#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 -0.39 7.00 3.03 0.00 -1.25 -2.67 105.19 110.92 1wqa n GLY 2 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.45 0.00 0.00 1.61 3.00 -1.26 -4.45 118.16 112.62 1wqa n LYS 3 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.26 1wqa n LYS 3 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.59 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 -4.86 3.14 -0.00 -1.20 -4.89 117.00 109.18 1wqa n LEU 4 Ca 0.00 0.62 -0.31 0.00 -0.00 0.00 0.00 56.01 56.31 1wqa n LEU 4 Cb 0.00 -0.12 -0.05 0.00 -0.00 0.00 0.00 43.42 43.26 1wqa n LEU 4 CO 0.00 -0.12 0.47 -0.36 -0.00 0.00 0.00 177.39 177.38 1wqa s PHE 5 N -1.47 3.42 0.00 1.96 0.40 -1.09 -3.39 117.98 117.81 1wqa s PHE 5 Ca 0.00 1.19 0.00 0.00 -0.60 0.00 0.00 56.93 57.52 1wqa s PHE 5 Cb 0.00 -2.54 0.00 0.00 0.51 0.00 0.00 43.02 40.99 1wqa s PHE 5 CO 0.00 -0.06 0.00 0.41 0.70 0.00 0.00 175.22 176.27 1wqa n GLY 6 N -0.94 1.64 0.33 4.36 0.00 0.10 -3.82 105.19 106.86 1wqa n GLY 6 Ca 0.04 -1.80 -0.06 0.00 0.00 0.00 0.00 46.02 44.20 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 1.26 -1.87 2.61 1.35 -1.97 -3.38 112.91 110.92 1wqa h THR 7 Ca 0.00 -0.92 -0.40 0.00 -0.55 0.00 0.00 66.41 64.54 1wqa h THR 7 Cb 0.00 0.51 -0.30 0.00 -1.73 0.00 0.00 68.15 66.63 1wqa h THR 7 CO 0.00 0.36 -0.74 0.12 -0.25 0.00 0.00 175.52 175.00 1wqa s PHE 8 N -5.34 -0.12 0.00 4.73 5.99 -1.26 -4.79 117.98 117.19 1wqa s PHE 8 Ca -0.12 -1.31 0.00 0.00 0.00 0.00 0.00 56.93 55.50 1wqa s PHE 8 Cb 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 43.02 42.76 1wqa s PHE 8 CO 0.84 -0.99 0.00 0.41 -0.00 0.00 0.00 175.22 175.47 1wqa n GLY 9 N 3.42 -2.53 3.11 13.12 0.00 -1.26 -4.84 105.19 116.21 1wqa n GLY 9 Ca 0.20 -1.89 -0.17 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.37 0.87 0.15 1.61 0.11 -0.09 0.00 120.40 122.68 1wqa s VAL 10 Ca 0.00 -1.02 -0.01 0.00 -2.93 0.00 0.00 61.98 58.02 1wqa s VAL 10 Cb 0.00 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 1wqa s VAL 10 CO 0.00 -0.16 0.09 0.00 -3.33 0.00 0.00 175.10 171.70 1wqa s ARG 11 N -1.31 1.01 0.00 1.54 3.03 -1.26 -1.03 118.95 120.93 1wqa s ARG 11 Ca -0.03 -1.47 0.00 0.00 2.03 0.00 0.00 55.73 56.26 1wqa s ARG 11 Cb -0.08 0.26 0.00 0.00 -1.03 0.00 0.00 34.95 34.09 1wqa s ARG 11 CO 0.01 -0.30 0.00 0.41 -1.13 0.00 0.00 175.30 174.29 1wqa n GLY 12 N -0.15 -1.31 3.74 3.88 0.00 -0.53 -4.95 105.19 105.87 1wqa n GLY 12 Ca -0.04 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.41 4.46 0.31 -0.61 1.01 -1.26 -1.34 121.20 121.35 1wqa s ILE 13 Ca 0.00 2.00 -0.29 0.00 0.00 0.00 0.00 60.65 62.36 1wqa s ILE 13 Cb 0.00 -4.29 -0.11 0.00 0.01 0.00 0.00 42.46 38.07 1wqa s ILE 13 CO 0.00 0.36 1.48 0.00 0.00 0.00 0.00 174.94 176.78 1wqa s ALA 14 N -0.23 3.63 0.00 9.38 0.00 0.32 -1.81 121.76 133.05 1wqa s ALA 14 Ca 0.44 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1wqa s ALA 14 Cb -0.23 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.30 1wqa s ALA 14 CO 0.29 -0.88 0.00 0.09 0.00 0.00 0.00 175.76 175.26 1wqa n ASN 15 N 1.54 -3.76 0.00 0.00 5.03 -0.04 -4.81 115.26 113.22 1wqa n ASN 15 Ca 0.05 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.50 1wqa n ASN 15 Cb 0.39 -1.81 0.00 0.00 -1.02 0.00 0.00 39.78 37.35 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 -1.25 0.00 0.02 3.52 1.02 -0.75 -4.86 120.64 118.35 1wqa n GLU 16 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 1wqa n GLU 16 Cb 0.20 0.00 -0.14 0.00 -0.02 0.00 0.00 31.44 31.48 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 -4.70 3.49 3.64 -1.79 -3.39 116.57 114.08 1wqa h LYS 17 Ca 0.00 -0.40 -0.73 0.00 -1.27 0.00 0.00 60.65 58.24 1wqa h LYS 17 Cb 0.00 0.15 -0.19 0.00 -0.41 0.00 0.00 32.23 31.78 1wqa h LYS 17 CO 0.00 1.17 1.13 0.42 -2.27 0.00 0.00 179.45 179.90 1wqa s ILE 18 N -2.52 5.05 0.54 2.00 -1.09 -0.80 -4.80 121.20 119.60 1wqa s ILE 18 Ca -0.15 -2.45 0.07 0.00 -2.23 0.00 0.00 60.65 55.89 1wqa s ILE 18 Cb 0.00 -4.84 0.06 0.00 -1.58 0.00 0.00 42.46 36.10 1wqa s ILE 18 CO 0.80 -1.54 0.75 0.42 -1.23 0.00 0.00 174.94 174.14 1wqa s THR 19 N 1.57 2.48 0.25 2.92 -4.23 -1.26 -0.86 115.64 116.51 1wqa s THR 19 Ca 0.39 -0.90 -0.01 0.00 -1.18 0.00 0.00 61.69 59.99 1wqa s THR 19 Cb -0.04 -2.58 0.05 0.00 1.34 0.00 0.00 72.50 71.26 1wqa s THR 19 CO -0.03 0.00 1.67 -0.65 -0.54 0.00 0.00 174.62 175.07 1wqa h PRO 20 N 0.21 0.60 -0.68 3.99 0.11 -1.93 -1.99 132.00 132.31 1wqa h PRO 20 Ca -0.35 -0.24 -0.04 0.00 0.11 0.00 0.00 66.00 65.47 1wqa h PRO 20 Cb 1.28 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1wqa h PRO 20 CO 0.43 0.81 0.26 0.93 -0.21 0.00 0.00 178.00 180.22 1wqa h GLU 21 N 0.52 1.02 -0.05 1.05 3.07 -1.97 -0.07 114.58 118.16 1wqa h GLU 21 Ca 0.07 -0.19 0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1wqa h GLU 21 Cb 0.73 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1wqa h GLU 21 CO 0.06 0.86 0.01 0.35 -1.40 0.00 0.00 179.01 178.89 1wqa h PHE 22 N 0.97 0.02 -0.65 4.33 3.57 -1.76 -0.60 116.94 122.81 1wqa h PHE 22 Ca 0.22 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.70 1wqa h PHE 22 Cb 0.23 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 1wqa h PHE 22 CO 0.02 0.01 0.29 0.00 -2.23 0.00 0.00 178.31 176.39 1wqa h ALA 23 N 1.04 0.85 -0.40 2.41 0.00 -1.16 -1.39 119.26 120.59 1wqa h ALA 23 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1wqa h ALA 23 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1wqa h ALA 23 CO -0.03 0.44 0.23 1.98 0.00 0.00 0.00 179.25 181.86 1wqa h MET 24 N 0.91 0.56 -0.83 0.00 1.85 -0.76 -1.31 114.93 115.35 1wqa h MET 24 Ca 0.22 -0.06 -0.03 0.00 -0.61 0.00 0.00 59.70 59.22 1wqa h MET 24 Cb 0.16 -0.11 -0.04 0.00 0.43 0.00 0.00 31.60 32.04 1wqa h MET 24 CO -0.02 0.44 0.39 0.87 -0.40 0.00 0.00 176.91 178.19 1wqa h LYS 25 N 0.52 1.21 -0.60 0.39 1.57 -0.87 -0.67 116.57 118.11 1wqa h LYS 25 Ca 0.14 -0.18 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1wqa h LYS 25 Cb 0.04 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 1wqa h LYS 25 CO -0.02 0.93 0.37 0.82 -0.57 0.00 0.00 179.45 180.98 1wqa h ILE 26 N 1.19 1.09 -0.69 1.86 1.08 -0.94 0.71 117.51 121.81 1wqa h ILE 26 Ca 0.28 -0.25 -0.04 0.00 -0.39 0.00 0.00 64.86 64.46 1wqa h ILE 26 Cb 0.13 0.28 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 1wqa h ILE 26 CO -0.03 0.14 0.27 1.23 -0.69 0.00 0.00 178.15 179.06 1wqa h GLY 27 N 0.74 1.11 1.52 5.37 0.00 -0.62 -0.30 103.07 110.89 1wqa h GLY 27 Ca 0.24 -0.61 -0.14 0.00 0.00 0.00 0.00 47.33 46.83 1wqa h GLY 27 CO -0.09 0.57 -0.43 -0.33 0.00 0.00 0.00 176.54 176.26 1wqa h MET 28 N 0.99 0.53 -0.39 4.80 2.86 -0.63 -1.21 114.93 121.88 1wqa h MET 28 Ca 0.23 -0.28 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 1wqa h MET 28 Cb 0.21 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 1wqa h MET 28 CO -0.02 0.86 -0.36 0.00 1.06 0.00 0.00 176.91 178.46 1wqa h ALA 29 N 1.10 0.57 -0.17 6.32 0.00 -0.64 -1.11 119.26 125.33 1wqa h ALA 29 Ca 0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1wqa h ALA 29 Cb 0.93 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1wqa h ALA 29 CO 0.08 0.66 -0.05 0.35 0.00 0.00 0.00 179.25 180.30 1wqa h PHE 30 N 0.76 0.38 -0.93 0.00 3.57 -0.97 -1.94 116.94 117.81 1wqa h PHE 30 Ca 0.07 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 1wqa h PHE 30 Cb 0.95 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.56 1wqa h PHE 30 CO 0.06 0.61 0.58 0.78 -2.23 0.00 0.00 178.31 178.11 1wqa h GLY 31 N 0.05 1.34 0.95 2.40 0.00 -1.22 -0.50 103.07 106.08 1wqa h GLY 31 Ca 0.04 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 46.79 1wqa h GLY 31 CO 0.02 0.52 0.11 -0.84 0.00 0.00 0.00 176.54 176.35 1wqa h THR 32 N 1.28 1.23 -0.37 4.70 2.02 -1.08 -1.71 112.91 118.97 1wqa h THR 32 Ca 0.34 -0.79 0.01 0.00 0.77 0.00 0.00 66.41 66.74 1wqa h THR 32 Cb -0.08 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1wqa h THR 32 CO -0.07 0.28 0.23 0.25 0.37 0.00 0.00 175.52 176.58 1wqa h LEU 33 N 0.56 0.38 -1.03 2.58 5.85 -0.91 0.39 115.31 123.12 1wqa h LEU 33 Ca 0.14 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.90 1wqa h LEU 33 Cb 0.31 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1wqa h LEU 33 CO 0.00 0.28 0.65 -0.07 -0.34 0.00 0.00 178.44 178.95 1wqa h LEU 34 N 0.47 1.05 -0.14 2.25 3.38 -0.88 -0.90 115.31 120.53 1wqa h LEU 34 Ca 0.14 -0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 1wqa h LEU 34 Cb -0.02 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1wqa h LEU 34 CO -0.05 0.70 -0.26 0.11 0.09 0.00 0.00 178.44 179.02 1wqa h LYS 35 N 1.21 0.43 0.00 1.13 1.57 -0.79 -3.13 116.57 116.99 1wqa h LYS 35 Ca 0.41 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1wqa h LYS 35 Cb 0.09 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1wqa h LYS 35 CO -0.15 0.87 -0.04 0.00 -0.57 0.00 0.00 179.45 179.57 1wqa h ARG 36 N 0.04 0.00 0.00 3.15 3.08 -0.45 0.12 114.38 120.32 1wqa h ARG 36 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1wqa h ARG 36 Cb 0.85 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.90 1wqa h ARG 36 CO 0.06 0.04 0.00 0.39 -1.07 0.00 0.00 179.97 179.39 1wqa n GLU 37 N -3.53 0.54 0.00 0.04 1.02 -0.39 -4.85 120.64 113.48 1wqa n GLU 37 Ca -0.02 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1wqa n GLU 37 Cb 0.14 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 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 0.55 1.63 3.31 0.62 0.00 0.38 -5.11 105.19 106.57 1wqa n GLY 38 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.15 3.33 0.10 1.61 0.52 -0.97 -5.00 118.95 118.39 1wqa s ARG 39 Ca 0.00 -0.67 -0.20 0.00 -0.52 0.00 0.00 55.73 54.33 1wqa s ARG 39 Cb 0.00 -2.82 -0.09 0.00 0.52 0.00 0.00 34.95 32.56 1wqa s ARG 39 CO 0.00 -0.06 1.67 -0.22 0.02 0.00 0.00 175.30 176.71 1wqa h LYS 40 N 7.60 0.25 -2.55 3.54 3.11 -1.90 -3.38 116.57 123.24 1wqa h LYS 40 Ca -0.37 -0.04 -0.59 0.00 -2.81 0.00 0.00 60.65 56.85 1wqa h LYS 40 Cb 1.17 -0.05 -0.39 0.00 -1.00 0.00 0.00 32.23 31.97 1wqa h LYS 40 CO 0.59 0.29 -0.88 0.21 -2.81 0.00 0.00 179.45 176.85 1wqa s LYS 41 N -5.72 0.71 0.57 1.90 2.20 -1.26 -4.97 119.74 113.17 1wqa s LYS 41 Ca -0.13 -1.61 -0.20 0.00 -0.36 0.00 0.00 55.97 53.66 1wqa s LYS 41 Cb 0.07 -1.41 -0.05 0.00 -1.51 0.00 0.00 37.83 34.93 1wqa s LYS 41 CO 0.70 -1.26 1.11 -2.30 -0.36 0.00 0.00 175.35 173.24 1wqa n PRO 42 N 3.65 1.18 -4.30 4.03 -0.02 -1.26 -4.71 135.00 133.56 1wqa n PRO 42 Ca 0.17 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.76 1wqa n PRO 42 Cb 0.40 -2.30 -0.15 0.00 -0.02 0.00 0.00 33.50 31.44 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 -2.47 2.68 -0.08 2.45 2.96 -1.26 -0.56 118.68 122.40 1wqa s LEU 43 Ca 0.74 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 54.27 1wqa s LEU 43 Cb -0.43 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.63 1wqa s LEU 43 CO 0.48 0.06 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.69 1wqa s VAL 44 N 0.99 1.63 -0.06 1.68 1.01 0.03 0.51 120.40 126.18 1wqa s VAL 44 Ca -0.01 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 1wqa s VAL 44 Cb -0.15 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 1wqa s VAL 44 CO -0.01 0.46 0.51 -0.69 0.00 0.00 0.00 175.10 175.37 1wqa s VAL 45 N 0.50 5.07 -0.06 2.92 1.01 -0.75 -1.03 120.40 128.05 1wqa s VAL 45 Ca -0.17 1.04 0.03 0.00 0.00 0.00 0.00 61.98 62.88 1wqa s VAL 45 Cb -0.17 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.38 1wqa s VAL 45 CO 0.06 0.39 -0.13 -0.69 0.00 0.00 0.00 175.10 174.73 1wqa s VAL 46 N 0.12 1.20 0.26 2.92 1.01 0.51 -0.64 120.40 125.77 1wqa s VAL 46 Ca 0.28 -0.52 0.02 0.00 0.00 0.00 0.00 61.98 61.75 1wqa s VAL 46 Cb -0.16 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 1wqa s VAL 46 CO 0.13 0.37 0.22 -0.83 0.00 0.00 0.00 175.10 174.98 1wqa s GLY 47 N 0.58 1.78 0.25 4.51 0.00 -0.62 -0.40 107.32 113.41 1wqa s GLY 47 Ca -0.14 -1.82 -0.17 0.00 0.00 0.00 0.00 44.72 42.60 1wqa s GLY 47 CO 0.04 -1.39 0.58 1.09 0.00 0.00 0.00 173.10 173.43 1wqa s ARG 48 N -3.82 1.61 0.00 2.90 1.70 -0.61 -0.54 118.95 120.20 1wqa s ARG 48 Ca 0.39 -1.07 0.00 0.00 -0.47 0.00 0.00 55.73 54.58 1wqa s ARG 48 Cb 0.05 0.54 0.00 0.00 -0.57 0.00 0.00 34.95 34.96 1wqa s ARG 48 CO 0.19 -0.70 0.00 -0.40 -1.08 0.00 0.00 175.30 173.30 1wqa n ASP 49 N -0.41 0.00 -0.36 -2.89 5.68 -0.88 -1.14 116.55 116.55 1wqa n ASP 49 Ca -0.04 -0.04 0.11 0.00 -0.50 0.00 0.00 54.79 54.32 1wqa n ASP 49 Cb 0.61 0.00 0.49 0.00 -1.14 0.00 0.00 41.12 41.07 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 -0.05 0.11 -1.68 2.12 -2.24 -1.26 -4.82 114.28 106.46 1wqa n THR 50 Ca 0.00 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 1wqa n THR 50 Cb 0.00 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 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 -0.08 1.93 0.28 -0.78 1.74 -1.26 -2.61 116.66 115.88 1wqa n ARG 51 Ca 0.17 0.68 0.12 0.00 -0.77 0.00 0.00 57.85 58.05 1wqa n ARG 51 Cb 0.25 -2.28 0.78 0.00 -1.02 0.00 0.00 32.46 30.19 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 2.27 0.71 -0.07 1.55 2.07 -1.85 -1.05 116.25 119.88 1wqa h VAL 52 Ca -0.46 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 66.93 1wqa h VAL 52 Cb 1.30 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1wqa h VAL 52 CO 0.61 0.03 0.00 -1.54 0.02 0.00 0.00 177.57 176.69 1wqa n SER 53 N -4.05 2.02 -0.10 0.57 3.41 -1.26 -4.49 113.62 109.72 1wqa n SER 53 Ca -0.03 -1.69 -0.10 0.00 -0.26 0.00 0.00 58.87 56.79 1wqa n SER 53 Cb 0.12 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 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 0.49 1.00 5.00 0.00 -1.54 -2.50 103.07 110.35 1wqa h GLY 54 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1wqa h GLY 54 CO 0.00 0.26 0.16 -2.09 0.00 0.00 0.00 176.54 174.87 1wqa h GLU 55 N 0.34 0.32 -0.97 4.80 4.81 -1.79 0.53 114.58 122.62 1wqa h GLU 55 Ca 0.10 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1wqa h GLU 55 Cb 0.20 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 1wqa h GLU 55 CO -0.01 0.21 0.60 1.98 -0.73 0.00 0.00 179.01 181.06 1wqa h MET 56 N 0.33 1.30 -0.01 1.92 4.05 -1.84 -1.06 114.93 119.61 1wqa h MET 56 Ca 0.09 -0.11 -0.19 0.00 -0.28 0.00 0.00 59.70 59.21 1wqa h MET 56 Cb -0.03 -0.28 -0.01 0.00 -0.80 0.00 0.00 31.60 30.48 1wqa h MET 56 CO -0.02 0.90 -0.82 -0.07 0.23 0.00 0.00 176.91 177.13 1wqa h LEU 57 N 1.33 0.24 -0.43 3.39 3.38 -1.20 -2.77 115.31 119.25 1wqa h LEU 57 Ca 0.35 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1wqa h LEU 57 Cb -0.08 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1wqa h LEU 57 CO -0.07 0.96 0.10 0.50 0.09 0.00 0.00 178.44 180.02 1wqa h LYS 58 N 0.11 0.70 -0.68 1.13 3.64 -0.51 0.26 116.57 121.23 1wqa h LYS 58 Ca -0.03 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1wqa h LYS 58 Cb 1.42 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 1wqa h LYS 58 CO 0.12 0.71 0.41 0.93 -2.27 0.00 0.00 179.45 179.35 1wqa h GLU 59 N 0.57 0.92 -0.22 1.90 4.39 -1.16 -0.37 114.58 120.60 1wqa h GLU 59 Ca 0.13 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 1wqa h GLU 59 Cb 0.33 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 1wqa h GLU 59 CO 0.00 0.66 0.13 0.00 -1.16 0.00 0.00 179.01 178.64 1wqa h ALA 60 N 1.21 0.29 -0.11 3.43 0.00 -1.18 0.11 119.26 123.00 1wqa h ALA 60 Ca 0.24 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1wqa h ALA 60 Cb -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1wqa h ALA 60 CO -0.05 -0.19 0.05 1.25 0.00 0.00 0.00 179.25 180.32 1wqa h LEU 61 N 0.26 0.14 -0.62 0.00 5.85 -0.73 -1.65 115.31 118.56 1wqa h LEU 61 Ca 0.08 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1wqa h LEU 61 Cb 0.05 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1wqa h LEU 61 CO -0.01 0.23 0.29 0.40 -0.34 0.00 0.00 178.44 179.01 1wqa h ILE 62 N 0.04 1.22 -0.44 4.05 2.04 -0.98 -0.76 117.51 122.67 1wqa h ILE 62 Ca 0.04 -0.63 0.06 0.00 1.00 0.00 0.00 64.86 65.33 1wqa h ILE 62 Cb 0.13 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.64 1wqa h ILE 62 CO -0.00 0.25 0.13 -1.28 0.00 0.00 0.00 178.15 177.25 1wqa h SER 63 N 0.85 0.09 -0.17 1.72 0.87 -0.61 0.56 113.55 116.86 1wqa h SER 63 Ca 0.21 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1wqa h SER 63 Cb 0.13 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1wqa h SER 63 CO -0.03 0.08 0.07 1.23 -0.53 0.00 0.00 176.83 177.66 1wqa h GLY 64 N 0.28 0.22 0.76 5.77 0.00 -0.71 -1.55 103.07 107.84 1wqa h GLY 64 Ca 0.21 -0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.53 1wqa h GLY 64 CO -0.25 0.04 0.19 1.41 0.00 0.00 0.00 176.54 177.93 1wqa h LEU 65 N 0.16 0.26 -0.81 3.11 3.38 -0.55 -2.47 115.31 118.39 1wqa h LEU 65 Ca 0.07 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1wqa h LEU 65 Cb 0.03 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1wqa h LEU 65 CO -0.06 0.19 0.41 -0.07 0.09 0.00 0.00 178.44 178.99 1wqa h LEU 66 N 0.38 1.05 -2.31 1.67 3.38 -0.75 -1.87 115.31 116.86 1wqa h LEU 66 Ca 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1wqa h LEU 66 Cb 0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1wqa h LEU 66 CO -0.14 0.88 -0.04 0.77 0.09 0.00 0.00 178.44 180.00 1wqa h SER 67 N 1.15 0.00 -0.61 -0.43 4.64 -0.84 -0.13 113.55 117.33 1wqa h SER 67 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 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 -0.04 0.04 0.00 1.33 -0.87 0.00 0.00 176.83 177.30 1wqa n VAL 68 N -3.50 2.27 -0.69 0.95 0.24 -0.98 -0.52 118.33 116.11 1wqa n VAL 68 Ca -0.02 -1.32 0.00 0.00 -2.04 0.00 0.00 64.34 60.96 1wqa n VAL 68 Cb 0.16 -0.06 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 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 0.86 0.60 3.89 7.63 0.00 -0.20 -4.46 105.19 113.50 1wqa n GLY 69 Ca 0.27 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.51 6.91 0.01 0.00 -0.00 0.28 -3.96 116.67 118.40 1wqa s ASP 71 Ca 0.22 1.37 0.04 0.00 -0.00 0.00 0.00 52.55 54.19 1wqa s ASP 71 Cb -0.13 -2.41 -0.02 0.00 -0.00 0.00 0.00 42.92 40.37 1wqa s ASP 71 CO 0.12 -0.12 -0.13 -0.69 -0.00 0.00 0.00 175.17 174.35 1wqa s VAL 72 N -1.80 1.06 -0.26 -1.27 1.01 0.18 -0.79 120.40 118.52 1wqa s VAL 72 Ca 0.50 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.70 1wqa s VAL 72 Cb -0.13 -0.93 0.04 0.00 0.00 0.00 0.00 36.38 35.37 1wqa s VAL 72 CO 0.19 0.14 -0.06 -0.63 0.00 0.00 0.00 175.10 174.74 1wqa s ILE 73 N -0.58 2.70 -0.42 2.22 1.01 -0.20 -1.70 121.20 124.23 1wqa s ILE 73 Ca 0.03 -1.25 -0.21 0.00 0.00 0.00 0.00 60.65 59.22 1wqa s ILE 73 Cb -0.06 -2.45 0.02 0.00 0.01 0.00 0.00 42.46 39.97 1wqa s ILE 73 CO 0.00 0.09 0.65 -0.62 0.00 0.00 0.00 174.94 175.07 1wqa s ASP 74 N 1.25 6.35 -0.02 3.58 2.15 0.26 -0.36 116.67 129.89 1wqa s ASP 74 Ca -0.03 -0.20 0.12 0.00 0.43 0.00 0.00 52.55 52.87 1wqa s ASP 74 Cb -0.18 -2.33 0.38 0.00 -0.30 0.00 0.00 42.92 40.49 1wqa s ASP 74 CO -0.04 -0.75 1.30 1.33 -0.17 0.00 0.00 175.17 176.83 1wqa n VAL 75 N 5.82 0.68 -3.26 1.11 0.24 0.46 -1.62 118.33 121.77 1wqa n VAL 75 Ca -0.01 -0.59 0.00 0.00 -2.04 0.00 0.00 64.34 61.70 1wqa n VAL 75 Cb 0.48 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 33.05 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 1.07 2.51 3.65 7.63 0.00 -1.26 -4.60 105.19 114.18 1wqa n GLY 76 Ca 0.14 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 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 5.14 0.00 -0.61 1.01 -1.26 -1.58 121.20 123.91 1wqa s ILE 77 Ca 0.00 0.78 -0.28 0.00 0.00 0.00 0.00 60.65 61.15 1wqa s ILE 77 Cb 0.00 -3.77 0.08 0.00 0.01 0.00 0.00 42.46 38.78 1wqa s ILE 77 CO 0.00 0.18 0.71 0.00 0.00 0.00 0.00 174.94 175.84 1wqa s ALA 78 N 1.74 -1.75 0.52 9.38 0.00 -0.30 -4.94 121.76 126.42 1wqa s ALA 78 Ca 0.20 1.09 -0.21 0.00 0.00 0.00 0.00 51.96 53.04 1wqa s ALA 78 Cb -0.15 0.20 -0.07 0.00 0.00 0.00 0.00 23.12 23.10 1wqa s ALA 78 CO 0.09 -0.50 0.97 -2.30 0.00 0.00 0.00 175.76 174.02 1wqa n PRO 79 N 0.42 1.11 -0.19 0.00 -0.02 -1.26 -4.46 135.00 130.60 1wqa n PRO 79 Ca -0.16 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1wqa n PRO 79 Cb 0.60 -2.11 0.09 0.00 -0.02 0.00 0.00 33.50 32.06 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 0.96 0.52 -0.23 3.45 2.02 -1.35 0.02 112.91 118.30 1wqa h THR 80 Ca -0.47 -0.04 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1wqa h THR 80 Cb 1.35 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1wqa h THR 80 CO 0.53 0.02 0.15 -0.65 0.37 0.00 0.00 175.52 175.95 1wqa h PRO 81 N 0.12 0.28 -0.31 6.66 0.11 -1.82 -0.29 132.00 136.75 1wqa h PRO 81 Ca 0.30 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.28 1wqa h PRO 81 Cb 0.48 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1wqa h PRO 81 CO -0.50 0.18 -0.28 0.00 -0.21 0.00 0.00 178.00 177.19 1wqa h ALA 82 N 1.86 0.94 -0.08 -0.75 0.00 -1.35 0.11 119.26 120.00 1wqa h ALA 82 Ca 0.09 -0.38 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 1wqa h ALA 82 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1wqa h ALA 82 CO -0.02 0.61 -0.62 0.28 0.00 0.00 0.00 179.25 179.50 1wqa h VAL 83 N 0.54 1.38 -0.27 0.00 2.07 -0.57 0.12 116.25 119.52 1wqa h VAL 83 Ca 0.07 -2.00 -0.10 0.00 0.82 0.00 0.00 66.70 65.49 1wqa h VAL 83 Cb 0.76 2.00 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1wqa h VAL 83 CO 0.06 0.59 -0.23 1.56 0.02 0.00 0.00 177.57 179.57 1wqa h GLN 84 N 0.20 0.63 -0.68 1.57 4.20 -0.77 -1.61 115.11 118.65 1wqa h GLN 84 Ca -0.01 -0.32 0.04 0.00 0.06 0.00 0.00 58.65 58.43 1wqa h GLN 84 Cb 1.13 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.87 1wqa h GLN 84 CO 0.10 0.91 0.41 2.35 -0.67 0.00 0.00 178.83 181.93 1wqa h TRP 85 N 0.35 0.75 -0.46 2.96 7.01 -0.58 -2.48 115.95 123.51 1wqa h TRP 85 Ca 0.05 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 60.99 1wqa h TRP 85 Cb 0.78 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 1wqa h TRP 85 CO 0.07 0.40 -0.03 0.00 -2.79 0.00 0.00 178.44 176.09 1wqa h ALA 86 N 1.32 1.09 -0.45 2.65 0.00 -0.61 0.86 119.26 124.12 1wqa h ALA 86 Ca 0.29 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1wqa h ALA 86 Cb 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1wqa h ALA 86 CO -0.15 0.57 0.26 1.15 0.00 0.00 0.00 179.25 181.09 1wqa h THR 87 N 0.71 1.04 -0.24 0.00 2.02 -0.84 -0.31 112.91 115.30 1wqa h THR 87 Ca 0.13 -0.18 -0.14 0.00 0.77 0.00 0.00 66.41 66.99 1wqa h THR 87 Cb 0.48 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 1wqa h THR 87 CO 0.02 0.10 -0.41 0.50 0.37 0.00 0.00 175.52 176.10 1wqa h LYS 88 N 0.53 0.71 -0.58 6.66 3.64 -1.26 -1.88 116.57 124.39 1wqa h LYS 88 Ca 0.18 -0.44 0.07 0.00 -1.27 0.00 0.00 60.65 59.19 1wqa h LYS 88 Cb 0.02 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.83 1wqa h LYS 88 CO -0.08 1.06 0.27 1.25 -2.27 0.00 0.00 179.45 179.67 1wqa h HIS 89 N 0.43 0.48 -0.25 1.91 2.76 -0.44 -1.72 115.15 118.32 1wqa h HIS 89 Ca 0.02 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1wqa h HIS 89 Cb 1.01 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 29.84 1wqa h HIS 89 CO 0.08 0.19 0.00 1.19 -1.30 0.00 0.00 177.93 178.09 1wqa n PHE 90 N -4.91 0.33 -3.76 5.26 3.01 -0.16 -4.91 117.46 112.32 1wqa n PHE 90 Ca 0.07 -0.17 -0.26 0.00 1.01 0.00 0.00 57.45 58.11 1wqa n PHE 90 Cb 0.20 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.72 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 0.25 -4.30 -4.86 4.37 3.02 -0.65 -4.96 115.26 108.14 1wqa n ASN 91 Ca 0.10 -0.71 -0.30 0.00 -0.03 0.00 0.00 54.58 53.63 1wqa n ASN 91 Cb 0.23 -4.30 0.06 0.00 -0.61 0.00 0.00 39.78 35.15 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 -3.38 2.70 -0.97 5.41 0.00 -0.71 -4.96 121.76 119.84 1wqa s ALA 92 Ca 0.47 -0.26 0.25 0.00 0.00 0.00 0.00 51.96 52.42 1wqa s ALA 92 Cb -0.22 -3.06 0.59 0.00 0.00 0.00 0.00 23.12 20.42 1wqa s ALA 92 CO 0.79 -1.30 1.47 -0.25 0.00 0.00 0.00 175.76 176.48 1wqa n ASP 93 N -3.13 0.45 0.00 0.00 8.00 0.18 -4.58 116.55 117.47 1wqa n ASP 93 Ca 0.07 -0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1wqa n ASP 93 Cb 0.57 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 1wqa n ASP 93 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wqa n GLY 94 N 1.49 -0.39 3.47 0.44 0.00 -1.18 -3.73 105.19 105.29 1wqa n GLY 94 Ca 0.06 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 45.04 1wqa n GLY 94 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wqa s GLY 95 N 0.00 0.65 -0.10 -0.02 0.00 -1.01 -1.82 107.32 105.01 1wqa s GLY 95 Ca 0.00 -0.99 -0.08 0.00 0.00 0.00 0.00 44.72 43.65 1wqa s GLY 95 CO 0.00 -0.78 0.27 0.00 0.00 0.00 0.00 173.10 172.59 1wqa s ALA 96 N -4.02 -0.66 -0.12 3.20 0.00 0.18 -0.52 121.76 119.82 1wqa s ALA 96 Ca 0.23 0.85 0.03 0.00 0.00 0.00 0.00 51.96 53.07 1wqa s ALA 96 Cb 0.01 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.64 1wqa s ALA 96 CO 0.07 -0.15 -0.21 0.08 0.00 0.00 0.00 175.76 175.56 1wqa s VAL 97 N 0.45 1.89 -0.49 0.00 1.01 0.29 -1.60 120.40 121.95 1wqa s VAL 97 Ca -0.02 -0.89 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 1wqa s VAL 97 Cb -0.04 -1.67 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1wqa s VAL 97 CO -0.02 0.52 0.59 -0.63 0.00 0.00 0.00 175.10 175.56 1wqa s ILE 98 N 0.71 4.92 -0.08 2.22 -1.09 0.30 -1.05 121.20 127.14 1wqa s ILE 98 Ca -0.11 -0.50 -0.30 0.00 -2.23 0.00 0.00 60.65 57.52 1wqa s ILE 98 Cb -0.16 -4.26 0.11 0.00 -1.58 0.00 0.00 42.46 36.57 1wqa s ILE 98 CO 0.01 -0.75 0.93 0.28 -1.23 0.00 0.00 174.94 174.19 1wqa s THR 99 N 2.52 0.00 -0.10 2.92 -1.32 0.31 -2.07 115.64 117.91 1wqa s THR 99 Ca 0.14 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 60.76 1wqa s THR 99 Cb -0.19 -1.00 0.22 0.00 -1.51 0.00 0.00 72.50 70.02 1wqa s THR 99 CO 0.12 0.00 1.11 0.00 -2.21 0.00 0.00 174.62 173.64 1wqa n ALA 100 N 0.24 2.27 -0.74 11.08 0.00 -1.26 -2.36 120.51 129.75 1wqa n ALA 100 Ca -0.10 -2.21 0.00 0.00 0.00 0.00 0.00 53.44 51.13 1wqa n ALA 100 Cb 0.60 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.63 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 -0.97 0.00 -0.64 0.00 2.88 -1.26 -1.72 113.62 111.91 1wqa n SER 101 Ca 0.11 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.73 1wqa n SER 101 Cb 0.67 0.00 0.08 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 0.06 -1.20 0.66 1.44 -1.26 -2.77 115.22 112.16 1wqa n HIS 102 Ca 0.00 -0.05 -0.30 0.00 -2.01 0.00 0.00 57.72 55.36 1wqa n HIS 102 Cb 0.00 -0.00 0.13 0.00 0.12 0.00 0.00 29.99 30.24 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 -1.25 3.63 0.95 4.39 -0.87 -0.70 -3.77 114.94 117.32 1wqa s ASN 103 Ca 0.19 1.56 -0.11 0.00 -1.57 0.00 0.00 52.86 52.93 1wqa s ASN 103 Cb 0.13 -2.24 0.12 0.00 -0.02 0.00 0.00 41.25 39.24 1wqa s ASN 103 CO 0.19 -2.55 0.86 -2.65 -2.57 0.00 0.00 177.10 170.39 1wqa n PRO 104 N -3.83 -0.52 -0.27 -0.60 -0.02 -1.26 -4.49 135.00 124.00 1wqa n PRO 104 Ca 0.07 -0.10 0.29 0.00 -2.02 0.00 0.00 63.50 61.75 1wqa n PRO 104 Cb 0.55 -2.17 0.67 0.00 -0.02 0.00 0.00 33.50 32.53 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 -1.83 0.11 0.00 0.52 0.11 -1.88 -1.88 132.00 127.15 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 1.28 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1wqa h PRO 105 CO 0.39 0.07 0.00 -0.85 -0.21 0.00 0.00 178.00 177.40 1wqa n GLU 106 N -4.33 0.16 -3.27 1.05 0.00 -1.26 -4.72 120.64 108.27 1wqa n GLU 106 Ca 0.22 0.28 -0.29 0.00 0.00 0.00 0.00 57.16 57.38 1wqa n GLU 106 Cb 1.03 -1.75 -0.03 0.00 0.00 0.00 0.00 31.44 30.69 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 -3.16 3.48 0.36 -1.84 2.02 -0.71 -0.52 117.35 116.98 1wqa s TYR 107 Ca 0.08 0.69 -0.15 0.00 -0.37 0.00 0.00 57.07 57.32 1wqa s TYR 107 Cb 0.11 -2.15 0.04 0.00 -0.40 0.00 0.00 41.96 39.57 1wqa s TYR 107 CO 0.45 0.13 0.74 1.21 -1.57 0.00 0.00 175.55 176.50 1wqa s ASN 108 N -3.18 0.07 -0.03 2.29 3.04 -0.45 -4.66 114.94 112.02 1wqa s ASN 108 Ca 0.45 -1.11 -0.15 0.00 0.04 0.00 0.00 52.86 52.09 1wqa s ASN 108 Cb -0.11 0.81 0.05 0.00 -1.54 0.00 0.00 41.25 40.46 1wqa s ASN 108 CO 0.30 -1.60 0.66 0.61 -3.04 0.00 0.00 177.10 174.04 1wqa n GLY 109 N -0.52 0.32 2.89 1.21 0.00 -0.99 -1.46 105.19 106.63 1wqa n GLY 109 Ca -0.07 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.04 0.19 -0.11 -0.61 1.01 -0.19 -0.53 121.20 118.92 1wqa s ILE 110 Ca 0.16 -0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.77 1wqa s ILE 110 Cb -0.00 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.29 1wqa s ILE 110 CO -0.01 0.07 -0.20 -0.54 0.00 0.00 0.00 174.94 174.26 1wqa s LYS 111 N 0.14 2.72 0.01 2.79 1.02 -0.21 -0.91 119.74 125.29 1wqa s LYS 111 Ca -0.01 -0.75 -0.02 0.00 0.02 0.00 0.00 55.97 55.21 1wqa s LYS 111 Cb -0.03 -2.16 -0.04 0.00 -0.52 0.00 0.00 37.83 35.07 1wqa s LYS 111 CO -0.00 0.05 0.18 -0.51 -0.92 0.00 0.00 175.35 174.14 1wqa s LEU 112 N 0.68 4.35 0.10 3.17 1.43 -1.26 -0.55 118.68 126.59 1wqa s LEU 112 Ca -0.12 0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.39 1wqa s LEU 112 Cb -0.16 -2.67 -0.04 0.00 0.03 0.00 0.00 46.19 43.35 1wqa s LEU 112 CO 0.02 0.24 -0.22 -0.76 0.23 0.00 0.00 176.35 175.87 1wqa s LEU 113 N -2.05 2.30 0.92 1.79 1.43 0.32 -0.52 118.68 122.87 1wqa s LEU 113 Ca 0.29 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 1wqa s LEU 113 Cb -0.13 -0.92 0.14 0.00 0.03 0.00 0.00 46.19 45.31 1wqa s LEU 113 CO 0.20 0.07 1.12 -1.61 0.23 0.00 0.00 176.35 176.37 1wqa s GLU 114 N -1.91 1.07 0.48 1.70 0.41 0.12 -2.40 118.70 118.17 1wqa s GLU 114 Ca 0.07 0.40 0.17 0.00 -0.41 0.00 0.00 54.97 55.20 1wqa s GLU 114 Cb -0.10 -1.82 1.17 0.00 -1.78 0.00 0.00 34.13 31.59 1wqa s GLU 114 CO 0.04 -2.27 2.03 -1.35 -0.49 0.00 0.00 175.26 173.23 1wqa h PRO 115 N -1.55 0.21 -0.33 0.39 0.11 -1.81 0.21 132.00 129.23 1wqa h PRO 115 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1wqa h PRO 115 Cb 1.32 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1wqa h PRO 115 CO 0.60 0.14 0.00 0.27 -0.21 0.00 0.00 178.00 178.80 1wqa n ASN 116 N -4.46 1.82 0.00 -2.05 0.23 -1.26 -3.79 115.26 105.75 1wqa n ASN 116 Ca 0.06 -1.97 0.00 0.00 -0.53 0.00 0.00 54.58 52.14 1wqa n ASN 116 Cb 0.33 -0.22 0.00 0.00 -2.08 0.00 0.00 39.78 37.81 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 1.06 2.07 3.82 4.83 0.00 0.06 -4.49 105.19 112.54 1wqa n GLY 117 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.61 2.84 0.35 1.61 0.23 -1.26 -4.60 119.30 117.87 1wqa s MET 118 Ca 0.00 0.87 -0.26 0.00 -1.03 0.00 0.00 55.69 55.28 1wqa s MET 118 Cb 0.00 -1.99 -0.13 0.00 -1.53 0.00 0.00 34.83 31.19 1wqa s MET 118 CO 0.00 -1.15 0.89 0.41 -2.03 0.00 0.00 175.02 173.15 1wqa n GLY 119 N -2.09 -0.56 3.67 3.16 0.00 -1.26 0.10 105.19 108.21 1wqa n GLY 119 Ca 0.07 0.21 -0.44 0.00 0.00 0.00 0.00 46.02 45.86 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 1.05 3.12 -4.77 0.99 7.94 0.32 -4.42 117.00 121.23 1wqa n LEU 120 Ca 0.10 1.16 -0.40 0.00 -1.11 0.00 0.00 56.01 55.77 1wqa n LEU 120 Cb 0.35 -1.43 -0.01 0.00 0.53 0.00 0.00 43.42 42.86 1wqa n LEU 120 CO 0.58 -0.55 0.97 -0.54 -1.11 0.00 0.00 177.39 176.74 1wqa s LYS 121 N -0.82 4.03 0.26 1.96 1.02 -1.26 -4.80 119.74 120.14 1wqa s LYS 121 Ca 0.65 2.17 -0.01 0.00 0.02 0.00 0.00 55.97 58.80 1wqa s LYS 121 Cb -0.64 -2.81 0.56 0.00 -0.52 0.00 0.00 37.83 34.43 1wqa s LYS 121 CO 0.53 -0.44 1.73 0.87 -0.92 0.00 0.00 175.35 177.12 1wqa h LYS 122 N 2.79 0.46 -0.54 1.68 1.79 -1.98 0.40 116.57 121.18 1wqa h LYS 122 Ca -0.49 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 57.92 1wqa h LYS 122 Cb 1.24 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.76 1wqa h LYS 122 CO 0.63 0.30 0.23 0.93 -1.08 0.00 0.00 179.45 180.46 1wqa h GLU 123 N 0.47 0.77 0.13 3.15 3.07 -2.00 -0.72 114.58 119.45 1wqa h GLU 123 Ca 0.47 -0.11 -0.29 0.00 -0.50 0.00 0.00 59.36 58.94 1wqa h GLU 123 Cb 0.77 -0.14 0.02 0.00 -0.84 0.00 0.00 28.75 28.56 1wqa h GLU 123 CO -0.44 0.62 -1.25 0.00 -1.40 0.00 0.00 179.01 176.55 1wqa h ARG 124 N 0.77 0.47 -0.13 2.33 3.08 -1.62 -3.14 114.38 116.13 1wqa h ARG 124 Ca 0.19 -0.69 -0.01 0.00 0.07 0.00 0.00 59.98 59.55 1wqa h ARG 124 Cb 0.13 0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1wqa h ARG 124 CO -0.02 1.30 0.06 1.49 -1.07 0.00 0.00 179.97 181.73 1wqa h GLU 125 N 0.18 0.18 -0.44 0.04 4.81 -0.60 -1.61 114.58 117.15 1wqa h GLU 125 Ca -0.17 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 58.96 1wqa h GLU 125 Cb 1.93 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 31.26 1wqa h GLU 125 CO 0.23 0.15 -0.07 0.00 -0.73 0.00 0.00 179.01 178.58 1wqa h ALA 126 N 1.88 1.04 -0.21 2.92 0.00 -1.09 -1.66 119.26 122.14 1wqa h ALA 126 Ca 0.05 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1wqa h ALA 126 Cb 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1wqa h ALA 126 CO -0.01 0.59 -0.39 0.82 0.00 0.00 0.00 179.25 180.26 1wqa h ILE 127 N 0.70 1.32 -0.59 0.00 2.04 -1.33 -2.17 117.51 117.49 1wqa h ILE 127 Ca 0.13 -1.61 0.07 0.00 1.00 0.00 0.00 64.86 64.44 1wqa h ILE 127 Cb 0.54 1.84 -0.06 0.00 -0.74 0.00 0.00 36.82 38.40 1wqa h ILE 127 CO 0.03 0.50 0.28 0.58 0.00 0.00 0.00 178.15 179.54 1wqa h VAL 128 N 0.32 0.88 -0.37 1.67 2.07 -1.09 -0.06 116.25 119.67 1wqa h VAL 128 Ca 0.01 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1wqa h VAL 128 Cb 0.99 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1wqa h VAL 128 CO 0.09 0.09 0.20 -0.33 0.02 0.00 0.00 177.57 177.64 1wqa h GLU 129 N 0.51 0.40 -0.55 1.57 5.08 -1.24 0.33 114.58 120.68 1wqa h GLU 129 Ca 0.28 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.63 1wqa h GLU 129 Cb 0.25 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1wqa h GLU 129 CO -0.22 0.27 0.34 1.49 -1.00 0.00 0.00 179.01 179.88 1wqa h GLU 130 N 0.42 0.65 -0.36 2.33 4.81 -0.68 -0.24 114.58 121.51 1wqa h GLU 130 Ca 0.15 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1wqa h GLU 130 Cb 0.03 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1wqa h GLU 130 CO -0.09 0.43 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.30 1wqa h LEU 131 N 0.67 0.76 -0.48 1.64 3.38 -0.63 -1.63 115.31 119.02 1wqa h LEU 131 Ca 0.22 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1wqa h LEU 131 Cb 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1wqa h LEU 131 CO -0.09 0.98 0.30 0.15 0.09 0.00 0.00 178.44 179.87 1wqa h PHE 132 N 0.64 0.63 -0.18 1.13 3.04 -0.43 0.24 116.94 122.01 1wqa h PHE 132 Ca 0.08 0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.88 1wqa h PHE 132 Cb 0.77 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 39.07 1wqa h PHE 132 CO 0.04 0.43 -0.48 0.74 -2.02 0.00 0.00 178.31 177.02 1wqa h PHE 133 N 0.65 0.83 0.00 0.41 0.04 -0.85 -3.13 116.94 114.88 1wqa h PHE 133 Ca 0.17 -0.32 0.00 0.00 2.80 0.00 0.00 57.97 60.62 1wqa h PHE 133 Cb -0.02 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 37.99 1wqa h PHE 133 CO -0.03 1.10 0.00 0.87 -0.60 0.00 0.00 178.31 179.65 1wqa h LYS 134 N 0.32 0.00 -5.95 1.51 1.57 -1.26 -3.47 116.57 109.29 1wqa h LYS 134 Ca -0.01 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.37 1wqa h LYS 134 Cb 1.10 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.50 1wqa h LYS 134 CO 0.10 0.00 -0.76 0.39 -0.57 0.00 0.00 179.45 178.61 1wqa n GLU 135 N -2.41 -6.33 -3.14 3.15 1.02 0.78 -4.92 120.64 108.79 1wqa n GLU 135 Ca 0.04 0.73 -0.45 0.00 -0.02 0.00 0.00 57.16 57.47 1wqa n GLU 135 Cb 0.40 -5.62 -0.01 0.00 -0.02 0.00 0.00 31.44 26.18 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 -3.87 6.88 0.03 1.62 2.15 -0.76 -5.01 116.67 117.70 1wqa s ASP 136 Ca 0.29 -2.71 0.06 0.00 0.43 0.00 0.00 52.55 50.62 1wqa s ASP 136 Cb -0.14 -2.30 -0.03 0.00 -0.30 0.00 0.00 42.92 40.15 1wqa s ASP 136 CO 0.77 -0.70 -0.14 -0.36 -0.17 0.00 0.00 175.17 174.57 1wqa s PHE 137 N 0.91 2.66 -0.95 -5.34 0.08 -1.26 -4.85 117.98 109.23 1wqa s PHE 137 Ca 0.29 -0.19 -0.14 0.00 0.12 0.00 0.00 56.93 57.01 1wqa s PHE 137 Cb -0.07 -1.51 0.21 0.00 -0.57 0.00 0.00 43.02 41.08 1wqa s PHE 137 CO -0.07 0.28 0.99 -0.51 -0.10 0.00 0.00 175.22 175.81 1wqa s ASP 138 N -1.41 6.90 0.24 1.36 1.01 -1.26 -5.02 116.67 118.49 1wqa s ASP 138 Ca 0.15 -2.81 -0.30 0.00 0.71 0.00 0.00 52.55 50.30 1wqa s ASP 138 Cb -0.11 -2.27 -0.09 0.00 1.01 0.00 0.00 42.92 41.46 1wqa s ASP 138 CO 0.06 -0.62 1.34 -0.13 0.21 0.00 0.00 175.17 176.03 1wqa s ARG 139 N 0.46 4.36 0.54 8.23 0.52 -1.26 -4.54 118.95 127.26 1wqa s ARG 139 Ca 0.26 2.14 -0.19 0.00 -0.52 0.00 0.00 55.73 57.43 1wqa s ARG 139 Cb -0.08 -3.15 -0.06 0.00 0.52 0.00 0.00 34.95 32.18 1wqa s ARG 139 CO -0.08 -0.27 1.10 0.00 0.02 0.00 0.00 175.30 176.06 1wqa s ALA 140 N -0.17 2.73 0.71 2.13 0.00 0.33 -4.96 121.76 122.53 1wqa s ALA 140 Ca 0.56 0.70 -0.13 0.00 0.00 0.00 0.00 51.96 53.09 1wqa s ALA 140 Cb -0.38 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.45 1wqa s ALA 140 CO 0.42 -0.69 1.11 0.15 0.00 0.00 0.00 175.76 176.75 1wqa s LYS 141 N -3.41 2.52 0.29 0.00 1.02 -1.26 -4.82 119.74 114.08 1wqa s LYS 141 Ca 0.70 1.32 0.04 0.00 0.02 0.00 0.00 55.97 58.05 1wqa s LYS 141 Cb -0.21 -1.92 0.69 0.00 -0.52 0.00 0.00 37.83 35.88 1wqa s LYS 141 CO 0.27 -1.46 1.75 0.11 -0.92 0.00 0.00 175.35 175.10 1wqa h TRP 142 N -0.49 0.90 -0.07 3.18 5.08 -1.98 0.24 115.95 122.80 1wqa h TRP 142 Ca -0.45 0.04 0.00 0.00 1.08 0.00 0.00 58.89 59.55 1wqa h TRP 142 Cb 1.24 -0.26 0.00 0.00 -3.00 0.00 0.00 29.16 27.15 1wqa h TRP 142 CO 0.55 0.15 0.00 2.48 -1.28 0.00 0.00 178.44 180.34 1wqa n TYR 143 N -4.86 0.10 -0.00 0.12 0.18 -1.26 -3.20 117.16 108.23 1wqa n TYR 143 Ca 0.22 -0.05 0.01 0.00 1.88 0.00 0.00 57.90 59.96 1wqa n TYR 143 Cb 0.57 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.54 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 -0.34 2.09 -1.86 -3.48 -0.58 0.06 -5.04 120.64 111.50 1wqa n GLU 144 Ca 0.12 -1.33 -0.41 0.00 -0.42 0.00 0.00 57.16 55.12 1wqa n GLU 144 Cb 0.14 -1.03 -0.00 0.00 -0.57 0.00 0.00 31.44 29.98 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 -0.79 2.17 0.94 -3.67 1.01 -1.11 -4.24 121.20 115.50 1wqa s ILE 145 Ca 0.02 0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.72 1wqa s ILE 145 Cb 0.01 -3.10 0.15 0.00 0.01 0.00 0.00 42.46 39.53 1wqa s ILE 145 CO 0.02 0.04 1.10 -0.83 0.00 0.00 0.00 174.94 175.26 1wqa s GLY 146 N -0.27 1.59 0.21 6.18 0.00 -0.39 -4.92 107.32 109.72 1wqa s GLY 146 Ca 0.54 -0.29 0.11 0.00 0.00 0.00 0.00 44.72 45.08 1wqa s GLY 146 CO 0.60 0.26 -0.23 -0.54 0.00 0.00 0.00 173.10 173.20 1wqa s GLU 147 N -5.02 1.54 0.06 2.90 2.02 -1.26 -4.89 118.70 114.06 1wqa s GLU 147 Ca 0.64 -1.58 0.06 0.00 0.02 0.00 0.00 54.97 54.11 1wqa s GLU 147 Cb -0.17 -1.79 -0.03 0.00 0.10 0.00 0.00 34.13 32.24 1wqa s GLU 147 CO 0.56 0.37 -0.18 0.54 0.02 0.00 0.00 175.26 176.58 1wqa s VAL 148 N -1.92 1.41 0.05 2.63 0.11 -1.26 -0.65 120.40 120.77 1wqa s VAL 148 Ca 0.23 -1.23 -0.02 0.00 -2.93 0.00 0.00 61.98 58.03 1wqa s VAL 148 Cb -0.07 -1.27 -0.03 0.00 -1.53 0.00 0.00 36.38 33.48 1wqa s VAL 148 CO 0.11 0.01 0.00 0.00 -3.33 0.00 0.00 175.10 171.90 1wqa s ARG 149 N -1.41 0.58 -0.01 1.54 1.70 -0.69 -4.97 118.95 115.69 1wqa s ARG 149 Ca 0.04 -1.05 -0.02 0.00 -0.47 0.00 0.00 55.73 54.23 1wqa s ARG 149 Cb -0.09 0.21 -0.04 0.00 -0.57 0.00 0.00 34.95 34.46 1wqa s ARG 149 CO 0.02 -0.12 0.16 1.03 -1.08 0.00 0.00 175.30 175.31 1wqa s ARG 150 N -3.37 3.35 -0.02 3.89 0.52 -1.26 -0.57 118.95 121.48 1wqa s ARG 150 Ca 0.02 -0.35 0.01 0.00 -0.52 0.00 0.00 55.73 54.88 1wqa s ARG 150 Cb 0.04 -3.04 0.01 0.00 0.52 0.00 0.00 34.95 32.48 1wqa s ARG 150 CO -0.08 0.67 -0.02 -1.21 0.02 0.00 0.00 175.30 174.68 1wqa s GLU 151 N -1.84 0.34 -0.29 3.54 0.41 -0.64 -4.91 118.70 115.31 1wqa s GLU 151 Ca 0.26 -0.03 -0.15 0.00 -0.41 0.00 0.00 54.97 54.64 1wqa s GLU 151 Cb -0.12 -0.42 -0.03 0.00 -1.78 0.00 0.00 34.13 31.77 1wqa s GLU 151 CO 0.17 -0.04 0.38 0.34 -0.49 0.00 0.00 175.26 175.62 1wqa s ASP 152 N 0.53 6.24 0.00 -0.19 -1.08 -1.26 -4.16 116.67 116.75 1wqa s ASP 152 Ca -0.05 0.18 0.11 0.00 -0.52 0.00 0.00 52.55 52.27 1wqa s ASP 152 Cb -0.08 -2.21 0.12 0.00 -1.46 0.00 0.00 42.92 39.28 1wqa s ASP 152 CO -0.01 -0.23 0.91 2.30 0.52 0.00 0.00 175.17 178.67 1wqa n ILE 153 N 5.16 0.11 0.13 4.11 -5.35 -1.26 -4.73 119.36 117.54 1wqa n ILE 153 Ca -0.08 -0.56 -0.14 0.00 -0.27 0.00 0.00 62.75 61.70 1wqa n ILE 153 Cb 0.50 1.16 -0.06 0.00 -1.74 0.00 0.00 39.64 39.49 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 2.24 0.28 -0.21 7.28 1.08 -1.93 0.46 117.51 126.71 1wqa h ILE 154 Ca 0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.45 1wqa h ILE 154 Cb 0.51 0.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.53 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 -0.60 0.34 -0.84 2.37 3.64 -1.96 -1.27 116.57 118.26 1wqa h LYS 155 Ca 0.02 -0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1wqa h LYS 155 Cb 0.61 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 1wqa h LYS 155 CO -0.17 0.44 0.55 -1.35 -2.27 0.00 0.00 179.45 176.65 1wqa h PRO 156 N 0.17 0.93 -0.17 1.90 0.11 -1.83 0.72 132.00 133.84 1wqa h PRO 156 Ca 0.07 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 1wqa h PRO 156 Cb 0.25 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1wqa h PRO 156 CO -0.00 0.62 -0.03 -0.92 -0.21 0.00 0.00 178.00 177.46 1wqa h TYR 157 N 0.96 0.35 -0.45 0.65 3.20 -0.67 -1.11 116.97 119.90 1wqa h TYR 157 Ca 0.35 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 62.15 1wqa h TYR 157 Cb 0.17 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 1wqa h TYR 157 CO -0.00 0.57 0.29 0.82 -1.64 0.00 0.00 178.16 178.19 1wqa h ILE 158 N 0.04 1.13 -0.65 1.81 2.04 -0.78 -2.19 117.51 118.90 1wqa h ILE 158 Ca 0.04 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1wqa h ILE 158 Cb 0.44 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1wqa h ILE 158 CO 0.01 0.13 0.33 -0.33 0.00 0.00 0.00 178.15 178.29 1wqa h GLU 159 N 0.61 0.92 -0.49 2.37 4.39 -0.80 -0.49 114.58 121.09 1wqa h GLU 159 Ca 0.16 -0.11 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 1wqa h GLU 159 Cb -0.03 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 1wqa h GLU 159 CO -0.03 0.70 0.10 0.00 -1.16 0.00 0.00 179.01 178.62 1wqa h ALA 160 N 1.44 1.26 0.07 3.43 0.00 -0.68 -1.69 119.26 123.10 1wqa h ALA 160 Ca 0.23 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1wqa h ALA 160 Cb 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1wqa h ALA 160 CO -0.03 0.51 -0.03 0.82 0.00 0.00 0.00 179.25 180.52 1wqa h ILE 161 N 0.72 1.23 -0.97 0.00 2.04 -0.81 -3.27 117.51 116.46 1wqa h ILE 161 Ca 0.16 -1.21 0.18 0.00 1.00 0.00 0.00 64.86 65.00 1wqa h ILE 161 Cb 0.29 2.00 -0.09 0.00 -0.74 0.00 0.00 36.82 38.28 1wqa h ILE 161 CO 0.00 0.29 0.61 0.11 0.00 0.00 0.00 178.15 179.16 1wqa h LYS 162 N -0.65 0.65 0.00 2.37 1.57 -0.95 0.24 116.57 119.79 1wqa h LYS 162 Ca -0.01 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1wqa h LYS 162 Cb 0.55 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1wqa h LYS 162 CO 0.02 0.43 0.00 -1.13 -0.57 0.00 0.00 179.45 178.19 1wqa n SER 163 N -4.65 0.39 0.06 0.86 3.41 -0.65 -1.88 113.62 111.16 1wqa n SER 163 Ca 0.21 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.59 1wqa n SER 163 Cb 0.59 -0.71 0.05 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.99 0.43 -4.57 4.33 4.01 0.07 -4.97 118.16 115.46 1wqa n LYS 164 Ca 0.00 0.06 -0.27 0.00 -0.51 0.00 0.00 58.31 57.59 1wqa n LYS 164 Cb 0.08 -1.70 -0.11 0.00 -0.51 0.00 0.00 35.03 32.79 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 -3.27 2.14 -1.14 -0.18 -7.23 -0.79 -5.06 120.40 104.87 1wqa s VAL 165 Ca 0.02 -2.12 -0.20 0.00 -1.81 0.00 0.00 61.98 57.87 1wqa s VAL 165 Cb 0.12 -2.79 0.07 0.00 0.56 0.00 0.00 36.38 34.35 1wqa s VAL 165 CO 0.78 -0.12 1.54 -0.62 -0.31 0.00 0.00 175.10 176.37 1wqa s ASP 166 N -3.65 6.69 0.25 4.85 -1.08 -1.26 -4.84 116.67 117.64 1wqa s ASP 166 Ca 0.33 -2.03 -0.05 0.00 -0.52 0.00 0.00 52.55 50.29 1wqa s ASP 166 Cb 0.05 -2.55 0.28 0.00 -1.46 0.00 0.00 42.92 39.25 1wqa s ASP 166 CO 0.17 -1.27 1.85 0.58 0.52 0.00 0.00 175.17 177.02 1wqa h VAL 167 N 6.05 1.24 -0.80 1.11 2.07 -1.88 -2.48 116.25 121.57 1wqa h VAL 167 Ca 0.31 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1wqa h VAL 167 Cb 0.94 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1wqa h VAL 167 CO 1.40 0.29 0.41 -0.33 0.02 0.00 0.00 177.57 179.36 1wqa h GLU 168 N 1.12 1.13 -0.70 1.57 4.39 -1.88 0.79 114.58 120.99 1wqa h GLU 168 Ca 0.27 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 1wqa h GLU 168 Cb 0.10 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.50 1wqa h GLU 168 CO -0.04 0.85 0.36 0.00 -1.16 0.00 0.00 179.01 179.03 1wqa h ALA 169 N 1.21 0.90 -0.25 3.43 0.00 -1.86 -0.83 119.26 121.87 1wqa h ALA 169 Ca 0.28 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1wqa h ALA 169 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1wqa h ALA 169 CO -0.04 0.45 -0.01 0.82 0.00 0.00 0.00 179.25 180.47 1wqa h ILE 170 N 0.98 1.26 -0.57 0.00 2.04 -0.98 -2.41 117.51 117.82 1wqa h ILE 170 Ca 0.24 -0.94 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 1wqa h ILE 170 Cb 0.09 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1wqa h ILE 170 CO -0.03 0.30 0.34 0.11 0.00 0.00 0.00 178.15 178.86 1wqa h LYS 171 N 0.22 0.77 -0.36 2.37 1.57 -0.66 0.39 116.57 120.87 1wqa h LYS 171 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1wqa h LYS 171 Cb 0.44 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1wqa h LYS 171 CO 0.02 0.54 0.11 -0.22 -0.57 0.00 0.00 179.45 179.33 1wqa h LYS 172 N 0.78 0.56 -0.02 3.15 3.64 -0.94 -3.13 116.57 120.61 1wqa h LYS 172 Ca 0.21 -0.12 -0.23 0.00 -1.27 0.00 0.00 60.65 59.24 1wqa h LYS 172 Cb -0.02 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1wqa h LYS 172 CO -0.04 0.58 -0.92 -0.09 -2.27 0.00 0.00 179.45 176.71 1wqa h ARG 173 N 0.43 0.47 -5.74 1.90 1.12 -0.96 -3.49 114.38 108.10 1wqa h ARG 173 Ca 0.11 -0.48 -0.32 0.00 -1.11 0.00 0.00 59.98 58.18 1wqa h ARG 173 Cb 0.26 0.13 0.16 0.00 -0.01 0.00 0.00 29.97 30.51 1wqa h ARG 173 CO -0.00 1.13 -0.88 1.17 -3.11 0.00 0.00 179.97 178.27 1wqa n LYS 174 N -3.78 -2.10 -1.64 0.20 4.81 0.13 -4.92 118.16 110.86 1wqa n LYS 174 Ca -0.07 0.72 -0.35 0.00 -0.87 0.00 0.00 58.31 57.74 1wqa n LYS 174 Cb 0.82 -5.23 0.07 0.00 0.02 0.00 0.00 35.03 30.72 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 -5.01 2.42 -0.42 1.64 0.04 -1.26 -4.50 135.00 127.92 1wqa s PRO 175 Ca 0.44 1.87 -0.10 0.00 0.04 0.00 0.00 61.00 63.25 1wqa s PRO 175 Cb -0.09 -1.85 0.07 0.00 0.04 0.00 0.00 34.50 32.66 1wqa s PRO 175 CO 0.78 -1.64 0.27 0.12 0.04 0.00 0.00 177.00 176.57 1wqa s PHE 176 N -1.72 3.31 -0.06 0.56 5.36 -1.26 -0.71 117.98 123.46 1wqa s PHE 176 Ca 0.78 -1.38 0.03 0.00 -0.96 0.00 0.00 56.93 55.40 1wqa s PHE 176 Cb -0.32 -2.91 -0.02 0.00 -0.34 0.00 0.00 43.02 39.43 1wqa s PHE 176 CO 0.41 -0.81 -0.14 0.08 -1.46 0.00 0.00 175.22 173.29 1wqa s VAL 177 N 1.47 3.04 -0.14 3.12 1.01 -0.60 -0.81 120.40 127.49 1wqa s VAL 177 Ca 0.03 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1wqa s VAL 177 Cb -0.23 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1wqa s VAL 177 CO 0.03 0.58 -0.02 -0.69 0.00 0.00 0.00 175.10 175.00 1wqa s VAL 178 N -0.53 4.07 -0.03 2.92 1.01 -0.86 -2.71 120.40 124.27 1wqa s VAL 178 Ca 0.07 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 61.78 1wqa s VAL 178 Cb -0.12 -2.76 -0.00 0.00 0.00 0.00 0.00 36.38 33.50 1wqa s VAL 178 CO 0.01 0.52 -0.13 -0.69 0.00 0.00 0.00 175.10 174.82 1wqa s VAL 179 N -0.01 1.06 -0.23 2.92 1.01 -0.46 -0.70 120.40 123.99 1wqa s VAL 179 Ca 0.02 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.47 1wqa s VAL 179 Cb -0.13 -0.91 0.03 0.00 0.00 0.00 0.00 36.38 35.37 1wqa s VAL 179 CO 0.02 0.31 -0.12 -0.62 0.00 0.00 0.00 175.10 174.69 1wqa s ASP 180 N -0.00 3.91 0.00 3.32 -1.08 0.13 -0.46 116.67 122.48 1wqa s ASP 180 Ca -0.01 -0.90 0.23 0.00 -0.52 0.00 0.00 52.55 51.35 1wqa s ASP 180 Cb -0.08 -1.57 0.57 0.00 -1.46 0.00 0.00 42.92 40.37 1wqa s ASP 180 CO 0.01 -0.09 1.49 0.35 0.52 0.00 0.00 175.17 177.45 1wqa n THR 181 N 4.60 0.80 -4.03 1.71 -2.24 -1.15 -1.36 114.28 112.62 1wqa n THR 181 Ca -0.18 -0.90 -0.31 0.00 -2.27 0.00 0.00 64.05 60.40 1wqa n THR 181 Cb 0.47 0.69 -0.01 0.00 -2.10 0.00 0.00 70.33 69.39 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 1.62 -2.82 -1.14 3.42 2.88 -1.21 -0.49 113.62 115.87 1wqa n SER 182 Ca 0.23 -0.93 -0.12 0.00 -1.33 0.00 0.00 58.87 56.72 1wqa n SER 182 Cb 0.62 -3.26 -0.05 0.00 -0.75 0.00 0.00 64.21 60.77 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 -2.82 -4.13 -1.60 -3.46 5.03 0.47 -4.76 115.26 103.99 1wqa n ASN 183 Ca -0.06 0.30 0.00 0.00 0.87 0.00 0.00 54.58 55.69 1wqa n ASN 183 Cb 0.56 -3.50 0.00 0.00 -1.02 0.00 0.00 39.78 35.83 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 -0.07 1.58 0.28 7.41 0.00 0.35 -1.67 105.19 113.08 1wqa n GLY 184 Ca -0.12 -2.06 0.11 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.12 1.94 0.00 4.61 0.00 -1.39 -0.21 119.26 124.09 1wqa h ALA 185 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wqa h ALA 185 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1wqa h ALA 185 CO 0.00 -0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.59 1wqa n GLY 186 N -1.50 -1.05 0.29 0.00 0.00 -1.26 -2.09 105.19 99.57 1wqa n GLY 186 Ca -0.02 0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.20 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 0.47 1.61 0.02 -1.27 -2.06 113.55 112.32 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 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1wqa h SER 187 CO 0.00 0.05 -0.48 0.18 -1.14 0.00 0.00 176.83 175.43 1wqa n LEU 188 N -3.26 0.55 0.07 5.07 4.77 -0.89 -4.70 117.00 118.61 1wqa n LEU 188 Ca -0.01 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1wqa n LEU 188 Cb 0.23 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1wqa n LEU 188 CO 0.26 0.13 0.00 0.35 -1.33 0.00 0.00 177.39 176.81 1wqa n THR 189 N -1.42 0.80 -0.20 -5.08 -2.24 -0.84 -4.85 114.28 100.44 1wqa n THR 189 Ca 0.06 0.27 0.01 0.00 -2.27 0.00 0.00 64.05 62.12 1wqa n THR 189 Cb 0.34 -1.23 0.11 0.00 -2.10 0.00 0.00 70.33 67.44 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 -0.18 -1.44 3.22 5.85 -1.69 -0.23 115.31 120.84 1wqa h LEU 190 Ca 0.00 0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1wqa h LEU 190 Cb 0.00 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1wqa h LEU 190 CO 0.00 -0.08 0.41 -0.65 -0.34 0.00 0.00 178.44 177.78 1wqa h PRO 191 N 0.16 0.71 0.02 5.25 0.11 -1.84 -0.83 132.00 135.59 1wqa h PRO 191 Ca 0.33 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.17 1wqa h PRO 191 Cb 0.52 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 31.49 1wqa h PRO 191 CO -0.49 0.47 -0.87 1.88 -0.21 0.00 0.00 178.00 178.78 1wqa h TYR 192 N 0.73 0.84 -0.24 0.65 0.05 -1.65 -2.63 116.97 114.71 1wqa h TYR 192 Ca 0.24 -0.47 0.02 0.00 0.05 0.00 0.00 58.73 58.58 1wqa h TYR 192 Cb 0.06 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 37.69 1wqa h TYR 192 CO -0.00 1.30 0.09 1.25 -1.05 0.00 0.00 178.16 179.75 1wqa h LEU 193 N 0.13 0.10 -0.77 3.88 5.85 -0.71 -0.47 115.31 123.32 1wqa h LEU 193 Ca -0.11 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1wqa h LEU 193 Cb 1.56 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.56 1wqa h LEU 193 CO 0.17 0.09 0.44 -0.07 -0.34 0.00 0.00 178.44 178.73 1wqa h LEU 194 N 0.20 0.94 -0.51 2.25 3.38 -1.21 -0.36 115.31 120.01 1wqa h LEU 194 Ca 0.11 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1wqa h LEU 194 Cb 0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1wqa h LEU 194 CO -0.11 0.75 -0.03 -0.09 0.09 0.00 0.00 178.44 179.05 1wqa h ARG 195 N 1.06 0.92 0.00 1.13 2.43 -1.11 -1.32 114.38 117.49 1wqa h ARG 195 Ca 0.27 -0.31 -0.06 0.00 -0.81 0.00 0.00 59.98 59.07 1wqa h ARG 195 Cb 0.00 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1wqa h ARG 195 CO -0.05 0.96 -0.31 0.93 -1.51 0.00 0.00 179.97 179.99 1wqa h GLU 196 N 0.78 0.00 0.00 0.20 5.08 -0.73 -1.95 114.58 117.96 1wqa h GLU 196 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1wqa h GLU 196 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1wqa h GLU 196 CO 0.03 0.31 0.00 -0.07 -1.00 0.00 0.00 179.01 178.28 1wqa h LEU 197 N 0.00 0.00 0.00 1.33 3.38 -0.80 -3.46 115.31 115.76 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 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1wqa h LEU 197 CO 0.04 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.18 1wqa n GLY 198 N 0.18 1.36 3.90 0.83 0.00 -0.73 -3.23 105.19 107.50 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 -4.88 4.22 -0.06 0.00 2.20 0.12 -4.47 119.74 116.85 1wqa s LYS 200 Ca 0.50 0.39 0.05 0.00 -0.36 0.00 0.00 55.97 56.55 1wqa s LYS 200 Cb -0.10 -3.53 -0.00 0.00 -1.51 0.00 0.00 37.83 32.68 1wqa s LYS 200 CO 0.47 -0.07 -0.22 0.08 -0.36 0.00 0.00 175.35 175.25 1wqa s VAL 201 N 1.38 1.81 -0.03 4.02 1.01 -1.26 -1.56 120.40 125.78 1wqa s VAL 201 Ca 0.24 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.36 1wqa s VAL 201 Cb -0.15 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 1wqa s VAL 201 CO 0.09 0.51 -0.20 -0.63 0.00 0.00 0.00 175.10 174.87 1wqa s ILE 202 N 0.08 1.59 0.15 2.22 -1.09 -1.10 -5.04 121.20 118.01 1wqa s ILE 202 Ca -0.08 -0.85 0.09 0.00 -2.23 0.00 0.00 60.65 57.58 1wqa s ILE 202 Cb -0.14 -1.34 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 1wqa s ILE 202 CO 0.05 0.45 -0.21 0.42 -1.23 0.00 0.00 174.94 174.41 1wqa s THR 203 N -0.34 1.95 -0.09 2.92 -4.23 -1.26 -1.35 115.64 113.25 1wqa s THR 203 Ca 0.04 -1.81 0.02 0.00 -1.18 0.00 0.00 61.69 58.77 1wqa s THR 203 Cb -0.09 -1.83 0.01 0.00 1.34 0.00 0.00 72.50 71.93 1wqa s THR 203 CO 0.00 -0.14 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.09 1wqa s VAL 204 N -1.57 1.47 -1.43 2.29 1.01 0.39 -4.80 120.40 117.76 1wqa s VAL 204 Ca 0.14 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1wqa s VAL 204 Cb -0.08 -1.32 0.05 0.00 0.00 0.00 0.00 36.38 35.02 1wqa s VAL 204 CO 0.06 0.43 0.99 0.59 0.00 0.00 0.00 175.10 177.18 1wqa n ASN 205 N 3.90 -4.41 -1.19 3.32 3.02 -1.26 -2.91 115.26 115.73 1wqa n ASN 205 Ca -0.21 -0.71 0.07 0.00 -0.03 0.00 0.00 54.58 53.71 1wqa n ASN 205 Cb 0.52 -4.30 0.26 0.00 -0.61 0.00 0.00 39.78 35.65 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 -4.67 2.80 -2.67 5.41 0.00 -1.26 -0.39 120.51 119.73 1wqa n ALA 206 Ca -0.05 -1.11 -0.38 0.00 0.00 0.00 0.00 53.44 51.90 1wqa n ALA 206 Cb 0.57 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.63 4.18 0.12 0.00 0.00 -1.26 -4.78 119.66 116.30 1wqa s GLN 207 Ca 0.38 0.24 -0.31 0.00 -0.00 0.00 0.00 55.36 55.67 1wqa s GLN 207 Cb 0.23 -3.54 -0.10 0.00 0.00 0.00 0.00 33.01 29.60 1wqa s GLN 207 CO 0.20 -0.05 1.72 -2.14 0.00 0.00 0.00 175.29 175.02 1wqa s PRO 208 N 1.34 4.17 -0.29 9.60 0.02 -1.26 -4.31 135.00 144.26 1wqa s PRO 208 Ca 0.20 2.48 0.02 0.00 0.02 0.00 0.00 61.00 63.72 1wqa s PRO 208 Cb -0.15 -3.46 0.19 0.00 0.02 0.00 0.00 34.50 31.10 1wqa s PRO 208 CO 0.08 -0.76 0.57 0.34 -0.33 0.00 0.00 177.00 176.90 1wqa s ASP 209 N 2.18 -1.29 0.04 2.53 -1.08 -0.67 -5.01 116.67 113.37 1wqa s ASP 209 Ca 0.76 0.47 0.03 0.00 -0.52 0.00 0.00 52.55 53.29 1wqa s ASP 209 Cb -0.44 1.99 0.16 0.00 -1.46 0.00 0.00 42.92 43.16 1wqa s ASP 209 CO 0.34 -0.29 1.09 0.61 0.52 0.00 0.00 175.17 177.44 1wqa n GLY 210 N 5.42 -0.54 0.03 2.66 0.00 -1.07 -0.27 105.19 111.41 1wqa n GLY 210 Ca 0.02 0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.60 0.26 -3.87 1.61 4.01 -1.26 -4.34 117.16 111.98 1wqa n TYR 211 Ca -0.00 0.08 -0.37 0.00 -0.16 0.00 0.00 57.90 57.45 1wqa n TYR 211 Cb 0.01 -0.63 0.03 0.00 -0.31 0.00 0.00 39.34 38.44 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 -1.72 -1.68 -0.34 -0.72 3.72 0.63 -4.83 117.46 112.53 1wqa n PHE 212 Ca 0.06 0.33 0.09 0.00 -0.05 0.00 0.00 57.45 57.88 1wqa n PHE 212 Cb 0.34 -3.20 0.26 0.00 -0.94 0.00 0.00 39.48 35.95 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 -2.17 0.77 -0.34 -1.08 0.11 -1.93 -2.76 132.00 124.59 1wqa h PRO 213 Ca -0.68 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.35 1wqa h PRO 213 Cb 1.38 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1wqa h PRO 213 CO 0.51 0.51 0.08 0.00 -0.21 0.00 0.00 178.00 178.89 1wqa h ALA 214 N 1.58 0.45 0.00 -0.75 0.00 -1.93 -3.48 119.26 115.12 1wqa h ALA 214 Ca 0.52 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1wqa h ALA 214 Cb 0.69 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1wqa h ALA 214 CO -0.34 0.11 0.00 2.89 0.00 0.00 0.00 179.25 181.92 1wqa n ARG 215 N -4.63 0.00 -1.68 0.00 0.00 -1.04 -5.10 116.66 104.21 1wqa n ARG 215 Ca -0.02 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.40 1wqa n ARG 215 Cb 0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 32.46 32.64 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 2.71 -2.88 2.89 3.02 -1.26 -4.78 115.26 114.96 1wqa n ASN 216 Ca 0.00 1.17 -0.20 0.00 -0.03 0.00 0.00 54.58 55.52 1wqa n ASN 216 Cb 0.00 -1.45 -0.05 0.00 -0.61 0.00 0.00 39.78 37.68 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 1.39 2.03 -3.98 3.52 -0.04 -1.25 -4.80 135.00 131.88 1wqa n PRO 217 Ca 0.09 -1.29 -0.30 0.00 -0.04 0.00 0.00 63.50 61.95 1wqa n PRO 217 Cb 0.33 -2.29 -0.16 0.00 -0.04 0.00 0.00 33.50 31.34 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 2.72 1.89 0.00 0.54 2.12 -1.25 -1.95 118.70 122.77 1wqa s GLU 218 Ca 0.44 -0.88 -0.05 0.00 0.36 0.00 0.00 54.97 54.85 1wqa s GLU 218 Cb 0.14 -2.45 -0.23 0.00 0.26 0.00 0.00 34.13 31.86 1wqa s GLU 218 CO -0.03 -0.48 3.26 -2.30 -0.54 0.00 0.00 175.26 175.18 1wqa n PRO 219 N 4.68 1.77 -2.10 4.30 -0.02 -1.26 -4.74 135.00 137.63 1wqa n PRO 219 Ca -0.14 -0.84 -0.29 0.00 -2.02 0.00 0.00 63.50 60.21 1wqa n PRO 219 Cb 0.46 -1.87 0.03 0.00 -0.02 0.00 0.00 33.50 32.09 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 2.06 5.79 0.27 2.55 6.03 -1.26 -4.90 114.94 125.48 1wqa s ASN 220 Ca 0.56 1.08 -0.00 0.00 -1.03 0.00 0.00 52.86 53.47 1wqa s ASN 220 Cb 0.27 -2.05 0.54 0.00 -3.03 0.00 0.00 41.25 36.98 1wqa s ASN 220 CO 0.00 -1.05 1.79 -0.08 -2.03 0.00 0.00 177.10 175.73 1wqa h GLU 221 N -0.34 0.75 -0.17 3.55 4.81 -1.97 -2.25 114.58 118.96 1wqa h GLU 221 Ca -0.45 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 58.77 1wqa h GLU 221 Cb 1.23 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 1wqa h GLU 221 CO 0.62 0.49 -0.06 0.93 -0.73 0.00 0.00 179.01 180.27 1wqa h GLU 222 N 0.77 -0.02 0.00 1.92 5.08 -1.96 -2.43 114.58 117.94 1wqa h GLU 222 Ca 0.48 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.82 1wqa h GLU 222 Cb 0.60 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 1wqa h GLU 222 CO -0.32 -0.01 -0.11 -0.91 -1.00 0.00 0.00 179.01 176.66 1wqa h ASN 223 N -0.02 0.00 -0.54 1.42 -0.26 -1.71 -2.96 115.58 111.50 1wqa h ASN 223 Ca 0.09 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.83 1wqa h ASN 223 Cb 0.15 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 1wqa h ASN 223 CO -0.19 0.11 0.00 0.18 -1.06 0.00 0.00 177.43 176.47 1wqa n LEU 224 N -3.38 3.97 -0.08 1.61 4.77 -0.93 -4.52 117.00 118.44 1wqa n LEU 224 Ca -0.01 -2.00 -0.07 0.00 -0.03 0.00 0.00 56.01 53.90 1wqa n LEU 224 Cb 0.29 -0.52 -0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1wqa n LEU 224 CO 0.29 0.69 0.75 0.50 -1.33 0.00 0.00 177.39 178.29 1wqa h LYS 225 N 3.41 -0.11 -0.37 3.23 3.64 -1.38 0.15 116.57 125.13 1wqa h LYS 225 Ca 0.00 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 1wqa h LYS 225 Cb 1.22 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 1wqa h LYS 225 CO 0.18 -0.08 -0.04 0.93 -2.27 0.00 0.00 179.45 178.18 1wqa h GLU 226 N -0.12 0.68 -0.51 1.90 3.07 -1.87 -2.91 114.58 114.83 1wqa h GLU 226 Ca 0.16 -0.24 0.05 0.00 -0.50 0.00 0.00 59.36 58.84 1wqa h GLU 226 Cb 0.36 -0.05 -0.05 0.00 -0.84 0.00 0.00 28.75 28.17 1wqa h GLU 226 CO -0.39 0.81 0.23 0.35 -1.40 0.00 0.00 179.01 178.61 1wqa h PHE 227 N 0.49 0.42 -0.79 4.33 3.57 -1.65 -1.01 116.94 122.30 1wqa h PHE 227 Ca 0.10 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.70 1wqa h PHE 227 Cb 0.52 -0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 1wqa h PHE 227 CO 0.04 0.18 0.46 0.52 -2.23 0.00 0.00 178.31 177.28 1wqa h MET 228 N 0.45 0.79 -0.65 1.11 2.86 -0.67 -0.16 114.93 118.66 1wqa h MET 228 Ca 0.23 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.79 1wqa h MET 228 Cb 0.19 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1wqa h MET 228 CO -0.19 0.52 0.28 0.93 1.06 0.00 0.00 176.91 179.51 1wqa h GLU 229 N 0.81 0.96 -0.83 1.72 4.39 -1.15 -2.68 114.58 117.81 1wqa h GLU 229 Ca 0.36 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 1wqa h GLU 229 Cb 0.26 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.71 1wqa h GLU 229 CO -0.21 0.79 0.45 0.82 -1.16 0.00 0.00 179.01 179.70 1wqa h ILE 230 N 0.91 1.24 -0.63 3.13 2.04 -0.06 0.96 117.51 125.10 1wqa h ILE 230 Ca 0.22 -0.61 0.03 0.00 1.00 0.00 0.00 64.86 65.50 1wqa h ILE 230 Cb 0.17 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.34 1wqa h ILE 230 CO -0.02 0.27 0.38 0.58 0.00 0.00 0.00 178.15 179.36 1wqa h VAL 231 N 1.16 1.06 -0.13 1.67 2.07 -0.74 -0.86 116.25 120.48 1wqa h VAL 231 Ca 0.29 -0.26 -0.23 0.00 0.82 0.00 0.00 66.70 67.33 1wqa h VAL 231 Cb 0.03 0.26 0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1wqa h VAL 231 CO -0.05 0.14 -0.81 0.50 0.02 0.00 0.00 177.57 177.37 1wqa h LYS 232 N 0.74 0.76 -0.64 1.57 3.64 -1.22 -2.56 116.57 118.87 1wqa h LYS 232 Ca 0.25 -0.64 -0.02 0.00 -1.27 0.00 0.00 60.65 58.97 1wqa h LYS 232 Cb 0.04 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 1wqa h LYS 232 CO -0.11 1.25 0.31 0.00 -2.27 0.00 0.00 179.45 178.62 1wqa h ALA 233 N 0.56 0.82 0.00 5.00 0.00 -0.56 -2.25 119.26 122.83 1wqa h ALA 233 Ca -0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wqa h ALA 233 Cb 1.44 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1wqa h ALA 233 CO 0.16 0.39 0.00 -0.07 0.00 0.00 0.00 179.25 179.73 1wqa h LEU 234 N 0.88 0.00 0.53 0.00 3.38 -1.20 -3.47 115.31 115.42 1wqa h LEU 234 Ca 0.22 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.00 1wqa h LEU 234 Cb 0.12 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.89 1wqa h LEU 234 CO -0.03 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 178.84 1wqa n GLY 235 N 0.38 0.07 3.82 0.83 0.00 -0.85 -5.01 105.19 104.44 1wqa n GLY 235 Ca 0.03 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.74 2.88 0.40 4.61 0.00 -0.98 -4.95 121.76 120.98 1wqa s ALA 236 Ca 0.10 0.25 0.13 0.00 0.00 0.00 0.00 51.96 52.44 1wqa s ALA 236 Cb -0.05 -3.17 0.81 0.00 0.00 0.00 0.00 23.12 20.71 1wqa s ALA 236 CO 0.13 -0.64 1.89 -0.44 0.00 0.00 0.00 175.76 176.70 1wqa h ASP 237 N 0.44 0.03 -5.27 0.00 3.32 -1.31 -3.40 116.42 110.23 1wqa h ASP 237 Ca -0.46 -0.01 0.38 0.00 0.02 0.00 0.00 57.03 56.96 1wqa h ASP 237 Cb 1.20 -0.01 -0.17 0.00 0.22 0.00 0.00 39.33 40.58 1wqa h ASP 237 CO 0.59 0.32 1.00 0.72 -1.72 0.00 0.00 179.24 180.15 1wqa s PHE 238 N -4.40 -0.00 0.22 4.55 -0.12 -1.22 -3.21 117.98 113.80 1wqa s PHE 238 Ca -0.03 -0.00 0.09 0.00 -0.05 0.00 0.00 56.93 56.94 1wqa s PHE 238 Cb 0.15 0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 42.99 1wqa s PHE 238 CO 0.72 -0.00 -0.17 0.20 -0.05 0.00 0.00 175.22 175.92 1wqa s GLY 239 N -2.64 1.56 -0.01 1.99 0.00 0.11 -2.04 107.32 106.29 1wqa s GLY 239 Ca 0.14 -1.69 0.01 0.00 0.00 0.00 0.00 44.72 43.18 1wqa s GLY 239 CO -0.05 -1.77 -0.01 0.14 0.00 0.00 0.00 173.10 171.41 1wqa s VAL 240 N -2.64 0.14 -0.01 1.40 1.01 0.12 -1.18 120.40 119.25 1wqa s VAL 240 Ca 0.23 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.25 1wqa s VAL 240 Cb -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 1wqa s VAL 240 CO 0.09 0.07 -0.16 0.00 0.00 0.00 0.00 175.10 175.11 1wqa s ALA 241 N 0.31 1.30 0.31 5.51 0.00 0.15 -0.69 121.76 128.65 1wqa s ALA 241 Ca -0.03 -0.70 0.10 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 0.31 -0.09 -0.65 0.00 0.00 0.00 175.76 175.33 1wqa s GLN 242 N -0.47 1.92 0.85 0.00 -0.21 -0.47 -0.13 119.66 121.16 1wqa s GLN 242 Ca 0.06 -1.75 -0.08 0.00 0.02 0.00 0.00 55.36 53.61 1wqa s GLN 242 Cb -0.06 -1.86 0.18 0.00 1.00 0.00 0.00 33.01 32.26 1wqa s GLN 242 CO -0.00 0.24 1.17 0.16 -2.12 0.00 0.00 175.29 174.73 1wqa s ASP 243 N -3.62 3.61 0.20 5.90 3.84 -1.24 -4.37 116.67 120.99 1wqa s ASP 243 Ca 0.32 -0.19 -0.15 0.00 -0.00 0.00 0.00 52.55 52.53 1wqa s ASP 243 Cb -0.02 0.05 0.19 0.00 -1.38 0.00 0.00 42.92 41.76 1wqa s ASP 243 CO 0.17 -2.38 1.63 1.23 -0.00 0.00 0.00 175.17 175.83 1wqa h GLY 244 N -1.11 0.36 -2.10 2.12 0.00 -1.20 -1.62 103.07 99.51 1wqa h GLY 244 Ca -0.39 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1wqa h GLY 244 CO 0.35 -0.22 0.00 2.09 0.00 0.00 0.00 176.54 178.77 1wqa n ASP 245 N -5.40 3.07 -2.79 0.19 3.85 -1.17 -1.12 116.55 113.17 1wqa n ASP 245 Ca 0.06 -1.99 -0.20 0.00 -0.71 0.00 0.00 54.79 51.94 1wqa n ASP 245 Cb 0.30 -0.38 0.01 0.00 -1.35 0.00 0.00 41.12 39.70 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 1.18 -0.85 0.06 2.12 0.00 -0.61 -0.98 120.51 121.42 1wqa n ALA 246 Ca 0.19 0.19 0.02 0.00 0.00 0.00 0.00 53.44 53.84 1wqa n ALA 246 Cb 0.49 -2.82 -0.05 0.00 0.00 0.00 0.00 19.45 17.06 1wqa n ALA 246 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1wqa h ASP 247 N -0.68 0.00 -2.67 0.00 2.03 -1.86 -3.38 116.42 109.86 1wqa h ASP 247 Ca -0.46 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.27 1wqa h ASP 247 Cb 1.33 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.80 1wqa h ASP 247 CO 0.53 0.49 -0.47 -0.13 -1.03 0.00 0.00 179.24 178.63 1wqa s ARG 248 N -2.98 3.44 -0.03 4.15 0.52 -1.26 -0.03 118.95 122.75 1wqa s ARG 248 Ca -0.02 -0.54 -0.01 0.00 -0.52 0.00 0.00 55.73 54.64 1wqa s ARG 248 Cb 0.09 -2.98 0.03 0.00 0.52 0.00 0.00 34.95 32.60 1wqa s ARG 248 CO 0.80 0.54 0.05 0.00 0.02 0.00 0.00 175.30 176.71 1wqa s ALA 249 N -1.67 0.14 -0.10 2.13 0.00 -1.26 -3.67 121.76 117.32 1wqa s ALA 249 Ca 0.35 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.58 1wqa s ALA 249 Cb -0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.53 1wqa s ALA 249 CO 0.28 -0.31 -0.13 0.08 0.00 0.00 0.00 175.76 175.69 1wqa s VAL 250 N 1.64 3.12 0.01 0.00 1.01 0.82 -4.92 120.40 122.09 1wqa s VAL 250 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1wqa s VAL 250 Cb -0.12 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1wqa s VAL 250 CO -0.03 0.55 0.08 -0.36 0.00 0.00 0.00 175.10 175.34 1wqa s PHE 251 N -0.06 3.26 -0.08 5.22 0.08 -1.26 -0.67 117.98 124.47 1wqa s PHE 251 Ca -0.02 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.21 1wqa s PHE 251 Cb -0.14 -1.71 0.02 0.00 -0.57 0.00 0.00 43.02 40.62 1wqa s PHE 251 CO 0.04 0.54 -0.07 0.42 -0.10 0.00 0.00 175.22 176.05 1wqa s ILE 252 N -1.23 0.82 1.01 0.64 -1.09 -0.32 -1.32 121.20 119.71 1wqa s ILE 252 Ca 0.24 -0.22 -0.16 0.00 -2.23 0.00 0.00 60.65 58.28 1wqa s ILE 252 Cb -0.12 -0.84 0.20 0.00 -1.58 0.00 0.00 42.46 40.12 1wqa s ILE 252 CO 0.15 0.31 1.20 1.51 -1.23 0.00 0.00 174.94 176.89 1wqa s ASP 253 N 1.32 2.70 0.37 3.58 3.84 -0.51 0.05 116.67 128.03 1wqa s ASP 253 Ca -0.03 0.59 0.24 0.00 -0.00 0.00 0.00 52.55 53.34 1wqa s ASP 253 Cb -0.14 -0.86 1.29 0.00 -1.38 0.00 0.00 42.92 41.84 1wqa s ASP 253 CO -0.03 -3.02 1.72 -0.33 -0.00 0.00 0.00 175.17 173.51 1wqa h GLU 254 N -1.83 0.00 -0.45 2.11 3.07 -1.77 -0.02 114.58 115.70 1wqa h GLU 254 Ca -0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 1wqa h GLU 254 Cb 1.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 1wqa h GLU 254 CO 0.45 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 178.15 1wqa n ASN 255 N -2.35 3.15 -0.04 1.42 3.02 -1.26 -4.50 115.26 114.70 1wqa n ASN 255 Ca -0.02 -1.95 -0.01 0.00 -0.03 0.00 0.00 54.58 52.57 1wqa n ASN 255 Cb 0.08 -0.29 -0.00 0.00 -0.61 0.00 0.00 39.78 38.95 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 1.45 0.43 3.75 7.41 0.00 -0.02 -4.90 105.19 113.31 1wqa n GLY 256 Ca 0.20 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.83 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 -1.91 4.30 -0.17 1.61 3.52 -1.25 -4.81 118.95 120.24 1wqa s ARG 257 Ca 0.00 0.64 -0.29 0.00 -0.13 0.00 0.00 55.73 55.95 1wqa s ARG 257 Cb 0.00 -3.36 -0.01 0.00 -1.56 0.00 0.00 34.95 30.01 1wqa s ARG 257 CO 0.00 0.32 1.22 0.12 -0.81 0.00 0.00 175.30 176.15 1wqa s PHE 258 N 0.03 2.94 -0.11 5.12 5.36 -1.26 -1.42 117.98 128.63 1wqa s PHE 258 Ca 0.30 1.09 -0.15 0.00 -0.96 0.00 0.00 56.93 57.20 1wqa s PHE 258 Cb -0.17 -3.46 -0.05 0.00 -0.34 0.00 0.00 43.02 39.00 1wqa s PHE 258 CO 0.15 -1.49 0.37 0.42 -1.46 0.00 0.00 175.22 173.21 1wqa s ILE 259 N 3.40 5.21 0.32 3.12 1.09 -0.44 -4.99 121.20 128.92 1wqa s ILE 259 Ca 0.53 0.73 -0.29 0.00 -1.10 0.00 0.00 60.65 60.52 1wqa s ILE 259 Cb -0.21 -3.70 -0.10 0.00 -1.06 0.00 0.00 42.46 37.39 1wqa s ILE 259 CO 0.14 0.43 1.27 -1.58 -0.10 0.00 0.00 174.94 175.10 1wqa s GLN 260 N 0.07 4.40 0.29 2.79 2.00 -1.26 -4.47 119.66 123.47 1wqa s GLN 260 Ca 0.21 2.15 0.03 0.00 -2.00 0.00 0.00 55.36 55.75 1wqa s GLN 260 Cb -0.14 -3.09 0.69 0.00 0.80 0.00 0.00 33.01 31.27 1wqa s GLN 260 CO 0.08 -0.12 1.73 0.78 -0.50 0.00 0.00 175.29 177.26 1wqa h GLY 261 N 3.45 1.57 2.00 2.59 0.00 -1.83 -1.15 103.07 109.70 1wqa h GLY 261 Ca -0.49 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 46.61 1wqa h GLY 261 CO 0.66 -0.17 -0.00 1.29 0.00 0.00 0.00 176.54 178.31 1wqa h ASP 262 N 0.54 0.00 -0.09 0.19 2.03 -1.74 -1.10 116.42 116.24 1wqa h ASP 262 Ca 0.54 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.81 1wqa h ASP 262 Cb 0.94 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.44 1wqa h ASP 262 CO -0.45 0.00 -0.09 0.11 -1.03 0.00 0.00 179.24 177.78 1wqa h LYS 263 N 0.00 0.23 -0.07 4.15 1.79 -1.55 0.29 116.57 121.40 1wqa h LYS 263 Ca -0.00 -0.12 -0.11 0.00 -2.18 0.00 0.00 60.65 58.24 1wqa h LYS 263 Cb 0.01 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1wqa h LYS 263 CO 0.00 0.65 -0.47 1.79 -1.08 0.00 0.00 179.45 180.34 1wqa h THR 264 N -0.18 1.34 -0.23 -0.16 1.35 -1.53 0.05 112.91 113.54 1wqa h THR 264 Ca 0.02 -1.65 -0.00 0.00 -0.55 0.00 0.00 66.41 64.23 1wqa h THR 264 Cb 0.61 1.80 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 1wqa h THR 264 CO 0.02 0.48 0.13 0.15 -0.25 0.00 0.00 175.52 176.06 1wqa h PHE 265 N 0.14 0.31 -0.67 4.73 3.57 -1.13 -0.79 116.94 123.10 1wqa h PHE 265 Ca 0.01 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1wqa h PHE 265 Cb 0.88 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.49 1wqa h PHE 265 CO 0.01 0.26 0.42 0.00 -2.23 0.00 0.00 178.31 176.77 1wqa h ALA 266 N 1.03 0.85 -0.73 2.41 0.00 -0.46 1.00 119.26 123.36 1wqa h ALA 266 Ca 0.08 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1wqa h ALA 266 Cb 0.04 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1wqa h ALA 266 CO -0.01 0.30 0.46 1.25 0.00 0.00 0.00 179.25 181.25 1wqa h LEU 267 N 0.91 0.75 -0.08 0.00 5.85 -0.75 0.10 115.31 122.09 1wqa h LEU 267 Ca 0.24 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.76 1wqa h LEU 267 Cb -0.06 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 40.82 1wqa h LEU 267 CO -0.05 0.51 -0.75 0.58 -0.34 0.00 0.00 178.44 178.40 1wqa h VAL 268 N 0.89 1.32 -0.75 1.05 2.07 -0.74 -3.05 116.25 117.03 1wqa h VAL 268 Ca 0.29 -2.01 -0.02 0.00 0.82 0.00 0.00 66.70 65.78 1wqa h VAL 268 Cb 0.03 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 1wqa h VAL 268 CO -0.11 0.62 0.39 0.00 0.02 0.00 0.00 177.57 178.49 1wqa h ALA 269 N 0.46 1.28 -0.14 1.67 0.00 -0.43 -0.61 119.26 121.49 1wqa h ALA 269 Ca -0.07 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.74 1wqa h ALA 269 Cb 1.40 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1wqa h ALA 269 CO 0.15 0.58 -0.02 0.22 0.00 0.00 0.00 179.25 180.18 1wqa h ASP 270 N 1.06 -0.10 -0.13 0.00 3.58 -0.82 0.20 116.42 120.20 1wqa h ASP 270 Ca 0.26 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.74 1wqa h ASP 270 Cb 0.05 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1wqa h ASP 270 CO -0.04 -0.03 0.03 0.00 -2.88 0.00 0.00 179.24 176.32 1wqa h ALA 271 N 1.13 0.17 -0.08 -0.78 0.00 -1.35 -2.22 119.26 116.13 1wqa h ALA 271 Ca 0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1wqa h ALA 271 Cb 0.10 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1wqa h ALA 271 CO -0.13 -0.20 0.04 0.28 0.00 0.00 0.00 179.25 179.24 1wqa h VAL 272 N 0.01 1.10 -0.11 0.00 2.07 -0.89 -1.79 116.25 116.64 1wqa h VAL 272 Ca 0.04 -0.30 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1wqa h VAL 272 Cb 0.25 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1wqa h VAL 272 CO 0.00 0.09 -0.13 -0.07 0.02 0.00 0.00 177.57 177.48 1wqa h LEU 273 N 0.01 0.17 -0.35 2.57 3.38 -0.66 -1.98 115.31 118.45 1wqa h LEU 273 Ca 0.03 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1wqa h LEU 273 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1wqa h LEU 273 CO -0.00 0.32 -0.24 0.50 0.09 0.00 0.00 178.44 179.11 1wqa h LYS 274 N 0.17 0.78 -0.58 1.13 3.64 -1.15 0.89 116.57 121.45 1wqa h LYS 274 Ca 0.04 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1wqa h LYS 274 Cb 0.35 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 1wqa h LYS 274 CO 0.02 0.99 0.38 0.93 -2.27 0.00 0.00 179.45 179.50 1wqa h GLU 275 N 0.56 0.77 0.00 1.90 5.08 -0.88 -2.46 114.58 119.54 1wqa h GLU 275 Ca 0.07 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1wqa h GLU 275 Cb 0.80 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1wqa h GLU 275 CO 0.06 0.52 -0.13 -0.22 -1.00 0.00 0.00 179.01 178.24 1wqa h LYS 276 N 0.79 0.00 -4.39 2.33 3.64 -1.30 -3.47 116.57 114.16 1wqa h LYS 276 Ca 0.21 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.34 1wqa h LYS 276 Cb -0.08 0.00 0.10 0.00 -0.41 0.00 0.00 32.23 31.85 1wqa h LYS 276 CO -0.04 0.00 -0.49 0.41 -2.27 0.00 0.00 179.45 177.05 1wqa n GLY 277 N 1.26 -0.09 0.00 5.01 0.00 0.22 -4.77 105.19 106.82 1wqa n GLY 277 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.32 0.47 0.00 -0.02 0.00 -0.65 -4.93 105.19 98.74 1wqa n GLY 278 Ca -0.09 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.03 2.81 -0.02 0.00 -1.26 -4.69 105.19 102.00 1wqa n GLY 279 Ca 0.00 -2.12 -0.21 0.00 0.00 0.00 0.00 46.02 43.69 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 0.87 -0.20 0.99 2.96 -1.26 -1.09 118.68 120.95 1wqa s LEU 280 Ca 0.00 -0.09 -0.08 0.00 -0.22 0.00 0.00 54.13 53.73 1wqa s LEU 280 Cb 0.00 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 1wqa s LEU 280 CO 0.00 -0.14 0.09 -0.22 -1.32 0.00 0.00 176.35 174.75 1wqa s LEU 281 N 1.57 3.92 -0.12 -0.68 0.20 0.06 -0.31 118.68 123.31 1wqa s LEU 281 Ca -0.01 0.10 0.00 0.00 0.69 0.00 0.00 54.13 54.92 1wqa s LEU 281 Cb -0.13 -2.01 -0.01 0.00 -0.43 0.00 0.00 46.19 43.61 1wqa s LEU 281 CO -0.03 0.15 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.35 1wqa s VAL 282 N 0.50 2.95 0.08 1.68 1.01 -0.38 -1.19 120.40 125.06 1wqa s VAL 282 Ca 0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 1wqa s VAL 282 Cb -0.12 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1wqa s VAL 282 CO 0.00 0.53 0.15 1.07 0.00 0.00 0.00 175.10 176.85 1wqa n THR 283 N 3.46 0.00 -3.06 3.92 5.66 -0.39 -1.61 114.28 122.25 1wqa n THR 283 Ca -0.18 -0.31 -0.17 0.00 -3.05 0.00 0.00 64.05 60.34 1wqa n THR 283 Cb 0.53 0.23 0.01 0.00 -1.55 0.00 0.00 70.33 69.55 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 -2.67 2.92 0.01 1.09 -4.23 -1.26 -0.56 115.64 110.94 1wqa s THR 284 Ca 0.05 -1.03 0.32 0.00 -1.18 0.00 0.00 61.69 59.84 1wqa s THR 284 Cb -0.01 -2.95 0.34 0.00 1.34 0.00 0.00 72.50 71.22 1wqa s THR 284 CO 0.04 0.00 1.94 -0.37 -0.54 0.00 0.00 174.62 175.69 1wqa h VAL 285 N 0.65 0.00 -0.01 2.29 -1.51 -1.47 -2.66 116.25 113.54 1wqa h VAL 285 Ca -0.40 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.78 1wqa h VAL 285 Cb 1.28 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 1wqa h VAL 285 CO 0.46 0.00 -0.07 0.00 -1.23 0.00 0.00 177.57 176.73 1wqa n ALA 286 N -1.97 2.71 -1.82 5.19 0.00 -1.26 -4.93 120.51 118.43 1wqa n ALA 286 Ca 0.00 -0.44 -0.34 0.00 0.00 0.00 0.00 53.44 52.66 1wqa n ALA 286 Cb 0.22 -1.15 -0.07 0.00 0.00 0.00 0.00 19.45 18.45 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 -2.13 4.33 0.61 0.00 2.01 -1.00 -4.75 115.64 114.71 1wqa s THR 287 Ca 0.34 1.60 -0.18 0.00 0.31 0.00 0.00 61.69 63.76 1wqa s THR 287 Cb 0.21 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 1wqa s THR 287 CO 0.38 -0.14 1.05 -0.24 -0.69 0.00 0.00 174.62 174.99 1wqa n SER 288 N -0.17 1.13 0.17 3.53 2.88 -1.26 -4.87 113.62 115.03 1wqa n SER 288 Ca 0.05 0.81 0.13 0.00 -1.33 0.00 0.00 58.87 58.53 1wqa n SER 288 Cb 0.52 -1.43 0.59 0.00 -0.75 0.00 0.00 64.21 63.14 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 0.51 0.00 -1.00 -3.46 -0.26 -1.98 -2.43 115.58 106.96 1wqa h ASN 289 Ca -0.49 0.00 0.21 0.00 -0.56 0.00 0.00 56.30 55.45 1wqa h ASN 289 Cb 1.36 0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 38.51 1wqa h ASN 289 CO 0.51 0.00 0.61 0.25 -1.06 0.00 0.00 177.43 177.75 1wqa h LEU 290 N 0.00 0.72 -1.00 1.61 5.85 -1.91 0.19 115.31 120.77 1wqa h LEU 290 Ca 0.00 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 1wqa h LEU 290 Cb 0.24 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1wqa h LEU 290 CO 0.00 0.23 -0.36 -0.07 -0.34 0.00 0.00 178.44 177.90 1wqa h LEU 291 N 0.69 0.27 -0.53 2.25 -0.00 -1.80 -1.54 115.31 114.66 1wqa h LEU 291 Ca 0.58 -0.10 -0.06 0.00 -0.00 0.00 0.00 57.88 58.30 1wqa h LEU 291 Cb 1.01 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.58 1wqa h LEU 291 CO -0.38 0.62 0.10 0.44 -0.00 0.00 0.00 178.44 179.23 1wqa h ASP 292 N 0.23 0.83 -0.67 -0.43 3.32 -0.84 -1.77 116.42 117.09 1wqa h ASP 292 Ca 0.03 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 56.85 1wqa h ASP 292 Cb 0.74 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 1wqa h ASP 292 CO 0.06 0.86 0.42 0.44 -1.72 0.00 0.00 179.24 179.30 1wqa h ASP 293 N 0.76 0.69 -0.52 6.45 3.32 -0.68 0.58 116.42 127.02 1wqa h ASP 293 Ca 0.16 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 1wqa h ASP 293 Cb 0.38 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1wqa h ASP 293 CO 0.01 0.48 0.13 0.40 -1.72 0.00 0.00 179.24 178.54 1wqa h ILE 294 N 0.82 1.24 -0.11 0.35 1.08 -1.09 -1.13 117.51 118.67 1wqa h ILE 294 Ca 0.26 -0.85 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 1wqa h ILE 294 Cb 0.00 0.81 -0.01 0.00 -3.07 0.00 0.00 36.82 34.55 1wqa h ILE 294 CO -0.10 0.31 0.05 0.00 -0.69 0.00 0.00 178.15 177.72 1wqa h ALA 295 N 1.00 0.15 -0.39 1.87 0.00 -0.88 -2.95 119.26 118.06 1wqa h ALA 295 Ca 0.16 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.04 1wqa h ALA 295 Cb 0.33 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1wqa h ALA 295 CO 0.00 -0.27 0.08 0.87 0.00 0.00 0.00 179.25 179.94 1wqa h LYS 296 N 0.03 0.21 -1.20 0.00 1.79 -0.77 0.93 116.57 117.57 1wqa h LYS 296 Ca 0.04 -0.01 0.34 0.00 -2.18 0.00 0.00 60.65 58.84 1wqa h LYS 296 Cb 0.16 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 30.70 1wqa h LYS 296 CO -0.00 0.14 0.84 -0.22 -1.08 0.00 0.00 179.45 179.12 1wqa h LYS 297 N 0.21 0.09 -0.26 3.15 3.64 -1.03 0.65 116.57 123.02 1wqa h LYS 297 Ca 0.19 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1wqa h LYS 297 Cb 0.22 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1wqa h LYS 297 CO -0.24 0.06 0.00 0.72 -2.27 0.00 0.00 179.45 177.72 1wqa n HIS 298 N -4.29 0.35 -2.12 1.91 8.25 -0.74 -4.98 115.22 113.59 1wqa n HIS 298 Ca 0.27 -0.49 -0.13 0.00 -0.26 0.00 0.00 57.72 57.11 1wqa n HIS 298 Cb 1.21 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 32.27 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 0.28 0.06 3.91 -1.41 0.00 0.22 -3.12 105.19 105.12 1wqa n GLY 299 Ca 0.09 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.61 3.81 0.58 4.61 0.00 0.23 -4.51 121.76 123.88 1wqa s ALA 300 Ca 0.00 -0.64 -0.09 0.00 0.00 0.00 0.00 51.96 51.23 1wqa s ALA 300 Cb 0.00 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1wqa s ALA 300 CO 0.00 0.61 0.94 0.15 0.00 0.00 0.00 175.76 177.46 1wqa s LYS 301 N -2.85 3.39 -0.02 0.00 1.02 -0.25 -4.25 119.74 116.77 1wqa s LYS 301 Ca 0.40 0.43 0.05 0.00 0.02 0.00 0.00 55.97 56.87 1wqa s LYS 301 Cb -0.12 -2.19 -0.01 0.00 -0.52 0.00 0.00 37.83 34.99 1wqa s LYS 301 CO 0.26 -0.53 -0.16 0.08 -0.92 0.00 0.00 175.35 174.08 1wqa s VAL 302 N -3.04 1.27 -0.12 3.17 1.01 -1.26 -0.76 120.40 120.67 1wqa s VAL 302 Ca 0.53 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1wqa s VAL 302 Cb -0.11 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.22 1wqa s VAL 302 CO 0.50 0.36 -0.19 -0.32 0.00 0.00 0.00 175.10 175.44 1wqa s MET 303 N -0.23 2.68 -0.36 2.72 1.75 -0.33 -4.96 119.30 120.57 1wqa s MET 303 Ca 0.03 -0.73 -0.09 0.00 -1.25 0.00 0.00 55.69 53.65 1wqa s MET 303 Cb -0.08 -2.18 0.03 0.00 2.84 0.00 0.00 34.83 35.45 1wqa s MET 303 CO 0.00 -0.01 0.15 1.03 -0.65 0.00 0.00 175.02 175.55 1wqa s ARG 304 N 0.81 2.71 0.60 4.11 1.81 -1.26 -1.26 118.95 126.47 1wqa s ARG 304 Ca -0.09 -1.14 0.09 0.00 -1.72 0.00 0.00 55.73 52.88 1wqa s ARG 304 Cb -0.16 -3.59 0.10 0.00 -0.45 0.00 0.00 34.95 30.85 1wqa s ARG 304 CO -0.00 -0.68 0.82 0.95 -0.68 0.00 0.00 175.30 175.71 1wqa s THR 305 N 1.47 2.06 0.81 0.02 -4.23 0.28 -4.69 115.64 111.37 1wqa s THR 305 Ca 0.00 -0.98 -0.11 0.00 -1.18 0.00 0.00 61.69 59.42 1wqa s THR 305 Cb -0.19 -2.08 0.08 0.00 1.34 0.00 0.00 72.50 71.65 1wqa s THR 305 CO 0.05 0.00 1.09 -0.54 -0.54 0.00 0.00 174.62 174.68 1wqa s LYS 306 N -4.72 1.93 0.27 3.99 1.02 -1.26 -1.30 119.74 119.67 1wqa s LYS 306 Ca 0.63 0.93 -0.24 0.00 0.02 0.00 0.00 55.97 57.31 1wqa s LYS 306 Cb -0.05 -1.88 -0.09 0.00 -0.52 0.00 0.00 37.83 35.29 1wqa s LYS 306 CO 0.40 -1.81 0.85 0.08 -0.92 0.00 0.00 175.35 173.95 1wqa s VAL 307 N -2.97 4.34 0.00 3.17 1.01 -1.26 -4.73 120.40 119.96 1wqa s VAL 307 Ca 0.62 1.65 0.00 0.00 0.00 0.00 0.00 61.98 64.24 1wqa s VAL 307 Cb -0.17 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.22 1wqa s VAL 307 CO 0.56 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.49 1wqa n GLY 308 N 0.77 4.20 3.77 4.51 0.00 -1.26 -5.03 105.19 112.15 1wqa n GLY 308 Ca -0.01 -1.22 -0.39 0.00 0.00 0.00 0.00 46.02 44.41 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 6.41 0.00 1.61 1.11 -1.26 -3.14 116.67 121.40 1wqa s ASP 309 Ca 0.00 2.60 0.00 0.00 0.18 0.00 0.00 52.55 55.33 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 -0.78 0.00 0.18 1.18 0.00 0.00 175.17 175.75 1wqa n LEU 310 N 0.20 0.00 -0.03 1.23 4.77 -1.26 -4.82 117.00 117.09 1wqa n LEU 310 Ca 0.03 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.90 1wqa n LEU 310 Cb 0.44 -0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 1wqa n LEU 310 CO 0.55 0.00 0.81 0.40 -1.33 0.00 0.00 177.39 177.83 1wqa h ILE 311 N 0.00 1.18 -0.60 -0.08 2.04 -1.90 0.15 117.51 118.29 1wqa h ILE 311 Ca 0.00 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 1wqa h ILE 311 Cb 0.00 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1wqa h ILE 311 CO 0.00 0.16 0.23 0.58 0.00 0.00 0.00 178.15 179.12 1wqa h VAL 312 N 0.04 1.23 -0.58 1.67 2.07 -1.88 -0.25 116.25 118.56 1wqa h VAL 312 Ca 0.04 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 1wqa h VAL 312 Cb 0.22 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1wqa h VAL 312 CO -0.00 0.29 0.19 0.00 0.02 0.00 0.00 177.57 178.07 1wqa h ALA 313 N 1.08 0.76 -0.61 1.67 0.00 -1.88 -0.21 119.26 120.08 1wqa h ALA 313 Ca 0.20 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1wqa h ALA 313 Cb 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1wqa h ALA 313 CO -0.01 0.42 0.12 -0.09 0.00 0.00 0.00 179.25 179.68 1wqa h ARG 314 N 0.82 0.97 -0.23 0.00 9.65 -0.41 -1.96 114.38 123.22 1wqa h ARG 314 Ca 0.19 -0.23 -0.07 0.00 -1.10 0.00 0.00 59.98 58.77 1wqa h ARG 314 Cb 0.27 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.71 1wqa h ARG 314 CO -0.01 0.88 -0.14 0.00 2.80 0.00 0.00 179.97 183.50 1wqa h ALA 315 N 1.20 0.32 -0.85 2.80 0.00 -0.69 -1.27 119.26 120.78 1wqa h ALA 315 Ca 0.19 -0.32 0.11 0.00 0.00 0.00 0.00 54.91 54.89 1wqa h ALA 315 Cb 0.37 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 1wqa h ALA 315 CO 0.01 0.20 0.48 -0.07 0.00 0.00 0.00 179.25 179.87 1wqa h LEU 316 N 0.20 0.67 0.13 0.00 3.38 -0.88 -0.48 115.31 118.33 1wqa h LEU 316 Ca 0.05 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1wqa h LEU 316 Cb 0.66 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1wqa h LEU 316 CO 0.04 0.36 -0.06 0.22 0.09 0.00 0.00 178.44 179.09 1wqa h TYR 317 N 0.77 -0.16 0.00 1.13 3.20 -1.26 0.28 116.97 120.93 1wqa h TYR 317 Ca 0.42 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.26 1wqa h TYR 317 Cb 0.44 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 1wqa h TYR 317 CO -0.06 0.23 -0.13 0.93 -1.64 0.00 0.00 178.16 177.49 1wqa h GLU 318 N -0.60 0.00 -0.29 1.82 4.39 -0.94 -3.00 114.58 115.95 1wqa h GLU 318 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1wqa h GLU 318 Cb 0.47 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1wqa h GLU 318 CO 0.03 0.13 0.00 0.09 -1.16 0.00 0.00 179.01 178.10 1wqa n ASN 319 N -3.84 2.83 -3.94 1.42 3.02 -0.21 -4.98 115.26 109.55 1wqa n ASN 319 Ca -0.02 -2.06 -0.27 0.00 -0.03 0.00 0.00 54.58 52.20 1wqa n ASN 319 Cb 0.23 -0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 39.18 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 0.29 -1.67 -4.58 6.41 5.15 -0.46 -4.92 115.26 115.48 1wqa n ASN 320 Ca 0.10 -0.94 -0.29 0.00 -0.60 0.00 0.00 54.58 52.86 1wqa n ASN 320 Cb 0.42 -3.33 0.21 0.00 -0.53 0.00 0.00 39.78 36.55 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 -4.03 1.59 -0.21 8.20 0.00 0.86 -4.88 107.32 108.85 1wqa s GLY 321 Ca 0.23 0.02 -0.11 0.00 0.00 0.00 0.00 44.72 44.85 1wqa s GLY 321 CO 0.87 0.62 0.02 2.41 0.00 0.00 0.00 173.10 177.02 1wqa n THR 322 N -4.53 1.59 -3.75 0.90 -1.04 0.58 -4.86 114.28 103.15 1wqa n THR 322 Ca 0.06 -0.38 -0.13 0.00 -2.04 0.00 0.00 64.05 61.55 1wqa n THR 322 Cb 0.54 -1.80 -0.09 0.00 -1.82 0.00 0.00 70.33 67.16 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 -2.48 0.04 0.12 12.58 1.10 -1.13 -4.46 121.20 126.97 1wqa s ILE 323 Ca -0.31 -0.37 0.00 0.00 -0.51 0.00 0.00 60.65 59.47 1wqa s ILE 323 Cb 0.09 -0.60 -0.04 0.00 0.15 0.00 0.00 42.46 42.06 1wqa s ILE 323 CO 0.61 -0.20 -0.01 -0.83 -2.11 0.00 0.00 174.94 172.40 1wqa s GLY 324 N -1.01 0.88 -0.05 1.50 0.00 -0.95 -1.26 107.32 106.43 1wqa s GLY 324 Ca -0.11 -1.41 -0.25 0.00 0.00 0.00 0.00 44.72 42.95 1wqa s GLY 324 CO 0.04 -1.42 1.10 0.61 0.00 0.00 0.00 173.10 173.43 1wqa n GLY 325 N -0.07 0.21 1.89 0.20 0.00 -0.64 -1.09 105.19 105.68 1wqa n GLY 325 Ca -0.09 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.80 0.30 -0.30 1.61 0.28 0.67 -4.06 120.64 118.33 1wqa n GLU 326 Ca 0.05 -1.82 -0.02 0.00 -0.16 0.00 0.00 57.16 55.21 1wqa n GLU 326 Cb 0.48 1.57 0.04 0.00 1.43 0.00 0.00 31.44 34.97 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 -0.06 -0.34 3.44 3.07 -1.93 0.14 114.58 118.90 1wqa h GLU 327 Ca -0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1wqa h GLU 327 Cb 0.69 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1wqa h GLU 327 CO 0.20 -0.04 0.00 0.27 -1.40 0.00 0.00 179.01 178.04 1wqa n ASN 328 N -5.47 1.63 0.00 1.42 0.23 -1.26 -3.26 115.26 108.55 1wqa n ASN 328 Ca 0.08 -2.04 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 1wqa n ASN 328 Cb 0.39 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 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 0.87 1.03 3.69 4.83 0.00 0.50 -4.00 105.19 112.11 1wqa n GLY 329 Ca 0.09 -0.85 -0.26 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.14 3.76 -0.02 0.00 -1.26 -0.24 105.19 106.28 1wqa n GLY 330 Ca 0.00 0.50 -0.40 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.20 3.50 -0.17 1.61 1.01 -1.26 -4.12 120.40 117.77 1wqa s VAL 331 Ca 0.20 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1wqa s VAL 331 Cb -0.09 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 32.35 1wqa s VAL 331 CO 0.88 0.35 -0.17 -0.63 0.00 0.00 0.00 175.10 175.53 1wqa s ILE 332 N -1.09 2.37 -0.55 2.22 1.01 -0.25 -2.88 121.20 122.03 1wqa s ILE 332 Ca 0.45 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 60.15 1wqa s ILE 332 Cb -0.32 -2.00 0.14 0.00 0.01 0.00 0.00 42.46 40.29 1wqa s ILE 332 CO 0.41 0.52 0.44 -0.36 0.00 0.00 0.00 174.94 175.95 1wqa s PHE 333 N 1.14 3.44 0.39 3.97 0.40 -1.26 -2.25 117.98 123.82 1wqa s PHE 333 Ca 0.01 -1.89 0.20 0.00 -0.60 0.00 0.00 56.93 54.66 1wqa s PHE 333 Cb -0.14 -3.56 1.18 0.00 0.51 0.00 0.00 43.02 41.01 1wqa s PHE 333 CO -0.07 -0.98 1.69 -1.35 0.70 0.00 0.00 175.22 175.21 1wqa h PRO 334 N 8.28 0.28 0.00 0.24 0.11 -1.78 0.11 132.00 139.23 1wqa h PRO 334 Ca -0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1wqa h PRO 334 Cb 1.06 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1wqa h PRO 334 CO 0.86 0.19 0.00 0.39 -0.21 0.00 0.00 178.00 179.23 1wqa n GLU 335 N -4.79 0.23 -0.01 1.05 -0.58 -1.26 -4.18 120.64 111.10 1wqa n GLU 335 Ca 0.31 0.26 -0.01 0.00 -0.42 0.00 0.00 57.16 57.30 1wqa n GLU 335 Cb 1.07 -1.80 -0.00 0.00 -0.57 0.00 0.00 31.44 30.14 1wqa n GLU 335 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 1wqa n HIS 336 N -2.20 0.01 -3.68 -0.32 -0.00 0.26 -5.07 115.22 104.23 1wqa n HIS 336 Ca 0.05 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.11 1wqa n HIS 336 Cb 0.37 -0.07 -0.09 0.00 -0.12 0.00 0.00 29.99 30.09 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 -1.12 -0.01 -1.30 3.57 -7.23 -0.58 -4.92 120.40 108.83 1wqa s VAL 337 Ca -0.02 0.02 -0.08 0.00 -1.81 0.00 0.00 61.98 60.09 1wqa s VAL 337 Cb 0.00 -0.80 -0.07 0.00 0.56 0.00 0.00 36.38 36.07 1wqa s VAL 337 CO 0.03 0.01 2.57 0.18 -0.31 0.00 0.00 175.10 177.57 1wqa n LEU 338 N 3.38 6.99 -3.51 1.32 4.77 -1.26 -4.07 117.00 124.62 1wqa n LEU 338 Ca -0.17 -3.68 -0.09 0.00 -0.03 0.00 0.00 56.01 52.05 1wqa n LEU 338 Cb 0.56 -1.34 -0.02 0.00 -2.33 0.00 0.00 43.42 40.29 1wqa n LEU 338 CO 0.06 1.40 0.65 -0.83 -1.33 0.00 0.00 177.39 177.34 1wqa s GLY 339 N 2.75 -0.47 0.12 -0.72 0.00 -1.26 -4.40 107.32 103.33 1wqa s GLY 339 Ca 0.56 0.87 -0.31 0.00 0.00 0.00 0.00 44.72 45.83 1wqa s GLY 339 CO -0.05 0.28 1.54 -1.60 0.00 0.00 0.00 173.10 173.27 1wqa s ARG 340 N -3.23 4.24 -0.33 2.90 3.52 -1.26 -4.46 118.95 120.33 1wqa s ARG 340 Ca 0.05 2.26 -0.01 0.00 -0.13 0.00 0.00 55.73 57.90 1wqa s ARG 340 Cb -0.01 -3.31 0.12 0.00 -1.56 0.00 0.00 34.95 30.18 1wqa s ARG 340 CO -0.09 -0.60 0.16 0.34 -0.81 0.00 0.00 175.30 174.31 1wqa s ASP 341 N 1.49 3.52 0.51 -2.12 -1.08 -1.14 -4.63 116.67 113.21 1wqa s ASP 341 Ca 0.69 -1.82 0.17 0.00 -0.52 0.00 0.00 52.55 51.08 1wqa s ASP 341 Cb -0.40 -0.59 1.25 0.00 -1.46 0.00 0.00 42.92 41.72 1wqa s ASP 341 CO 0.31 -0.37 2.10 1.23 0.52 0.00 0.00 175.17 178.95 1wqa h GLY 342 N 7.70 0.08 1.26 2.66 0.00 -0.63 -1.99 103.07 112.16 1wqa h GLY 342 Ca -0.08 -0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 1wqa h GLY 342 CO 0.40 0.02 -0.12 0.00 0.00 0.00 0.00 176.54 176.84 1wqa h ALA 343 N 1.90 0.89 -0.50 3.60 0.00 -1.84 0.18 119.26 123.48 1wqa h ALA 343 Ca 0.09 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1wqa h ALA 343 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1wqa h ALA 343 CO -0.01 0.63 -0.19 1.98 0.00 0.00 0.00 179.25 181.67 1wqa h MET 344 N 0.78 1.01 -0.34 0.00 -1.53 -1.80 -1.26 114.93 111.80 1wqa h MET 344 Ca 0.13 -0.42 -0.00 0.00 -3.44 0.00 0.00 59.70 55.97 1wqa h MET 344 Cb 0.64 -0.04 -0.02 0.00 -0.55 0.00 0.00 31.60 31.63 1wqa h MET 344 CO 0.04 1.10 0.20 1.15 0.14 0.00 0.00 176.91 179.55 1wqa h THR 345 N 0.88 1.12 -0.72 -0.77 2.02 -1.10 -1.14 112.91 113.19 1wqa h THR 345 Ca 0.12 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1wqa h THR 345 Cb 0.76 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 1wqa h THR 345 CO 0.06 0.12 0.47 0.58 0.37 0.00 0.00 175.52 177.11 1wqa h VAL 346 N 0.44 1.19 -0.55 3.16 2.07 -0.77 0.32 116.25 122.11 1wqa h VAL 346 Ca 0.12 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1wqa h VAL 346 Cb 0.01 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 1wqa h VAL 346 CO -0.02 0.19 0.35 0.00 0.02 0.00 0.00 177.57 178.10 1wqa h ALA 347 N 1.25 0.70 -0.37 1.67 0.00 -0.82 0.11 119.26 121.81 1wqa h ALA 347 Ca 0.26 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1wqa h ALA 347 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1wqa h ALA 347 CO -0.05 0.17 0.05 -0.22 0.00 0.00 0.00 179.25 179.20 1wqa h LYS 348 N 0.75 0.62 -0.81 0.00 1.63 -0.67 -1.22 116.57 116.87 1wqa h LYS 348 Ca 0.20 -0.17 -0.04 0.00 -0.85 0.00 0.00 60.65 59.79 1wqa h LYS 348 Cb -0.04 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.48 1wqa h LYS 348 CO -0.04 0.69 0.33 0.28 -3.45 0.00 0.00 179.45 177.26 1wqa h VAL 349 N 0.45 1.26 -0.82 2.00 2.07 -0.71 -0.51 116.25 120.00 1wqa h VAL 349 Ca 0.11 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1wqa h VAL 349 Cb 0.37 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 1wqa h VAL 349 CO 0.01 0.33 0.46 0.58 0.02 0.00 0.00 177.57 178.97 1wqa h VAL 350 N 1.17 1.24 -0.11 2.57 2.07 -0.49 0.62 116.25 123.31 1wqa h VAL 350 Ca 0.27 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1wqa h VAL 350 Cb 0.20 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1wqa h VAL 350 CO -0.02 0.26 0.04 -0.08 0.02 0.00 0.00 177.57 177.79 1wqa h GLU 351 N 1.13 0.17 -0.42 1.57 4.81 -0.75 -0.54 114.58 120.55 1wqa h GLU 351 Ca 0.29 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.53 1wqa h GLU 351 Cb 0.01 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1wqa h GLU 351 CO -0.05 0.30 0.19 0.82 -0.73 0.00 0.00 179.01 179.54 1wqa h ILE 352 N 0.01 0.93 -0.24 2.32 2.04 -0.74 -1.25 117.51 120.57 1wqa h ILE 352 Ca 0.04 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1wqa h ILE 352 Cb 0.19 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1wqa h ILE 352 CO -0.00 0.07 0.15 0.15 0.00 0.00 0.00 178.15 178.52 1wqa h PHE 353 N 0.38 0.28 0.00 1.37 3.57 -0.77 -0.41 116.94 121.37 1wqa h PHE 353 Ca 0.19 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 1wqa h PHE 353 Cb 0.13 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 1wqa h PHE 353 CO -0.12 0.17 -0.01 0.00 -2.23 0.00 0.00 178.31 176.12 1wqa h ALA 354 N 1.10 1.88 0.00 2.41 0.00 -0.55 -2.69 119.26 121.40 1wqa h ALA 354 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1wqa h ALA 354 Cb -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1wqa h ALA 354 CO -0.03 0.02 -1.23 1.63 0.00 0.00 0.00 179.25 179.64 1wqa n LYS 355 N -4.38 0.54 0.05 0.00 5.02 -0.52 -4.41 118.16 114.46 1wqa n LYS 355 Ca -0.03 0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 56.17 1wqa n LYS 355 Cb 0.10 -1.70 0.01 0.00 -0.02 0.00 0.00 35.03 33.42 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 0.50 -0.66 4.39 4.64 -0.73 -3.47 113.55 118.21 1wqa h SER 356 Ca 0.00 -0.35 -0.19 0.00 -0.47 0.00 0.00 61.79 60.78 1wqa h SER 356 Cb 0.93 -0.15 -0.06 0.00 -0.31 0.00 0.00 62.40 62.81 1wqa h SER 356 CO 0.00 1.10 -0.19 0.61 -0.87 0.00 0.00 176.83 177.49 1wqa n GLY 357 N 0.66 0.82 3.68 -0.77 0.00 -1.23 -5.00 105.19 103.35 1wqa n GLY 357 Ca -0.05 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.21 2.11 0.26 1.61 1.02 -1.26 -5.14 119.74 115.12 1wqa s LYS 358 Ca 0.00 -2.33 -0.08 0.00 0.02 0.00 0.00 55.97 53.58 1wqa s LYS 358 Cb 0.00 -1.23 -0.07 0.00 -0.52 0.00 0.00 37.83 36.01 1wqa s LYS 358 CO 0.00 -0.40 0.56 0.15 -0.92 0.00 0.00 175.35 174.75 1wqa s LYS 359 N -3.82 3.76 0.24 1.68 1.02 -1.26 -4.97 119.74 116.39 1wqa s LYS 359 Ca 0.12 0.22 -0.05 0.00 0.02 0.00 0.00 55.97 56.28 1wqa s LYS 359 Cb 0.02 -2.63 0.40 0.00 -0.52 0.00 0.00 37.83 35.10 1wqa s LYS 359 CO 0.07 0.27 1.77 0.35 -0.92 0.00 0.00 175.35 176.88 1wqa h PHE 360 N 2.24 0.64 -0.84 3.18 3.57 -1.98 -0.64 116.94 123.11 1wqa h PHE 360 Ca -0.47 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.11 1wqa h PHE 360 Cb 1.18 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1wqa h PHE 360 CO 0.60 0.19 0.55 0.66 -2.23 0.00 0.00 178.31 178.09 1wqa h SER 361 N 0.58 0.85 -0.48 0.41 4.64 -1.94 -2.27 113.55 115.35 1wqa h SER 361 Ca 0.39 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.61 1wqa h SER 361 Cb 0.47 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1wqa h SER 361 CO -0.31 0.57 -0.07 -0.33 -0.87 0.00 0.00 176.83 175.81 1wqa h GLU 362 N 0.98 0.89 -0.92 4.77 5.08 -1.52 -0.48 114.58 123.38 1wqa h GLU 362 Ca 0.35 -0.32 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1wqa h GLU 362 Cb 0.14 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.27 1wqa h GLU 362 CO -0.12 0.96 0.60 -0.07 -1.00 0.00 0.00 179.01 179.38 1wqa h LEU 363 N 0.74 0.95 -0.00 1.33 3.38 -0.85 -0.18 115.31 120.68 1wqa h LEU 363 Ca 0.13 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1wqa h LEU 363 Cb 0.61 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1wqa h LEU 363 CO 0.04 0.63 -0.01 0.40 0.09 0.00 0.00 178.44 179.59 1wqa h ILE 364 N 1.09 1.56 0.00 1.22 1.08 -1.23 -3.32 117.51 117.92 1wqa h ILE 364 Ca 0.38 -1.65 -0.04 0.00 -0.39 0.00 0.00 64.86 63.16 1wqa h ILE 364 Cb 0.11 2.67 -0.01 0.00 -3.07 0.00 0.00 36.82 36.53 1wqa h ILE 364 CO -0.13 0.43 -0.19 0.44 -0.69 0.00 0.00 178.15 178.01 1wqa h ASP 365 N -0.69 0.00 0.57 1.72 3.32 -0.87 -2.28 116.42 118.19 1wqa h ASP 365 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wqa h ASP 365 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1wqa h ASP 365 CO 0.00 0.19 0.00 -0.62 -1.72 0.00 0.00 179.24 177.09 1wqa n GLU 366 N -3.83 0.08 -2.69 3.56 1.02 -0.10 -4.78 120.64 113.90 1wqa n GLU 366 Ca -0.02 0.15 -0.34 0.00 -0.02 0.00 0.00 57.16 56.93 1wqa n GLU 366 Cb 0.28 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.15 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 -2.87 3.97 0.09 -4.62 1.43 -0.86 -4.95 118.68 110.87 1wqa s LEU 367 Ca 0.12 1.83 -0.37 0.00 -1.03 0.00 0.00 54.13 54.68 1wqa s LEU 367 Cb 0.13 -4.45 -0.17 0.00 0.03 0.00 0.00 46.19 41.72 1wqa s LEU 367 CO 0.33 -0.49 1.30 -2.65 0.23 0.00 0.00 176.35 175.08 1wqa n PRO 368 N -0.57 1.07 -2.97 1.29 -0.02 -1.26 -4.90 135.00 127.64 1wqa n PRO 368 Ca 0.07 0.38 -0.40 0.00 -2.02 0.00 0.00 63.50 61.54 1wqa n PRO 368 Cb 0.53 -2.00 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 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 0.37 4.54 0.03 -0.52 2.36 -1.26 -4.93 119.74 120.33 1wqa s LYS 369 Ca 0.84 1.13 -0.03 0.00 -2.55 0.00 0.00 55.97 55.36 1wqa s LYS 369 Cb -0.97 -3.30 -0.02 0.00 -1.05 0.00 0.00 37.83 32.49 1wqa s LYS 369 CO 0.48 0.45 0.04 0.71 1.55 0.00 0.00 175.35 178.58 1wqa s TYR 370 N -0.69 0.24 -0.03 4.03 2.02 -1.26 -4.75 117.35 116.91 1wqa s TYR 370 Ca 0.37 -0.53 0.05 0.00 -0.37 0.00 0.00 57.07 56.59 1wqa s TYR 370 Cb -0.22 -0.18 -0.01 0.00 -0.40 0.00 0.00 41.96 41.15 1wqa s TYR 370 CO 0.25 -0.29 -0.18 0.71 -1.57 0.00 0.00 175.55 174.47 1wqa s TYR 371 N -2.16 1.68 0.04 2.71 1.51 0.55 -4.98 117.35 116.71 1wqa s TYR 371 Ca -0.09 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.58 1wqa s TYR 371 Cb -0.04 -1.11 -0.03 0.00 -0.11 0.00 0.00 41.96 40.67 1wqa s TYR 371 CO -0.03 -0.10 -0.06 1.14 -1.11 0.00 0.00 175.55 175.39 1wqa s GLN 372 N -0.19 0.52 0.05 -0.62 0.00 -1.26 -0.99 119.66 117.18 1wqa s GLN 372 Ca 0.01 -0.84 0.03 0.00 -0.00 0.00 0.00 55.36 54.57 1wqa s GLN 372 Cb -0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 33.01 32.76 1wqa s GLN 372 CO 0.01 -0.00 -0.10 0.42 0.00 0.00 0.00 175.29 175.61 1wqa s ILE 373 N -1.93 0.77 0.10 3.63 1.01 -0.52 -4.98 121.20 119.28 1wqa s ILE 373 Ca -0.07 -1.18 0.04 0.00 0.00 0.00 0.00 60.65 59.43 1wqa s ILE 373 Cb -0.06 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 1wqa s ILE 373 CO -0.02 -0.33 -0.10 -0.54 0.00 0.00 0.00 174.94 173.96 1wqa s LYS 374 N -1.68 0.88 0.02 2.79 1.02 -1.26 -1.25 119.74 120.26 1wqa s LYS 374 Ca -0.06 -1.21 -0.24 0.00 0.02 0.00 0.00 55.97 54.47 1wqa s LYS 374 Cb -0.10 -0.53 0.06 0.00 -0.52 0.00 0.00 37.83 36.73 1wqa s LYS 374 CO 0.01 0.08 0.56 0.99 -0.92 0.00 0.00 175.35 176.06 1wqa s THR 375 N -2.63 0.02 -0.05 2.17 2.01 -0.13 -4.98 115.64 112.06 1wqa s THR 375 Ca 0.07 -0.17 0.00 0.00 0.31 0.00 0.00 61.69 61.91 1wqa s THR 375 Cb -0.02 -0.96 0.02 0.00 0.01 0.00 0.00 72.50 71.56 1wqa s THR 375 CO -0.00 -0.09 -0.03 -1.59 -0.69 0.00 0.00 174.62 172.21 1wqa s LYS 376 N -2.11 0.75 -0.12 4.92 -2.85 -1.26 0.27 119.74 119.34 1wqa s LYS 376 Ca -0.07 -0.05 0.03 0.00 -1.00 0.00 0.00 55.97 54.88 1wqa s LYS 376 Cb -0.01 -0.85 0.01 0.00 -2.06 0.00 0.00 37.83 34.92 1wqa s LYS 376 CO 0.01 -0.14 -0.20 1.03 0.10 0.00 0.00 175.35 176.15 1wqa s ARG 377 N 1.17 2.74 0.16 1.78 1.81 -1.26 -4.98 118.95 120.36 1wqa s ARG 377 Ca -0.07 -0.76 -0.32 0.00 -1.72 0.00 0.00 55.73 52.86 1wqa s ARG 377 Cb -0.14 -2.20 -0.10 0.00 -0.45 0.00 0.00 34.95 32.07 1wqa s ARG 377 CO -0.01 0.03 1.59 -1.58 -0.68 0.00 0.00 175.30 174.64 1wqa s HIS 378 N 0.73 2.98 -0.03 -0.53 5.65 -1.26 -2.25 115.29 120.58 1wqa s HIS 378 Ca -0.10 0.57 -0.01 0.00 0.25 0.00 0.00 55.06 55.76 1wqa s HIS 378 Cb -0.16 -3.95 0.02 0.00 -1.18 0.00 0.00 32.58 27.31 1wqa s HIS 378 CO 0.01 -3.55 0.06 0.08 -0.65 0.00 0.00 174.74 170.69 1wqa s VAL 379 N 1.30 -0.04 0.50 0.89 1.01 0.14 -4.94 120.40 119.26 1wqa s VAL 379 Ca 0.71 0.14 0.05 0.00 0.00 0.00 0.00 61.98 62.88 1wqa s VAL 379 Cb -0.44 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 35.83 1wqa s VAL 379 CO 0.31 0.06 0.26 -1.83 0.00 0.00 0.00 175.10 173.90 1wqa s GLU 380 N 0.78 2.25 3.67 2.72 -1.05 -1.26 -4.18 118.70 121.62 1wqa s GLU 380 Ca -0.06 -2.04 0.00 0.00 -0.15 0.00 0.00 54.97 52.72 1wqa s GLU 380 Cb -0.09 -1.96 0.00 0.00 -0.44 0.00 0.00 34.13 31.65 1wqa s GLU 380 CO -0.03 -0.42 0.00 0.41 0.95 0.00 0.00 175.26 176.18 1wqa n GLY 381 N -1.51 0.21 2.15 -3.83 0.00 -1.26 -3.87 105.19 97.08 1wqa n GLY 381 Ca -0.05 -0.96 -0.20 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 1.93 6.06 -0.66 1.61 -0.08 -1.26 -4.65 116.55 119.51 1wqa n ASP 382 Ca 0.00 -2.45 0.50 0.00 -1.51 0.00 0.00 54.79 51.33 1wqa n ASP 382 Cb 0.00 -1.38 0.78 0.00 2.34 0.00 0.00 41.12 42.86 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 2.95 -0.00 0.06 -0.67 0.63 -1.25 0.12 116.66 118.49 1wqa n ARG 383 Ca 0.52 1.07 -0.21 0.00 -0.92 0.00 0.00 57.85 58.31 1wqa n ARG 383 Cb 0.62 -2.42 -0.12 0.00 0.45 0.00 0.00 32.46 30.99 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 0.92 0.00 -0.14 3.86 -1.94 -3.15 115.15 114.70 1wqa h HIS 384 Ca 0.90 -0.55 -0.02 0.00 -1.16 0.00 0.00 60.37 59.54 1wqa h HIS 384 Cb 3.54 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 31.92 1wqa h HIS 384 CO -0.00 1.39 -0.09 0.00 0.86 0.00 0.00 177.93 180.10 1wqa h ALA 385 N 0.30 1.23 -0.30 2.45 0.00 0.48 -2.05 119.26 121.37 1wqa h ALA 385 Ca -0.15 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1wqa h ALA 385 Cb 1.74 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1wqa h ALA 385 CO 0.20 0.11 -0.01 0.82 0.00 0.00 0.00 179.25 180.37 1wqa h ILE 386 N 0.00 1.26 -0.38 0.00 1.08 -1.33 -2.57 117.51 115.56 1wqa h ILE 386 Ca -0.00 -0.97 -0.06 0.00 -0.39 0.00 0.00 64.86 63.44 1wqa h ILE 386 Cb 0.30 1.30 -0.02 0.00 -3.07 0.00 0.00 36.82 35.33 1wqa h ILE 386 CO 0.01 0.31 -0.02 0.58 -0.69 0.00 0.00 178.15 178.35 1wqa h VAL 387 N 0.33 1.22 -0.81 1.67 2.07 -1.38 -2.49 116.25 116.85 1wqa h VAL 387 Ca 0.08 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1wqa h VAL 387 Cb 0.46 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1wqa h VAL 387 CO 0.02 0.31 0.45 0.78 0.02 0.00 0.00 177.57 179.15 1wqa h ASN 388 N 0.58 1.01 -0.61 0.57 2.35 -1.30 -1.99 115.58 116.18 1wqa h ASN 388 Ca 0.12 -0.09 -0.05 0.00 -0.55 0.00 0.00 56.30 55.73 1wqa h ASN 388 Cb 0.40 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 1wqa h ASN 388 CO 0.02 0.81 0.20 0.11 -1.65 0.00 0.00 177.43 176.92 1wqa h LYS 389 N 1.13 0.95 -0.65 0.81 1.57 -1.11 -1.91 116.57 117.36 1wqa h LYS 389 Ca 0.29 -0.20 0.10 0.00 -1.87 0.00 0.00 60.65 58.97 1wqa h LYS 389 Cb 0.02 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1wqa h LYS 389 CO -0.05 0.83 0.43 0.28 -0.57 0.00 0.00 179.45 180.38 1wqa h VAL 390 N 0.87 0.90 0.06 0.50 2.07 -0.95 -1.65 116.25 118.05 1wqa h VAL 390 Ca 0.20 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1wqa h VAL 390 Cb 0.27 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1wqa h VAL 390 CO -0.01 0.09 -0.03 0.00 0.02 0.00 0.00 177.57 177.64 1wqa h ALA 391 N 1.67 -0.08 0.03 1.67 0.00 -0.71 -2.37 119.26 119.47 1wqa h ALA 391 Ca 0.30 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1wqa h ALA 391 Cb 0.54 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1wqa h ALA 391 CO -0.09 -0.32 -0.34 0.93 0.00 0.00 0.00 179.25 179.43 1wqa h GLU 392 N -0.52 -0.49 0.12 0.00 5.08 -0.89 0.25 114.58 118.13 1wqa h GLU 392 Ca -0.01 0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1wqa h GLU 392 Cb 0.46 0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 1wqa h GLU 392 CO 0.01 -0.33 -0.50 0.52 -1.00 0.00 0.00 179.01 177.72 1wqa h MET 393 N -0.51 -0.70 -0.72 2.33 2.86 -1.39 0.46 114.93 117.26 1wqa h MET 393 Ca 0.05 0.05 0.16 0.00 -2.06 0.00 0.00 59.70 57.90 1wqa h MET 393 Cb 0.58 0.16 -0.12 0.00 0.06 0.00 0.00 31.60 32.28 1wqa h MET 393 CO -0.26 -0.47 0.05 0.00 1.06 0.00 0.00 176.91 177.30 1wqa h ALA 394 N -0.42 0.80 -0.66 6.32 0.00 -1.20 0.35 119.26 124.44 1wqa h ALA 394 Ca 0.00 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1wqa h ALA 394 Cb 0.74 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1wqa h ALA 394 CO -0.28 -0.40 0.34 0.00 0.00 0.00 0.00 179.25 178.92 1wqa h ARG 395 N 0.15 0.94 0.00 0.00 3.08 0.03 0.29 114.38 118.86 1wqa h ARG 395 Ca 0.40 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 60.30 1wqa h ARG 395 Cb 0.69 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 1wqa h ARG 395 CO -0.59 0.73 -0.13 0.93 -1.07 0.00 0.00 179.97 179.84 1wqa h GLU 396 N 0.91 0.00 -0.62 0.04 4.39 0.32 -1.84 114.58 117.79 1wqa h GLU 396 Ca 0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1wqa h GLU 396 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1wqa h GLU 396 CO -0.03 0.13 0.00 0.54 -1.16 0.00 0.00 179.01 178.48 1wqa n ARG 397 N -3.62 3.03 -1.24 2.33 1.74 0.87 -4.89 116.66 114.88 1wqa n ARG 397 Ca -0.02 -2.04 -0.03 0.00 -0.77 0.00 0.00 57.85 54.99 1wqa n ARG 397 Cb 0.25 -1.75 -0.01 0.00 -1.02 0.00 0.00 32.46 29.93 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 0.84 0.55 3.76 -0.13 0.00 -0.69 -5.03 105.19 104.49 1wqa n GLY 398 Ca 0.18 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.12 3.49 -0.35 1.61 4.12 0.92 -5.00 117.35 120.04 1wqa s TYR 399 Ca 0.00 0.58 -0.29 0.00 0.02 0.00 0.00 57.07 57.38 1wqa s TYR 399 Cb 0.00 -2.26 0.01 0.00 -1.52 0.00 0.00 41.96 38.19 1wqa s TYR 399 CO 0.00 0.35 1.28 0.99 0.02 0.00 0.00 175.55 178.18 1wqa s THR 400 N 0.12 4.14 -0.05 -0.71 2.01 -1.26 -3.74 115.64 116.15 1wqa s THR 400 Ca 0.16 1.26 0.04 0.00 0.31 0.00 0.00 61.69 63.45 1wqa s THR 400 Cb -0.13 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.10 1wqa s THR 400 CO 0.04 -0.61 -0.16 -0.69 -0.69 0.00 0.00 174.62 172.51 1wqa s VAL 401 N 4.52 2.89 -0.29 3.82 1.01 -1.26 0.51 120.40 131.60 1wqa s VAL 401 Ca 0.55 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 1wqa s VAL 401 Cb -0.14 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.16 1wqa s VAL 401 CO 0.25 0.59 -0.00 -0.62 0.00 0.00 0.00 175.10 175.31 1wqa s ASP 402 N -0.64 4.80 -0.47 3.32 -1.08 -0.24 -4.93 116.67 117.44 1wqa s ASP 402 Ca 0.10 -1.16 0.02 0.00 -0.52 0.00 0.00 52.55 50.99 1wqa s ASP 402 Cb -0.11 -1.72 0.55 0.00 -1.46 0.00 0.00 42.92 40.18 1wqa s ASP 402 CO 0.01 -0.23 1.89 0.35 0.52 0.00 0.00 175.17 177.71 1wqa n THR 403 N 4.65 3.14 -0.15 1.71 -2.24 -1.25 -2.16 114.28 117.98 1wqa n THR 403 Ca -0.14 -2.03 -0.08 0.00 -2.27 0.00 0.00 64.05 59.54 1wqa n THR 403 Cb 0.44 -0.72 0.01 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.93 1.14 -1.89 4.28 2.02 -1.97 -3.38 112.91 114.03 1wqa h THR 404 Ca 0.57 -0.30 -0.37 0.00 0.77 0.00 0.00 66.41 67.09 1wqa h THR 404 Cb 2.13 0.50 -0.30 0.00 -1.74 0.00 0.00 68.15 68.74 1wqa h THR 404 CO 1.14 0.14 -0.69 -0.62 0.37 0.00 0.00 175.52 175.85 1wqa s ASP 405 N -5.67 0.94 0.00 4.18 -1.08 -1.26 -4.79 116.67 108.99 1wqa s ASP 405 Ca -0.13 -1.70 0.00 0.00 -0.52 0.00 0.00 52.55 50.20 1wqa s ASP 405 Cb 0.11 0.60 0.00 0.00 -1.46 0.00 0.00 42.92 42.18 1wqa s ASP 405 CO 0.74 -0.23 0.00 0.61 0.52 0.00 0.00 175.17 176.80 1wqa n GLY 406 N 4.04 -1.83 3.54 2.66 0.00 -1.26 -4.81 105.19 107.53 1wqa n GLY 406 Ca 0.13 -1.59 -0.37 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.32 3.36 -0.33 4.61 0.00 0.10 -3.93 121.76 124.24 1wqa s ALA 407 Ca 0.00 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 50.91 1wqa s ALA 407 Cb 0.00 -2.24 0.10 0.00 0.00 0.00 0.00 23.12 20.98 1wqa s ALA 407 CO 0.00 -0.43 0.09 0.21 0.00 0.00 0.00 175.76 175.63 1wqa s LYS 408 N 1.51 1.07 -0.12 0.00 2.20 -0.92 -0.08 119.74 123.41 1wqa s LYS 408 Ca 0.06 -1.47 -0.29 0.00 -0.36 0.00 0.00 55.97 53.91 1wqa s LYS 408 Cb -0.15 -2.53 -0.03 0.00 -1.51 0.00 0.00 37.83 33.61 1wqa s LYS 408 CO 0.06 -0.98 1.34 0.42 -0.36 0.00 0.00 175.35 175.84 1wqa s ILE 409 N 1.25 4.09 -0.25 5.43 1.01 -0.21 -1.08 121.20 131.44 1wqa s ILE 409 Ca 0.11 1.35 -0.11 0.00 0.00 0.00 0.00 60.65 62.00 1wqa s ILE 409 Cb -0.18 -3.87 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1wqa s ILE 409 CO -0.17 -0.10 0.17 -0.63 0.00 0.00 0.00 174.94 174.21 1wqa s ILE 410 N 3.36 5.35 0.26 2.92 -1.09 0.18 -1.53 121.20 130.65 1wqa s ILE 410 Ca 0.59 0.18 0.11 0.00 -2.23 0.00 0.00 60.65 59.30 1wqa s ILE 410 Cb -0.25 -3.51 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 1wqa s ILE 410 CO 0.19 0.33 -0.12 -0.36 -1.23 0.00 0.00 174.94 173.74 1wqa s PHE 411 N 1.19 2.47 -0.10 3.97 0.40 0.12 -4.43 117.98 121.61 1wqa s PHE 411 Ca 0.08 -0.28 0.30 0.00 -0.60 0.00 0.00 56.93 56.42 1wqa s PHE 411 Cb -0.14 -1.10 1.26 0.00 0.51 0.00 0.00 43.02 43.55 1wqa s PHE 411 CO 0.06 0.65 1.89 1.05 0.70 0.00 0.00 175.22 179.57 1wqa h GLU 412 N 2.28 0.00 0.00 0.44 4.11 -2.01 -2.77 114.58 116.62 1wqa h GLU 412 Ca -0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1wqa h GLU 412 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1wqa h GLU 412 CO 0.59 0.00 -1.54 -3.47 0.07 0.00 0.00 179.01 174.66 1wqa n ASP 413 N -2.77 0.48 0.00 3.06 -0.08 -1.26 -5.07 116.55 110.91 1wqa n ASP 413 Ca 0.01 -0.44 0.00 0.00 -1.51 0.00 0.00 54.79 52.85 1wqa n ASP 413 Cb 0.27 1.55 0.00 0.00 2.34 0.00 0.00 41.12 45.27 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 1.37 -0.81 3.73 0.27 0.00 -1.05 -3.29 105.19 105.41 1wqa n GLY 414 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.07 -0.03 1.61 1.48 -0.28 -0.70 118.94 116.94 1wqa s TRP 415 Ca 0.00 -0.16 0.02 0.00 -1.06 0.00 0.00 56.10 54.89 1wqa s TRP 415 Cb 0.00 0.61 0.01 0.00 -1.16 0.00 0.00 33.47 32.93 1wqa s TRP 415 CO 0.00 -0.62 -0.06 0.08 -4.06 0.00 0.00 176.95 172.29 1wqa s VAL 416 N -2.83 0.59 -0.16 -0.66 1.01 -0.58 -1.34 120.40 116.42 1wqa s VAL 416 Ca 0.14 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1wqa s VAL 416 Cb 0.01 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.84 1wqa s VAL 416 CO 0.00 0.21 -0.18 -0.22 0.00 0.00 0.00 175.10 174.91 1wqa s LEU 417 N 0.50 2.27 -0.32 3.92 2.96 0.71 -1.04 118.68 127.68 1wqa s LEU 417 Ca -0.07 -0.57 0.03 0.00 -0.22 0.00 0.00 54.13 53.30 1wqa s LEU 417 Cb -0.10 -1.51 0.08 0.00 0.50 0.00 0.00 46.19 45.16 1wqa s LEU 417 CO 0.00 0.05 0.01 -0.69 -1.32 0.00 0.00 176.35 174.40 1wqa s VAL 418 N 1.02 2.39 0.05 1.68 1.01 0.88 0.36 120.40 127.80 1wqa s VAL 418 Ca -0.02 -2.02 0.06 0.00 0.00 0.00 0.00 61.98 60.00 1wqa s VAL 418 Cb -0.15 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1wqa s VAL 418 CO -0.05 -0.39 -0.16 -0.60 0.00 0.00 0.00 175.10 173.90 1wqa s ARG 419 N 1.01 1.04 -0.15 2.72 3.52 -0.96 -0.73 118.95 125.41 1wqa s ARG 419 Ca 0.03 -0.88 -0.14 0.00 -0.13 0.00 0.00 55.73 54.62 1wqa s ARG 419 Cb -0.20 -1.10 -0.05 0.00 -1.56 0.00 0.00 34.95 32.05 1wqa s ARG 419 CO -0.06 0.27 0.30 0.00 -0.81 0.00 0.00 175.30 175.00 1wqa s ALA 420 N -0.94 3.61 0.49 6.12 0.00 -1.26 -1.93 121.76 127.85 1wqa s ALA 420 Ca 0.03 -0.44 -0.24 0.00 0.00 0.00 0.00 51.96 51.31 1wqa s ALA 420 Cb -0.09 -2.38 -0.07 0.00 0.00 0.00 0.00 23.12 20.59 1wqa s ALA 420 CO 0.02 0.14 1.39 0.45 0.00 0.00 0.00 175.76 177.76 1wqa s SER 421 N 0.29 5.61 0.00 0.00 0.15 -0.77 -4.89 113.70 114.08 1wqa s SER 421 Ca 0.17 2.84 0.22 0.00 0.70 0.00 0.00 55.95 59.88 1wqa s SER 421 Cb -0.13 -2.64 0.83 0.00 -1.71 0.00 0.00 66.02 62.36 1wqa s SER 421 CO 0.05 -1.35 1.59 0.61 1.20 0.00 0.00 173.24 175.34 1wqa n GLY 422 N 0.64 0.13 1.59 9.45 0.00 -1.26 -4.53 105.19 111.22 1wqa n GLY 422 Ca 0.07 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.20 0.46 -2.99 2.61 -1.04 -1.26 -5.09 114.28 107.16 1wqa n THR 423 Ca 0.16 0.15 -0.35 0.00 -2.04 0.00 0.00 64.05 61.98 1wqa n THR 423 Cb 0.31 -0.89 -0.06 0.00 -1.82 0.00 0.00 70.33 67.87 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 -1.86 4.26 -0.64 -2.82 8.01 -1.26 -4.93 118.70 119.44 1wqa s GLU 424 Ca 0.00 0.96 -0.05 0.00 0.01 0.00 0.00 54.97 55.89 1wqa s GLU 424 Cb 0.00 -2.63 -0.06 0.00 -4.31 0.00 0.00 34.13 27.13 1wqa s GLU 424 CO 0.00 0.24 2.00 -2.30 0.01 0.00 0.00 175.26 175.21 1wqa n PRO 425 N 0.18 1.67 -4.42 0.39 -0.02 -1.26 -4.32 135.00 127.22 1wqa n PRO 425 Ca 0.02 -1.17 -0.21 0.00 -2.02 0.00 0.00 63.50 60.12 1wqa n PRO 425 Cb 0.52 -2.26 -0.10 0.00 -0.02 0.00 0.00 33.50 31.63 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 3.25 1.78 -0.38 4.25 1.01 -1.26 0.25 121.20 130.10 1wqa s ILE 426 Ca 0.35 -2.18 0.11 0.00 0.00 0.00 0.00 60.65 58.93 1wqa s ILE 426 Cb 0.10 -2.35 0.34 0.00 0.01 0.00 0.00 42.46 40.57 1wqa s ILE 426 CO -0.02 -0.38 0.74 0.00 0.00 0.00 0.00 174.94 175.28 1wqa n ILE 427 N -0.55 -0.19 -0.92 2.92 3.06 -0.95 -1.84 119.36 120.89 1wqa n ILE 427 Ca -0.06 -4.36 -0.29 0.00 -2.50 0.00 0.00 62.75 55.54 1wqa n ILE 427 Cb 0.62 -0.23 0.01 0.00 0.54 0.00 0.00 39.64 40.58 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 0.35 0.00 -3.85 9.51 1.74 -0.81 -4.46 116.66 119.15 1wqa n ARG 428 Ca 0.24 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 57.04 1wqa n ARG 428 Cb 0.66 -0.76 -0.17 0.00 -1.02 0.00 0.00 32.46 31.17 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 -1.53 0.92 -0.02 0.55 1.01 0.14 -2.27 121.20 120.00 1wqa s ILE 429 Ca 0.41 -0.56 0.05 0.00 0.00 0.00 0.00 60.65 60.55 1wqa s ILE 429 Cb -0.33 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 1wqa s ILE 429 CO 0.53 0.06 -0.17 -0.36 0.00 0.00 0.00 174.94 175.00 1wqa s PHE 430 N 1.71 2.59 0.01 3.97 0.40 0.16 -0.96 117.98 125.86 1wqa s PHE 430 Ca 0.00 -0.24 -0.03 0.00 -0.60 0.00 0.00 56.93 56.07 1wqa s PHE 430 Cb -0.15 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 41.80 1wqa s PHE 430 CO -0.07 0.16 0.04 -1.54 0.70 0.00 0.00 175.22 174.51 1wqa s SER 431 N -0.89 0.14 -0.08 1.36 1.04 -0.38 0.26 113.70 115.15 1wqa s SER 431 Ca 0.12 -0.36 -0.13 0.00 0.48 0.00 0.00 55.95 56.07 1wqa s SER 431 Cb -0.10 0.14 0.03 0.00 0.10 0.00 0.00 66.02 66.19 1wqa s SER 431 CO 0.01 -0.32 0.32 -0.70 0.98 0.00 0.00 173.24 173.54 1wqa s GLU 432 N -1.37 0.51 0.38 4.02 2.12 -0.45 -1.44 118.70 122.47 1wqa s GLU 432 Ca -0.15 0.17 -0.16 0.00 0.36 0.00 0.00 54.97 55.20 1wqa s GLU 432 Cb -0.09 0.23 0.06 0.00 0.26 0.00 0.00 34.13 34.60 1wqa s GLU 432 CO 0.00 -0.10 0.80 0.00 -0.54 0.00 0.00 175.26 175.42 1wqa s ALA 433 N -0.48 -0.76 -2.17 6.30 0.00 -0.16 -1.13 121.76 123.37 1wqa s ALA 433 Ca -0.06 -0.75 0.17 0.00 0.00 0.00 0.00 51.96 51.32 1wqa s ALA 433 Cb -0.04 0.67 0.54 0.00 0.00 0.00 0.00 23.12 24.29 1wqa s ALA 433 CO 0.02 -0.99 1.42 1.63 0.00 0.00 0.00 175.76 177.84 1wqa n LYS 434 N -0.54 1.92 -3.67 0.00 5.02 -1.21 -0.33 118.16 119.35 1wqa n LYS 434 Ca -0.08 -1.41 -0.14 0.00 -2.02 0.00 0.00 58.31 54.65 1wqa n LYS 434 Cb 0.60 -1.37 -0.08 0.00 -0.02 0.00 0.00 35.03 34.15 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 -1.29 -0.47 0.46 4.39 1.04 -1.26 -4.80 113.70 111.77 1wqa s SER 435 Ca 0.31 0.71 0.17 0.00 0.48 0.00 0.00 55.95 57.62 1wqa s SER 435 Cb 0.17 0.74 1.14 0.00 0.10 0.00 0.00 66.02 68.16 1wqa s SER 435 CO 0.23 -0.35 1.98 0.11 0.98 0.00 0.00 173.24 176.19 1wqa h LYS 436 N 4.38 0.28 0.75 4.02 1.57 -1.92 -0.54 116.57 125.11 1wqa h LYS 436 Ca -0.28 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 1wqa h LYS 436 Cb 1.17 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.42 1wqa h LYS 436 CO 0.29 0.19 -0.36 0.93 -0.57 0.00 0.00 179.45 179.92 1wqa h GLU 437 N 0.29 -0.97 -0.71 3.15 3.07 -1.99 0.94 114.58 118.36 1wqa h GLU 437 Ca 0.28 0.07 0.05 0.00 -0.50 0.00 0.00 59.36 59.26 1wqa h GLU 437 Cb 0.72 0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 28.80 1wqa h GLU 437 CO -0.06 -0.65 0.47 0.87 -1.40 0.00 0.00 179.01 178.23 1wqa h LYS 438 N -1.01 0.75 -0.44 2.33 1.79 -1.89 0.05 116.57 118.15 1wqa h LYS 438 Ca -0.10 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1wqa h LYS 438 Cb 0.78 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 1wqa h LYS 438 CO 0.17 0.50 0.29 0.00 -1.08 0.00 0.00 179.45 179.33 1wqa h ALA 439 N 1.61 0.56 -0.24 3.86 0.00 -0.87 0.35 119.26 124.52 1wqa h ALA 439 Ca 0.30 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 1wqa h ALA 439 Cb 0.20 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1wqa h ALA 439 CO -0.09 0.01 0.01 0.37 0.00 0.00 0.00 179.25 179.54 1wqa h GLN 440 N 0.59 0.42 0.41 0.00 5.75 0.15 -1.66 115.11 120.76 1wqa h GLN 440 Ca 0.16 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1wqa h GLN 440 Cb -0.07 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 1wqa h GLN 440 CO -0.04 0.59 -0.51 0.93 -2.65 0.00 0.00 178.83 177.15 1wqa h GLU 441 N 0.19 -0.91 -0.96 1.69 5.08 -0.72 0.86 114.58 119.81 1wqa h GLU 441 Ca 0.07 0.06 0.16 0.00 -1.00 0.00 0.00 59.36 58.65 1wqa h GLU 441 Cb 0.40 0.21 -0.09 0.00 0.50 0.00 0.00 28.75 29.77 1wqa h GLU 441 CO 0.01 -0.61 0.61 1.88 -1.00 0.00 0.00 179.01 179.90 1wqa h TYR 442 N -0.95 0.96 0.36 4.33 0.99 -0.94 0.15 116.97 121.87 1wqa h TYR 442 Ca -0.05 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.69 1wqa h TYR 442 Cb 0.85 -0.30 0.00 0.00 1.00 0.00 0.00 36.73 38.28 1wqa h TYR 442 CO -0.31 0.30 -0.17 1.25 -0.00 0.00 0.00 178.16 179.23 1wqa h LEU 443 N 0.76 -0.41 -0.99 3.88 6.46 -0.55 -2.47 115.31 121.99 1wqa h LEU 443 Ca 0.51 -0.04 0.07 0.00 -0.12 0.00 0.00 57.88 58.31 1wqa h LEU 443 Cb 0.78 0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.75 1wqa h LEU 443 CO -0.28 -0.22 0.64 0.78 -0.62 0.00 0.00 178.44 178.73 1wqa h ASN 444 N -0.57 1.00 -0.92 1.25 2.35 0.48 -0.45 115.58 118.72 1wqa h ASN 444 Ca -0.05 0.02 0.12 0.00 -0.55 0.00 0.00 56.30 55.83 1wqa h ASN 444 Cb 0.42 -0.19 -0.08 0.00 0.05 0.00 0.00 38.32 38.52 1wqa h ASN 444 CO 0.08 0.62 0.55 0.25 -1.65 0.00 0.00 177.43 177.28 1wqa h LEU 445 N 1.13 0.79 -0.23 1.61 7.12 -0.51 0.35 115.31 125.57 1wqa h LEU 445 Ca 0.44 0.05 -0.05 0.00 0.13 0.00 0.00 57.88 58.46 1wqa h LEU 445 Cb 0.22 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.25 1wqa h LEU 445 CO -0.19 0.42 -0.04 1.23 -0.13 0.00 0.00 178.44 179.73 1wqa h GLY 446 N 0.87 0.47 1.05 3.75 0.00 -0.65 -2.03 103.07 106.54 1wqa h GLY 446 Ca 0.46 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1wqa h GLY 446 CO -0.27 0.34 0.44 -2.22 0.00 0.00 0.00 176.54 174.83 1wqa h ILE 447 N 0.17 1.26 0.71 2.60 2.04 -0.49 -0.36 117.51 123.44 1wqa h ILE 447 Ca 0.06 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 1wqa h ILE 447 Cb 0.49 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1wqa h ILE 447 CO 0.02 0.30 -0.44 -0.08 0.00 0.00 0.00 178.15 177.96 1wqa h GLU 448 N 1.22 -1.04 -1.00 2.37 4.81 -0.20 -1.50 114.58 119.24 1wqa h GLU 448 Ca 0.30 0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.65 1wqa h GLU 448 Cb 0.08 0.24 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 1wqa h GLU 448 CO -0.04 -0.69 0.65 -0.07 -0.73 0.00 0.00 179.01 178.13 1wqa h LEU 449 N -1.07 1.07 0.14 1.64 3.38 -1.27 -1.90 115.31 117.30 1wqa h LEU 449 Ca -0.09 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1wqa h LEU 449 Cb 0.87 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1wqa h LEU 449 CO 0.09 0.71 -0.22 0.25 0.09 0.00 0.00 178.44 179.36 1wqa h LEU 450 N 1.22 -0.61 -0.23 1.67 6.46 -0.82 -0.33 115.31 122.68 1wqa h LEU 450 Ca 0.42 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 58.24 1wqa h LEU 450 Cb 0.09 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 1wqa h LEU 450 CO -0.15 -0.31 0.12 -0.33 -0.62 0.00 0.00 178.44 177.15 1wqa h GLU 451 N -0.43 0.32 0.00 1.25 5.08 -0.98 -1.21 114.58 118.61 1wqa h GLU 451 Ca 0.02 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1wqa h GLU 451 Cb 0.44 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1wqa h GLU 451 CO -0.10 0.30 -0.07 1.57 -1.00 0.00 0.00 179.01 179.71 1wqa h LYS 452 N 0.25 0.00 -0.12 2.33 2.10 -1.22 -2.29 116.57 117.61 1wqa h LYS 452 Ca 0.08 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.64 1wqa h LYS 452 Cb 0.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.41 1wqa h LYS 452 CO -0.01 0.07 -0.29 0.00 -2.00 0.00 0.00 179.45 177.22 1wqa h ALA 453 N 1.93 0.20 -3.41 0.07 0.00 -0.33 -3.46 119.26 114.27 1wqa h ALA 453 Ca -0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1wqa h ALA 453 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1wqa h ALA 453 CO 0.01 0.22 0.00 1.47 0.00 0.00 0.00 179.25 180.95 1wqa n LEU 454 N -4.42 0.00 0.00 0.00 -0.00 -0.52 -5.03 117.00 107.02 1wqa n LEU 454 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.94 1wqa n LEU 454 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.89 1wqa n LEU 454 CO 0.42 -0.45 0.00 -1.54 -0.00 0.00 0.00 177.39 175.82