 0.00 0.00 60.65 58.40 1wqa h LYS 17 Cb 0.00 0.06 -0.18 0.00 -0.41 0.00 0.00 32.23 31.70 1wqa h LYS 17 CO 0.00 0.93 1.37 0.42 -2.27 0.00 0.00 179.45 179.89 1wqa s ILE 18 N -3.37 5.02 0.56 2.00 -1.09 -0.83 -4.79 121.20 118.70 1wqa s ILE 18 Ca -0.15 -2.63 0.04 0.00 -2.23 0.00 0.00 60.65 55.68 1wqa s ILE 18 Cb 0.02 -4.92 0.06 0.00 -1.58 0.00 0.00 42.46 36.05 1wqa s ILE 18 CO 0.76 -1.63 0.78 0.42 -1.23 0.00 0.00 174.94 174.04 1wqa s THR 19 N 1.61 2.50 0.23 2.92 -4.23 -1.26 -0.73 115.64 116.68 1wqa s THR 19 Ca 0.43 -0.81 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 1wqa s THR 19 Cb -0.03 -2.70 0.06 0.00 1.34 0.00 0.00 72.50 71.18 1wqa s THR 19 CO 0.00 0.00 1.68 -0.65 -0.54 0.00 0.00 174.62 175.11 1wqa h PRO 20 N 0.09 0.76 -0.71 3.99 0.11 -1.93 -2.20 132.00 132.11 1wqa h PRO 20 Ca -0.37 -0.27 -0.04 0.00 0.11 0.00 0.00 66.00 65.42 1wqa h PRO 20 Cb 1.28 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 1wqa h PRO 20 CO 0.45 0.87 0.27 0.93 -0.21 0.00 0.00 178.00 180.31 1wqa h GLU 21 N 0.68 1.06 -0.12 1.05 3.07 -1.97 -0.46 114.58 117.89 1wqa h GLU 21 Ca 0.11 -0.20 0.02 0.00 -0.50 0.00 0.00 59.36 58.79 1wqa h GLU 21 Cb 0.64 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 1wqa h GLU 21 CO 0.04 0.88 0.00 0.35 -1.40 0.00 0.00 179.01 178.89 1wqa h PHE 22 N 1.02 -0.00 -0.52 4.33 3.57 -1.81 -0.27 116.94 123.26 1wqa h PHE 22 Ca 0.23 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1wqa h PHE 22 Cb 0.22 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1wqa h PHE 22 CO 0.02 -0.01 0.34 0.00 -2.23 0.00 0.00 178.31 176.42 1wqa h ALA 23 N 1.10 0.66 -0.62 2.41 0.00 -1.06 -0.97 119.26 120.78 1wqa h ALA 23 Ca 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1wqa h ALA 23 Cb 0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1wqa h ALA 23 CO -0.09 0.12 0.30 1.98 0.00 0.00 0.00 179.25 181.56 1wqa h MET 24 N 0.70 0.90 -0.58 0.00 1.85 -0.89 -0.57 114.93 116.34 1wqa h MET 24 Ca 0.19 -0.13 -0.07 0.00 -0.61 0.00 0.00 59.70 59.08 1wqa h MET 24 Cb -0.06 -0.16 -0.02 0.00 0.43 0.00 0.00 31.60 31.78 1wqa h MET 24 CO -0.04 0.72 0.08 0.87 -0.40 0.00 0.00 176.91 178.14 1wqa h LYS 25 N 0.86 0.96 -0.48 0.39 1.57 -0.75 -0.48 116.57 118.62 1wqa h LYS 25 Ca 0.21 -0.26 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1wqa h LYS 25 Cb 0.11 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1wqa h LYS 25 CO -0.03 0.92 0.29 0.82 -0.57 0.00 0.00 179.45 180.88 1wqa h ILE 26 N 0.86 1.06 -0.42 1.86 1.08 -0.93 0.11 117.51 121.12 1wqa h ILE 26 Ca 0.17 -0.20 0.01 0.00 -0.39 0.00 0.00 64.86 64.45 1wqa h ILE 26 Cb 0.43 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 34.58 1wqa h ILE 26 CO 0.01 0.11 0.27 1.23 -0.69 0.00 0.00 178.15 179.08 1wqa h GLY 27 N 0.58 0.59 1.42 5.37 0.00 -0.68 0.46 103.07 110.82 1wqa h GLY 27 Ca 0.19 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 1wqa h GLY 27 CO -0.08 0.20 -0.17 -0.33 0.00 0.00 0.00 176.54 176.15 1wqa h MET 28 N 0.55 0.68 -0.09 4.80 2.86 -0.72 -0.73 114.93 122.28 1wqa h MET 28 Ca 0.16 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1wqa h MET 28 Cb -0.04 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.57 1wqa h MET 28 CO -0.05 0.81 -0.01 0.00 1.06 0.00 0.00 176.91 178.72 1wqa h ALA 29 N 1.20 0.12 -0.38 6.32 0.00 -0.48 -1.24 119.26 124.80 1wqa h ALA 29 Ca 0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wqa h ALA 29 Cb 0.63 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1wqa h ALA 29 CO 0.04 -0.17 0.24 0.35 0.00 0.00 0.00 179.25 179.71 1wqa h PHE 30 N -0.15 0.50 -0.50 0.00 3.57 -0.81 -1.49 116.94 118.06 1wqa h PHE 30 Ca 0.02 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1wqa h PHE 30 Cb 0.40 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1wqa h PHE 30 CO 0.05 0.35 0.10 0.78 -2.23 0.00 0.00 178.31 177.36 1wqa h GLY 31 N 0.50 0.83 0.89 2.40 0.00 -1.13 -1.47 103.07 105.09 1wqa h GLY 31 Ca 0.14 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1wqa h GLY 31 CO -0.03 0.45 0.09 -0.84 0.00 0.00 0.00 176.54 176.21 1wqa h THR 32 N 0.74 1.19 -0.30 4.70 2.02 -0.79 -1.81 112.91 118.67 1wqa h THR 32 Ca 0.16 -0.61 0.04 0.00 0.77 0.00 0.00 66.41 66.77 1wqa h THR 32 Cb 0.30 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 1wqa h THR 32 CO 0.00 0.20 0.09 0.25 0.37 0.00 0.00 175.52 176.43 1wqa h LEU 33 N 0.27 0.08 -1.21 2.58 5.85 -0.93 -0.60 115.31 121.35 1wqa h LEU 33 Ca 0.09 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.93 1wqa h LEU 33 Cb 0.23 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 1wqa h LEU 33 CO -0.00 0.08 0.57 -0.07 -0.34 0.00 0.00 178.44 178.68 1wqa h LEU 34 N 0.21 0.80 -0.08 2.25 3.38 -1.08 -0.87 115.31 119.93 1wqa h LEU 34 Ca 0.13 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 1wqa h LEU 34 Cb 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1wqa h LEU 34 CO -0.15 0.48 -0.16 0.11 0.09 0.00 0.00 178.44 178.80 1wqa h LYS 35 N 0.88 0.25 0.00 1.13 1.57 -0.68 -3.21 116.57 116.51 1wqa h LYS 35 Ca 0.40 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1wqa h LYS 35 Cb 0.38 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 1wqa h LYS 35 CO -0.17 0.76 -0.03 0.00 -0.57 0.00 0.00 179.45 179.44 1wqa h ARG 36 N -0.22 0.00 0.00 3.15 3.08 -0.75 -0.01 114.38 119.63 1wqa h ARG 36 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1wqa h ARG 36 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1wqa h ARG 36 CO 0.04 0.03 0.00 0.39 -1.07 0.00 0.00 179.97 179.36 1wqa n GLU 37 N -3.56 0.73 0.00 0.04 1.02 -0.36 -4.84 120.64 113.66 1wqa n GLU 37 Ca -0.03 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1wqa n GLU 37 Cb 0.13 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1wqa n GLU 37 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wqa n GLY 38 N 0.61 1.70 3.31 0.62 0.00 -0.06 -5.11 105.19 106.26 1wqa n GLY 38 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1wqa n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wqa s ARG 39 N -0.18 3.31 0.12 1.61 0.52 -0.93 -5.01 118.95 118.39 1wqa s ARG 39 Ca 0.00 -0.70 -0.15 0.00 -0.52 0.00 0.00 55.73 54.36 1wqa s ARG 39 Cb 0.00 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.75 1wqa s ARG 39 CO 0.00 0.05 1.55 -0.22 0.02 0.00 0.00 175.30 176.71 1wqa h LYS 40 N 7.22 0.69 -2.17 3.54 3.11 -1.90 -3.39 116.57 123.66 1wqa h LYS 40 Ca -0.32 -0.23 -0.49 0.00 -2.81 0.00 0.00 60.65 56.81 1wqa h LYS 40 Cb 1.19 -0.06 -0.34 0.00 -1.00 0.00 0.00 32.23 32.02 1wqa h LYS 40 CO 0.57 0.80 -0.82 0.21 -2.81 0.00 0.00 179.45 177.40 1wqa s LYS 41 N -4.94 0.76 0.64 1.90 2.20 -1.26 -4.97 119.74 114.06 1wqa s LYS 41 Ca -0.13 -1.48 -0.18 0.00 -0.36 0.00 0.00 55.97 53.82 1wqa s LYS 41 Cb 0.10 -1.07 -0.03 0.00 -1.51 0.00 0.00 37.83 35.32 1wqa s LYS 41 CO 0.79 -1.29 0.95 -2.30 -0.36 0.00 0.00 175.35 173.15 1wqa n PRO 42 N 3.52 0.78 -4.40 4.03 -0.02 -1.26 -4.68 135.00 132.97 1wqa n PRO 42 Ca 0.19 0.31 -0.33 0.00 -2.02 0.00 0.00 63.50 61.65 1wqa n PRO 42 Cb 0.45 -2.18 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 1wqa n PRO 42 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1wqa s LEU 43 N -2.29 2.41 -0.06 2.45 2.96 -1.26 -0.54 118.68 122.35 1wqa s LEU 43 Ca 0.76 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.20 1wqa s LEU 43 Cb -0.39 -1.55 0.00 0.00 0.50 0.00 0.00 46.19 44.74 1wqa s LEU 43 CO 0.47 0.06 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.69 1wqa s VAL 44 N 0.97 1.52 -0.11 1.68 1.01 -0.09 0.29 120.40 125.67 1wqa s VAL 44 Ca -0.02 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 61.05 1wqa s VAL 44 Cb -0.15 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1wqa s VAL 44 CO -0.03 0.44 0.44 -0.69 0.00 0.00 0.00 175.10 175.26 1wqa s VAL 45 N 0.26 5.18 -0.08 2.92 1.01 -0.50 -1.04 120.40 128.15 1wqa s VAL 45 Ca -0.10 0.88 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1wqa s VAL 45 Cb -0.14 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.47 1wqa s VAL 45 CO 0.04 0.37 -0.14 -0.69 0.00 0.00 0.00 175.10 174.67 1wqa s VAL 46 N 0.38 1.34 0.28 2.92 1.01 0.44 -0.39 120.40 126.37 1wqa s VAL 46 Ca 0.24 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.67 1wqa s VAL 46 Cb -0.15 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1wqa s VAL 46 CO 0.10 0.40 0.22 -0.83 0.00 0.00 0.00 175.10 174.99 1wqa s GLY 47 N 0.68 1.96 0.24 4.51 0.00 -0.69 -0.32 107.32 113.70 1wqa s GLY 47 Ca -0.14 -1.92 -0.18 0.00 0.00 0.00 0.00 44.72 42.48 1wqa s GLY 47 CO 0.04 -1.44 0.59 1.09 0.00 0.00 0.00 173.10 173.38 1wqa s ARG 48 N -3.73 1.57 0.00 2.90 1.70 -0.56 -0.81 118.95 120.02 1wqa s ARG 48 Ca 0.40 -0.99 0.00 0.00 -0.47 0.00 0.00 55.73 54.67 1wqa s ARG 48 Cb 0.04 0.54 0.00 0.00 -0.57 0.00 0.00 34.95 34.97 1wqa s ARG 48 CO 0.21 -0.69 0.00 -0.40 -1.08 0.00 0.00 175.30 173.35 1wqa n ASP 49 N -0.40 0.00 -0.37 -2.89 5.68 -0.90 -1.37 116.55 116.31 1wqa n ASP 49 Ca -0.06 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.35 1wqa n ASP 49 Cb 0.61 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.12 1wqa n ASP 49 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1wqa n THR 50 N 0.00 0.08 -1.67 2.12 -2.24 -1.26 -4.81 114.28 106.49 1wqa n THR 50 Ca 0.00 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 1wqa n THR 50 Cb 0.00 0.19 0.02 0.00 -2.10 0.00 0.00 70.33 68.43 1wqa n THR 50 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1wqa n ARG 51 N -0.09 1.66 0.28 -0.78 1.74 -1.26 -2.79 116.66 115.43 1wqa n ARG 51 Ca 0.18 0.60 0.13 0.00 -0.77 0.00 0.00 57.85 57.99 1wqa n ARG 51 Cb 0.27 -2.28 0.83 0.00 -1.02 0.00 0.00 32.46 30.26 1wqa n ARG 51 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1wqa h VAL 52 N 1.76 0.62 -0.02 1.55 2.07 -1.85 -1.55 116.25 118.83 1wqa h VAL 52 Ca -0.47 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1wqa h VAL 52 Cb 1.31 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1wqa h VAL 52 CO 0.58 0.03 -0.18 -1.54 0.02 0.00 0.00 177.57 176.48 1wqa n SER 53 N -3.92 1.89 -0.15 0.57 3.41 -1.26 -4.48 113.62 109.67 1wqa n SER 53 Ca -0.03 -1.48 -0.08 0.00 -0.26 0.00 0.00 58.87 57.03 1wqa n SER 53 Cb 0.12 0.15 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 1wqa n SER 53 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1wqa h GLY 54 N 4.83 0.66 0.90 5.00 0.00 -1.63 -2.43 103.07 110.41 1wqa h GLY 54 Ca 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 47.33 47.07 1wqa h GLY 54 CO 0.00 0.26 0.11 -2.09 0.00 0.00 0.00 176.54 174.83 1wqa h GLU 55 N 0.61 0.24 -0.80 4.80 4.81 -1.79 0.13 114.58 122.58 1wqa h GLU 55 Ca 0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1wqa h GLU 55 Cb -0.01 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 1wqa h GLU 55 CO -0.03 0.16 0.50 1.98 -0.73 0.00 0.00 179.01 180.89 1wqa h MET 56 N 0.24 1.07 -0.09 1.92 4.05 -1.84 -1.02 114.93 119.27 1wqa h MET 56 Ca 0.09 -0.08 -0.16 0.00 -0.28 0.00 0.00 59.70 59.27 1wqa h MET 56 Cb 0.02 -0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 30.58 1wqa h MET 56 CO -0.06 0.74 -0.63 -0.07 0.23 0.00 0.00 176.91 177.12 1wqa h LEU 57 N 1.09 0.37 -0.63 3.39 3.38 -1.15 -2.64 115.31 119.12 1wqa h LEU 57 Ca 0.29 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1wqa h LEU 57 Cb -0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1wqa h LEU 57 CO -0.06 0.90 0.19 0.50 0.09 0.00 0.00 178.44 180.07 1wqa h LYS 58 N 0.24 0.98 -0.65 1.13 3.64 -0.37 -0.29 116.57 121.25 1wqa h LYS 58 Ca -0.01 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1wqa h LYS 58 Cb 1.16 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 1wqa h LYS 58 CO 0.10 0.87 0.23 0.93 -2.27 0.00 0.00 179.45 179.31 1wqa h GLU 59 N 0.91 1.00 -0.36 1.90 4.39 -1.09 -0.65 114.58 120.68 1wqa h GLU 59 Ca 0.20 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1wqa h GLU 59 Cb 0.30 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1wqa h GLU 59 CO -0.01 0.86 0.12 0.00 -1.16 0.00 0.00 179.01 178.82 1wqa h ALA 60 N 1.09 0.47 -0.50 3.43 0.00 -1.19 0.20 119.26 122.77 1wqa h ALA 60 Ca 0.21 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1wqa h ALA 60 Cb 0.26 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1wqa h ALA 60 CO -0.01 0.11 0.13 1.25 0.00 0.00 0.00 179.25 180.73 1wqa h LEU 61 N 0.44 0.75 -0.33 0.00 5.85 -0.88 -2.10 115.31 119.03 1wqa h LEU 61 Ca 0.12 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 1wqa h LEU 61 Cb 0.25 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1wqa h LEU 61 CO -0.00 0.78 -0.01 0.40 -0.34 0.00 0.00 178.44 179.26 1wqa h ILE 62 N 0.69 1.26 -0.58 4.05 2.04 -1.02 -1.27 117.51 122.68 1wqa h ILE 62 Ca 0.16 -0.99 0.09 0.00 1.00 0.00 0.00 64.86 65.11 1wqa h ILE 62 Cb 0.32 1.26 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 1wqa h ILE 62 CO -0.00 0.32 0.21 -1.28 0.00 0.00 0.00 178.15 177.41 1wqa h SER 63 N 0.39 0.21 -0.40 1.72 0.87 -0.86 0.35 113.55 115.82 1wqa h SER 63 Ca 0.09 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1wqa h SER 63 Cb 0.47 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1wqa h SER 63 CO 0.02 0.13 0.26 1.23 -0.53 0.00 0.00 176.83 177.94 1wqa h GLY 64 N 0.39 0.57 0.97 5.77 0.00 -1.00 -0.92 103.07 108.86 1wqa h GLY 64 Ca 0.29 -0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.40 1wqa h GLY 64 CO -0.29 0.22 0.18 1.41 0.00 0.00 0.00 176.54 178.05 1wqa h LEU 65 N 0.54 0.29 -1.09 3.11 3.38 -0.47 -2.38 115.31 118.68 1wqa h LEU 65 Ca 0.15 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1wqa h LEU 65 Cb -0.03 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1wqa h LEU 65 CO -0.03 0.21 0.34 -0.07 0.09 0.00 0.00 178.44 178.99 1wqa h LEU 66 N 0.36 0.88 -1.84 1.67 3.38 -0.82 -1.81 115.31 117.13 1wqa h LEU 66 Ca 0.11 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1wqa h LEU 66 Cb -0.02 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.50 1wqa h LEU 66 CO -0.04 0.74 -0.10 0.77 0.09 0.00 0.00 178.44 179.91 1wqa h SER 67 N 0.98 0.00 -0.57 -0.43 4.64 -0.67 -0.35 113.55 117.14 1wqa h SER 67 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1wqa h SER 67 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1wqa h SER 67 CO -0.03 0.10 0.00 1.33 -0.87 0.00 0.00 176.83 177.35 1wqa n VAL 68 N -3.42 2.32 -0.75 0.95 0.24 -0.96 -0.78 118.33 115.93 1wqa n VAL 68 Ca -0.01 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.92 1wqa n VAL 68 Cb 0.26 -0.10 0.00 0.00 -1.47 0.00 0.00 33.84 32.53 1wqa n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wqa n GLY 69 N 0.70 0.54 3.85 7.63 0.00 -0.65 -4.49 105.19 112.77 1wqa n GLY 69 Ca 0.26 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 1wqa n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa s ASP 71 N -0.94 6.88 0.03 0.00 -0.00 0.29 -3.93 116.67 119.01 1wqa s ASP 71 Ca 0.14 1.55 0.04 0.00 -0.00 0.00 0.00 52.55 54.29 1wqa s ASP 71 Cb -0.12 -2.48 -0.02 0.00 -0.00 0.00 0.00 42.92 40.30 1wqa s ASP 71 CO 0.04 -0.31 -0.13 -0.69 -0.00 0.00 0.00 175.17 174.08 1wqa s VAL 72 N -2.11 1.04 -0.24 -1.27 1.01 0.28 -0.91 120.40 118.20 1wqa s VAL 72 Ca 0.59 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.67 1wqa s VAL 72 Cb -0.09 -0.94 0.05 0.00 0.00 0.00 0.00 36.38 35.39 1wqa s VAL 72 CO 0.14 0.02 -0.12 -0.63 0.00 0.00 0.00 175.10 174.51 1wqa s ILE 73 N -0.80 2.24 -0.44 2.22 1.01 -0.21 -1.74 121.20 123.49 1wqa s ILE 73 Ca 0.01 -1.42 -0.22 0.00 0.00 0.00 0.00 60.65 59.02 1wqa s ILE 73 Cb -0.07 -2.22 0.02 0.00 0.01 0.00 0.00 42.46 40.20 1wqa s ILE 73 CO 0.01 0.11 0.71 -0.62 0.00 0.00 0.00 174.94 175.15 1wqa s ASP 74 N 1.17 6.37 -0.00 3.58 2.15 0.22 -0.42 116.67 129.74 1wqa s ASP 74 Ca -0.05 -0.22 0.14 0.00 0.43 0.00 0.00 52.55 52.85 1wqa s ASP 74 Cb -0.18 -2.35 0.42 0.00 -0.30 0.00 0.00 42.92 40.51 1wqa s ASP 74 CO -0.07 -0.84 1.35 1.33 -0.17 0.00 0.00 175.17 176.77 1wqa n VAL 75 N 5.99 0.66 -4.81 1.11 0.24 0.56 -1.71 118.33 120.36 1wqa n VAL 75 Ca 0.00 -0.64 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1wqa n VAL 75 Cb 0.48 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.15 1wqa n VAL 75 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1wqa n GLY 76 N 1.23 2.27 3.66 7.63 0.00 -1.26 -4.59 105.19 114.13 1wqa n GLY 76 Ca 0.16 -0.50 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 1wqa n GLY 76 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wqa s ILE 77 N 0.00 5.05 -0.02 -0.61 1.01 -1.26 -1.49 121.20 123.88 1wqa s ILE 77 Ca 0.00 1.08 -0.29 0.00 0.00 0.00 0.00 60.65 61.45 1wqa s ILE 77 Cb 0.00 -3.90 0.09 0.00 0.01 0.00 0.00 42.46 38.66 1wqa s ILE 77 CO 0.00 0.13 0.76 0.00 0.00 0.00 0.00 174.94 175.83 1wqa s ALA 78 N 1.87 -1.77 0.56 9.38 0.00 -0.47 -4.95 121.76 126.38 1wqa s ALA 78 Ca 0.26 1.13 -0.20 0.00 0.00 0.00 0.00 51.96 53.16 1wqa s ALA 78 Cb -0.16 0.13 -0.06 0.00 0.00 0.00 0.00 23.12 23.04 1wqa s ALA 78 CO 0.10 -0.50 1.00 -2.30 0.00 0.00 0.00 175.76 174.06 1wqa n PRO 79 N 0.38 1.06 -0.19 0.00 -0.02 -1.26 -4.45 135.00 130.52 1wqa n PRO 79 Ca -0.15 0.40 -0.01 0.00 -2.02 0.00 0.00 63.50 61.72 1wqa n PRO 79 Cb 0.60 -2.18 0.10 0.00 -0.02 0.00 0.00 33.50 31.99 1wqa n PRO 79 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1wqa h THR 80 N 0.77 0.72 0.00 3.45 2.02 -1.38 -0.13 112.91 118.36 1wqa h THR 80 Ca -0.48 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 66.57 1wqa h THR 80 Cb 1.35 0.38 -0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1wqa h THR 80 CO 0.52 0.06 -0.11 -0.65 0.37 0.00 0.00 175.52 175.71 1wqa h PRO 81 N 0.32 0.00 -0.32 6.66 0.11 -1.82 -0.83 132.00 136.12 1wqa h PRO 81 Ca 0.29 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.25 1wqa h PRO 81 Cb 0.39 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1wqa h PRO 81 CO -0.34 0.11 -0.40 0.00 -0.21 0.00 0.00 178.00 177.17 1wqa h ALA 82 N 1.89 0.70 -0.46 -0.75 0.00 -1.38 0.13 119.26 119.38 1wqa h ALA 82 Ca -0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1wqa h ALA 82 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1wqa h ALA 82 CO 0.01 0.67 -0.21 0.28 0.00 0.00 0.00 179.25 180.00 1wqa h VAL 83 N 0.63 1.27 -0.34 0.00 2.07 -0.57 0.23 116.25 119.54 1wqa h VAL 83 Ca 0.05 -1.36 -0.04 0.00 0.82 0.00 0.00 66.70 66.17 1wqa h VAL 83 Cb 0.95 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1wqa h VAL 83 CO 0.09 0.47 0.06 1.56 0.02 0.00 0.00 177.57 179.76 1wqa h GLN 84 N 0.81 0.57 -0.47 1.57 4.20 -0.99 -0.87 115.11 119.93 1wqa h GLN 84 Ca 0.11 -0.15 0.05 0.00 0.06 0.00 0.00 58.65 58.72 1wqa h GLN 84 Cb 0.77 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 28.43 1wqa h GLN 84 CO 0.06 0.64 0.19 2.35 -0.67 0.00 0.00 178.83 181.40 1wqa h TRP 85 N 0.40 0.34 -0.66 2.96 7.01 -0.48 -2.32 115.95 123.21 1wqa h TRP 85 Ca 0.11 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 1wqa h TRP 85 Cb 0.35 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.29 1wqa h TRP 85 CO 0.02 0.14 0.37 0.00 -2.79 0.00 0.00 178.44 176.18 1wqa h ALA 86 N 1.29 1.41 -0.77 2.65 0.00 -0.26 0.26 119.26 123.84 1wqa h ALA 86 Ca 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1wqa h ALA 86 Cb 0.19 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1wqa h ALA 86 CO -0.20 0.49 0.50 1.15 0.00 0.00 0.00 179.25 181.20 1wqa h THR 87 N 0.92 1.20 -0.08 0.00 2.02 -0.61 0.47 112.91 116.82 1wqa h THR 87 Ca 0.24 -0.39 -0.08 0.00 0.77 0.00 0.00 66.41 66.95 1wqa h THR 87 Cb 0.01 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1wqa h THR 87 CO -0.04 0.20 -0.25 0.50 0.37 0.00 0.00 175.52 176.30 1wqa h LYS 88 N 1.05 0.32 -0.74 6.66 3.64 -1.17 -1.91 116.57 124.42 1wqa h LYS 88 Ca 0.28 -0.23 0.10 0.00 -1.27 0.00 0.00 60.65 59.53 1wqa h LYS 88 Cb -0.10 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 1wqa h LYS 88 CO -0.06 0.85 0.38 1.25 -2.27 0.00 0.00 179.45 179.60 1wqa h HIS 89 N -0.16 0.68 -0.29 1.91 2.76 -0.01 -1.85 115.15 118.19 1wqa h HIS 89 Ca -0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1wqa h HIS 89 Cb 0.87 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.64 1wqa h HIS 89 CO 0.12 0.24 0.00 1.19 -1.30 0.00 0.00 177.93 178.18 1wqa n PHE 90 N -4.84 0.40 -3.82 5.26 3.01 0.11 -4.91 117.46 112.66 1wqa n PHE 90 Ca 0.12 -0.20 -0.27 0.00 1.01 0.00 0.00 57.45 58.12 1wqa n PHE 90 Cb 0.29 -0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.78 1wqa n PHE 90 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1wqa n ASN 91 N 0.35 -3.66 -4.88 4.37 3.02 -0.70 -4.96 115.26 108.81 1wqa n ASN 91 Ca 0.10 -0.78 -0.30 0.00 -0.03 0.00 0.00 54.58 53.57 1wqa n ASN 91 Cb 0.25 -4.02 0.02 0.00 -0.61 0.00 0.00 39.78 35.42 1wqa n ASN 91 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wqa s ALA 92 N -3.43 3.08 -0.86 5.41 0.00 -0.72 -4.97 121.76 120.28 1wqa s ALA 92 Ca 0.43 -0.25 0.25 0.00 0.00 0.00 0.00 51.96 52.40 1wqa s ALA 92 Cb -0.21 -2.98 0.54 0.00 0.00 0.00 0.00 23.12 20.46 1wqa s ALA 92 CO 0.82 -0.80 1.45 -0.25 0.00 0.00 0.00 175.76 176.98 1wqa n ASP 93 N -2.77 0.52 -3.75 0.00 8.00 0.14 -4.59 116.55 114.11 1wqa n ASP 93 Ca 0.06 -0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.58 1wqa n ASP 93 Cb 0.55 0.11 0.01 0.00 -0.02 0.00 0.00 41.12 41.76 1wqa n ASP 93 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1wqa s GLY 94 N -3.26 -0.27 0.21 0.44 0.00 -1.16 -3.35 107.32 99.93 1wqa s GLY 94 Ca 0.10 0.36 -0.12 0.00 0.00 0.00 0.00 44.72 45.06 1wqa s GLY 94 CO 0.69 3.49 0.41 -0.32 0.00 0.00 0.00 173.10 177.37 1wqa s GLY 95 N -3.49 0.50 -0.10 0.20 0.00 -1.01 -1.42 107.32 102.01 1wqa s GLY 95 Ca 0.24 -0.85 -0.09 0.00 0.00 0.00 0.00 44.72 44.02 1wqa s GLY 95 CO -0.03 -0.69 0.26 0.00 0.00 0.00 0.00 173.10 172.65 1wqa s ALA 96 N -3.99 -0.64 -0.14 3.20 0.00 0.47 -0.17 121.76 120.49 1wqa s ALA 96 Ca 0.20 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.94 1wqa s ALA 96 Cb 0.01 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.70 1wqa s ALA 96 CO 0.05 -0.13 -0.17 0.08 0.00 0.00 0.00 175.76 175.59 1wqa s VAL 97 N 0.24 1.70 -0.55 0.00 1.01 0.13 -1.71 120.40 121.23 1wqa s VAL 97 Ca -0.01 -0.74 -0.21 0.00 0.00 0.00 0.00 61.98 61.02 1wqa s VAL 97 Cb -0.03 -1.55 0.06 0.00 0.00 0.00 0.00 36.38 34.86 1wqa s VAL 97 CO -0.01 0.48 0.78 -0.63 0.00 0.00 0.00 175.10 175.72 1wqa s ILE 98 N 1.15 4.64 -0.05 2.22 -1.09 0.01 -1.16 121.20 126.92 1wqa s ILE 98 Ca -0.02 -0.25 -0.29 0.00 -2.23 0.00 0.00 60.65 57.87 1wqa s ILE 98 Cb -0.14 -4.44 0.10 0.00 -1.58 0.00 0.00 42.46 36.40 1wqa s ILE 98 CO -0.06 -1.01 0.85 0.28 -1.23 0.00 0.00 174.94 173.77 1wqa s THR 99 N 3.25 0.00 -0.12 2.92 -1.32 -0.38 -2.11 115.64 117.87 1wqa s THR 99 Ca 0.21 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.86 1wqa s THR 99 Cb -0.17 -1.00 0.27 0.00 -1.51 0.00 0.00 72.50 70.09 1wqa s THR 99 CO 0.14 0.00 1.14 0.00 -2.21 0.00 0.00 174.62 173.69 1wqa n ALA 100 N 0.34 2.29 -0.87 11.08 0.00 -1.26 -1.91 120.51 130.17 1wqa n ALA 100 Ca -0.13 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 50.79 1wqa n ALA 100 Cb 0.60 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.66 1wqa n ALA 100 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wqa n SER 101 N -1.31 0.00 -0.65 0.00 2.88 -1.26 -1.85 113.62 111.44 1wqa n SER 101 Ca 0.15 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.76 1wqa n SER 101 Cb 0.65 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.21 1wqa n SER 101 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wqa n HIS 102 N 0.00 0.17 -1.38 0.66 1.44 -1.26 -2.71 115.22 112.14 1wqa n HIS 102 Ca 0.00 -0.14 -0.30 0.00 -2.01 0.00 0.00 57.72 55.27 1wqa n HIS 102 Cb 0.00 -0.01 0.12 0.00 0.12 0.00 0.00 29.99 30.22 1wqa n HIS 102 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1wqa s ASN 103 N -1.15 3.87 0.87 4.39 -0.87 -0.77 -3.80 114.94 117.49 1wqa s ASN 103 Ca 0.20 1.35 -0.12 0.00 -1.57 0.00 0.00 52.86 52.73 1wqa s ASN 103 Cb 0.13 -2.05 0.10 0.00 -0.02 0.00 0.00 41.25 39.41 1wqa s ASN 103 CO 0.19 -2.37 1.04 -2.65 -2.57 0.00 0.00 177.10 170.74 1wqa n PRO 104 N -3.70 -0.17 -0.38 -0.60 -0.02 -1.26 -4.52 135.00 124.35 1wqa n PRO 104 Ca 0.07 0.02 0.33 0.00 -2.02 0.00 0.00 63.50 61.90 1wqa n PRO 104 Cb 0.56 -2.31 0.66 0.00 -0.02 0.00 0.00 33.50 32.40 1wqa n PRO 104 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1wqa h PRO 105 N -1.42 0.13 0.00 0.52 0.11 -1.88 -1.37 132.00 128.08 1wqa h PRO 105 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1wqa h PRO 105 Cb 1.29 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1wqa h PRO 105 CO 0.42 0.09 0.00 -0.85 -0.21 0.00 0.00 178.00 177.45 1wqa n GLU 106 N -4.39 0.17 -3.27 1.05 0.00 -1.26 -4.72 120.64 108.22 1wqa n GLU 106 Ca 0.29 0.32 -0.28 0.00 0.00 0.00 0.00 57.16 57.49 1wqa n GLU 106 Cb 1.23 -1.78 -0.03 0.00 0.00 0.00 0.00 31.44 30.86 1wqa n GLU 106 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1wqa s TYR 107 N -3.20 3.48 0.34 -1.84 2.02 -0.52 -0.40 117.35 117.23 1wqa s TYR 107 Ca 0.07 0.66 -0.13 0.00 -0.37 0.00 0.00 57.07 57.30 1wqa s TYR 107 Cb 0.11 -2.12 0.03 0.00 -0.40 0.00 0.00 41.96 39.57 1wqa s TYR 107 CO 0.44 0.13 0.66 1.21 -1.57 0.00 0.00 175.55 176.42 1wqa s ASN 108 N -3.27 0.16 0.01 2.29 3.04 -0.57 -4.65 114.94 111.95 1wqa s ASN 108 Ca 0.44 -1.10 -0.03 0.00 0.04 0.00 0.00 52.86 52.21 1wqa s ASN 108 Cb -0.11 0.75 0.01 0.00 -1.54 0.00 0.00 41.25 40.37 1wqa s ASN 108 CO 0.31 -1.47 0.13 0.61 -3.04 0.00 0.00 177.10 173.64 1wqa n GLY 109 N -0.51 0.99 2.96 1.21 0.00 -0.80 -1.39 105.19 107.65 1wqa n GLY 109 Ca -0.05 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 1wqa n GLY 109 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wqa s ILE 110 N -2.38 -0.04 -0.13 -0.61 1.01 0.03 -1.25 121.20 117.83 1wqa s ILE 110 Ca 0.03 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.83 1wqa s ILE 110 Cb -0.00 -0.26 -0.01 0.00 0.01 0.00 0.00 42.46 42.20 1wqa s ILE 110 CO 0.00 0.06 -0.15 -0.54 0.00 0.00 0.00 174.94 174.31 1wqa s LYS 111 N 1.02 3.30 0.08 2.79 1.02 -0.31 -1.22 119.74 126.42 1wqa s LYS 111 Ca -0.08 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.20 1wqa s LYS 111 Cb -0.10 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1wqa s LYS 111 CO -0.05 0.17 0.19 -0.51 -0.92 0.00 0.00 175.35 174.23 1wqa s LEU 112 N 0.43 4.22 0.08 3.17 1.43 -1.26 -0.70 118.68 126.06 1wqa s LEU 112 Ca -0.11 0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.23 1wqa s LEU 112 Cb -0.16 -2.83 -0.03 0.00 0.03 0.00 0.00 46.19 43.19 1wqa s LEU 112 CO 0.05 0.15 -0.17 -0.76 0.23 0.00 0.00 176.35 175.85 1wqa s LEU 113 N -2.62 2.27 1.01 1.79 1.43 0.76 -1.09 118.68 122.24 1wqa s LEU 113 Ca 0.34 -0.62 -0.13 0.00 -1.03 0.00 0.00 54.13 52.69 1wqa s LEU 113 Cb -0.12 -0.69 0.20 0.00 0.03 0.00 0.00 46.19 45.60 1wqa s LEU 113 CO 0.27 -0.00 1.10 -1.61 0.23 0.00 0.00 176.35 176.33 1wqa s GLU 114 N -1.71 0.30 0.53 1.70 0.41 0.63 -2.39 118.70 118.17 1wqa s GLU 114 Ca 0.02 0.44 0.20 0.00 -0.41 0.00 0.00 54.97 55.22 1wqa s GLU 114 Cb -0.10 -1.73 1.35 0.00 -1.78 0.00 0.00 34.13 31.88 1wqa s GLU 114 CO 0.03 -2.80 2.11 -1.35 -0.49 0.00 0.00 175.26 172.76 1wqa h PRO 115 N -1.94 0.00 -0.40 0.39 0.11 -1.80 -0.83 132.00 127.52 1wqa h PRO 115 Ca -0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1wqa h PRO 115 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1wqa h PRO 115 CO 0.57 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.63 1wqa n ASN 116 N -4.43 2.30 0.00 -2.05 0.23 -1.26 -4.09 115.26 105.97 1wqa n ASN 116 Ca 0.01 -1.96 0.00 0.00 -0.53 0.00 0.00 54.58 52.09 1wqa n ASN 116 Cb 0.24 -0.27 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 1wqa n ASN 116 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1wqa n GLY 117 N 1.20 1.44 3.83 4.83 0.00 -0.32 -4.43 105.19 111.74 1wqa n GLY 117 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1wqa n GLY 117 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1wqa s MET 118 N -0.51 2.83 0.34 1.61 0.23 -1.26 -4.61 119.30 117.94 1wqa s MET 118 Ca 0.00 0.78 -0.27 0.00 -1.03 0.00 0.00 55.69 55.17 1wqa s MET 118 Cb 0.00 -1.99 -0.13 0.00 -1.53 0.00 0.00 34.83 31.18 1wqa s MET 118 CO 0.00 -1.13 1.05 0.41 -2.03 0.00 0.00 175.02 173.32 1wqa n GLY 119 N -2.29 -0.13 3.63 3.16 0.00 -1.26 -0.27 105.19 108.04 1wqa n GLY 119 Ca 0.07 0.26 -0.45 0.00 0.00 0.00 0.00 46.02 45.89 1wqa n GLY 119 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wqa n LEU 120 N 0.91 2.42 -4.76 0.99 7.94 -0.25 -4.47 117.00 119.78 1wqa n LEU 120 Ca 0.09 1.16 -0.38 0.00 -1.11 0.00 0.00 56.01 55.77 1wqa n LEU 120 Cb 0.35 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 42.96 1wqa n LEU 120 CO 0.59 -0.94 0.91 -0.54 -1.11 0.00 0.00 177.39 176.31 1wqa s LYS 121 N -0.91 3.70 0.27 1.96 1.02 -1.26 -4.82 119.74 119.70 1wqa s LYS 121 Ca 0.65 2.02 -0.01 0.00 0.02 0.00 0.00 55.97 58.65 1wqa s LYS 121 Cb -0.70 -2.51 0.49 0.00 -0.52 0.00 0.00 37.83 34.58 1wqa s LYS 121 CO 0.55 -0.67 1.83 0.87 -0.92 0.00 0.00 175.35 177.01 1wqa h LYS 122 N 2.17 0.90 -0.70 1.68 1.79 -1.98 0.60 116.57 121.03 1wqa h LYS 122 Ca -0.50 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 57.87 1wqa h LYS 122 Cb 1.26 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 31.67 1wqa h LYS 122 CO 0.60 0.60 0.26 0.93 -1.08 0.00 0.00 179.45 180.77 1wqa h GLU 123 N 0.93 1.06 -0.13 3.15 3.07 -2.00 -0.13 114.58 120.53 1wqa h GLU 123 Ca 0.46 -0.20 -0.20 0.00 -0.50 0.00 0.00 59.36 58.92 1wqa h GLU 123 Cb 0.42 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1wqa h GLU 123 CO -0.25 0.89 -0.72 0.00 -1.40 0.00 0.00 179.01 177.52 1wqa h ARG 124 N 1.01 0.59 -0.49 2.33 3.08 -1.76 -2.85 114.38 116.29 1wqa h ARG 124 Ca 0.23 -0.47 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 1wqa h ARG 124 Cb 0.23 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1wqa h ARG 124 CO -0.02 1.09 0.21 1.49 -1.07 0.00 0.00 179.97 181.68 1wqa h GLU 125 N 0.41 0.70 -0.51 0.04 4.81 -0.62 -1.47 114.58 117.94 1wqa h GLU 125 Ca -0.03 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.06 1wqa h GLU 125 Cb 1.31 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.54 1wqa h GLU 125 CO 0.14 0.56 0.12 0.00 -0.73 0.00 0.00 179.01 179.09 1wqa h ALA 126 N 1.54 1.25 -0.22 2.92 0.00 -0.80 -1.32 119.26 122.63 1wqa h ALA 126 Ca 0.17 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1wqa h ALA 126 Cb 0.11 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1wqa h ALA 126 CO -0.02 0.52 -0.15 0.82 0.00 0.00 0.00 179.25 180.42 1wqa h ILE 127 N 0.75 1.31 -0.59 0.00 2.04 -1.20 -2.19 117.51 117.64 1wqa h ILE 127 Ca 0.17 -1.27 0.09 0.00 1.00 0.00 0.00 64.86 64.84 1wqa h ILE 127 Cb 0.29 1.67 -0.07 0.00 -0.74 0.00 0.00 36.82 37.97 1wqa h ILE 127 CO -0.00 0.39 0.23 0.58 0.00 0.00 0.00 178.15 179.35 1wqa h VAL 128 N 0.19 0.79 -0.50 1.67 2.07 -0.90 -0.37 116.25 119.20 1wqa h VAL 128 Ca 0.04 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.44 1wqa h VAL 128 Cb 0.68 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1wqa h VAL 128 CO 0.04 0.08 0.30 -0.33 0.02 0.00 0.00 177.57 177.68 1wqa h GLU 129 N 0.42 0.59 -0.20 1.57 5.08 -1.13 0.67 114.58 121.58 1wqa h GLU 129 Ca 0.30 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.63 1wqa h GLU 129 Cb 0.35 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1wqa h GLU 129 CO -0.29 0.39 0.11 1.49 -1.00 0.00 0.00 179.01 179.71 1wqa h GLU 130 N 0.60 0.22 -0.29 2.33 4.81 -0.69 0.18 114.58 121.74 1wqa h GLU 130 Ca 0.20 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1wqa h GLU 130 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1wqa h GLU 130 CO -0.08 0.14 -0.05 -0.07 -0.73 0.00 0.00 179.01 178.23 1wqa h LEU 131 N 0.22 0.43 -0.06 1.64 3.38 -0.63 0.43 115.31 120.72 1wqa h LEU 131 Ca 0.08 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1wqa h LEU 131 Cb 0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1wqa h LEU 131 CO -0.05 0.54 0.00 0.15 0.09 0.00 0.00 178.44 179.17 1wqa h PHE 132 N 0.44 0.11 -0.43 1.13 3.04 -0.38 0.13 116.94 120.99 1wqa h PHE 132 Ca 0.09 -0.02 -0.13 0.00 3.98 0.00 0.00 57.97 61.89 1wqa h PHE 132 Cb 0.36 -0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.83 1wqa h PHE 132 CO 0.01 0.38 -0.26 0.74 -2.02 0.00 0.00 178.31 177.15 1wqa h PHE 133 N -0.18 1.06 -0.00 0.41 0.04 -0.59 -2.94 116.94 114.75 1wqa h PHE 133 Ca 0.02 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.52 1wqa h PHE 133 Cb 0.33 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1wqa h PHE 133 CO 0.03 1.07 -0.16 1.63 -0.60 0.00 0.00 178.31 180.29 1wqa n LYS 134 N -4.09 0.06 -3.81 1.51 5.02 0.11 -4.91 118.16 112.04 1wqa n LYS 134 Ca -0.00 -0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.03 1wqa n LYS 134 Cb 0.48 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 34.00 1wqa n LYS 134 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1wqa n GLU 135 N -1.45 -4.43 -3.25 1.97 1.02 0.39 -4.90 120.64 109.99 1wqa n GLU 135 Ca 0.07 0.54 -0.46 0.00 -0.02 0.00 0.00 57.16 57.30 1wqa n GLU 135 Cb 0.33 -5.01 -0.01 0.00 -0.02 0.00 0.00 31.44 26.73 1wqa n GLU 135 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wqa s ASP 136 N -4.23 6.91 -0.02 1.62 2.15 -0.69 -5.02 116.67 117.38 1wqa s ASP 136 Ca 0.09 -2.86 0.05 0.00 0.43 0.00 0.00 52.55 50.26 1wqa s ASP 136 Cb -0.05 -2.25 -0.03 0.00 -0.30 0.00 0.00 42.92 40.30 1wqa s ASP 136 CO 0.84 -0.58 -0.16 -0.36 -0.17 0.00 0.00 175.17 174.74 1wqa s PHE 137 N 0.24 2.63 -0.90 -5.34 0.08 -1.26 -4.83 117.98 108.60 1wqa s PHE 137 Ca 0.25 -0.21 -0.16 0.00 0.12 0.00 0.00 56.93 56.93 1wqa s PHE 137 Cb -0.09 -1.57 0.18 0.00 -0.57 0.00 0.00 43.02 40.97 1wqa s PHE 137 CO -0.08 0.18 0.96 -0.51 -0.10 0.00 0.00 175.22 175.67 1wqa s ASP 138 N -0.92 6.74 0.25 1.36 1.01 -1.26 -5.01 116.67 118.84 1wqa s ASP 138 Ca 0.12 -2.47 -0.30 0.00 0.71 0.00 0.00 52.55 50.62 1wqa s ASP 138 Cb -0.11 -2.30 -0.10 0.00 1.01 0.00 0.00 42.92 41.43 1wqa s ASP 138 CO 0.02 -0.78 1.36 -0.13 0.21 0.00 0.00 175.17 175.85 1wqa s ARG 139 N 1.23 4.33 0.50 8.23 0.52 -1.26 -4.55 118.95 127.95 1wqa s ARG 139 Ca 0.26 2.20 -0.20 0.00 -0.52 0.00 0.00 55.73 57.47 1wqa s ARG 139 Cb -0.07 -3.13 -0.08 0.00 0.52 0.00 0.00 34.95 32.19 1wqa s ARG 139 CO -0.09 -0.30 1.05 0.00 0.02 0.00 0.00 175.30 175.98 1wqa s ALA 140 N -0.25 2.83 0.66 2.13 0.00 0.04 -4.96 121.76 122.22 1wqa s ALA 140 Ca 0.56 0.63 -0.15 0.00 0.00 0.00 0.00 51.96 53.00 1wqa s ALA 140 Cb -0.39 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1wqa s ALA 140 CO 0.44 -0.43 1.11 0.15 0.00 0.00 0.00 175.76 177.03 1wqa s LYS 141 N -3.31 2.77 0.30 0.00 1.02 -1.26 -4.81 119.74 114.45 1wqa s LYS 141 Ca 0.68 1.39 0.06 0.00 0.02 0.00 0.00 55.97 58.12 1wqa s LYS 141 Cb -0.18 -1.95 0.74 0.00 -0.52 0.00 0.00 37.83 35.93 1wqa s LYS 141 CO 0.22 -1.28 1.76 0.11 -0.92 0.00 0.00 175.35 175.25 1wqa h TRP 142 N -0.02 1.00 -0.10 3.18 5.08 -1.98 0.73 115.95 123.83 1wqa h TRP 142 Ca -0.47 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.54 1wqa h TRP 142 Cb 1.25 -0.29 0.00 0.00 -3.00 0.00 0.00 29.16 27.12 1wqa h TRP 142 CO 0.54 0.17 0.00 2.48 -1.28 0.00 0.00 178.44 180.36 1wqa n TYR 143 N -4.82 0.13 0.01 0.12 0.18 -1.26 -3.27 117.16 108.25 1wqa n TYR 143 Ca 0.23 -0.07 0.00 0.00 1.88 0.00 0.00 57.90 59.95 1wqa n TYR 143 Cb 0.60 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.57 1wqa n TYR 143 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1wqa n GLU 144 N -0.22 1.46 -1.79 -3.48 -0.58 0.23 -5.04 120.64 111.23 1wqa n GLU 144 Ca 0.11 -1.15 -0.41 0.00 -0.42 0.00 0.00 57.16 55.28 1wqa n GLU 144 Cb 0.16 -1.02 -0.01 0.00 -0.57 0.00 0.00 31.44 30.00 1wqa n GLU 144 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1wqa s ILE 145 N -0.64 2.06 1.01 -3.67 1.01 -1.09 -4.23 121.20 115.66 1wqa s ILE 145 Ca 0.02 0.05 -0.12 0.00 0.00 0.00 0.00 60.65 60.60 1wqa s ILE 145 Cb 0.01 -3.03 0.19 0.00 0.01 0.00 0.00 42.46 39.64 1wqa s ILE 145 CO 0.01 0.01 1.08 -0.83 0.00 0.00 0.00 174.94 175.21 1wqa s GLY 146 N 0.24 1.58 0.21 6.18 0.00 -0.23 -4.92 107.32 110.38 1wqa s GLY 146 Ca 0.59 -0.18 0.11 0.00 0.00 0.00 0.00 44.72 45.24 1wqa s GLY 146 CO 0.54 0.41 -0.22 -0.54 0.00 0.00 0.00 173.10 173.29 1wqa s GLU 147 N -4.83 1.54 0.07 2.90 2.02 -1.26 -4.87 118.70 114.28 1wqa s GLU 147 Ca 0.66 -1.58 0.07 0.00 0.02 0.00 0.00 54.97 54.14 1wqa s GLU 147 Cb -0.20 -1.78 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 1wqa s GLU 147 CO 0.59 0.37 -0.20 0.54 0.02 0.00 0.00 175.26 176.58 1wqa s VAL 148 N -1.93 1.58 0.06 2.63 0.11 -1.26 -0.55 120.40 121.03 1wqa s VAL 148 Ca 0.23 -1.34 -0.02 0.00 -2.93 0.00 0.00 61.98 57.92 1wqa s VAL 148 Cb -0.07 -1.42 -0.03 0.00 -1.53 0.00 0.00 36.38 33.33 1wqa s VAL 148 CO 0.11 0.03 0.01 0.00 -3.33 0.00 0.00 175.10 171.92 1wqa s ARG 149 N -1.53 0.64 -0.02 1.54 1.70 -0.71 -4.97 118.95 115.60 1wqa s ARG 149 Ca 0.06 -1.16 -0.00 0.00 -0.47 0.00 0.00 55.73 54.16 1wqa s ARG 149 Cb -0.09 0.23 -0.04 0.00 -0.57 0.00 0.00 34.95 34.48 1wqa s ARG 149 CO 0.03 -0.13 0.06 1.03 -1.08 0.00 0.00 175.30 175.20 1wqa s ARG 150 N -3.83 3.01 -0.02 3.89 0.52 -1.26 -0.61 118.95 120.65 1wqa s ARG 150 Ca 0.06 -0.49 0.02 0.00 -0.52 0.00 0.00 55.73 54.79 1wqa s ARG 150 Cb 0.07 -2.82 0.01 0.00 0.52 0.00 0.00 34.95 32.72 1wqa s ARG 150 CO -0.10 0.65 -0.05 -1.21 0.02 0.00 0.00 175.30 174.61 1wqa s GLU 151 N -1.58 0.55 -0.28 3.54 0.41 -0.70 -4.92 118.70 115.73 1wqa s GLU 151 Ca 0.21 -0.16 -0.14 0.00 -0.41 0.00 0.00 54.97 54.48 1wqa s GLU 151 Cb -0.12 -0.56 -0.04 0.00 -1.78 0.00 0.00 34.13 31.63 1wqa s GLU 151 CO 0.11 0.05 0.31 0.34 -0.49 0.00 0.00 175.26 175.58 1wqa s ASP 152 N 0.24 6.17 0.00 -0.19 -1.08 -1.26 -4.24 116.67 116.31 1wqa s ASP 152 Ca -0.03 0.13 0.11 0.00 -0.52 0.00 0.00 52.55 52.24 1wqa s ASP 152 Cb -0.07 -2.18 0.19 0.00 -1.46 0.00 0.00 42.92 39.41 1wqa s ASP 152 CO -0.00 -0.16 1.05 2.30 0.52 0.00 0.00 175.17 178.88 1wqa n ILE 153 N 5.11 0.50 0.21 4.11 -5.35 -1.26 -4.73 119.36 117.96 1wqa n ILE 153 Ca -0.10 -0.75 -0.15 0.00 -0.27 0.00 0.00 62.75 61.48 1wqa n ILE 153 Cb 0.51 0.86 -0.07 0.00 -1.74 0.00 0.00 39.64 39.20 1wqa n ILE 153 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1wqa h ILE 154 N 2.04 0.49 -0.15 7.28 1.08 -1.93 -0.30 117.51 126.03 1wqa h ILE 154 Ca 0.00 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 1wqa h ILE 154 Cb 0.59 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 1wqa h ILE 154 CO 0.00 0.00 0.06 0.50 -0.69 0.00 0.00 178.15 178.02 1wqa h LYS 155 N -0.57 0.23 -0.98 2.37 3.64 -1.96 -1.30 116.57 118.00 1wqa h LYS 155 Ca -0.03 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1wqa h LYS 155 Cb 0.49 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.21 1wqa h LYS 155 CO 0.01 0.33 0.63 -1.35 -2.27 0.00 0.00 179.45 176.80 1wqa h PRO 156 N 0.08 1.11 -0.09 1.90 0.11 -1.84 0.26 132.00 133.53 1wqa h PRO 156 Ca 0.05 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1wqa h PRO 156 Cb 0.19 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.05 1wqa h PRO 156 CO -0.00 0.73 0.01 -0.92 -0.21 0.00 0.00 178.00 177.61 1wqa h TYR 157 N 1.14 0.16 -0.68 0.65 3.20 -0.90 0.10 116.97 120.65 1wqa h TYR 157 Ca 0.42 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.29 1wqa h TYR 157 Cb 0.17 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 1wqa h TYR 157 CO -0.00 0.39 0.44 0.82 -1.64 0.00 0.00 178.16 178.16 1wqa h ILE 158 N -0.11 1.13 -0.30 1.81 2.04 -0.81 -1.82 117.51 119.46 1wqa h ILE 158 Ca 0.03 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.51 1wqa h ILE 158 Cb 0.32 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1wqa h ILE 158 CO 0.00 0.16 -0.12 -0.33 0.00 0.00 0.00 178.15 177.86 1wqa h GLU 159 N 0.87 0.51 -0.51 2.37 4.39 -0.81 -1.45 114.58 119.95 1wqa h GLU 159 Ca 0.26 -0.15 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 1wqa h GLU 159 Cb -0.04 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.54 1wqa h GLU 159 CO -0.08 0.63 0.11 0.00 -1.16 0.00 0.00 179.01 178.51 1wqa h ALA 160 N 1.40 1.23 -0.08 3.43 0.00 -0.15 -1.79 119.26 123.30 1wqa h ALA 160 Ca 0.09 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1wqa h ALA 160 Cb 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1wqa h ALA 160 CO 0.03 0.53 -0.30 0.82 0.00 0.00 0.00 179.25 180.33 1wqa h ILE 161 N 0.76 1.41 -0.87 0.00 2.04 -1.07 -3.29 117.51 116.49 1wqa h ILE 161 Ca 0.17 -1.67 0.08 0.00 1.00 0.00 0.00 64.86 64.43 1wqa h ILE 161 Cb 0.30 2.25 -0.07 0.00 -0.74 0.00 0.00 36.82 38.57 1wqa h ILE 161 CO 0.00 0.48 0.53 0.11 0.00 0.00 0.00 178.15 179.28 1wqa h LYS 162 N -0.12 0.92 0.00 2.37 1.57 -1.10 -1.44 116.57 118.76 1wqa h LYS 162 Ca -0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1wqa h LYS 162 Cb 0.93 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1wqa h LYS 162 CO 0.06 0.61 0.05 -1.13 -0.57 0.00 0.00 179.45 178.47 1wqa n SER 163 N -4.64 0.45 0.03 0.86 3.41 -0.69 -1.71 113.62 111.32 1wqa n SER 163 Ca 0.13 0.69 0.11 0.00 -0.26 0.00 0.00 58.87 59.55 1wqa n SER 163 Cb 0.22 -0.73 0.06 0.00 -0.26 0.00 0.00 64.21 63.49 1wqa n SER 163 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wqa n LYS 164 N -2.11 0.25 -4.57 4.33 4.01 -0.54 -4.98 118.16 114.56 1wqa n LYS 164 Ca -0.01 0.01 -0.26 0.00 -0.51 0.00 0.00 58.31 57.53 1wqa n LYS 164 Cb 0.07 -1.60 -0.11 0.00 -0.51 0.00 0.00 35.03 32.89 1wqa n LYS 164 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 1wqa s VAL 165 N -3.17 2.01 -1.21 -0.18 -7.23 -0.70 -5.06 120.40 104.86 1wqa s VAL 165 Ca 0.05 -2.08 -0.18 0.00 -1.81 0.00 0.00 61.98 57.96 1wqa s VAL 165 Cb 0.15 -2.83 0.09 0.00 0.56 0.00 0.00 36.38 34.35 1wqa s VAL 165 CO 0.78 -0.09 1.60 -0.62 -0.31 0.00 0.00 175.10 176.46 1wqa s ASP 166 N -3.64 6.82 0.26 4.85 -1.08 -1.26 -4.85 116.67 117.77 1wqa s ASP 166 Ca 0.34 -2.37 -0.05 0.00 -0.52 0.00 0.00 52.55 49.95 1wqa s ASP 166 Cb 0.07 -2.53 0.31 0.00 -1.46 0.00 0.00 42.92 39.31 1wqa s ASP 166 CO 0.17 -1.14 1.94 0.58 0.52 0.00 0.00 175.17 177.24 1wqa h VAL 167 N 5.61 1.24 -0.79 1.11 2.07 -1.88 -2.44 116.25 121.16 1wqa h VAL 167 Ca 0.36 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1wqa h VAL 167 Cb 0.90 -0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1wqa h VAL 167 CO 1.39 0.24 0.48 -0.33 0.02 0.00 0.00 177.57 179.36 1wqa h GLU 168 N 1.30 1.08 -0.78 1.57 4.39 -1.88 0.14 114.58 120.39 1wqa h GLU 168 Ca 0.36 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.94 1wqa h GLU 168 Cb -0.13 -0.23 -0.04 0.00 -0.10 0.00 0.00 28.75 28.26 1wqa h GLU 168 CO -0.08 0.76 0.40 0.00 -1.16 0.00 0.00 179.01 178.93 1wqa h ALA 169 N 1.25 1.00 -0.13 3.43 0.00 -1.84 -0.18 119.26 122.79 1wqa h ALA 169 Ca 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1wqa h ALA 169 Cb -0.04 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 1wqa h ALA 169 CO -0.05 0.54 -0.03 0.82 0.00 0.00 0.00 179.25 180.52 1wqa h ILE 170 N 1.09 1.29 -0.82 0.00 2.04 -0.94 -2.40 117.51 117.77 1wqa h ILE 170 Ca 0.27 -0.98 0.05 0.00 1.00 0.00 0.00 64.86 65.20 1wqa h ILE 170 Cb 0.07 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.77 1wqa h ILE 170 CO -0.04 0.28 0.54 0.11 0.00 0.00 0.00 178.15 179.04 1wqa h LYS 171 N -0.05 0.93 -0.63 2.37 1.57 -0.53 0.38 116.57 120.60 1wqa h LYS 171 Ca 0.03 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1wqa h LYS 171 Cb 0.46 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1wqa h LYS 171 CO 0.01 0.62 0.33 -0.22 -0.57 0.00 0.00 179.45 179.62 1wqa h LYS 172 N 0.96 0.89 0.06 3.15 3.64 -0.83 -2.96 116.57 121.47 1wqa h LYS 172 Ca 0.34 -0.11 -0.24 0.00 -1.27 0.00 0.00 60.65 59.37 1wqa h LYS 172 Cb 0.13 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1wqa h LYS 172 CO -0.11 0.69 -1.07 -0.09 -2.27 0.00 0.00 179.45 176.59 1wqa h ARG 173 N 0.86 0.18 -5.97 1.90 1.12 -0.84 -3.49 114.38 108.14 1wqa h ARG 173 Ca 0.22 -0.27 -0.34 0.00 -1.11 0.00 0.00 59.98 58.48 1wqa h ARG 173 Cb 0.07 0.10 0.10 0.00 -0.01 0.00 0.00 29.97 30.22 1wqa h ARG 173 CO -0.03 1.09 -0.81 1.17 -3.11 0.00 0.00 179.97 178.27 1wqa n LYS 174 N -3.52 -1.49 -2.04 0.20 4.81 0.13 -4.92 118.16 111.32 1wqa n LYS 174 Ca -0.05 0.71 -0.36 0.00 -0.87 0.00 0.00 58.31 57.73 1wqa n LYS 174 Cb 0.94 -4.60 0.03 0.00 0.02 0.00 0.00 35.03 31.41 1wqa n LYS 174 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1wqa s PRO 175 N -5.15 3.13 -0.46 1.64 0.04 -1.26 -4.55 135.00 128.38 1wqa s PRO 175 Ca 0.38 1.85 -0.15 0.00 0.04 0.00 0.00 61.00 63.13 1wqa s PRO 175 Cb -0.11 -2.04 0.07 0.00 0.04 0.00 0.00 34.50 32.46 1wqa s PRO 175 CO 0.82 -1.08 0.38 0.12 0.04 0.00 0.00 177.00 177.27 1wqa s PHE 176 N -1.56 3.26 -0.09 0.56 5.36 -1.26 -0.93 117.98 123.31 1wqa s PHE 176 Ca 0.74 -1.01 0.01 0.00 -0.96 0.00 0.00 56.93 55.72 1wqa s PHE 176 Cb -0.31 -3.14 -0.02 0.00 -0.34 0.00 0.00 43.02 39.21 1wqa s PHE 176 CO 0.35 -0.80 -0.13 0.08 -1.46 0.00 0.00 175.22 173.26 1wqa s VAL 177 N 1.61 3.15 -0.15 3.12 1.01 -0.49 -0.87 120.40 127.78 1wqa s VAL 177 Ca 0.04 -0.66 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 1wqa s VAL 177 Cb -0.24 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1wqa s VAL 177 CO 0.06 0.56 0.01 -0.69 0.00 0.00 0.00 175.10 175.04 1wqa s VAL 178 N -0.22 4.32 -0.02 2.92 1.01 -0.95 -2.57 120.40 124.89 1wqa s VAL 178 Ca 0.01 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.82 1wqa s VAL 178 Cb -0.13 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1wqa s VAL 178 CO 0.03 0.51 -0.14 -0.69 0.00 0.00 0.00 175.10 174.81 1wqa s VAL 179 N 0.04 1.14 -0.20 2.92 1.01 -0.29 -0.47 120.40 124.56 1wqa s VAL 179 Ca 0.03 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.41 1wqa s VAL 179 Cb -0.13 -0.96 0.04 0.00 0.00 0.00 0.00 36.38 35.33 1wqa s VAL 179 CO 0.02 0.33 -0.14 -0.62 0.00 0.00 0.00 175.10 174.69 1wqa s ASP 180 N -0.27 3.49 -0.05 3.32 -1.08 0.13 -0.24 116.67 121.97 1wqa s ASP 180 Ca 0.04 -0.90 0.20 0.00 -0.52 0.00 0.00 52.55 51.37 1wqa s ASP 180 Cb -0.06 -1.37 0.65 0.00 -1.46 0.00 0.00 42.92 40.68 1wqa s ASP 180 CO -0.00 -0.11 1.55 0.35 0.52 0.00 0.00 175.17 177.49 1wqa n THR 181 N 4.62 1.40 -4.21 1.71 -2.24 -1.19 -1.22 114.28 113.15 1wqa n THR 181 Ca -0.16 -1.11 -0.34 0.00 -2.27 0.00 0.00 64.05 60.17 1wqa n THR 181 Cb 0.47 0.32 -0.04 0.00 -2.10 0.00 0.00 70.33 68.98 1wqa n THR 181 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1wqa n SER 182 N 1.27 -1.89 -0.89 3.42 2.88 -1.24 -0.50 113.62 116.68 1wqa n SER 182 Ca 0.24 -1.07 -0.11 0.00 -1.33 0.00 0.00 58.87 56.60 1wqa n SER 182 Cb 0.73 -2.55 -0.05 0.00 -0.75 0.00 0.00 64.21 61.59 1wqa n SER 182 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1wqa n ASN 183 N -2.74 -4.95 -1.93 -3.46 5.03 0.26 -4.75 115.26 102.71 1wqa n ASN 183 Ca -0.06 0.26 0.00 0.00 0.87 0.00 0.00 54.58 55.65 1wqa n ASN 183 Cb 0.56 -3.79 0.00 0.00 -1.02 0.00 0.00 39.78 35.53 1wqa n ASN 183 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1wqa n GLY 184 N 0.16 1.31 0.33 7.41 0.00 0.35 -1.53 105.19 113.21 1wqa n GLY 184 Ca -0.11 -2.03 0.11 0.00 0.00 0.00 0.00 46.02 43.99 1wqa n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa h ALA 185 N -0.07 2.06 0.00 4.61 0.00 -1.41 -0.56 119.26 123.90 1wqa h ALA 185 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wqa h ALA 185 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1wqa h ALA 185 CO 0.00 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.52 1wqa n GLY 186 N -1.54 -0.83 0.24 0.00 0.00 -1.26 -1.94 105.19 99.86 1wqa n GLY 186 Ca 0.06 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.18 1wqa n GLY 186 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1wqa h SER 187 N 0.00 0.00 0.79 1.61 0.02 -1.32 -1.77 113.55 112.87 1wqa h SER 187 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1wqa h SER 187 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 1wqa h SER 187 CO 0.00 0.18 -0.31 0.18 -1.14 0.00 0.00 176.83 175.73 1wqa n LEU 188 N -3.72 0.38 0.05 5.07 4.77 -0.82 -4.68 117.00 118.05 1wqa n LEU 188 Ca -0.02 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1wqa n LEU 188 Cb 0.29 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1wqa n LEU 188 CO 0.32 0.04 -0.13 0.35 -1.33 0.00 0.00 177.39 176.64 1wqa n THR 189 N -1.64 0.61 -0.24 -5.08 -2.24 -0.99 -4.84 114.28 99.87 1wqa n THR 189 Ca 0.06 0.20 -0.01 0.00 -2.27 0.00 0.00 64.05 62.03 1wqa n THR 189 Cb 0.36 -1.30 0.11 0.00 -2.10 0.00 0.00 70.33 67.40 1wqa n THR 189 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1wqa h LEU 190 N 0.00 0.54 -1.26 3.22 5.85 -1.61 -0.12 115.31 121.93 1wqa h LEU 190 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1wqa h LEU 190 Cb 0.26 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1wqa h LEU 190 CO 0.00 0.34 0.45 -0.65 -0.34 0.00 0.00 178.44 178.24 1wqa h PRO 191 N 0.67 0.96 -0.03 5.25 0.11 -1.83 -1.05 132.00 136.07 1wqa h PRO 191 Ca 0.32 -0.07 -0.15 0.00 0.11 0.00 0.00 66.00 66.21 1wqa h PRO 191 Cb 0.24 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.15 1wqa h PRO 191 CO -0.21 0.65 -0.56 1.88 -0.21 0.00 0.00 178.00 179.55 1wqa h TYR 192 N 0.98 0.63 -0.28 0.65 0.05 -1.73 -2.44 116.97 114.82 1wqa h TYR 192 Ca 0.26 -0.32 0.06 0.00 0.05 0.00 0.00 58.73 58.78 1wqa h TYR 192 Cb -0.08 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 37.53 1wqa h TYR 192 CO 0.00 1.12 -0.07 1.25 -1.05 0.00 0.00 178.16 179.41 1wqa h LEU 193 N -0.04 -0.26 -0.98 3.88 5.85 -0.76 -0.23 115.31 122.77 1wqa h LEU 193 Ca -0.06 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1wqa h LEU 193 Cb 1.25 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 42.41 1wqa h LEU 193 CO 0.11 -0.09 0.59 -0.07 -0.34 0.00 0.00 178.44 178.64 1wqa h LEU 194 N -0.00 1.13 -0.41 2.25 3.38 -1.20 -0.48 115.31 119.99 1wqa h LEU 194 Ca 0.13 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1wqa h LEU 194 Cb 0.21 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1wqa h LEU 194 CO -0.29 0.86 -0.07 -0.09 0.09 0.00 0.00 178.44 178.94 1wqa h ARG 195 N 1.31 0.76 0.00 1.13 2.43 -1.02 -1.14 114.38 117.85 1wqa h ARG 195 Ca 0.34 -0.28 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 1wqa h ARG 195 Cb -0.08 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1wqa h ARG 195 CO -0.07 0.88 -0.26 0.93 -1.51 0.00 0.00 179.97 179.95 1wqa h GLU 196 N 0.58 0.00 0.00 0.20 5.08 -0.60 -1.66 114.58 118.18 1wqa h GLU 196 Ca 0.11 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1wqa h GLU 196 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1wqa h GLU 196 CO 0.03 0.26 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.05 1wqa h LEU 197 N 0.00 0.00 0.00 1.33 3.38 -0.87 -3.47 115.31 115.68 1wqa h LEU 197 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wqa h LEU 197 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1wqa h LEU 197 CO 0.03 0.18 0.00 0.61 0.09 0.00 0.00 178.44 179.35 1wqa n GLY 198 N 0.25 1.59 3.90 0.83 0.00 -0.62 -3.17 105.19 107.98 1wqa n GLY 198 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1wqa n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa s LYS 200 N -4.11 4.31 -0.08 0.00 2.20 -0.11 -4.39 119.74 117.55 1wqa s LYS 200 Ca 0.46 0.68 0.04 0.00 -0.36 0.00 0.00 55.97 56.79 1wqa s LYS 200 Cb -0.10 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 1wqa s LYS 200 CO 0.36 -0.06 -0.20 0.08 -0.36 0.00 0.00 175.35 175.16 1wqa s VAL 201 N 1.30 1.76 -0.03 4.02 1.01 -1.26 -1.40 120.40 125.80 1wqa s VAL 201 Ca 0.31 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.50 1wqa s VAL 201 Cb -0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 1wqa s VAL 201 CO 0.13 0.49 -0.21 -0.63 0.00 0.00 0.00 175.10 174.88 1wqa s ILE 202 N 0.37 1.72 0.15 2.22 -1.09 -1.06 -5.04 121.20 118.47 1wqa s ILE 202 Ca -0.16 -0.91 0.10 0.00 -2.23 0.00 0.00 60.65 57.45 1wqa s ILE 202 Cb -0.17 -1.45 -0.04 0.00 -1.58 0.00 0.00 42.46 39.23 1wqa s ILE 202 CO 0.07 0.49 -0.22 0.42 -1.23 0.00 0.00 174.94 174.47 1wqa s THR 203 N -0.30 2.01 -0.08 2.92 -4.23 -1.26 -1.13 115.64 113.56 1wqa s THR 203 Ca 0.03 -1.84 0.01 0.00 -1.18 0.00 0.00 61.69 58.71 1wqa s THR 203 Cb -0.10 -1.88 0.02 0.00 1.34 0.00 0.00 72.50 71.88 1wqa s THR 203 CO 0.01 -0.14 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.16 1wqa s VAL 204 N -1.59 1.05 -1.37 2.29 1.01 0.66 -4.80 120.40 117.65 1wqa s VAL 204 Ca 0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 1wqa s VAL 204 Cb -0.08 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1wqa s VAL 204 CO 0.07 0.35 1.15 0.59 0.00 0.00 0.00 175.10 177.26 1wqa n ASN 205 N 4.15 -5.99 -1.00 3.32 3.02 -1.26 -3.18 115.26 114.31 1wqa n ASN 205 Ca -0.20 -0.57 0.07 0.00 -0.03 0.00 0.00 54.58 53.84 1wqa n ASN 205 Cb 0.51 -4.90 0.22 0.00 -0.61 0.00 0.00 39.78 35.00 1wqa n ASN 205 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wqa n ALA 206 N -4.94 2.66 -2.68 5.41 0.00 -1.26 -0.58 120.51 119.13 1wqa n ALA 206 Ca -0.00 -0.93 -0.39 0.00 0.00 0.00 0.00 53.44 52.12 1wqa n ALA 206 Cb 0.56 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.96 1wqa n ALA 206 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1wqa s GLN 207 N -1.55 4.25 0.09 0.00 0.00 -1.26 -4.77 119.66 116.41 1wqa s GLN 207 Ca 0.32 0.47 -0.31 0.00 -0.00 0.00 0.00 55.36 55.84 1wqa s GLN 207 Cb 0.19 -3.52 -0.08 0.00 0.00 0.00 0.00 33.01 29.59 1wqa s GLN 207 CO 0.19 -0.06 1.58 -1.25 0.00 0.00 0.00 175.29 175.74 1wqa s PRO 208 N 1.35 4.22 -0.30 9.60 0.05 -1.26 -4.28 135.00 144.38 1wqa s PRO 208 Ca 0.26 2.27 0.01 0.00 0.05 0.00 0.00 61.00 63.59 1wqa s PRO 208 Cb -0.15 -3.44 0.19 0.00 0.05 0.00 0.00 34.50 31.15 1wqa s PRO 208 CO 0.10 -0.65 0.59 0.34 0.05 0.00 0.00 177.00 177.43 1wqa s ASP 209 N 1.88 -1.41 0.00 6.66 -1.08 -0.58 -5.02 116.67 117.12 1wqa s ASP 209 Ca 0.71 0.66 0.03 0.00 -0.52 0.00 0.00 52.55 53.43 1wqa s ASP 209 Cb -0.40 2.10 0.16 0.00 -1.46 0.00 0.00 42.92 43.33 1wqa s ASP 209 CO 0.31 -0.27 0.97 0.61 0.52 0.00 0.00 175.17 177.31 1wqa n GLY 210 N 5.42 -0.45 0.01 2.66 0.00 -1.12 -0.49 105.19 111.22 1wqa n GLY 210 Ca 0.01 -0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.15 1wqa n GLY 210 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wqa n TYR 211 N -1.34 0.00 -3.91 1.61 4.01 -1.26 -4.30 117.16 111.98 1wqa n TYR 211 Ca 0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.35 1wqa n TYR 211 Cb 0.03 -0.41 0.03 0.00 -0.31 0.00 0.00 39.34 38.68 1wqa n TYR 211 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1wqa n PHE 212 N -1.42 -1.61 -0.27 -0.72 3.72 0.35 -4.85 117.46 112.66 1wqa n PHE 212 Ca 0.08 0.23 0.04 0.00 -0.05 0.00 0.00 57.45 57.75 1wqa n PHE 212 Cb 0.32 -3.05 0.18 0.00 -0.94 0.00 0.00 39.48 35.99 1wqa n PHE 212 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1wqa h PRO 213 N -2.32 0.59 -0.37 -1.08 0.11 -1.93 -2.74 132.00 124.26 1wqa h PRO 213 Ca -0.69 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.38 1wqa h PRO 213 Cb 1.39 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1wqa h PRO 213 CO 0.50 0.39 0.22 0.00 -0.21 0.00 0.00 178.00 178.90 1wqa h ALA 214 N 1.50 0.47 0.00 -0.75 0.00 -1.93 -3.48 119.26 115.06 1wqa h ALA 214 Ca 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1wqa h ALA 214 Cb 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1wqa h ALA 214 CO -0.32 -0.04 0.00 2.89 0.00 0.00 0.00 179.25 181.78 1wqa n ARG 215 N -4.80 0.00 -1.66 0.00 0.00 -1.03 -5.10 116.66 104.07 1wqa n ARG 215 Ca -0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 57.85 57.40 1wqa n ARG 215 Cb 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 32.46 32.49 1wqa n ARG 215 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1wqa n ASN 216 N 0.00 2.54 -2.58 2.89 3.02 -1.26 -4.76 115.26 115.11 1wqa n ASN 216 Ca 0.00 1.15 -0.11 0.00 -0.03 0.00 0.00 54.58 55.59 1wqa n ASN 216 Cb 0.00 -1.41 -0.06 0.00 -0.61 0.00 0.00 39.78 37.70 1wqa n ASN 216 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1wqa n PRO 217 N 1.74 1.35 -4.06 3.52 -0.04 -1.25 -4.80 135.00 131.46 1wqa n PRO 217 Ca 0.11 -0.83 -0.32 0.00 -0.04 0.00 0.00 63.50 62.42 1wqa n PRO 217 Cb 0.31 -2.00 -0.16 0.00 -0.04 0.00 0.00 33.50 31.62 1wqa n PRO 217 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1wqa s GLU 218 N 2.55 2.35 0.00 0.54 2.12 -1.25 -1.85 118.70 123.15 1wqa s GLU 218 Ca 0.35 -1.07 -0.04 0.00 0.36 0.00 0.00 54.97 54.57 1wqa s GLU 218 Cb 0.14 -2.67 -0.18 0.00 0.26 0.00 0.00 34.13 31.68 1wqa s GLU 218 CO -0.01 -0.44 2.89 -2.30 -0.54 0.00 0.00 175.26 174.85 1wqa n PRO 219 N 4.55 1.54 -2.04 4.30 -0.02 -1.26 -4.75 135.00 137.33 1wqa n PRO 219 Ca -0.16 -0.65 -0.30 0.00 -2.02 0.00 0.00 63.50 60.37 1wqa n PRO 219 Cb 0.45 -1.70 0.02 0.00 -0.02 0.00 0.00 33.50 32.24 1wqa n PRO 219 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1wqa s ASN 220 N 2.08 6.07 0.30 2.55 6.03 -1.26 -4.89 114.94 125.82 1wqa s ASN 220 Ca 0.44 1.25 0.05 0.00 -1.03 0.00 0.00 52.86 53.56 1wqa s ASN 220 Cb 0.21 -2.30 0.69 0.00 -3.03 0.00 0.00 41.25 36.81 1wqa s ASN 220 CO 0.00 -0.91 1.80 -0.08 -2.03 0.00 0.00 177.10 175.88 1wqa h GLU 221 N -0.27 0.81 -0.18 3.55 4.81 -1.97 -1.90 114.58 119.43 1wqa h GLU 221 Ca -0.45 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 58.76 1wqa h GLU 221 Cb 1.21 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 1wqa h GLU 221 CO 0.62 0.54 0.02 0.93 -0.73 0.00 0.00 179.01 180.38 1wqa h GLU 222 N 0.83 0.08 0.00 1.92 5.08 -1.96 -2.52 114.58 118.01 1wqa h GLU 222 Ca 0.55 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.91 1wqa h GLU 222 Cb 0.78 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1wqa h GLU 222 CO -0.34 0.05 0.00 -0.91 -1.00 0.00 0.00 179.01 176.81 1wqa h ASN 223 N 0.08 0.00 -0.65 1.42 -0.26 -1.66 -3.01 115.58 111.50 1wqa h ASN 223 Ca 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.82 1wqa h ASN 223 Cb 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.35 1wqa h ASN 223 CO -0.12 0.00 0.00 0.18 -1.06 0.00 0.00 177.43 176.43 1wqa n LEU 224 N -3.04 4.22 -0.10 1.61 4.77 -0.93 -4.56 117.00 118.98 1wqa n LEU 224 Ca 0.00 -2.12 -0.06 0.00 -0.03 0.00 0.00 56.01 53.79 1wqa n LEU 224 Cb 0.28 -0.53 -0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1wqa n LEU 224 CO 0.26 0.83 0.70 0.50 -1.33 0.00 0.00 177.39 178.36 1wqa h LYS 225 N 3.97 -0.17 -0.52 3.23 3.64 -1.39 0.20 116.57 125.52 1wqa h LYS 225 Ca 0.00 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1wqa h LYS 225 Cb 1.21 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1wqa h LYS 225 CO 0.14 -0.11 -0.05 0.93 -2.27 0.00 0.00 179.45 178.08 1wqa h GLU 226 N -0.18 0.96 -0.65 1.90 3.07 -1.87 -2.92 114.58 114.89 1wqa h GLU 226 Ca 0.18 -0.33 0.03 0.00 -0.50 0.00 0.00 59.36 58.74 1wqa h GLU 226 Cb 0.45 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.25 1wqa h GLU 226 CO -0.47 1.00 0.40 0.35 -1.40 0.00 0.00 179.01 178.89 1wqa h PHE 227 N 0.82 0.74 -0.98 4.33 3.57 -1.58 -1.35 116.94 122.50 1wqa h PHE 227 Ca 0.14 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1wqa h PHE 227 Cb 0.60 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 39.04 1wqa h PHE 227 CO 0.04 0.42 0.64 0.52 -2.23 0.00 0.00 178.31 177.71 1wqa h MET 228 N 0.77 1.24 -0.57 1.11 2.86 -0.56 -0.73 114.93 119.06 1wqa h MET 228 Ca 0.26 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.76 1wqa h MET 228 Cb 0.04 -0.28 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 1wqa h MET 228 CO -0.11 0.82 0.09 0.93 1.06 0.00 0.00 176.91 179.70 1wqa h GLU 229 N 1.28 0.94 -0.89 1.72 4.39 -1.19 -2.79 114.58 118.04 1wqa h GLU 229 Ca 0.38 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1wqa h GLU 229 Cb -0.07 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.43 1wqa h GLU 229 CO -0.10 0.90 0.52 0.82 -1.16 0.00 0.00 179.01 179.99 1wqa h ILE 230 N 0.84 1.25 -0.72 3.13 2.04 -0.42 0.17 117.51 123.79 1wqa h ILE 230 Ca 0.17 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.46 1wqa h ILE 230 Cb 0.42 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.48 1wqa h ILE 230 CO 0.01 0.27 0.47 0.58 0.00 0.00 0.00 178.15 179.48 1wqa h VAL 231 N 1.24 1.15 -0.11 1.67 2.07 -0.91 -0.38 116.25 120.98 1wqa h VAL 231 Ca 0.32 -0.32 -0.15 0.00 0.82 0.00 0.00 66.70 67.36 1wqa h VAL 231 Cb -0.01 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 29.89 1wqa h VAL 231 CO -0.06 0.17 -0.53 0.50 0.02 0.00 0.00 177.57 177.68 1wqa h LYS 232 N 0.94 0.55 -0.46 1.57 3.64 -1.17 -2.70 116.57 118.94 1wqa h LYS 232 Ca 0.27 -0.45 0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1wqa h LYS 232 Cb -0.06 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 1wqa h LYS 232 CO -0.08 1.07 0.23 0.00 -2.27 0.00 0.00 179.45 178.40 1wqa h ALA 233 N 0.49 0.58 0.00 5.00 0.00 -0.40 -1.70 119.26 123.23 1wqa h ALA 233 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1wqa h ALA 233 Cb 1.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1wqa h ALA 233 CO 0.11 -0.12 0.00 -0.07 0.00 0.00 0.00 179.25 179.17 1wqa h LEU 234 N 0.46 0.00 0.44 0.00 3.38 -1.14 -3.47 115.31 114.99 1wqa h LEU 234 Ca 0.20 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 1wqa h LEU 234 Cb 0.10 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.88 1wqa h LEU 234 CO -0.14 0.00 -0.30 0.61 0.09 0.00 0.00 178.44 178.70 1wqa n GLY 235 N 0.17 0.05 3.82 0.83 0.00 -0.64 -5.01 105.19 104.41 1wqa n GLY 235 Ca 0.02 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1wqa n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa s ALA 236 N -2.81 2.81 0.36 4.61 0.00 -1.04 -4.95 121.76 120.75 1wqa s ALA 236 Ca 0.13 0.25 0.19 0.00 0.00 0.00 0.00 51.96 52.53 1wqa s ALA 236 Cb -0.06 -3.19 1.02 0.00 0.00 0.00 0.00 23.12 20.90 1wqa s ALA 236 CO 0.16 -0.79 1.92 -0.44 0.00 0.00 0.00 175.76 176.61 1wqa h ASP 237 N 0.20 0.00 0.00 0.00 3.32 -1.35 -3.40 116.42 115.19 1wqa h ASP 237 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1wqa h ASP 237 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1wqa h ASP 237 CO 0.58 0.25 0.00 2.22 -1.72 0.00 0.00 179.24 180.57 1wqa n PHE 238 N -3.86 0.00 -4.42 4.55 1.16 -1.22 -3.43 117.46 110.24 1wqa n PHE 238 Ca -0.02 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.33 1wqa n PHE 238 Cb 0.34 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.10 1wqa n PHE 238 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1wqa s GLY 239 N 0.00 1.71 -0.01 4.97 0.00 0.92 -2.25 107.32 112.66 1wqa s GLY 239 Ca 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 42.97 1wqa s GLY 239 CO 0.00 -1.83 -0.01 0.14 0.00 0.00 0.00 173.10 171.40 1wqa s VAL 240 N -2.42 0.11 -0.00 1.40 1.01 0.39 -1.16 120.40 119.71 1wqa s VAL 240 Ca 0.25 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.29 1wqa s VAL 240 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 1wqa s VAL 240 CO 0.12 0.06 -0.16 0.00 0.00 0.00 0.00 175.10 175.12 1wqa s ALA 241 N 0.34 1.32 0.29 5.51 0.00 0.05 -0.69 121.76 128.58 1wqa s ALA 241 Ca -0.03 -0.71 0.11 0.00 0.00 0.00 0.00 51.96 51.33 1wqa s ALA 241 Cb -0.05 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1wqa s ALA 241 CO -0.01 0.32 -0.12 -0.65 0.00 0.00 0.00 175.76 175.30 1wqa s GLN 242 N -0.48 1.88 0.74 0.00 -0.21 -0.36 -0.06 119.66 121.17 1wqa s GLN 242 Ca 0.06 -1.71 -0.07 0.00 0.02 0.00 0.00 55.36 53.66 1wqa s GLN 242 Cb -0.06 -1.87 0.16 0.00 1.00 0.00 0.00 33.01 32.24 1wqa s GLN 242 CO -0.00 0.29 1.00 -0.40 -2.12 0.00 0.00 175.29 174.06 1wqa n ASP 243 N -0.75 0.70 -0.19 5.90 3.85 -1.24 -4.32 116.55 120.50 1wqa n ASP 243 Ca -0.05 -1.74 -0.01 0.00 -0.71 0.00 0.00 54.79 52.27 1wqa n ASP 243 Cb 0.60 -0.71 0.06 0.00 -1.35 0.00 0.00 41.12 39.73 1wqa n ASP 243 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 1wqa h GLY 244 N -0.97 0.48 -1.85 6.12 0.00 -1.16 -1.76 103.07 103.94 1wqa h GLY 244 Ca -0.33 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1wqa h GLY 244 CO 0.29 -0.21 0.00 2.09 0.00 0.00 0.00 176.54 178.72 1wqa n ASP 245 N -5.35 2.85 -3.25 0.19 3.85 -1.18 -1.17 116.55 112.49 1wqa n ASP 245 Ca 0.07 -1.92 -0.23 0.00 -0.71 0.00 0.00 54.79 51.99 1wqa n ASP 245 Cb 0.31 -0.26 0.04 0.00 -1.35 0.00 0.00 41.12 39.86 1wqa n ASP 245 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1wqa n ALA 246 N 1.08 -1.07 0.01 2.12 0.00 -0.66 -1.07 120.51 120.92 1wqa n ALA 246 Ca 0.18 0.27 -0.02 0.00 0.00 0.00 0.00 53.44 53.88 1wqa n ALA 246 Cb 0.49 -4.09 -0.10 0.00 0.00 0.00 0.00 19.45 15.76 1wqa n ALA 246 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1wqa n ASP 247 N -2.61 0.82 -4.94 0.00 5.75 -1.26 -4.30 116.55 110.01 1wqa n ASP 247 Ca -0.06 0.37 -0.25 0.00 -0.01 0.00 0.00 54.79 54.83 1wqa n ASP 247 Cb 0.59 0.17 -0.03 0.00 -1.03 0.00 0.00 41.12 40.82 1wqa n ASP 247 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1wqa s ARG 248 N -2.84 3.49 -0.07 0.11 0.52 -1.26 0.07 118.95 118.96 1wqa s ARG 248 Ca -0.04 -0.43 -0.03 0.00 -0.52 0.00 0.00 55.73 54.71 1wqa s ARG 248 Cb 0.08 -2.82 0.04 0.00 0.52 0.00 0.00 34.95 32.77 1wqa s ARG 248 CO 0.82 0.36 0.16 0.00 0.02 0.00 0.00 175.30 176.66 1wqa s ALA 249 N -1.97 -0.27 -0.08 2.13 0.00 -1.26 -3.72 121.76 116.58 1wqa s ALA 249 Ca 0.38 0.68 0.03 0.00 0.00 0.00 0.00 51.96 53.05 1wqa s ALA 249 Cb -0.10 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 1wqa s ALA 249 CO 0.30 -0.24 -0.19 0.08 0.00 0.00 0.00 175.76 175.71 1wqa s VAL 250 N 1.41 2.56 -0.02 0.00 1.01 0.91 -4.92 120.40 121.35 1wqa s VAL 250 Ca -0.07 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 1wqa s VAL 250 Cb -0.12 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1wqa s VAL 250 CO -0.06 0.56 0.04 -0.36 0.00 0.00 0.00 175.10 175.28 1wqa s PHE 251 N -0.06 3.21 -0.09 5.22 0.08 -1.26 -0.77 117.98 124.31 1wqa s PHE 251 Ca -0.05 0.18 0.01 0.00 0.12 0.00 0.00 56.93 57.19 1wqa s PHE 251 Cb -0.14 -1.73 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 1wqa s PHE 251 CO 0.04 0.52 -0.12 0.42 -0.10 0.00 0.00 175.22 175.98 1wqa s ILE 252 N -1.10 1.21 1.03 0.64 -1.09 -0.31 -1.31 121.20 120.26 1wqa s ILE 252 Ca 0.20 -0.48 -0.17 0.00 -2.23 0.00 0.00 60.65 57.98 1wqa s ILE 252 Cb -0.12 -1.13 0.22 0.00 -1.58 0.00 0.00 42.46 39.84 1wqa s ILE 252 CO 0.10 0.38 1.23 1.51 -1.23 0.00 0.00 174.94 176.94 1wqa s ASP 253 N 1.02 2.52 0.41 3.58 3.84 -0.54 -0.06 116.67 127.45 1wqa s ASP 253 Ca -0.07 0.46 0.27 0.00 -0.00 0.00 0.00 52.55 53.22 1wqa s ASP 253 Cb -0.15 -0.64 1.49 0.00 -1.38 0.00 0.00 42.92 42.25 1wqa s ASP 253 CO -0.01 -3.12 1.84 1.05 -0.00 0.00 0.00 175.17 174.94 1wqa h GLU 254 N -1.90 0.00 -0.61 2.11 -0.00 -1.78 -0.65 114.58 111.75 1wqa h GLU 254 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.91 1wqa h GLU 254 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.02 1wqa h GLU 254 CO 0.40 0.00 0.00 0.09 -0.00 0.00 0.00 179.01 179.50 1wqa n ASN 255 N -2.46 3.36 -0.47 3.06 3.02 -1.26 -4.47 115.26 116.03 1wqa n ASN 255 Ca -0.02 -2.06 -0.06 0.00 -0.03 0.00 0.00 54.58 52.42 1wqa n ASN 255 Cb 0.04 -0.42 -0.02 0.00 -0.61 0.00 0.00 39.78 38.77 1wqa n ASN 255 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wqa n GLY 256 N 1.39 0.75 3.74 7.41 0.00 -0.25 -4.90 105.19 113.33 1wqa n GLY 256 Ca 0.20 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 1wqa n GLY 256 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wqa s ARG 257 N -2.71 4.30 -0.19 1.61 3.52 -1.25 -4.80 118.95 119.43 1wqa s ARG 257 Ca 0.00 0.53 -0.29 0.00 -0.13 0.00 0.00 55.73 55.84 1wqa s ARG 257 Cb 0.00 -3.40 -0.02 0.00 -1.56 0.00 0.00 34.95 29.98 1wqa s ARG 257 CO 0.00 0.25 1.35 0.12 -0.81 0.00 0.00 175.30 176.21 1wqa s PHE 258 N 0.30 2.63 -0.05 5.12 5.36 -1.26 -1.46 117.98 128.61 1wqa s PHE 258 Ca 0.28 0.83 -0.17 0.00 -0.96 0.00 0.00 56.93 56.91 1wqa s PHE 258 Cb -0.16 -3.70 -0.05 0.00 -0.34 0.00 0.00 43.02 38.77 1wqa s PHE 258 CO 0.13 -2.07 0.47 0.42 -1.46 0.00 0.00 175.22 172.70 1wqa s ILE 259 N 3.95 5.07 0.30 3.12 1.09 -0.43 -4.99 121.20 129.31 1wqa s ILE 259 Ca 0.59 0.95 -0.29 0.00 -1.10 0.00 0.00 60.65 60.80 1wqa s ILE 259 Cb -0.22 -3.80 -0.10 0.00 -1.06 0.00 0.00 42.46 37.29 1wqa s ILE 259 CO 0.20 0.44 1.23 -1.58 -0.10 0.00 0.00 174.94 175.13 1wqa s GLN 260 N -0.17 4.46 0.31 2.79 2.00 -1.26 -4.49 119.66 123.31 1wqa s GLN 260 Ca 0.26 2.05 0.08 0.00 -2.00 0.00 0.00 55.36 55.75 1wqa s GLN 260 Cb -0.16 -3.13 0.84 0.00 0.80 0.00 0.00 33.01 31.36 1wqa s GLN 260 CO 0.12 -0.05 1.74 0.78 -0.50 0.00 0.00 175.29 177.39 1wqa h GLY 261 N 3.78 1.88 2.00 2.59 0.00 -1.83 -0.99 103.07 110.49 1wqa h GLY 261 Ca -0.48 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.52 1wqa h GLY 261 CO 0.67 -0.19 -0.06 1.29 0.00 0.00 0.00 176.54 178.25 1wqa h ASP 262 N 0.63 0.00 -0.08 0.19 2.03 -1.75 -1.19 116.42 116.25 1wqa h ASP 262 Ca 0.63 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.90 1wqa h ASP 262 Cb 1.13 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.63 1wqa h ASP 262 CO -0.45 0.06 -0.07 0.11 -1.03 0.00 0.00 179.24 177.86 1wqa h LYS 263 N 0.00 0.19 -0.08 4.15 1.79 -1.53 0.45 116.57 121.55 1wqa h LYS 263 Ca -0.00 -0.10 -0.09 0.00 -2.18 0.00 0.00 60.65 58.28 1wqa h LYS 263 Cb 0.12 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 1wqa h LYS 263 CO 0.01 0.61 -0.36 1.79 -1.08 0.00 0.00 179.45 180.41 1wqa h THR 264 N -0.22 1.28 -0.28 -0.16 1.35 -1.54 0.16 112.91 113.51 1wqa h THR 264 Ca 0.01 -1.35 -0.00 0.00 -0.55 0.00 0.00 66.41 64.52 1wqa h THR 264 Cb 0.56 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.60 1wqa h THR 264 CO 0.02 0.40 0.16 0.15 -0.25 0.00 0.00 175.52 175.99 1wqa h PHE 265 N 0.14 0.37 -0.56 4.73 3.57 -1.03 -0.31 116.94 123.85 1wqa h PHE 265 Ca 0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1wqa h PHE 265 Cb 0.70 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 1wqa h PHE 265 CO 0.01 0.30 0.36 0.00 -2.23 0.00 0.00 178.31 176.75 1wqa h ALA 266 N 1.04 0.71 -0.35 2.41 0.00 -0.17 0.18 119.26 123.08 1wqa h ALA 266 Ca 0.10 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1wqa h ALA 266 Cb 0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1wqa h ALA 266 CO -0.02 0.16 0.08 1.25 0.00 0.00 0.00 179.25 180.72 1wqa h LEU 267 N 0.76 0.03 -0.28 0.00 5.85 -0.34 0.54 115.31 121.87 1wqa h LEU 267 Ca 0.20 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.89 1wqa h LEU 267 Cb -0.06 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1wqa h LEU 267 CO -0.04 0.05 -0.16 0.58 -0.34 0.00 0.00 178.44 178.53 1wqa h VAL 268 N 0.20 1.30 -0.87 1.05 2.07 -0.56 -2.97 116.25 116.48 1wqa h VAL 268 Ca 0.16 -1.27 0.03 0.00 0.82 0.00 0.00 66.70 66.44 1wqa h VAL 268 Cb 0.18 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1wqa h VAL 268 CO -0.21 0.40 0.57 0.00 0.02 0.00 0.00 177.57 178.36 1wqa h ALA 269 N 0.73 1.44 -0.09 1.67 0.00 -0.32 -0.71 119.26 121.99 1wqa h ALA 269 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1wqa h ALA 269 Cb 0.69 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1wqa h ALA 269 CO 0.05 0.49 0.02 0.22 0.00 0.00 0.00 179.25 180.02 1wqa h ASP 270 N 1.11 0.01 -0.15 0.00 3.58 -0.81 0.18 116.42 120.33 1wqa h ASP 270 Ca 0.34 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.79 1wqa h ASP 270 Cb -0.02 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1wqa h ASP 270 CO -0.09 0.02 0.05 0.00 -2.88 0.00 0.00 179.24 176.34 1wqa h ALA 271 N 1.06 0.20 -0.03 -0.78 0.00 -1.27 -2.13 119.26 116.30 1wqa h ALA 271 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1wqa h ALA 271 Cb 0.03 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1wqa h ALA 271 CO -0.05 -0.19 0.01 0.28 0.00 0.00 0.00 179.25 179.30 1wqa h VAL 272 N 0.07 1.12 -0.29 0.00 2.07 -0.97 -1.68 116.25 116.57 1wqa h VAL 272 Ca 0.05 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1wqa h VAL 272 Cb 0.21 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1wqa h VAL 272 CO -0.00 0.10 0.02 -0.07 0.02 0.00 0.00 177.57 177.63 1wqa h LEU 273 N -0.09 0.40 -0.39 2.57 3.38 -0.69 -1.77 115.31 118.71 1wqa h LEU 273 Ca 0.01 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1wqa h LEU 273 Cb 0.15 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1wqa h LEU 273 CO -0.00 0.46 0.03 0.50 0.09 0.00 0.00 178.44 179.52 1wqa h LYS 274 N 0.43 0.67 -0.48 1.13 3.64 -1.16 0.15 116.57 120.95 1wqa h LYS 274 Ca 0.10 -0.20 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1wqa h LYS 274 Cb 0.26 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 1wqa h LYS 274 CO 0.01 0.75 0.26 0.93 -2.27 0.00 0.00 179.45 179.13 1wqa h GLU 275 N 0.51 0.50 0.00 1.90 5.08 -0.66 -2.24 114.58 119.68 1wqa h GLU 275 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1wqa h GLU 275 Cb 0.42 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1wqa h GLU 275 CO 0.01 0.33 0.00 -0.22 -1.00 0.00 0.00 179.01 178.14 1wqa h LYS 276 N 0.52 0.00 -4.14 2.33 3.64 -1.24 -3.47 116.57 114.20 1wqa h LYS 276 Ca 0.20 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.38 1wqa h LYS 276 Cb 0.08 0.00 0.10 0.00 -0.41 0.00 0.00 32.23 32.00 1wqa h LYS 276 CO -0.12 0.00 -0.45 0.41 -2.27 0.00 0.00 179.45 177.01 1wqa n GLY 277 N 1.09 -0.02 0.00 5.01 0.00 0.45 -4.79 105.19 106.93 1wqa n GLY 277 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1wqa n GLY 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wqa n GLY 278 N -1.13 0.30 0.00 -0.02 0.00 -0.76 -4.93 105.19 98.65 1wqa n GLY 278 Ca -0.14 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1wqa n GLY 278 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wqa n GLY 279 N 0.00 -0.08 2.78 -0.02 0.00 -1.26 -4.69 105.19 101.92 1wqa n GLY 279 Ca 0.00 -2.09 -0.19 0.00 0.00 0.00 0.00 46.02 43.74 1wqa n GLY 279 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wqa s LEU 280 N 0.00 0.85 -0.19 0.99 2.96 -1.26 -1.24 118.68 120.80 1wqa s LEU 280 Ca 0.00 -0.03 -0.08 0.00 -0.22 0.00 0.00 54.13 53.81 1wqa s LEU 280 Cb 0.00 -0.27 -0.04 0.00 0.50 0.00 0.00 46.19 46.38 1wqa s LEU 280 CO 0.00 -0.15 0.07 -0.22 -1.32 0.00 0.00 176.35 174.73 1wqa s LEU 281 N 1.44 3.83 -0.12 -0.68 0.20 -0.23 -0.41 118.68 122.72 1wqa s LEU 281 Ca -0.04 0.08 -0.00 0.00 0.69 0.00 0.00 54.13 54.86 1wqa s LEU 281 Cb -0.13 -1.97 -0.02 0.00 -0.43 0.00 0.00 46.19 43.64 1wqa s LEU 281 CO -0.03 0.17 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.40 1wqa s VAL 282 N 0.41 3.24 0.00 1.68 1.01 -0.42 -1.15 120.40 125.17 1wqa s VAL 282 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1wqa s VAL 282 Cb -0.12 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 33.90 1wqa s VAL 282 CO 0.00 0.53 0.00 1.07 0.00 0.00 0.00 175.10 176.70 1wqa n THR 283 N 3.30 0.00 -3.40 3.92 5.66 -0.39 -1.86 114.28 121.50 1wqa n THR 283 Ca -0.18 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.61 1wqa n THR 283 Cb 0.53 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 1wqa n THR 283 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1wqa s THR 284 N -2.71 2.37 0.22 1.09 -4.23 -1.26 -1.02 115.64 110.10 1wqa s THR 284 Ca 0.00 -1.23 0.33 0.00 -1.18 0.00 0.00 61.69 59.61 1wqa s THR 284 Cb 0.00 -2.60 0.36 0.00 1.34 0.00 0.00 72.50 71.60 1wqa s THR 284 CO 0.00 0.00 2.02 -0.37 -0.54 0.00 0.00 174.62 175.73 1wqa h VAL 285 N 0.69 0.16 -0.01 2.29 -1.51 -1.54 -2.86 116.25 113.47 1wqa h VAL 285 Ca -0.37 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 1wqa h VAL 285 Cb 1.28 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.91 1wqa h VAL 285 CO 0.51 0.05 -0.07 0.00 -1.23 0.00 0.00 177.57 176.83 1wqa n ALA 286 N -2.13 2.73 -1.79 5.19 0.00 -1.26 -4.91 120.51 118.34 1wqa n ALA 286 Ca -0.00 -0.37 -0.37 0.00 0.00 0.00 0.00 53.44 52.69 1wqa n ALA 286 Cb 0.29 -1.23 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 1wqa n ALA 286 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1wqa s THR 287 N -2.19 4.21 0.47 0.00 2.01 -1.08 -4.79 115.64 114.28 1wqa s THR 287 Ca 0.35 1.83 -0.22 0.00 0.31 0.00 0.00 61.69 63.96 1wqa s THR 287 Cb 0.21 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.59 1wqa s THR 287 CO 0.40 0.17 0.86 -0.24 -0.69 0.00 0.00 174.62 175.12 1wqa n SER 288 N 0.64 0.49 0.21 3.53 2.88 -1.26 -4.86 113.62 115.23 1wqa n SER 288 Ca 0.02 0.93 0.14 0.00 -1.33 0.00 0.00 58.87 58.63 1wqa n SER 288 Cb 0.50 -1.29 0.71 0.00 -0.75 0.00 0.00 64.21 63.37 1wqa n SER 288 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 1wqa h ASN 289 N 1.04 0.00 -1.00 -3.46 -0.26 -1.98 -2.28 115.58 107.64 1wqa h ASN 289 Ca -0.45 0.00 0.22 0.00 -0.56 0.00 0.00 56.30 55.52 1wqa h ASN 289 Cb 1.36 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 38.50 1wqa h ASN 289 CO 0.53 0.00 0.59 0.25 -1.06 0.00 0.00 177.43 177.75 1wqa h LEU 290 N 0.00 0.71 -0.99 1.61 5.85 -1.91 0.16 115.31 120.73 1wqa h LEU 290 Ca 0.00 0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.74 1wqa h LEU 290 Cb 0.16 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1wqa h LEU 290 CO 0.00 0.17 -0.37 -0.07 -0.34 0.00 0.00 178.44 177.83 1wqa h LEU 291 N 0.65 0.26 -0.85 2.25 -0.00 -1.77 -1.74 115.31 114.11 1wqa h LEU 291 Ca 0.62 -0.10 -0.09 0.00 -0.00 0.00 0.00 57.88 58.31 1wqa h LEU 291 Cb 1.09 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 41.66 1wqa h LEU 291 CO -0.44 0.62 -0.08 0.44 -0.00 0.00 0.00 178.44 178.98 1wqa h ASP 292 N 0.22 0.75 -0.49 -0.43 3.32 -0.89 -1.24 116.42 117.66 1wqa h ASP 292 Ca 0.02 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 1wqa h ASP 292 Cb 0.76 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1wqa h ASP 292 CO 0.06 0.87 0.17 0.44 -1.72 0.00 0.00 179.24 179.06 1wqa h ASP 293 N 0.70 0.70 -0.60 6.45 3.32 -0.72 -0.30 116.42 125.97 1wqa h ASP 293 Ca 0.13 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.93 1wqa h ASP 293 Cb 0.55 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1wqa h ASP 293 CO 0.03 0.71 0.18 0.40 -1.72 0.00 0.00 179.24 178.84 1wqa h ILE 294 N 0.66 1.25 -0.45 0.35 1.08 -1.05 -1.01 117.51 118.34 1wqa h ILE 294 Ca 0.16 -0.85 -0.06 0.00 -0.39 0.00 0.00 64.86 63.72 1wqa h ILE 294 Cb 0.25 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.64 1wqa h ILE 294 CO -0.01 0.32 0.05 0.00 -0.69 0.00 0.00 178.15 177.82 1wqa h ALA 295 N 1.05 0.60 0.05 1.87 0.00 -0.98 -3.04 119.26 118.81 1wqa h ALA 295 Ca 0.19 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1wqa h ALA 295 Cb 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1wqa h ALA 295 CO -0.00 0.35 -0.08 0.87 0.00 0.00 0.00 179.25 180.39 1wqa h LYS 296 N 0.61 -0.15 -1.33 0.00 1.79 -0.89 0.19 116.57 116.79 1wqa h LYS 296 Ca 0.13 0.01 0.42 0.00 -2.18 0.00 0.00 60.65 59.03 1wqa h LYS 296 Cb 0.42 0.03 -0.12 0.00 -1.58 0.00 0.00 32.23 30.99 1wqa h LYS 296 CO 0.01 -0.10 0.87 -0.22 -1.08 0.00 0.00 179.45 178.93 1wqa h LYS 297 N -0.16 0.11 -0.33 3.15 3.64 -1.07 0.15 116.57 122.06 1wqa h LYS 297 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1wqa h LYS 297 Cb 0.17 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1wqa h LYS 297 CO -0.04 0.07 0.00 0.72 -2.27 0.00 0.00 179.45 177.93 1wqa n HIS 298 N -4.61 0.44 -2.06 1.91 8.25 -0.91 -4.97 115.22 113.27 1wqa n HIS 298 Ca 0.36 -0.45 -0.10 0.00 -0.26 0.00 0.00 57.72 57.27 1wqa n HIS 298 Cb 1.40 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 32.48 1wqa n HIS 298 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wqa n GLY 299 N 0.58 0.13 3.90 -1.41 0.00 0.51 -3.01 105.19 105.89 1wqa n GLY 299 Ca 0.12 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1wqa n GLY 299 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa s ALA 300 N -2.48 3.86 0.69 4.61 0.00 0.57 -4.43 121.76 124.59 1wqa s ALA 300 Ca 0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 1wqa s ALA 300 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 21.09 1wqa s ALA 300 CO 0.00 0.71 1.07 0.15 0.00 0.00 0.00 175.76 177.69 1wqa s LYS 301 N -2.44 3.02 0.02 0.00 1.02 -0.37 -4.29 119.74 116.69 1wqa s LYS 301 Ca 0.37 0.60 0.04 0.00 0.02 0.00 0.00 55.97 57.00 1wqa s LYS 301 Cb -0.13 -2.03 -0.02 0.00 -0.52 0.00 0.00 37.83 35.14 1wqa s LYS 301 CO 0.24 -0.95 -0.13 0.08 -0.92 0.00 0.00 175.35 173.66 1wqa s VAL 302 N -3.26 1.06 -0.06 3.17 1.01 -1.26 -1.06 120.40 119.99 1wqa s VAL 302 Ca 0.57 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.80 1wqa s VAL 302 Cb -0.12 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.34 1wqa s VAL 302 CO 0.53 0.13 -0.19 -0.32 0.00 0.00 0.00 175.10 175.25 1wqa s MET 303 N -0.76 2.14 -0.35 2.72 1.75 -0.30 -4.95 119.30 119.55 1wqa s MET 303 Ca 0.03 -0.66 -0.01 0.00 -1.25 0.00 0.00 55.69 53.80 1wqa s MET 303 Cb -0.07 -1.76 0.09 0.00 2.84 0.00 0.00 34.83 35.93 1wqa s MET 303 CO 0.00 0.20 0.09 1.03 -0.65 0.00 0.00 175.02 175.69 1wqa s ARG 304 N 0.22 2.02 0.75 4.11 1.81 -1.26 -1.27 118.95 125.34 1wqa s ARG 304 Ca -0.10 -1.64 -0.02 0.00 -1.72 0.00 0.00 55.73 52.25 1wqa s ARG 304 Cb -0.14 -3.33 0.14 0.00 -0.45 0.00 0.00 34.95 31.16 1wqa s ARG 304 CO 0.04 -0.88 1.03 0.95 -0.68 0.00 0.00 175.30 175.77 1wqa s THR 305 N 1.12 2.10 0.87 0.02 -4.23 -0.19 -4.61 115.64 110.73 1wqa s THR 305 Ca 0.04 -0.53 -0.11 0.00 -1.18 0.00 0.00 61.69 59.90 1wqa s THR 305 Cb -0.21 -2.57 0.12 0.00 1.34 0.00 0.00 72.50 71.18 1wqa s THR 305 CO -0.04 0.00 1.09 -0.54 -0.54 0.00 0.00 174.62 174.59 1wqa s LYS 306 N -5.23 1.43 0.25 3.99 1.02 -1.26 -1.55 119.74 118.38 1wqa s LYS 306 Ca 0.67 0.89 -0.23 0.00 0.02 0.00 0.00 55.97 57.32 1wqa s LYS 306 Cb -0.05 -1.82 -0.09 0.00 -0.52 0.00 0.00 37.83 35.35 1wqa s LYS 306 CO 0.45 -2.14 0.81 0.08 -0.92 0.00 0.00 175.35 173.63 1wqa s VAL 307 N -2.93 4.42 0.00 3.17 1.01 -1.26 -4.72 120.40 120.09 1wqa s VAL 307 Ca 0.63 1.53 0.00 0.00 0.00 0.00 0.00 61.98 64.14 1wqa s VAL 307 Cb -0.18 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.25 1wqa s VAL 307 CO 0.57 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.51 1wqa n GLY 308 N 0.81 4.12 3.76 4.51 0.00 -1.26 -5.02 105.19 112.11 1wqa n GLY 308 Ca -0.01 -1.06 -0.39 0.00 0.00 0.00 0.00 46.02 44.56 1wqa n GLY 308 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wqa s ASP 309 N 0.00 5.99 0.00 1.61 1.11 -1.26 -3.03 116.67 121.09 1wqa s ASP 309 Ca 0.00 2.66 0.00 0.00 0.18 0.00 0.00 52.55 55.39 1wqa s ASP 309 Cb 0.00 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 41.36 1wqa s ASP 309 CO 0.00 -1.07 0.00 0.18 1.18 0.00 0.00 175.17 175.46 1wqa n LEU 310 N -0.28 0.00 -0.02 1.23 4.77 -1.26 -4.82 117.00 116.62 1wqa n LEU 310 Ca 0.06 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.92 1wqa n LEU 310 Cb 0.44 -0.22 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 1wqa n LEU 310 CO 0.54 0.00 0.74 0.40 -1.33 0.00 0.00 177.39 177.74 1wqa h ILE 311 N 0.00 1.24 -0.29 -0.08 2.04 -1.89 -1.20 117.51 117.33 1wqa h ILE 311 Ca 0.00 -0.76 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 1wqa h ILE 311 Cb 0.00 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1wqa h ILE 311 CO 0.00 0.21 0.18 0.58 0.00 0.00 0.00 178.15 179.12 1wqa h VAL 312 N -0.13 1.09 -0.43 1.67 2.07 -1.87 -0.75 116.25 117.90 1wqa h VAL 312 Ca 0.02 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.38 1wqa h VAL 312 Cb 0.33 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1wqa h VAL 312 CO 0.00 0.09 0.18 0.00 0.02 0.00 0.00 177.57 177.87 1wqa h ALA 313 N 1.08 0.52 -0.67 1.67 0.00 -1.89 0.25 119.26 120.21 1wqa h ALA 313 Ca 0.10 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1wqa h ALA 313 Cb -0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1wqa h ALA 313 CO -0.02 -0.19 0.26 0.00 0.00 0.00 0.00 179.25 179.30 1wqa h ARG 314 N 0.38 1.01 -0.43 0.00 3.08 -1.04 -0.46 114.38 116.92 1wqa h ARG 314 Ca 0.19 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1wqa h ARG 314 Cb 0.14 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1wqa h ARG 314 CO -0.16 0.85 0.08 0.00 -1.07 0.00 0.00 179.97 179.66 1wqa h ALA 315 N 1.11 0.57 -0.51 0.04 0.00 -0.50 0.15 119.26 120.13 1wqa h ALA 315 Ca 0.22 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1wqa h ALA 315 Cb 0.22 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1wqa h ALA 315 CO -0.02 0.28 0.23 -0.07 0.00 0.00 0.00 179.25 179.67 1wqa h LEU 316 N 0.56 0.29 0.52 0.00 3.38 -0.26 -1.58 115.31 118.22 1wqa h LEU 316 Ca 0.13 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 1wqa h LEU 316 Cb 0.36 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.11 1wqa h LEU 316 CO 0.01 0.20 -0.25 0.22 0.09 0.00 0.00 178.44 178.71 1wqa h TYR 317 N 0.44 -0.65 0.00 1.13 3.20 -0.80 0.20 116.97 120.49 1wqa h TYR 317 Ca 0.23 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1wqa h TYR 317 Cb 0.19 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 1wqa h TYR 317 CO -0.13 -0.35 -0.05 0.93 -1.64 0.00 0.00 178.16 176.93 1wqa h GLU 318 N -0.84 0.00 -0.29 1.82 4.39 -0.89 -2.79 114.58 115.98 1wqa h GLU 318 Ca -0.07 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1wqa h GLU 318 Cb 0.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1wqa h GLU 318 CO 0.12 0.05 0.00 0.09 -1.16 0.00 0.00 179.01 178.11 1wqa n ASN 319 N -3.28 2.77 -3.89 1.42 3.02 -0.60 -4.97 115.26 109.74 1wqa n ASN 319 Ca -0.01 -1.89 -0.26 0.00 -0.03 0.00 0.00 54.58 52.39 1wqa n ASN 319 Cb 0.23 -0.19 0.01 0.00 -0.61 0.00 0.00 39.78 39.21 1wqa n ASN 319 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1wqa n ASN 320 N 0.60 -1.92 -4.62 6.41 5.15 -0.51 -4.92 115.26 115.45 1wqa n ASN 320 Ca 0.11 -0.89 -0.29 0.00 -0.60 0.00 0.00 54.58 52.91 1wqa n ASN 320 Cb 0.41 -3.55 0.19 0.00 -0.53 0.00 0.00 39.78 36.30 1wqa n ASN 320 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1wqa s GLY 321 N -4.02 1.59 -0.17 8.20 0.00 0.58 -4.89 107.32 108.62 1wqa s GLY 321 Ca 0.23 -0.03 -0.04 0.00 0.00 0.00 0.00 44.72 44.88 1wqa s GLY 321 CO 0.85 0.55 0.16 2.41 0.00 0.00 0.00 173.10 177.08 1wqa n THR 322 N -4.37 1.68 -3.63 0.90 -1.04 0.46 -4.85 114.28 103.43 1wqa n THR 322 Ca 0.06 -0.61 -0.15 0.00 -2.04 0.00 0.00 64.05 61.31 1wqa n THR 322 Cb 0.55 -1.64 -0.07 0.00 -1.82 0.00 0.00 70.33 67.34 1wqa n THR 322 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1wqa s ILE 323 N -2.54 0.03 0.16 12.58 1.10 -1.09 -4.54 121.20 126.89 1wqa s ILE 323 Ca -0.27 -0.25 -0.05 0.00 -0.51 0.00 0.00 60.65 59.57 1wqa s ILE 323 Cb 0.07 -0.86 -0.03 0.00 0.15 0.00 0.00 42.46 41.80 1wqa s ILE 323 CO 0.71 -0.14 0.18 -0.83 -2.11 0.00 0.00 174.94 172.75 1wqa s GLY 324 N -1.46 0.82 0.00 1.50 0.00 -0.98 -1.30 107.32 105.90 1wqa s GLY 324 Ca -0.10 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.39 1wqa s GLY 324 CO 0.05 -1.11 0.00 0.61 0.00 0.00 0.00 173.10 172.64 1wqa n GLY 325 N -0.18 -1.20 1.55 0.20 0.00 -0.78 -0.87 105.19 103.91 1wqa n GLY 325 Ca -0.05 -0.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 1wqa n GLY 325 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1wqa n GLU 326 N -0.03 0.24 -0.28 1.61 0.28 0.58 -4.14 120.64 118.89 1wqa n GLU 326 Ca 0.00 -1.51 -0.05 0.00 -0.16 0.00 0.00 57.16 55.44 1wqa n GLU 326 Cb 0.00 1.30 -0.00 0.00 1.43 0.00 0.00 31.44 34.17 1wqa n GLU 326 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1wqa h GLU 327 N 0.00 -0.11 -0.28 3.44 3.07 -1.94 0.59 114.58 119.35 1wqa h GLU 327 Ca -0.12 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.75 1wqa h GLU 327 Cb 0.57 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 1wqa h GLU 327 CO 0.17 -0.07 0.00 0.27 -1.40 0.00 0.00 179.01 177.97 1wqa n ASN 328 N -5.42 1.29 0.00 1.42 0.23 -1.26 -3.33 115.26 108.19 1wqa n ASN 328 Ca 0.05 -2.03 0.00 0.00 -0.53 0.00 0.00 54.58 52.08 1wqa n ASN 328 Cb 0.36 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.87 1wqa n ASN 328 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1wqa n GLY 329 N 0.78 1.03 3.78 4.83 0.00 0.20 -3.98 105.19 111.83 1wqa n GLY 329 Ca 0.07 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 1wqa n GLY 329 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wqa n GLY 330 N 0.00 -1.05 3.77 -0.02 0.00 -1.26 -0.30 105.19 106.33 1wqa n GLY 330 Ca 0.00 0.46 -0.38 0.00 0.00 0.00 0.00 46.02 46.09 1wqa n GLY 330 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wqa s VAL 331 N -3.33 3.26 -0.16 1.61 1.01 -1.26 -4.14 120.40 117.38 1wqa s VAL 331 Ca 0.33 1.08 0.01 0.00 0.00 0.00 0.00 61.98 63.40 1wqa s VAL 331 Cb -0.15 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.64 1wqa s VAL 331 CO 0.89 0.12 -0.17 -0.63 0.00 0.00 0.00 175.10 175.31 1wqa s ILE 332 N -1.40 1.83 -0.53 2.22 1.01 -0.05 -3.08 121.20 121.19 1wqa s ILE 332 Ca 0.55 -0.79 -0.14 0.00 0.00 0.00 0.00 60.65 60.27 1wqa s ILE 332 Cb -0.30 -1.68 0.13 0.00 0.01 0.00 0.00 42.46 40.62 1wqa s ILE 332 CO 0.38 0.50 0.46 -0.36 0.00 0.00 0.00 174.94 175.93 1wqa s PHE 333 N 1.38 3.31 0.42 3.97 0.40 -1.26 -2.32 117.98 123.88 1wqa s PHE 333 Ca 0.05 -1.48 0.21 0.00 -0.60 0.00 0.00 56.93 55.11 1wqa s PHE 333 Cb -0.13 -3.72 1.16 0.00 0.51 0.00 0.00 43.02 40.85 1wqa s PHE 333 CO -0.12 -1.01 1.79 -1.35 0.70 0.00 0.00 175.22 175.23 1wqa h PRO 334 N 8.73 0.33 0.00 0.24 0.11 -1.80 0.59 132.00 140.21 1wqa h PRO 334 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1wqa h PRO 334 Cb 1.09 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1wqa h PRO 334 CO 0.98 0.22 0.00 0.93 -0.21 0.00 0.00 178.00 179.92 1wqa h GLU 335 N 0.34 0.00 0.00 1.05 4.39 -1.93 -3.38 114.58 115.05 1wqa h GLU 335 Ca 0.57 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.27 1wqa h GLU 335 Cb 1.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.20 1wqa h GLU 335 CO -0.24 0.00 0.00 1.58 -1.16 0.00 0.00 179.01 179.19 1wqa n HIS 336 N -2.33 0.00 -3.70 4.33 -0.00 0.13 -5.05 115.22 108.59 1wqa n HIS 336 Ca 0.05 0.00 -0.13 0.00 0.46 0.00 0.00 57.72 58.09 1wqa n HIS 336 Cb 0.39 -0.10 -0.09 0.00 -0.12 0.00 0.00 29.99 30.07 1wqa n HIS 336 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 1wqa s VAL 337 N -0.86 -0.00 -1.60 3.57 -7.23 -0.77 -4.92 120.40 108.58 1wqa s VAL 337 Ca 0.00 0.00 -0.10 0.00 -1.81 0.00 0.00 61.98 60.07 1wqa s VAL 337 Cb 0.00 -0.71 -0.07 0.00 0.56 0.00 0.00 36.38 36.16 1wqa s VAL 337 CO 0.00 0.00 2.91 0.18 -0.31 0.00 0.00 175.10 177.88 1wqa n LEU 338 N 2.83 8.68 -3.50 1.32 4.77 -1.26 -4.13 117.00 125.71 1wqa n LEU 338 Ca -0.14 -4.40 -0.10 0.00 -0.03 0.00 0.00 56.01 51.34 1wqa n LEU 338 Cb 0.56 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.08 1wqa n LEU 338 CO 0.10 2.05 0.65 -0.83 -1.33 0.00 0.00 177.39 178.03 1wqa s GLY 339 N 2.06 -0.46 0.12 -0.72 0.00 -1.26 -4.50 107.32 102.56 1wqa s GLY 339 Ca 0.68 1.11 -0.31 0.00 0.00 0.00 0.00 44.72 46.20 1wqa s GLY 339 CO -0.06 0.45 1.75 -1.60 0.00 0.00 0.00 173.10 173.63 1wqa s ARG 340 N -2.81 4.16 -0.35 2.90 3.52 -1.26 -4.53 118.95 120.58 1wqa s ARG 340 Ca 0.03 2.51 -0.00 0.00 -0.13 0.00 0.00 55.73 58.13 1wqa s ARG 340 Cb -0.01 -3.50 0.12 0.00 -1.56 0.00 0.00 34.95 30.00 1wqa s ARG 340 CO -0.07 -0.79 0.16 0.34 -0.81 0.00 0.00 175.30 174.13 1wqa s ASP 341 N 2.34 3.66 0.45 -2.12 -1.08 -1.18 -4.65 116.67 114.09 1wqa s ASP 341 Ca 0.78 -1.94 0.15 0.00 -0.52 0.00 0.00 52.55 51.02 1wqa s ASP 341 Cb -0.45 -0.74 1.09 0.00 -1.46 0.00 0.00 42.92 41.36 1wqa s ASP 341 CO 0.34 -0.36 2.00 1.23 0.52 0.00 0.00 175.17 178.90 1wqa h GLY 342 N 7.59 0.46 0.99 2.66 0.00 -0.55 -2.05 103.07 112.16 1wqa h GLY 342 Ca -0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1wqa h GLY 342 CO 0.43 0.08 0.18 0.00 0.00 0.00 0.00 176.54 177.23 1wqa h ALA 343 N 1.72 0.72 -0.60 3.60 0.00 -1.84 0.14 119.26 123.01 1wqa h ALA 343 Ca 0.25 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1wqa h ALA 343 Cb 0.55 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1wqa h ALA 343 CO -0.06 0.38 0.16 1.98 0.00 0.00 0.00 179.25 181.71 1wqa h MET 344 N 0.77 0.94 -0.56 0.00 -1.53 -1.82 -0.66 114.93 112.06 1wqa h MET 344 Ca 0.18 -0.22 0.01 0.00 -3.44 0.00 0.00 59.70 56.23 1wqa h MET 344 Cb 0.27 -0.13 -0.03 0.00 -0.55 0.00 0.00 31.60 31.17 1wqa h MET 344 CO -0.01 0.86 0.37 1.15 0.14 0.00 0.00 176.91 179.43 1wqa h THR 345 N 0.86 1.14 -0.35 -0.77 2.02 -1.02 -0.74 112.91 114.04 1wqa h THR 345 Ca 0.19 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 1wqa h THR 345 Cb 0.33 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1wqa h THR 345 CO -0.00 0.14 0.20 0.58 0.37 0.00 0.00 175.52 176.81 1wqa h VAL 346 N 0.76 1.13 -0.97 3.16 2.07 -0.44 -0.37 116.25 121.59 1wqa h VAL 346 Ca 0.21 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.43 1wqa h VAL 346 Cb -0.08 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1wqa h VAL 346 CO -0.05 0.13 0.64 0.00 0.02 0.00 0.00 177.57 178.31 1wqa h ALA 347 N 1.07 1.34 -0.35 1.67 0.00 -0.64 0.35 119.26 122.70 1wqa h ALA 347 Ca 0.12 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1wqa h ALA 347 Cb 0.04 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1wqa h ALA 347 CO -0.02 0.58 -0.17 -0.22 0.00 0.00 0.00 179.25 179.42 1wqa h LYS 348 N 1.27 0.73 -0.68 0.00 1.63 -0.87 -1.98 116.57 116.66 1wqa h LYS 348 Ca 0.37 -0.32 -0.04 0.00 -0.85 0.00 0.00 60.65 59.81 1wqa h LYS 348 Cb -0.07 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.51 1wqa h LYS 348 CO -0.10 0.93 0.27 0.28 -3.45 0.00 0.00 179.45 177.38 1wqa h VAL 349 N 0.51 1.24 -0.73 2.00 2.07 -0.61 -0.55 116.25 120.18 1wqa h VAL 349 Ca 0.08 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1wqa h VAL 349 Cb 0.71 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1wqa h VAL 349 CO 0.05 0.31 0.47 0.58 0.02 0.00 0.00 177.57 179.00 1wqa h VAL 350 N 0.97 1.19 -0.16 2.57 2.07 -0.87 0.63 116.25 122.65 1wqa h VAL 350 Ca 0.23 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 1wqa h VAL 350 Cb 0.22 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1wqa h VAL 350 CO -0.02 0.19 0.08 -0.08 0.02 0.00 0.00 177.57 177.76 1wqa h GLU 351 N 0.99 0.23 -0.37 1.57 4.81 -0.94 0.25 114.58 121.11 1wqa h GLU 351 Ca 0.26 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.49 1wqa h GLU 351 Cb -0.09 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 1wqa h GLU 351 CO -0.05 0.27 0.18 0.82 -0.73 0.00 0.00 179.01 179.50 1wqa h ILE 352 N 0.13 0.96 -0.16 2.32 2.04 -0.72 -1.33 117.51 120.76 1wqa h ILE 352 Ca 0.06 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.80 1wqa h ILE 352 Cb 0.12 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1wqa h ILE 352 CO -0.01 0.07 0.05 0.15 0.00 0.00 0.00 178.15 178.41 1wqa h PHE 353 N 0.37 0.10 0.00 1.37 3.57 -0.73 -0.59 116.94 121.02 1wqa h PHE 353 Ca 0.16 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 1wqa h PHE 353 Cb 0.08 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.80 1wqa h PHE 353 CO -0.11 0.05 -0.01 0.00 -2.23 0.00 0.00 178.31 176.01 1wqa h ALA 354 N 1.10 1.63 0.00 2.41 0.00 -0.47 -2.58 119.26 121.34 1wqa h ALA 354 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wqa h ALA 354 Cb 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1wqa h ALA 354 CO -0.07 0.02 -1.35 1.63 0.00 0.00 0.00 179.25 179.48 1wqa n LYS 355 N -4.01 0.54 0.02 0.00 5.02 -0.54 -4.46 118.16 114.72 1wqa n LYS 355 Ca -0.03 -0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.11 1wqa n LYS 355 Cb 0.10 -1.66 -0.01 0.00 -0.02 0.00 0.00 35.03 33.44 1wqa n LYS 355 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1wqa h SER 356 N 0.00 0.67 -0.25 4.39 4.64 -0.70 -3.47 113.55 118.82 1wqa h SER 356 Ca 0.00 -0.44 -0.11 0.00 -0.47 0.00 0.00 61.79 60.77 1wqa h SER 356 Cb 0.93 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.77 1wqa h SER 356 CO 0.00 1.20 -0.10 0.61 -0.87 0.00 0.00 176.83 177.67 1wqa n GLY 357 N 0.60 0.79 3.73 -0.77 0.00 -1.24 -5.01 105.19 103.30 1wqa n GLY 357 Ca -0.05 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 1wqa n GLY 357 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wqa s LYS 358 N -2.27 2.15 0.25 1.61 1.02 -1.26 -5.14 119.74 116.11 1wqa s LYS 358 Ca 0.00 -2.36 -0.09 0.00 0.02 0.00 0.00 55.97 53.54 1wqa s LYS 358 Cb 0.00 -1.48 -0.07 0.00 -0.52 0.00 0.00 37.83 35.77 1wqa s LYS 358 CO 0.00 -0.34 0.56 0.15 -0.92 0.00 0.00 175.35 174.80 1wqa s LYS 359 N -3.85 3.77 0.18 1.68 1.02 -1.26 -4.97 119.74 116.30 1wqa s LYS 359 Ca 0.10 0.23 -0.15 0.00 0.02 0.00 0.00 55.97 56.17 1wqa s LYS 359 Cb 0.02 -2.63 0.15 0.00 -0.52 0.00 0.00 37.83 34.86 1wqa s LYS 359 CO 0.05 0.27 1.67 0.35 -0.92 0.00 0.00 175.35 176.78 1wqa h PHE 360 N 2.29 -0.12 -0.87 3.18 3.57 -1.98 -0.49 116.94 122.51 1wqa h PHE 360 Ca -0.47 0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.23 1wqa h PHE 360 Cb 1.17 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.97 1wqa h PHE 360 CO 0.61 -0.15 0.57 0.66 -2.23 0.00 0.00 178.31 177.77 1wqa h SER 361 N 0.06 0.55 -0.33 0.41 4.64 -1.94 -1.57 113.55 115.37 1wqa h SER 361 Ca 0.23 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.47 1wqa h SER 361 Cb 0.35 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1wqa h SER 361 CO -0.43 0.26 -0.26 -0.33 -0.87 0.00 0.00 176.83 175.21 1wqa h GLU 362 N 0.58 0.76 -0.95 4.77 5.08 -1.50 -0.12 114.58 123.20 1wqa h GLU 362 Ca 0.44 -0.37 0.08 0.00 -1.00 0.00 0.00 59.36 58.51 1wqa h GLU 362 Cb 0.86 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.04 1wqa h GLU 362 CO -0.19 0.99 0.61 -0.07 -1.00 0.00 0.00 179.01 179.36 1wqa h LEU 363 N 0.53 0.93 0.09 1.33 3.38 -0.74 -0.08 115.31 120.75 1wqa h LEU 363 Ca 0.06 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1wqa h LEU 363 Cb 0.82 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1wqa h LEU 363 CO 0.07 0.56 -0.05 0.40 0.09 0.00 0.00 178.44 179.51 1wqa h ILE 364 N 1.03 1.05 0.00 1.22 1.08 -1.24 -3.32 117.51 117.33 1wqa h ILE 364 Ca 0.43 -1.38 -0.01 0.00 -0.39 0.00 0.00 64.86 63.51 1wqa h ILE 364 Cb 0.30 1.82 -0.00 0.00 -3.07 0.00 0.00 36.82 35.86 1wqa h ILE 364 CO -0.18 0.29 -0.07 0.44 -0.69 0.00 0.00 178.15 177.94 1wqa h ASP 365 N -0.85 0.00 0.69 1.72 3.32 -0.85 -1.97 116.42 118.47 1wqa h ASP 365 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1wqa h ASP 365 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1wqa h ASP 365 CO 0.02 0.07 0.00 -0.62 -1.72 0.00 0.00 179.24 176.99 1wqa n GLU 366 N -3.74 0.02 -2.62 3.56 1.02 -0.06 -4.79 120.64 114.03 1wqa n GLU 366 Ca -0.02 0.19 -0.35 0.00 -0.02 0.00 0.00 57.16 56.96 1wqa n GLU 366 Cb 0.17 -1.53 -0.05 0.00 -0.02 0.00 0.00 31.44 30.01 1wqa n GLU 366 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1wqa s LEU 367 N -3.14 3.97 0.10 -4.62 1.43 -0.74 -4.94 118.68 110.74 1wqa s LEU 367 Ca 0.09 1.90 -0.36 0.00 -1.03 0.00 0.00 54.13 54.73 1wqa s LEU 367 Cb 0.12 -4.43 -0.16 0.00 0.03 0.00 0.00 46.19 41.75 1wqa s LEU 367 CO 0.36 -0.57 1.31 -2.65 0.23 0.00 0.00 176.35 175.03 1wqa n PRO 368 N -0.58 1.16 -3.07 1.29 -0.02 -1.26 -4.90 135.00 127.62 1wqa n PRO 368 Ca 0.07 0.42 -0.39 0.00 -2.02 0.00 0.00 63.50 61.58 1wqa n PRO 368 Cb 0.52 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.91 1wqa n PRO 368 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1wqa s LYS 369 N 0.32 4.43 0.03 -0.52 2.36 -1.26 -4.93 119.74 120.16 1wqa s LYS 369 Ca 0.82 1.01 -0.05 0.00 -2.55 0.00 0.00 55.97 55.20 1wqa s LYS 369 Cb -0.93 -3.20 -0.01 0.00 -1.05 0.00 0.00 37.83 32.64 1wqa s LYS 369 CO 0.48 0.56 0.09 0.71 1.55 0.00 0.00 175.35 178.74 1wqa s TYR 370 N -1.19 0.17 -0.03 4.03 2.02 -1.26 -4.75 117.35 116.34 1wqa s TYR 370 Ca 0.35 -0.43 0.05 0.00 -0.37 0.00 0.00 57.07 56.67 1wqa s TYR 370 Cb -0.21 -0.13 -0.01 0.00 -0.40 0.00 0.00 41.96 41.21 1wqa s TYR 370 CO 0.24 -0.33 -0.17 0.71 -1.57 0.00 0.00 175.55 174.42 1wqa s TYR 371 N -2.23 1.64 0.05 2.71 1.51 -0.50 -5.00 117.35 115.53 1wqa s TYR 371 Ca -0.08 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.59 1wqa s TYR 371 Cb -0.03 -1.09 -0.03 0.00 -0.11 0.00 0.00 41.96 40.70 1wqa s TYR 371 CO -0.03 -0.11 -0.06 1.14 -1.11 0.00 0.00 175.55 175.38 1wqa s GLN 372 N -0.14 0.58 0.05 -0.62 0.00 -1.26 -2.04 119.66 116.23 1wqa s GLN 372 Ca 0.00 -0.92 0.03 0.00 -0.00 0.00 0.00 55.36 54.47 1wqa s GLN 372 Cb -0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 33.01 32.71 1wqa s GLN 372 CO 0.01 0.01 -0.09 0.42 0.00 0.00 0.00 175.29 175.64 1wqa s ILE 373 N -2.15 0.62 0.03 3.63 1.01 -1.06 -5.02 121.20 118.26 1wqa s ILE 373 Ca -0.04 -1.16 0.05 0.00 0.00 0.00 0.00 60.65 59.50 1wqa s ILE 373 Cb -0.05 -0.73 -0.02 0.00 0.01 0.00 0.00 42.46 41.67 1wqa s ILE 373 CO -0.02 -0.39 -0.14 -0.54 0.00 0.00 0.00 174.94 173.85 1wqa s LYS 374 N -1.74 0.95 -0.01 2.79 1.02 -1.26 -2.84 119.74 118.66 1wqa s LYS 374 Ca -0.08 -0.72 -0.16 0.00 0.02 0.00 0.00 55.97 55.04 1wqa s LYS 374 Cb -0.09 -0.96 0.03 0.00 -0.52 0.00 0.00 37.83 36.29 1wqa s LYS 374 CO 0.00 0.24 0.33 0.99 -0.92 0.00 0.00 175.35 176.00 1wqa s THR 375 N -0.78 0.06 -0.06 2.17 2.01 -0.73 -5.01 115.64 113.29 1wqa s THR 375 Ca 0.02 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 61.55 1wqa s THR 375 Cb -0.07 -0.66 0.03 0.00 0.01 0.00 0.00 72.50 71.80 1wqa s THR 375 CO 0.01 -0.25 0.01 -1.59 -0.69 0.00 0.00 174.62 172.11 1wqa s LYS 376 N -1.41 0.45 -0.17 4.92 -2.85 -1.26 0.51 119.74 119.93 1wqa s LYS 376 Ca -0.13 0.17 -0.03 0.00 -1.00 0.00 0.00 55.97 54.98 1wqa s LYS 376 Cb -0.05 -0.86 -0.02 0.00 -2.06 0.00 0.00 37.83 34.85 1wqa s LYS 376 CO 0.04 -0.31 -0.06 1.03 0.10 0.00 0.00 175.35 176.16 1wqa s ARG 377 N 2.00 3.52 0.09 1.78 1.81 -1.26 -4.95 118.95 121.94 1wqa s ARG 377 Ca 0.05 -0.59 -0.31 0.00 -1.72 0.00 0.00 55.73 53.16 1wqa s ARG 377 Cb -0.12 -2.88 -0.08 0.00 -0.45 0.00 0.00 34.95 31.42 1wqa s ARG 377 CO -0.05 0.11 1.50 -1.58 -0.68 0.00 0.00 175.30 174.61 1wqa s HIS 378 N 0.68 2.90 -0.02 -0.53 5.65 -1.26 -1.94 115.29 120.78 1wqa s HIS 378 Ca -0.03 0.68 0.00 0.00 0.25 0.00 0.00 55.06 55.96 1wqa s HIS 378 Cb -0.15 -3.81 0.02 0.00 -1.18 0.00 0.00 32.58 27.46 1wqa s HIS 378 CO 0.02 -3.02 0.01 0.08 -0.65 0.00 0.00 174.74 171.18 1wqa s VAL 379 N 1.79 0.05 0.43 0.89 1.01 0.23 -4.95 120.40 119.85 1wqa s VAL 379 Ca 0.68 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.82 1wqa s VAL 379 Cb -0.38 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1wqa s VAL 379 CO 0.30 0.08 0.25 -1.83 0.00 0.00 0.00 175.10 173.90 1wqa s GLU 380 N 0.67 2.31 3.14 2.72 -1.05 -1.26 -4.14 118.70 121.09 1wqa s GLU 380 Ca -0.06 -1.79 0.00 0.00 -0.15 0.00 0.00 54.97 52.97 1wqa s GLU 380 Cb -0.09 -2.08 0.00 0.00 -0.44 0.00 0.00 34.13 31.52 1wqa s GLU 380 CO -0.02 -0.19 0.00 0.41 0.95 0.00 0.00 175.26 176.42 1wqa n GLY 381 N -1.37 0.17 2.16 -3.83 0.00 -1.26 -4.09 105.19 96.97 1wqa n GLY 381 Ca -0.00 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1wqa n GLY 381 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wqa n ASP 382 N 2.57 4.40 -0.34 1.61 -0.08 -1.26 -4.64 116.55 118.81 1wqa n ASP 382 Ca 0.00 -2.28 0.31 0.00 -1.51 0.00 0.00 54.79 51.31 1wqa n ASP 382 Cb 0.00 -1.13 0.54 0.00 2.34 0.00 0.00 41.12 42.87 1wqa n ASP 382 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1wqa n ARG 383 N 2.77 -0.04 -0.03 -0.67 0.63 -1.26 -0.42 116.66 117.64 1wqa n ARG 383 Ca 0.37 1.12 -0.13 0.00 -0.92 0.00 0.00 57.85 58.28 1wqa n ARG 383 Cb 0.65 -2.10 -0.11 0.00 0.45 0.00 0.00 32.46 31.35 1wqa n ARG 383 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1wqa h HIS 384 N 0.00 0.05 -0.44 -0.14 3.86 -1.95 -3.21 115.15 113.32 1wqa h HIS 384 Ca 0.74 -0.02 0.13 0.00 -1.16 0.00 0.00 60.37 60.05 1wqa h HIS 384 Cb 2.18 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 30.62 1wqa h HIS 384 CO -0.01 0.67 0.34 0.00 0.86 0.00 0.00 177.93 179.80 1wqa h ALA 385 N 0.37 2.33 -0.11 2.45 0.00 -1.13 -0.61 119.26 122.55 1wqa h ALA 385 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1wqa h ALA 385 Cb 0.68 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1wqa h ALA 385 CO 0.01 -0.57 0.06 0.82 0.00 0.00 0.00 179.25 179.57 1wqa h ILE 386 N 0.00 1.08 -0.71 0.00 1.08 -1.47 -1.78 117.51 115.70 1wqa h ILE 386 Ca 0.21 -0.21 0.02 0.00 -0.39 0.00 0.00 64.86 64.49 1wqa h ILE 386 Cb 0.90 1.02 -0.04 0.00 -3.07 0.00 0.00 36.82 35.63 1wqa h ILE 386 CO -0.00 0.07 0.47 0.58 -0.69 0.00 0.00 178.15 178.58 1wqa h VAL 387 N 0.09 1.14 -0.75 1.67 2.07 -1.17 -1.30 116.25 118.00 1wqa h VAL 387 Ca 0.04 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1wqa h VAL 387 Cb 0.06 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 29.95 1wqa h VAL 387 CO -0.01 0.17 0.37 0.78 0.02 0.00 0.00 177.57 178.90 1wqa h ASN 388 N 0.90 0.96 -0.59 0.57 2.35 -1.08 -1.65 115.58 117.05 1wqa h ASN 388 Ca 0.27 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.89 1wqa h ASN 388 Cb -0.01 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.08 1wqa h ASN 388 CO -0.07 0.80 0.25 0.11 -1.65 0.00 0.00 177.43 176.87 1wqa h LYS 389 N 1.06 0.88 -0.82 0.81 1.57 -0.42 -2.20 116.57 117.44 1wqa h LYS 389 Ca 0.26 -0.15 0.08 0.00 -1.87 0.00 0.00 60.65 58.97 1wqa h LYS 389 Cb 0.09 -0.15 -0.07 0.00 0.08 0.00 0.00 32.23 32.19 1wqa h LYS 389 CO -0.04 0.74 0.48 0.28 -0.57 0.00 0.00 179.45 180.34 1wqa h VAL 390 N 0.81 0.94 -0.56 0.50 2.07 -0.70 -0.61 116.25 118.71 1wqa h VAL 390 Ca 0.20 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.46 1wqa h VAL 390 Cb 0.18 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.97 1wqa h VAL 390 CO -0.02 0.15 0.34 0.00 0.02 0.00 0.00 177.57 178.06 1wqa h ALA 391 N 1.44 0.71 0.43 1.67 0.00 -0.74 0.39 119.26 123.16 1wqa h ALA 391 Ca 0.39 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1wqa h ALA 391 Cb 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1wqa h ALA 391 CO -0.23 0.07 -0.21 0.93 0.00 0.00 0.00 179.25 179.81 1wqa h GLU 392 N 0.68 -0.55 -0.74 0.00 5.08 -0.86 -1.41 114.58 116.77 1wqa h GLU 392 Ca 0.22 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.77 1wqa h GLU 392 Cb 0.01 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 29.28 1wqa h GLU 392 CO -0.09 -0.26 0.23 0.52 -1.00 0.00 0.00 179.01 178.41 1wqa h MET 393 N -0.84 0.33 -0.24 2.33 2.86 -1.05 0.66 114.93 118.98 1wqa h MET 393 Ca -0.06 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1wqa h MET 393 Cb 0.56 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 1wqa h MET 393 CO 0.10 0.22 0.06 0.00 1.06 0.00 0.00 176.91 178.34 1wqa h ALA 394 N 1.58 0.25 -0.36 6.32 0.00 -0.82 0.23 119.26 126.46 1wqa h ALA 394 Ca 0.41 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 1wqa h ALA 394 Cb 0.67 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1wqa h ALA 394 CO -0.46 -0.36 0.14 0.00 0.00 0.00 0.00 179.25 178.57 1wqa h ARG 395 N 0.15 0.54 -0.99 0.00 3.08 0.17 0.38 114.38 117.70 1wqa h ARG 395 Ca 0.11 -0.10 0.10 0.00 0.07 0.00 0.00 59.98 60.16 1wqa h ARG 395 Cb 0.10 -0.09 -0.08 0.00 0.08 0.00 0.00 29.97 29.98 1wqa h ARG 395 CO -0.13 0.52 0.63 0.93 -1.07 0.00 0.00 179.97 180.85 1wqa h GLU 396 N 0.43 1.01 -0.78 0.04 4.39 0.76 0.92 114.58 121.35 1wqa h GLU 396 Ca 0.12 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1wqa h GLU 396 Cb 0.19 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1wqa h GLU 396 CO -0.01 0.67 0.00 0.54 -1.16 0.00 0.00 179.01 179.05 1wqa n ARG 397 N -4.57 1.42 -0.43 2.33 1.74 0.77 -4.84 116.66 113.09 1wqa n ARG 397 Ca 0.18 -0.37 0.00 0.00 -0.77 0.00 0.00 57.85 56.88 1wqa n ARG 397 Cb 0.30 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1wqa n ARG 397 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wqa n GLY 398 N 0.19 1.69 3.75 -0.13 0.00 0.32 -5.03 105.19 105.97 1wqa n GLY 398 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1wqa n GLY 398 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wqa s TYR 399 N -3.26 3.62 -0.23 1.61 4.12 0.13 -4.94 117.35 118.39 1wqa s TYR 399 Ca 0.00 1.66 -0.22 0.00 0.02 0.00 0.00 57.07 58.53 1wqa s TYR 399 Cb 0.00 -3.26 -0.02 0.00 -1.52 0.00 0.00 41.96 37.17 1wqa s TYR 399 CO 0.00 -0.51 0.69 0.99 0.02 0.00 0.00 175.55 176.74 1wqa s THR 400 N -0.62 4.95 0.05 -0.71 2.01 -1.26 -3.37 115.64 116.68 1wqa s THR 400 Ca 0.47 1.29 0.08 0.00 0.31 0.00 0.00 61.69 63.84 1wqa s THR 400 Cb -0.30 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 1wqa s THR 400 CO 0.37 0.02 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.41 1wqa s VAL 401 N 2.40 1.83 -0.22 3.82 1.01 -1.26 -0.52 120.40 127.47 1wqa s VAL 401 Ca 0.30 -1.28 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 1wqa s VAL 401 Cb -0.16 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1wqa s VAL 401 CO 0.09 0.25 0.03 -0.62 0.00 0.00 0.00 175.10 174.85 1wqa s ASP 402 N -1.22 4.96 -0.30 3.32 -1.08 -0.30 -4.93 116.67 117.12 1wqa s ASP 402 Ca 0.09 -0.20 0.10 0.00 -0.52 0.00 0.00 52.55 52.01 1wqa s ASP 402 Cb -0.09 -1.87 0.58 0.00 -1.46 0.00 0.00 42.92 40.08 1wqa s ASP 402 CO 0.02 0.02 1.60 0.35 0.52 0.00 0.00 175.17 177.68 1wqa n THR 403 N 4.52 2.68 -0.30 1.71 -2.24 -1.26 -1.32 114.28 118.07 1wqa n THR 403 Ca -0.17 -2.24 0.02 0.00 -2.27 0.00 0.00 64.05 59.39 1wqa n THR 403 Cb 0.52 -0.34 0.15 0.00 -2.10 0.00 0.00 70.33 68.56 1wqa n THR 403 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1wqa h THR 404 N 1.44 0.99 -1.75 4.28 2.02 -1.95 -3.36 112.91 114.57 1wqa h THR 404 Ca 0.26 -0.31 -0.33 0.00 0.77 0.00 0.00 66.41 66.81 1wqa h THR 404 Cb 1.95 0.01 -0.28 0.00 -1.74 0.00 0.00 68.15 68.09 1wqa h THR 404 CO 0.54 0.16 -0.66 -0.62 0.37 0.00 0.00 175.52 175.31 1wqa s ASP 405 N -5.70 0.52 0.00 4.18 -1.08 -1.26 -4.76 116.67 108.56 1wqa s ASP 405 Ca -0.12 -1.66 0.00 0.00 -0.52 0.00 0.00 52.55 50.25 1wqa s ASP 405 Cb 0.19 0.80 0.00 0.00 -1.46 0.00 0.00 42.92 42.45 1wqa s ASP 405 CO 0.79 -0.21 0.00 0.61 0.52 0.00 0.00 175.17 176.87 1wqa n GLY 406 N 3.96 -0.40 3.10 2.66 0.00 -1.26 -4.79 105.19 108.47 1wqa n GLY 406 Ca 0.14 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.41 1wqa n GLY 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wqa s ALA 407 N -1.41 2.47 -0.35 4.61 0.00 -0.22 -4.01 121.76 122.85 1wqa s ALA 407 Ca 0.00 -1.49 0.03 0.00 0.00 0.00 0.00 51.96 50.50 1wqa s ALA 407 Cb 0.00 -1.41 0.10 0.00 0.00 0.00 0.00 23.12 21.81 1wqa s ALA 407 CO 0.00 -0.78 0.07 0.21 0.00 0.00 0.00 175.76 175.27 1wqa s LYS 408 N 1.21 1.55 -0.02 0.00 2.20 -0.44 0.13 119.74 124.37 1wqa s LYS 408 Ca -0.02 -1.87 -0.30 0.00 -0.36 0.00 0.00 55.97 53.42 1wqa s LYS 408 Cb -0.16 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 32.85 1wqa s LYS 408 CO -0.09 -0.96 1.27 0.42 -0.36 0.00 0.00 175.35 175.64 1wqa s ILE 409 N 0.93 4.03 -0.19 5.43 1.01 0.21 -1.15 121.20 131.48 1wqa s ILE 409 Ca 0.11 1.39 -0.08 0.00 0.00 0.00 0.00 60.65 62.07 1wqa s ILE 409 Cb -0.20 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1wqa s ILE 409 CO -0.07 0.01 0.07 -0.63 0.00 0.00 0.00 174.94 174.31 1wqa s ILE 410 N 2.17 4.80 0.21 2.92 -1.09 0.33 -1.56 121.20 128.97 1wqa s ILE 410 Ca 0.59 -0.03 0.11 0.00 -2.23 0.00 0.00 60.65 59.09 1wqa s ILE 410 Cb -0.28 -3.18 -0.04 0.00 -1.58 0.00 0.00 42.46 37.38 1wqa s ILE 410 CO 0.24 0.44 -0.21 -0.36 -1.23 0.00 0.00 174.94 173.82 1wqa s PHE 411 N 0.52 2.16 0.38 3.97 0.40 0.70 -4.45 117.98 121.65 1wqa s PHE 411 Ca 0.04 -0.39 0.20 0.00 -0.60 0.00 0.00 56.93 56.17 1wqa s PHE 411 Cb -0.13 -1.04 1.06 0.00 0.51 0.00 0.00 43.02 43.43 1wqa s PHE 411 CO 0.01 0.50 1.95 1.05 0.70 0.00 0.00 175.22 179.43 1wqa h GLU 412 N 2.98 0.00 0.00 0.44 4.11 -2.01 -2.33 114.58 117.77 1wqa h GLU 412 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1wqa h GLU 412 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1wqa h GLU 412 CO 0.52 0.23 -0.61 -3.47 0.07 0.00 0.00 179.01 175.75 1wqa n ASP 413 N -3.90 0.58 0.00 3.06 -0.08 -1.26 -5.04 116.55 109.91 1wqa n ASP 413 Ca -0.02 -0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 1wqa n ASP 413 Cb 0.32 0.30 0.00 0.00 2.34 0.00 0.00 41.12 44.07 1wqa n ASP 413 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1wqa n GLY 414 N 1.43 -0.67 3.81 0.27 0.00 -0.88 -3.07 105.19 106.09 1wqa n GLY 414 Ca 0.04 -0.41 -0.04 0.00 0.00 0.00 0.00 46.02 45.61 1wqa n GLY 414 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1wqa s TRP 415 N -4.00 -0.05 -0.04 1.61 1.48 -0.29 -0.21 118.94 117.44 1wqa s TRP 415 Ca 0.00 -0.36 -0.00 0.00 -1.06 0.00 0.00 56.10 54.68 1wqa s TRP 415 Cb 0.00 0.69 0.03 0.00 -1.16 0.00 0.00 33.47 33.03 1wqa s TRP 415 CO 0.00 -1.00 0.01 0.08 -4.06 0.00 0.00 176.95 171.98 1wqa s VAL 416 N -2.92 0.18 -0.23 -0.66 1.01 -0.60 -1.62 120.40 115.55 1wqa s VAL 416 Ca 0.15 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.26 1wqa s VAL 416 Cb -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 36.38 36.04 1wqa s VAL 416 CO 0.05 0.18 -0.04 -0.22 0.00 0.00 0.00 175.10 175.07 1wqa s LEU 417 N 1.47 3.02 -0.31 3.92 2.96 0.30 -0.62 118.68 129.42 1wqa s LEU 417 Ca -0.03 -0.55 -0.07 0.00 -0.22 0.00 0.00 54.13 53.25 1wqa s LEU 417 Cb -0.13 -1.72 0.02 0.00 0.50 0.00 0.00 46.19 44.86 1wqa s LEU 417 CO -0.03 -0.06 0.10 -0.69 -1.32 0.00 0.00 176.35 174.35 1wqa s VAL 418 N 1.44 3.97 0.00 1.68 1.01 0.12 -1.03 120.40 127.60 1wqa s VAL 418 Ca 0.04 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 1wqa s VAL 418 Cb -0.15 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 1wqa s VAL 418 CO -0.04 -0.02 -0.00 -0.60 0.00 0.00 0.00 175.10 174.44 1wqa s ARG 419 N 1.48 0.09 -0.08 2.72 3.52 -0.93 -1.05 118.95 124.70 1wqa s ARG 419 Ca 0.01 -0.17 -0.10 0.00 -0.13 0.00 0.00 55.73 55.35 1wqa s ARG 419 Cb -0.18 0.03 -0.05 0.00 -1.56 0.00 0.00 34.95 33.20 1wqa s ARG 419 CO 0.03 -0.02 0.24 0.00 -0.81 0.00 0.00 175.30 174.74 1wqa s ALA 420 N -0.41 3.80 0.32 6.12 0.00 -1.26 -1.56 121.76 128.77 1wqa s ALA 420 Ca -0.05 -0.49 -0.28 0.00 0.00 0.00 0.00 51.96 51.14 1wqa s ALA 420 Cb -0.03 -2.14 -0.10 0.00 0.00 0.00 0.00 23.12 20.86 1wqa s ALA 420 CO -0.00 0.54 1.16 0.45 0.00 0.00 0.00 175.76 177.91 1wqa s SER 421 N -0.94 7.01 0.00 0.00 0.15 -0.94 -4.91 113.70 114.07 1wqa s SER 421 Ca 0.18 2.38 0.25 0.00 0.70 0.00 0.00 55.95 59.46 1wqa s SER 421 Cb -0.14 -2.63 1.26 0.00 -1.71 0.00 0.00 66.02 62.81 1wqa s SER 421 CO 0.07 -0.33 1.84 0.61 1.20 0.00 0.00 173.24 176.63 1wqa n GLY 422 N 0.97 -1.11 0.00 9.45 0.00 -1.26 -4.51 105.19 108.73 1wqa n GLY 422 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1wqa n GLY 422 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wqa n THR 423 N -1.29 0.00 -2.25 2.61 -1.04 -1.26 -5.06 114.28 106.00 1wqa n THR 423 Ca 0.12 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.75 1wqa n THR 423 Cb 0.20 -0.20 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 1wqa n THR 423 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1wqa s GLU 424 N 0.05 3.84 -0.37 -2.82 8.01 -1.26 -4.86 118.70 121.28 1wqa s GLU 424 Ca 0.00 1.82 -0.04 0.00 0.01 0.00 0.00 54.97 56.76 1wqa s GLU 424 Cb 0.00 -2.50 -0.04 0.00 -4.31 0.00 0.00 34.13 27.28 1wqa s GLU 424 CO 0.00 -0.49 1.47 -2.30 0.01 0.00 0.00 175.26 173.95 1wqa n PRO 425 N -0.30 0.84 -4.40 0.39 -0.02 -1.26 -4.32 135.00 125.93 1wqa n PRO 425 Ca 0.06 -0.93 -0.24 0.00 -2.02 0.00 0.00 63.50 60.38 1wqa n PRO 425 Cb 0.47 -2.22 -0.09 0.00 -0.02 0.00 0.00 33.50 31.64 1wqa n PRO 425 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1wqa s ILE 426 N 4.48 2.75 -0.37 4.25 1.01 -1.26 0.75 121.20 132.80 1wqa s ILE 426 Ca 0.20 -2.15 0.12 0.00 0.00 0.00 0.00 60.65 58.82 1wqa s ILE 426 Cb 0.05 -2.60 0.35 0.00 0.01 0.00 0.00 42.46 40.26 1wqa s ILE 426 CO 0.01 -0.32 0.73 0.00 0.00 0.00 0.00 174.94 175.35 1wqa n ILE 427 N -0.79 -0.18 -1.15 2.92 3.06 -0.82 -2.21 119.36 120.19 1wqa n ILE 427 Ca -0.05 -4.55 -0.36 0.00 -2.50 0.00 0.00 62.75 55.29 1wqa n ILE 427 Cb 0.61 -0.29 0.01 0.00 0.54 0.00 0.00 39.64 40.51 1wqa n ILE 427 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1wqa n ARG 428 N 0.31 0.00 -3.85 9.51 1.74 -0.60 -4.34 116.66 119.43 1wqa n ARG 428 Ca 0.25 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 57.08 1wqa n ARG 428 Cb 0.66 -0.93 -0.17 0.00 -1.02 0.00 0.00 32.46 31.00 1wqa n ARG 428 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1wqa s ILE 429 N -1.85 0.69 0.09 0.55 1.01 0.18 -2.18 121.20 119.69 1wqa s ILE 429 Ca 0.52 -0.08 0.09 0.00 0.00 0.00 0.00 60.65 61.19 1wqa s ILE 429 Cb -0.45 -0.77 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 1wqa s ILE 429 CO 0.62 0.31 -0.22 -0.36 0.00 0.00 0.00 174.94 175.29 1wqa s PHE 430 N 1.82 2.45 0.00 3.97 0.40 -0.19 -1.78 117.98 124.65 1wqa s PHE 430 Ca 0.05 -0.32 -0.10 0.00 -0.60 0.00 0.00 56.93 55.96 1wqa s PHE 430 Cb -0.12 -1.36 0.01 0.00 0.51 0.00 0.00 43.02 42.06 1wqa s PHE 430 CO -0.06 0.30 0.19 -1.54 0.70 0.00 0.00 175.22 174.81 1wqa s SER 431 N -1.80 -0.04 -0.09 1.36 1.04 -1.13 0.11 113.70 113.15 1wqa s SER 431 Ca 0.15 -0.13 -0.11 0.00 0.48 0.00 0.00 55.95 56.34 1wqa s SER 431 Cb -0.10 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.29 1wqa s SER 431 CO 0.07 -0.41 0.30 -0.70 0.98 0.00 0.00 173.24 173.47 1wqa s GLU 432 N -1.46 0.43 0.31 4.02 2.12 -0.64 -2.58 118.70 120.90 1wqa s GLU 432 Ca -0.14 0.24 -0.17 0.00 0.36 0.00 0.00 54.97 55.26 1wqa s GLU 432 Cb -0.06 0.20 0.02 0.00 0.26 0.00 0.00 34.13 34.55 1wqa s GLU 432 CO 0.02 -0.08 0.68 0.00 -0.54 0.00 0.00 175.26 175.34 1wqa s ALA 433 N -0.26 -0.76 -1.29 6.30 0.00 -0.86 -1.13 121.76 123.75 1wqa s ALA 433 Ca -0.04 -0.63 0.07 0.00 0.00 0.00 0.00 51.96 51.37 1wqa s ALA 433 Cb -0.03 0.86 0.30 0.00 0.00 0.00 0.00 23.12 24.25 1wqa s ALA 433 CO 0.01 -0.97 1.10 1.63 0.00 0.00 0.00 175.76 177.53 1wqa n LYS 434 N -0.47 2.17 -3.59 0.00 5.02 -1.17 -1.41 118.16 118.70 1wqa n LYS 434 Ca -0.04 -1.18 -0.14 0.00 -2.02 0.00 0.00 58.31 54.93 1wqa n LYS 434 Cb 0.60 -1.55 -0.06 0.00 -0.02 0.00 0.00 35.03 34.00 1wqa n LYS 434 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1wqa s SER 435 N -0.63 -0.63 0.34 4.39 1.04 -1.26 -4.89 113.70 112.06 1wqa s SER 435 Ca 0.21 1.01 0.04 0.00 0.48 0.00 0.00 55.95 57.69 1wqa s SER 435 Cb 0.14 0.95 0.67 0.00 0.10 0.00 0.00 66.02 67.87 1wqa s SER 435 CO 0.10 -0.36 1.93 0.11 0.98 0.00 0.00 173.24 175.99 1wqa h LYS 436 N 3.95 0.83 0.91 4.02 1.57 -1.92 -0.70 116.57 125.23 1wqa h LYS 436 Ca -0.27 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.42 1wqa h LYS 436 Cb 1.16 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 33.29 1wqa h LYS 436 CO 0.20 0.55 -0.46 0.93 -0.57 0.00 0.00 179.45 180.10 1wqa h GLU 437 N 0.85 -1.20 -0.90 3.15 3.07 -1.98 0.48 114.58 118.05 1wqa h GLU 437 Ca 0.36 0.08 0.03 0.00 -0.50 0.00 0.00 59.36 59.33 1wqa h GLU 437 Cb 0.28 0.27 -0.05 0.00 -0.84 0.00 0.00 28.75 28.41 1wqa h GLU 437 CO -0.13 -0.80 0.59 0.87 -1.40 0.00 0.00 179.01 178.14 1wqa h LYS 438 N -1.25 1.09 -0.90 2.33 1.79 -1.93 -0.40 116.57 117.30 1wqa h LYS 438 Ca -0.12 -0.07 0.03 0.00 -2.18 0.00 0.00 60.65 58.31 1wqa h LYS 438 Cb 0.96 -0.25 -0.05 0.00 -1.58 0.00 0.00 32.23 31.31 1wqa h LYS 438 CO 0.19 0.72 0.59 0.00 -1.08 0.00 0.00 179.45 179.87 1wqa h ALA 439 N 1.48 1.19 -0.37 3.86 0.00 -0.86 0.47 119.26 125.03 1wqa h ALA 439 Ca 0.36 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 1wqa h ALA 439 Cb 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1wqa h ALA 439 CO -0.11 0.45 -0.20 0.37 0.00 0.00 0.00 179.25 179.76 1wqa h GLN 440 N 1.14 0.79 0.36 0.00 5.75 0.10 -2.15 115.11 121.11 1wqa h GLN 440 Ca 0.36 -0.36 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 1wqa h GLN 440 Cb -0.00 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 28.52 1wqa h GLN 440 CO -0.12 0.98 -0.25 0.93 -2.65 0.00 0.00 178.83 177.72 1wqa h GLU 441 N 0.58 -0.56 -0.87 1.69 5.08 -0.30 -1.98 114.58 118.22 1wqa h GLU 441 Ca 0.08 0.04 0.21 0.00 -1.00 0.00 0.00 59.36 58.69 1wqa h GLU 441 Cb 0.76 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 30.01 1wqa h GLU 441 CO 0.06 -0.37 0.32 1.88 -1.00 0.00 0.00 179.01 179.89 1wqa h TYR 442 N -0.58 0.52 -0.04 4.33 0.99 -1.01 0.17 116.97 121.34 1wqa h TYR 442 Ca -0.05 0.04 0.02 0.00 2.00 0.00 0.00 58.73 60.75 1wqa h TYR 442 Cb 0.47 -0.09 -0.03 0.00 1.00 0.00 0.00 36.73 38.09 1wqa h TYR 442 CO -0.04 -0.09 -0.10 1.25 -0.00 0.00 0.00 178.16 179.17 1wqa h LEU 443 N 0.33 -0.31 -0.33 3.88 6.46 -1.20 -2.65 115.31 121.49 1wqa h LEU 443 Ca 0.53 0.05 0.03 0.00 -0.12 0.00 0.00 57.88 58.38 1wqa h LEU 443 Cb 1.02 0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 41.06 1wqa h LEU 443 CO -0.56 -0.15 0.12 0.78 -0.62 0.00 0.00 178.44 178.02 1wqa h ASN 444 N -0.16 0.15 -1.12 1.25 2.35 -0.24 -1.38 115.58 116.42 1wqa h ASN 444 Ca 0.05 0.03 0.31 0.00 -0.55 0.00 0.00 56.30 56.15 1wqa h ASN 444 Cb 0.23 0.01 -0.09 0.00 0.05 0.00 0.00 38.32 38.53 1wqa h ASN 444 CO -0.14 0.12 0.75 0.25 -1.65 0.00 0.00 177.43 176.76 1wqa h LEU 445 N 0.27 0.30 0.07 1.61 7.12 -0.88 0.26 115.31 124.06 1wqa h LEU 445 Ca 0.15 0.07 -0.00 0.00 0.13 0.00 0.00 57.88 58.22 1wqa h LEU 445 Cb 0.11 0.03 0.00 0.00 -0.53 0.00 0.00 40.66 40.26 1wqa h LEU 445 CO -0.14 0.02 -0.04 1.23 -0.13 0.00 0.00 178.44 179.39 1wqa h GLY 446 N 0.25 -0.10 0.90 3.75 0.00 -0.97 -2.45 103.07 104.44 1wqa h GLY 446 Ca 0.62 0.04 0.15 0.00 0.00 0.00 0.00 47.33 48.14 1wqa h GLY 446 CO -0.24 -0.04 0.41 -2.22 0.00 0.00 0.00 176.54 174.45 1wqa h ILE 447 N -0.82 0.76 0.31 2.60 2.04 -0.44 -0.20 117.51 121.75 1wqa h ILE 447 Ca -0.01 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 1wqa h ILE 447 Cb 0.61 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1wqa h ILE 447 CO 0.02 0.02 -0.15 -0.08 0.00 0.00 0.00 178.15 177.96 1wqa h GLU 448 N 0.11 -0.40 -0.92 2.37 4.81 -0.58 -2.29 114.58 117.68 1wqa h GLU 448 Ca 0.28 0.03 0.25 0.00 -0.13 0.00 0.00 59.36 59.78 1wqa h GLU 448 Cb 0.95 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.37 1wqa h GLU 448 CO -0.03 -0.26 0.64 -0.07 -0.73 0.00 0.00 179.01 178.55 1wqa h LEU 449 N -0.63 0.16 0.28 1.64 3.38 -1.08 -1.34 115.31 117.73 1wqa h LEU 449 Ca -0.04 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1wqa h LEU 449 Cb 0.32 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1wqa h LEU 449 CO 0.07 0.05 -0.14 0.25 0.09 0.00 0.00 178.44 178.77 1wqa h LEU 450 N 0.16 -0.32 -0.45 1.67 6.46 -1.04 -1.68 115.31 120.11 1wqa h LEU 450 Ca 0.46 -0.19 0.03 0.00 -0.12 0.00 0.00 57.88 58.06 1wqa h LEU 450 Cb 1.55 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 41.53 1wqa h LEU 450 CO -0.08 0.04 0.24 -0.33 -0.62 0.00 0.00 178.44 177.69 1wqa h GLU 451 N -0.73 0.46 0.00 1.25 5.08 -0.68 0.31 114.58 120.26 1wqa h GLU 451 Ca -0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1wqa h GLU 451 Cb 0.49 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1wqa h GLU 451 CO 0.06 0.31 0.00 0.36 -1.00 0.00 0.00 179.01 178.74 1wqa n LYS 452 N -4.88 0.09 0.07 2.33 2.85 -0.62 -1.97 118.16 116.03 1wqa n LYS 452 Ca 0.03 0.33 -0.11 0.00 -1.05 0.00 0.00 58.31 57.51 1wqa n LYS 452 Cb 0.10 -1.67 -0.13 0.00 -0.65 0.00 0.00 35.03 32.67 1wqa n LYS 452 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1wqa h ALA 453 N 2.38 0.28 -0.81 0.58 0.00 0.04 -3.29 119.26 118.45 1wqa h ALA 453 Ca 0.00 -0.94 -0.55 0.00 0.00 0.00 0.00 54.91 53.42 1wqa h ALA 453 Cb 0.30 -0.04 -0.32 0.00 0.00 0.00 0.00 17.79 17.73 1wqa h ALA 453 CO 0.00 1.17 0.10 1.47 0.00 0.00 0.00 179.25 181.99 1wqa n LEU 454 N -3.40 6.11 0.00 0.00 -0.00 -0.83 -5.00 117.00 113.88 1wqa n LEU 454 Ca -0.05 -4.34 0.00 0.00 -0.00 0.00 0.00 56.01 51.62 1wqa n LEU 454 Cb 0.98 -0.69 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 1wqa n LEU 454 CO 0.49 1.65 0.00 -1.54 -0.00 0.00 0.00 177.39 177.99