#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uwk n ASN 5 N 0.00 -3.12 -0.21 6.41 6.94 -1.26 -1.06 115.26 122.96 1uwk n ASN 5 Ca 0.00 0.06 0.02 0.00 -0.02 0.00 0.00 54.58 54.65 1uwk n ASN 5 Cb 0.00 -0.43 0.03 0.00 -2.36 0.00 0.00 39.78 37.02 1uwk n ASN 5 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1uwk n LYS 6 N 1.73 0.42 -4.56 -3.83 5.02 -1.26 -1.54 118.16 114.14 1uwk n LYS 6 Ca -0.01 -1.00 -0.33 0.00 -2.02 0.00 0.00 58.31 54.94 1uwk n LYS 6 Cb 0.46 -1.10 -0.13 0.00 -0.02 0.00 0.00 35.03 34.24 1uwk n LYS 6 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1uwk s TYR 7 N -0.53 2.94 -0.06 2.13 5.04 -1.26 -3.95 117.35 121.65 1uwk s TYR 7 Ca 0.07 -0.37 -0.02 0.00 -2.44 0.00 0.00 57.07 54.30 1uwk s TYR 7 Cb 0.04 -1.88 0.04 0.00 0.35 0.00 0.00 41.96 40.51 1uwk s TYR 7 CO 0.06 -0.04 0.13 0.50 -1.34 0.00 0.00 175.55 174.86 1uwk s ARG 8 N 0.18 0.07 -1.27 4.97 3.52 -0.30 -5.02 118.95 121.11 1uwk s ARG 8 Ca -0.04 0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 55.80 1uwk s ARG 8 Cb -0.14 -0.20 0.15 0.00 -1.56 0.00 0.00 34.95 33.19 1uwk s ARG 8 CO 0.04 -0.18 1.68 -3.47 -0.81 0.00 0.00 175.30 172.56 1uwk n ASP 9 N 4.31 5.03 -4.12 -2.12 4.64 -1.26 -4.58 116.55 118.45 1uwk n ASP 9 Ca -0.25 -3.00 -0.12 0.00 -1.38 0.00 0.00 54.79 50.05 1uwk n ASP 9 Cb 0.51 -1.57 -0.11 0.00 -1.04 0.00 0.00 41.12 38.91 1uwk n ASP 9 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 1uwk s VAL 10 N 1.70 0.62 -0.23 5.18 -7.23 -1.26 -5.13 120.40 114.05 1uwk s VAL 10 Ca 0.44 -1.57 -0.06 0.00 -1.81 0.00 0.00 61.98 58.98 1uwk s VAL 10 Cb 0.03 -1.22 -0.02 0.00 0.56 0.00 0.00 36.38 35.73 1uwk s VAL 10 CO 0.01 -0.66 0.02 -1.61 -0.31 0.00 0.00 175.10 172.54 1uwk s GLU 11 N -2.86 3.54 -0.09 4.82 2.02 -1.26 -4.72 118.70 120.14 1uwk s GLU 11 Ca 0.02 -0.54 -0.01 0.00 0.02 0.00 0.00 54.97 54.46 1uwk s GLU 11 Cb -0.01 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 31.02 1uwk s GLU 11 CO -0.03 -0.17 -0.04 0.42 0.02 0.00 0.00 175.26 175.46 1uwk s ILE 12 N 1.50 3.94 0.02 -1.63 1.01 -1.26 -5.06 121.20 119.72 1uwk s ILE 12 Ca 0.06 -0.38 -0.05 0.00 0.00 0.00 0.00 60.65 60.28 1uwk s ILE 12 Cb -0.15 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 1uwk s ILE 12 CO 0.01 0.58 0.08 -0.13 0.00 0.00 0.00 174.94 175.47 1uwk s ARG 13 N -0.55 0.46 0.39 2.79 0.52 -1.26 -3.20 118.95 118.11 1uwk s ARG 13 Ca 0.09 -0.54 -0.26 0.00 -0.52 0.00 0.00 55.73 54.49 1uwk s ARG 13 Cb -0.12 0.18 -0.09 0.00 0.52 0.00 0.00 34.95 35.45 1uwk s ARG 13 CO 0.02 -0.11 1.26 0.00 0.02 0.00 0.00 175.30 176.50 1uwk s ALA 14 N -1.71 3.26 0.74 2.13 0.00 -1.26 -4.80 121.76 120.13 1uwk s ALA 14 Ca -0.13 1.16 -0.14 0.00 0.00 0.00 0.00 51.96 52.85 1uwk s ALA 14 Cb -0.07 -3.45 0.05 0.00 0.00 0.00 0.00 23.12 19.65 1uwk s ALA 14 CO -0.01 -0.71 1.19 -2.14 0.00 0.00 0.00 175.76 174.10 1uwk s PRO 15 N -2.18 2.08 0.43 0.00 0.02 -1.26 -5.00 135.00 129.10 1uwk s PRO 15 Ca 0.56 1.71 0.06 0.00 0.02 0.00 0.00 61.00 63.34 1uwk s PRO 15 Cb -0.36 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.26 1uwk s PRO 15 CO 0.47 -1.87 0.01 1.03 -0.33 0.00 0.00 177.00 176.30 1uwk s ARG 16 N -4.01 2.01 1.30 5.54 1.81 -1.26 -4.88 118.95 119.47 1uwk s ARG 16 Ca 0.73 -2.18 0.00 0.00 -1.72 0.00 0.00 55.73 52.56 1uwk s ARG 16 Cb -0.28 -1.60 0.00 0.00 -0.45 0.00 0.00 34.95 32.62 1uwk s ARG 16 CO 0.46 -0.13 0.00 0.41 -0.68 0.00 0.00 175.30 175.37 1uwk n GLY 17 N -1.04 -1.79 0.95 -3.53 0.00 -0.04 -4.48 105.19 95.26 1uwk n GLY 17 Ca -0.08 -1.33 0.11 0.00 0.00 0.00 0.00 46.02 44.71 1uwk n GLY 17 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uwk n ASN 18 N 0.15 3.04 -4.87 1.61 6.94 -1.26 -4.60 115.26 116.26 1uwk n ASN 18 Ca 0.00 -1.92 -0.37 0.00 -0.02 0.00 0.00 54.58 52.27 1uwk n ASN 18 Cb 0.00 -0.11 -0.06 0.00 -2.36 0.00 0.00 39.78 37.25 1uwk n ASN 18 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 1uwk s LYS 19 N -1.61 3.54 0.24 -3.83 -2.85 -1.26 -5.07 119.74 108.90 1uwk s LYS 19 Ca 0.30 -0.02 -0.13 0.00 -1.00 0.00 0.00 55.97 55.12 1uwk s LYS 19 Cb 0.19 -3.19 -0.08 0.00 -2.06 0.00 0.00 37.83 32.69 1uwk s LYS 19 CO 0.28 0.76 0.62 -0.51 0.10 0.00 0.00 175.35 176.59 1uwk s LEU 20 N -1.07 4.19 -0.26 2.77 1.43 -1.26 -4.95 118.68 119.53 1uwk s LEU 20 Ca 0.17 1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 54.36 1uwk s LEU 20 Cb -0.13 -3.70 -0.16 0.00 0.03 0.00 0.00 46.19 42.23 1uwk s LEU 20 CO 0.06 -0.07 -0.25 1.07 0.23 0.00 0.00 176.35 177.39 1uwk n THR 21 N 0.06 1.49 -1.91 5.49 5.66 -1.26 -5.01 114.28 118.80 1uwk n THR 21 Ca -0.00 -0.53 -0.25 0.00 -3.05 0.00 0.00 64.05 60.22 1uwk n THR 21 Cb 0.52 -1.50 0.17 0.00 -1.55 0.00 0.00 70.33 67.97 1uwk n THR 21 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uwk n ALA 22 N -3.45 -1.13 0.38 1.79 0.00 -1.26 -4.91 120.51 111.93 1uwk n ALA 22 Ca -0.47 -1.54 0.12 0.00 0.00 0.00 0.00 53.44 51.55 1uwk n ALA 22 Cb 0.97 -0.03 0.22 0.00 0.00 0.00 0.00 19.45 20.60 1uwk n ALA 22 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1uwk h LYS 23 N 0.00 0.00 -3.21 0.00 1.57 -1.81 -3.47 116.57 109.65 1uwk h LYS 23 Ca -0.36 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.44 1uwk h LYS 23 Cb 1.04 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.28 1uwk h LYS 23 CO 0.27 0.00 0.11 -1.54 -0.57 0.00 0.00 179.45 177.72 1uwk s SER 24 N -5.25 -0.23 0.48 0.86 1.04 -1.26 -5.03 113.70 104.31 1uwk s SER 24 Ca 0.07 -0.65 0.26 0.00 0.48 0.00 0.00 55.95 56.10 1uwk s SER 24 Cb 0.09 0.67 1.19 0.00 0.10 0.00 0.00 66.02 68.07 1uwk s SER 24 CO 0.67 -1.24 1.95 -0.50 0.98 0.00 0.00 173.24 175.11 1uwk h TRP 25 N 2.09 0.00 0.00 5.02 4.06 -1.98 0.97 115.95 126.12 1uwk h TRP 25 Ca -0.23 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.70 1uwk h TRP 25 Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.41 1uwk h TRP 25 CO 0.40 0.18 -0.11 -0.07 -3.56 0.00 0.00 178.44 175.28 1uwk h LEU 26 N 0.00 0.00 0.00 -4.49 3.38 -1.98 -0.90 115.31 111.32 1uwk h LEU 26 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1uwk h LEU 26 Cb 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1uwk h LEU 26 CO 0.02 0.11 -2.01 0.35 0.09 0.00 0.00 178.44 177.01 1uwk n THR 27 N -3.22 0.70 -0.32 0.22 -2.24 -0.91 -4.30 114.28 104.22 1uwk n THR 27 Ca 0.01 -0.59 -0.04 0.00 -2.27 0.00 0.00 64.05 61.16 1uwk n THR 27 Cb 0.39 -0.32 0.09 0.00 -2.10 0.00 0.00 70.33 68.40 1uwk n THR 27 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1uwk h GLU 28 N 0.00 1.23 0.33 -0.78 4.57 -0.76 -3.01 114.58 116.16 1uwk h GLU 28 Ca -0.28 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 57.74 1uwk h GLU 28 Cb 1.56 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 1uwk h GLU 28 CO 0.02 0.92 -0.30 0.00 -1.18 0.00 0.00 179.01 178.46 1uwk h ALA 29 N 1.26 -0.66 -0.11 2.92 0.00 -1.35 0.13 119.26 121.45 1uwk h ALA 29 Ca 0.30 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1uwk h ALA 29 Cb 0.08 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1uwk h ALA 29 CO -0.04 -0.90 -0.20 -1.00 0.00 0.00 0.00 179.25 177.10 1uwk h PRO 30 N -0.66 0.18 -0.16 0.00 0.13 -1.76 -0.05 132.00 129.69 1uwk h PRO 30 Ca -0.02 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 65.09 1uwk h PRO 30 Cb 0.59 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1uwk h PRO 30 CO -0.04 0.39 -0.05 1.25 -0.23 0.00 0.00 178.00 179.31 1uwk h LEU 31 N 0.17 -0.18 -0.76 1.56 5.85 -1.32 0.45 115.31 121.08 1uwk h LEU 31 Ca 0.03 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.70 1uwk h LEU 31 Cb 0.46 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1uwk h LEU 31 CO 0.03 -0.07 -0.12 0.03 -0.34 0.00 0.00 178.44 177.97 1uwk h ARG 32 N -0.02 0.81 -0.01 1.25 3.08 -0.22 -2.11 114.38 117.16 1uwk h ARG 32 Ca 0.08 -0.28 -0.18 0.00 0.07 0.00 0.00 59.98 59.67 1uwk h ARG 32 Cb 0.14 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1uwk h ARG 32 CO -0.17 0.90 -0.80 0.52 -1.07 0.00 0.00 179.97 179.34 1uwk h MET 33 N 0.73 0.19 -0.10 0.04 2.86 -0.77 0.19 114.93 118.07 1uwk h MET 33 Ca 0.12 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1uwk h MET 33 Cb 0.62 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1uwk h MET 33 CO 0.04 0.89 0.03 1.25 1.06 0.00 0.00 176.91 180.19 1uwk h LEU 34 N 0.11 0.03 -1.00 1.22 5.85 -0.84 -1.39 115.31 119.30 1uwk h LEU 34 Ca -0.03 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1uwk h LEU 34 Cb 1.40 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.42 1uwk h LEU 34 CO 0.12 0.04 0.00 0.24 -0.34 0.00 0.00 178.44 178.50 1uwk h MET 35 N 0.08 0.72 -0.26 1.25 2.86 -1.11 -2.60 114.93 115.87 1uwk h MET 35 Ca 0.04 -0.18 -0.04 0.00 -2.06 0.00 0.00 59.70 57.46 1uwk h MET 35 Cb 0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1uwk h MET 35 CO -0.05 0.73 -0.02 -0.97 1.06 0.00 0.00 176.91 177.67 1uwk h ASN 36 N 0.68 0.37 -0.02 1.22 -1.24 -0.44 -1.51 115.58 114.64 1uwk h ASN 36 Ca 0.14 -0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1uwk h ASN 36 Cb 0.42 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.37 1uwk h ASN 36 CO 0.02 0.45 0.03 0.78 -1.29 0.00 0.00 177.43 177.41 1uwk h ASN 37 N 0.38 0.00 -0.35 1.15 4.21 -0.85 -1.74 115.58 118.38 1uwk h ASN 37 Ca 0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.59 1uwk h ASN 37 Cb 0.29 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.49 1uwk h ASN 37 CO 0.01 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.33 1uwk n LEU 38 N -3.63 3.18 -4.76 1.61 4.77 -0.60 -4.21 117.00 113.36 1uwk n LEU 38 Ca -0.03 -1.56 -0.41 0.00 -0.03 0.00 0.00 56.01 53.99 1uwk n LEU 38 Cb 0.11 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1uwk n LEU 38 CO 0.25 0.70 1.15 -0.62 -1.33 0.00 0.00 177.39 177.54 1uwk s ASP 39 N -1.27 6.46 0.66 -1.43 3.68 -0.66 -4.42 116.67 119.69 1uwk s ASP 39 Ca 0.33 2.90 0.42 0.00 2.13 0.00 0.00 52.55 58.33 1uwk s ASP 39 Cb 0.19 -2.65 2.33 0.00 -1.45 0.00 0.00 42.92 41.34 1uwk s ASP 39 CO 0.26 -0.81 2.34 -0.65 0.13 0.00 0.00 175.17 176.44 1uwk h PRO 40 N 4.01 0.00 -0.00 4.34 0.11 -1.89 0.12 132.00 138.68 1uwk h PRO 40 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1uwk h PRO 40 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1uwk h PRO 40 CO 0.72 0.00 -0.37 0.94 -0.21 0.00 0.00 178.00 179.08 1uwk n GLN 41 N -3.16 0.32 -0.07 1.05 7.27 -1.26 -4.45 117.38 117.08 1uwk n GLN 41 Ca -0.03 -0.18 -0.14 0.00 0.07 0.00 0.00 57.00 56.72 1uwk n GLN 41 Cb 0.09 -1.50 -0.05 0.00 2.41 0.00 0.00 30.24 31.20 1uwk n GLN 41 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1uwk n VAL 42 N -1.19 0.93 -3.30 1.69 0.31 0.24 -4.58 118.33 112.44 1uwk n VAL 42 Ca 0.08 -0.12 -0.32 0.00 -0.01 0.00 0.00 64.34 63.97 1uwk n VAL 42 Cb 0.34 -1.76 -0.06 0.00 -0.91 0.00 0.00 33.84 31.45 1uwk n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1uwk s ALA 43 N -2.32 3.46 0.12 3.52 0.00 -0.21 -4.53 121.76 121.81 1uwk s ALA 43 Ca -0.20 -0.13 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 1uwk s ALA 43 Cb 0.07 -2.58 -0.07 0.00 0.00 0.00 0.00 23.12 20.54 1uwk s ALA 43 CO 0.26 0.43 1.44 0.93 0.00 0.00 0.00 175.76 178.82 1uwk h GLU 44 N 2.47 0.86 -0.83 0.00 4.39 -0.79 -3.41 114.58 117.27 1uwk h GLU 44 Ca -0.47 -0.48 -0.35 0.00 0.34 0.00 0.00 59.36 58.40 1uwk h GLU 44 Cb 1.17 0.03 -0.25 0.00 -0.10 0.00 0.00 28.75 29.60 1uwk h GLU 44 CO 0.67 1.12 -0.75 -1.71 -1.16 0.00 0.00 179.01 177.18 1uwk n ASN 45 N -4.10 -1.26 0.19 1.42 5.15 -0.22 -5.01 115.26 111.42 1uwk n ASN 45 Ca -0.03 -3.27 0.14 0.00 -0.60 0.00 0.00 54.58 50.81 1uwk n ASN 45 Cb 0.55 0.85 0.56 0.00 -0.53 0.00 0.00 39.78 41.20 1uwk n ASN 45 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1uwk h PRO 46 N 3.39 0.00 0.00 1.20 0.13 -1.76 -1.74 132.00 133.22 1uwk h PRO 46 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1uwk h PRO 46 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1uwk h PRO 46 CO 0.32 0.00 0.00 0.87 -0.23 0.00 0.00 178.00 178.96 1uwk h LYS 47 N 0.00 0.00 -0.40 0.86 1.57 -1.84 -0.87 116.57 115.89 1uwk h LYS 47 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1uwk h LYS 47 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1uwk h LYS 47 CO 0.00 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.27 1uwk n GLU 48 N -2.80 3.44 -1.03 3.15 1.02 -0.73 -1.15 120.64 122.54 1uwk n GLU 48 Ca 0.00 -2.79 -0.01 0.00 -0.02 0.00 0.00 57.16 54.34 1uwk n GLU 48 Cb 0.23 -1.85 -0.00 0.00 -0.02 0.00 0.00 31.44 29.80 1uwk n GLU 48 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1uwk n LEU 49 N 0.14 0.44 -4.67 -4.62 4.77 -0.33 -4.88 117.00 107.84 1uwk n LEU 49 Ca 0.22 0.02 -0.40 0.00 -0.03 0.00 0.00 56.01 55.82 1uwk n LEU 49 Cb 0.88 -1.61 -0.05 0.00 -2.33 0.00 0.00 43.42 40.31 1uwk n LEU 49 CO 0.19 -0.55 0.45 -0.69 -1.33 0.00 0.00 177.39 175.45 1uwk s VAL 50 N -1.53 4.99 -0.20 4.08 1.01 -0.74 -1.83 120.40 126.17 1uwk s VAL 50 Ca 0.00 1.35 -0.16 0.00 0.00 0.00 0.00 61.98 63.18 1uwk s VAL 50 Cb 0.00 -4.01 -0.10 0.00 0.00 0.00 0.00 36.38 32.26 1uwk s VAL 50 CO 0.00 0.11 -0.14 0.52 0.00 0.00 0.00 175.10 175.59 1uwk n VAL 51 N 4.54 1.49 -3.84 2.92 0.31 0.61 -1.06 118.33 123.31 1uwk n VAL 51 Ca 0.00 -0.01 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 1uwk n VAL 51 Cb 0.50 -2.16 0.01 0.00 -0.91 0.00 0.00 33.84 31.27 1uwk n VAL 51 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1uwk s TYR 52 N -2.48 0.04 -0.59 3.52 -0.85 -1.22 -0.42 117.35 115.35 1uwk s TYR 52 Ca -0.27 -0.49 -0.00 0.00 -0.52 0.00 0.00 57.07 55.78 1uwk s TYR 52 Cb 0.07 0.72 0.00 0.00 0.38 0.00 0.00 41.96 43.13 1uwk s TYR 52 CO 0.43 -1.08 0.49 0.41 -1.52 0.00 0.00 175.55 174.28 1uwk n GLY 53 N -0.61 0.07 6.40 5.49 0.00 -1.26 -2.12 105.19 113.15 1uwk n GLY 53 Ca -0.05 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1uwk n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uwk n GLY 54 N -1.08 1.69 2.30 -0.02 0.00 -1.26 -3.56 105.19 103.26 1uwk n GLY 54 Ca -0.13 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 1uwk n GLY 54 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1uwk n ILE 55 N 0.00 3.38 -2.14 -0.61 -5.35 -1.26 -4.90 119.36 108.48 1uwk n ILE 55 Ca 0.00 -3.32 -0.43 0.00 -0.27 0.00 0.00 62.75 58.73 1uwk n ILE 55 Cb 0.00 -1.16 -0.03 0.00 -1.74 0.00 0.00 39.64 36.71 1uwk n ILE 55 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1uwk s GLY 56 N -2.19 1.43 0.23 3.28 0.00 -0.90 -4.35 107.32 104.82 1uwk s GLY 56 Ca 0.61 0.64 0.10 0.00 0.00 0.00 0.00 44.72 46.07 1uwk s GLY 56 CO -0.03 2.90 -0.10 0.50 0.00 0.00 0.00 173.10 176.37 1uwk s ARG 57 N 4.17 2.00 0.12 2.90 0.52 -0.18 -0.28 118.95 128.20 1uwk s ARG 57 Ca 0.68 -1.44 0.19 0.00 -0.52 0.00 0.00 55.73 54.64 1uwk s ARG 57 Cb -0.27 -2.05 -0.08 0.00 0.52 0.00 0.00 34.95 33.07 1uwk s ARG 57 CO 0.26 0.39 0.93 0.00 0.02 0.00 0.00 175.30 176.90 1uwk h ALA 58 N 2.51 0.61 -2.77 2.13 0.00 -1.48 -2.74 119.26 117.53 1uwk h ALA 58 Ca -0.45 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 53.87 1uwk h ALA 58 Cb 1.23 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 19.07 1uwk h ALA 58 CO 0.56 0.59 -0.08 0.00 0.00 0.00 0.00 179.25 180.33 1uwk s ALA 59 N -3.07 -0.85 0.22 0.00 0.00 -1.26 -4.74 121.76 112.05 1uwk s ALA 59 Ca -0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 51.96 51.75 1uwk s ALA 59 Cb 0.09 0.73 0.21 0.00 0.00 0.00 0.00 23.12 24.15 1uwk s ALA 59 CO 0.80 -0.67 1.64 -0.09 0.00 0.00 0.00 175.76 177.44 1uwk h ARG 60 N 2.35 0.75 -2.63 0.00 2.43 -1.31 -3.47 114.38 112.50 1uwk h ARG 60 Ca -0.33 -0.30 0.13 0.00 -0.81 0.00 0.00 59.98 58.67 1uwk h ARG 60 Cb 1.25 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.74 1uwk h ARG 60 CO 0.45 0.90 0.52 0.54 -1.51 0.00 0.00 179.97 180.88 1uwk s ASN 61 N -6.75 0.00 0.28 -3.80 2.20 -1.26 -4.94 114.94 100.67 1uwk s ASN 61 Ca -0.09 -0.77 0.13 0.00 -0.94 0.00 0.00 52.86 51.19 1uwk s ASN 61 Cb 0.13 0.57 0.31 0.00 -2.00 0.00 0.00 41.25 40.26 1uwk s ASN 61 CO 0.83 -1.13 1.56 -0.50 -2.94 0.00 0.00 177.10 174.92 1uwk h TRP 62 N 2.00 0.00 -0.67 1.54 4.06 -1.17 -0.71 115.95 121.00 1uwk h TRP 62 Ca -0.28 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.66 1uwk h TRP 62 Cb 1.22 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.35 1uwk h TRP 62 CO 1.35 0.60 0.40 1.49 -3.56 0.00 0.00 178.44 178.72 1uwk h GLU 63 N 0.00 0.91 -0.62 0.49 4.81 -1.34 -0.57 114.58 118.27 1uwk h GLU 63 Ca -0.01 -0.08 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 1uwk h GLU 63 Cb 1.20 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1uwk h GLU 63 CO 0.08 0.65 0.03 0.00 -0.73 0.00 0.00 179.01 179.04 1uwk h TYR 65 N 0.98 -0.65 -0.93 0.00 5.03 -0.85 0.88 116.97 121.43 1uwk h TYR 65 Ca 0.18 0.02 0.08 0.00 2.58 0.00 0.00 58.73 61.59 1uwk h TYR 65 Cb 0.53 0.29 -0.07 0.00 1.55 0.00 0.00 36.73 39.03 1uwk h TYR 65 CO 0.04 -0.33 0.60 -0.44 -1.32 0.00 0.00 178.16 176.70 1uwk h ASP 66 N -0.38 0.90 0.23 -2.11 3.32 -0.93 -1.13 116.42 116.33 1uwk h ASP 66 Ca 0.06 0.02 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 1uwk h ASP 66 Cb 0.46 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1uwk h ASP 66 CO -0.22 0.55 -0.73 0.50 -1.72 0.00 0.00 179.24 177.63 1uwk h LYS 67 N 1.00 0.43 -0.43 3.56 1.63 -0.88 -1.07 116.57 120.81 1uwk h LYS 67 Ca 0.42 -0.35 -0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1uwk h LYS 67 Cb 0.30 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.98 1uwk h LYS 67 CO -0.17 0.98 0.23 0.82 -3.45 0.00 0.00 179.45 177.86 1uwk h ILE 68 N 0.29 1.16 -0.52 2.00 2.04 -0.25 0.40 117.51 122.62 1uwk h ILE 68 Ca -0.03 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1uwk h ILE 68 Cb 1.30 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 1uwk h ILE 68 CO 0.13 0.16 0.24 0.58 0.00 0.00 0.00 178.15 179.26 1uwk h VAL 69 N 0.55 1.20 -0.60 1.67 2.07 -1.02 -0.05 116.25 120.07 1uwk h VAL 69 Ca 0.15 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1uwk h VAL 69 Cb 0.06 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1uwk h VAL 69 CO -0.02 0.23 0.37 -0.08 0.02 0.00 0.00 177.57 178.08 1uwk h GLU 70 N 0.70 0.81 -0.12 1.57 4.81 -1.05 -1.40 114.58 119.91 1uwk h GLU 70 Ca 0.18 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1uwk h GLU 70 Cb 0.14 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1uwk h GLU 70 CO -0.02 0.58 -0.40 1.15 -0.73 0.00 0.00 179.01 179.59 1uwk h THR 71 N 0.81 1.37 -0.85 0.32 2.02 -0.59 -2.85 112.91 113.15 1uwk h THR 71 Ca 0.22 -1.71 0.11 0.00 0.77 0.00 0.00 66.41 65.80 1uwk h THR 71 Cb -0.03 2.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.44 1uwk h THR 71 CO -0.04 0.51 0.55 -0.07 0.37 0.00 0.00 175.52 176.84 1uwk h LEU 72 N 0.08 0.68 -1.51 2.58 3.38 -0.96 -1.11 115.31 118.46 1uwk h LEU 72 Ca -0.02 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1uwk h LEU 72 Cb 1.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1uwk h LEU 72 CO 0.08 0.38 0.03 0.74 0.09 0.00 0.00 178.44 179.76 1uwk h THR 73 N 0.74 1.14 -0.02 0.22 2.02 -1.03 -3.01 112.91 112.97 1uwk h THR 73 Ca 0.40 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1uwk h THR 73 Cb 0.54 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1uwk h THR 73 CO -0.17 0.17 -0.11 -2.11 0.37 0.00 0.00 175.52 173.68 1uwk n ARG 74 N -4.37 1.65 -2.01 6.66 1.85 -0.77 -3.58 116.66 116.10 1uwk n ARG 74 Ca 0.00 -1.44 -0.41 0.00 -1.00 0.00 0.00 57.85 55.00 1uwk n ARG 74 Cb 0.18 -1.36 -0.02 0.00 -1.05 0.00 0.00 32.46 30.20 1uwk n ARG 74 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 1uwk s LEU 75 N -1.77 4.38 0.60 2.89 2.96 -0.49 -4.97 118.68 122.28 1uwk s LEU 75 Ca 0.21 2.65 -0.05 0.00 -0.22 0.00 0.00 54.13 56.72 1uwk s LEU 75 Cb 0.16 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.25 1uwk s LEU 75 CO 0.30 -0.71 0.90 -1.61 -1.32 0.00 0.00 176.35 173.91 1uwk s GLU 76 N -0.21 2.73 0.00 1.98 0.41 -1.26 -4.60 118.70 117.74 1uwk s GLU 76 Ca 0.60 -0.17 0.22 0.00 -0.41 0.00 0.00 54.97 55.21 1uwk s GLU 76 Cb -0.42 -2.29 1.02 0.00 -1.78 0.00 0.00 34.13 30.66 1uwk s GLU 76 CO 0.42 -0.79 1.69 -0.40 -0.49 0.00 0.00 175.26 175.69 1uwk n ASP 77 N -2.60 0.00 -0.39 -0.19 3.85 -1.26 -2.06 116.55 113.90 1uwk n ASP 77 Ca 0.05 0.19 0.08 0.00 -0.71 0.00 0.00 54.79 54.41 1uwk n ASP 77 Cb 0.58 -0.37 0.18 0.00 -1.35 0.00 0.00 41.12 40.16 1uwk n ASP 77 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1uwk n ASP 78 N -1.37 2.62 -4.55 -1.12 5.75 -1.26 -3.64 116.55 112.96 1uwk n ASP 78 Ca 0.08 -3.23 -0.27 0.00 -0.01 0.00 0.00 54.79 51.36 1uwk n ASP 78 Cb 0.20 -0.48 -0.10 0.00 -1.03 0.00 0.00 41.12 39.72 1uwk n ASP 78 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1uwk s GLU 79 N -2.94 2.01 -0.07 0.11 2.02 -0.88 -0.22 118.70 118.73 1uwk s GLU 79 Ca 0.36 -1.27 0.01 0.00 0.02 0.00 0.00 54.97 54.10 1uwk s GLU 79 Cb 0.31 -2.14 0.02 0.00 0.10 0.00 0.00 34.13 32.42 1uwk s GLU 79 CO 0.03 0.44 -0.09 0.99 0.02 0.00 0.00 175.26 176.64 1uwk s THR 80 N -1.64 0.94 -0.02 3.63 2.01 0.44 -4.63 115.64 116.37 1uwk s THR 80 Ca 0.24 -0.35 -0.20 0.00 0.31 0.00 0.00 61.69 61.69 1uwk s THR 80 Cb -0.09 -0.90 -0.05 0.00 0.01 0.00 0.00 72.50 71.47 1uwk s THR 80 CO 0.14 0.32 0.57 -0.22 -0.69 0.00 0.00 174.62 174.75 1uwk s LEU 81 N 0.89 4.39 -0.22 4.42 2.96 -0.09 -1.30 118.68 129.74 1uwk s LEU 81 Ca -0.11 1.10 -0.11 0.00 -0.22 0.00 0.00 54.13 54.79 1uwk s LEU 81 Cb -0.15 -2.88 -0.05 0.00 0.50 0.00 0.00 46.19 43.61 1uwk s LEU 81 CO 0.01 0.09 0.19 -0.76 -1.32 0.00 0.00 176.35 174.55 1uwk s LEU 82 N -0.06 4.16 -0.19 -0.68 1.02 0.45 -1.10 118.68 122.28 1uwk s LEU 82 Ca 0.30 0.22 -0.04 0.00 0.02 0.00 0.00 54.13 54.63 1uwk s LEU 82 Cb -0.18 -2.16 -0.02 0.00 0.02 0.00 0.00 46.19 43.85 1uwk s LEU 82 CO 0.16 0.09 -0.03 -0.69 0.02 0.00 0.00 176.35 175.89 1uwk s VAL 83 N 0.84 3.65 -0.25 -1.59 1.01 0.07 -1.43 120.40 122.69 1uwk s VAL 83 Ca 0.09 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1uwk s VAL 83 Cb -0.13 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.67 1uwk s VAL 83 CO 0.03 0.45 -0.12 -1.58 0.00 0.00 0.00 175.10 173.88 1uwk s GLN 84 N 0.99 2.38 -1.40 2.72 -0.44 0.13 -0.76 119.66 123.27 1uwk s GLN 84 Ca 0.01 -1.26 -0.15 0.00 -2.50 0.00 0.00 55.36 51.45 1uwk s GLN 84 Cb -0.15 -2.86 0.02 0.00 -1.64 0.00 0.00 33.01 28.39 1uwk s GLN 84 CO 0.01 -0.51 0.29 0.43 0.50 0.00 0.00 175.29 176.00 1uwk n SER 85 N 4.47 -1.19 -0.08 6.67 7.64 0.32 -1.48 113.62 129.97 1uwk n SER 85 Ca -0.15 -1.29 -0.01 0.00 1.01 0.00 0.00 58.87 58.43 1uwk n SER 85 Cb 0.43 -1.57 -0.00 0.00 -1.01 0.00 0.00 64.21 62.06 1uwk n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uwk n GLY 86 N -2.38 0.49 3.10 0.23 0.00 -1.26 -4.24 105.19 101.14 1uwk n GLY 86 Ca -0.23 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 44.90 1uwk n GLY 86 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1uwk s LYS 87 N -1.36 2.31 -0.69 1.61 2.20 -0.55 -1.12 119.74 122.15 1uwk s LYS 87 Ca 0.00 -0.62 -0.27 0.00 -0.36 0.00 0.00 55.97 54.72 1uwk s LYS 87 Cb 0.00 -1.85 0.03 0.00 -1.51 0.00 0.00 37.83 34.50 1uwk s LYS 87 CO 0.00 0.05 1.25 -1.25 -0.36 0.00 0.00 175.35 175.04 1uwk s PRO 88 N 0.64 3.30 -0.08 4.03 0.04 -1.26 -0.69 135.00 140.97 1uwk s PRO 88 Ca -0.14 -0.08 0.20 0.00 0.04 0.00 0.00 61.00 61.03 1uwk s PRO 88 Cb -0.16 -4.12 -0.30 0.00 0.04 0.00 0.00 34.50 29.95 1uwk s PRO 88 CO 0.04 -1.99 0.35 1.33 0.04 0.00 0.00 177.00 176.77 1uwk n VAL 89 N 6.48 0.52 -3.53 -0.36 0.24 -0.51 -5.01 118.33 116.15 1uwk n VAL 89 Ca 0.05 -0.63 -0.14 0.00 -2.04 0.00 0.00 64.34 61.58 1uwk n VAL 89 Cb 0.49 -0.18 -0.05 0.00 -1.47 0.00 0.00 33.84 32.63 1uwk n VAL 89 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1uwk s GLY 90 N -4.86 -0.45 -0.12 7.63 0.00 -1.23 -5.01 107.32 103.28 1uwk s GLY 90 Ca -0.08 1.52 0.02 0.00 0.00 0.00 0.00 44.72 46.17 1uwk s GLY 90 CO 0.88 0.88 -0.18 0.14 0.00 0.00 0.00 173.10 174.82 1uwk s VAL 91 N -1.49 1.75 0.11 1.40 1.01 -1.26 -0.41 120.40 121.51 1uwk s VAL 91 Ca -0.05 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.20 1uwk s VAL 91 Cb -0.00 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1uwk s VAL 91 CO 0.04 0.49 -0.17 -0.36 0.00 0.00 0.00 175.10 175.10 1uwk s PHE 92 N 0.89 1.53 -0.03 5.22 0.40 -0.42 -4.94 117.98 120.64 1uwk s PHE 92 Ca -0.07 -0.48 -0.30 0.00 -0.60 0.00 0.00 56.93 55.48 1uwk s PHE 92 Cb -0.15 -0.82 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 1uwk s PHE 92 CO -0.01 0.16 1.19 0.21 0.70 0.00 0.00 175.22 177.47 1uwk s LYS 93 N -2.20 4.38 0.00 0.44 2.20 -1.26 -0.42 119.74 122.87 1uwk s LYS 93 Ca 0.06 1.69 0.00 0.00 -0.36 0.00 0.00 55.97 57.36 1uwk s LYS 93 Cb -0.08 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.73 1uwk s LYS 93 CO 0.04 -0.39 0.00 0.25 -0.36 0.00 0.00 175.35 174.89 1uwk n THR 94 N 4.43 0.00 -3.84 3.43 -2.24 0.69 -4.92 114.28 111.83 1uwk n THR 94 Ca 0.10 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.82 1uwk n THR 94 Cb 0.46 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.68 1uwk n THR 94 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1uwk s HIS 95 N 2.59 -0.17 -0.18 4.78 -3.43 -1.24 -4.87 115.29 112.77 1uwk s HIS 95 Ca 0.00 -0.28 0.29 0.00 -0.80 0.00 0.00 55.06 54.27 1uwk s HIS 95 Cb 0.00 0.70 1.18 0.00 -1.43 0.00 0.00 32.58 33.04 1uwk s HIS 95 CO 0.00 -1.19 1.86 0.66 -2.00 0.00 0.00 174.74 174.07 1uwk h SER 96 N 2.00 0.00 -0.67 7.38 4.64 -1.88 -1.85 113.55 123.17 1uwk h SER 96 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1uwk h SER 96 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1uwk h SER 96 CO 0.24 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.79 1uwk n ASN 97 N -2.68 3.73 -4.97 4.97 3.02 -1.26 -4.89 115.26 113.18 1uwk n ASN 97 Ca 0.01 -2.05 -0.22 0.00 -0.03 0.00 0.00 54.58 52.29 1uwk n ASN 97 Cb 0.27 -0.47 0.02 0.00 -0.61 0.00 0.00 39.78 38.99 1uwk n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uwk s ALA 98 N -1.19 3.90 0.57 5.41 0.00 -0.70 -3.97 121.76 125.78 1uwk s ALA 98 Ca 0.46 -1.21 -0.20 0.00 0.00 0.00 0.00 51.96 51.00 1uwk s ALA 98 Cb 0.24 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 1uwk s ALA 98 CO 0.30 -0.42 1.28 -2.14 0.00 0.00 0.00 175.76 174.78 1uwk s PRO 99 N -4.54 3.06 0.37 0.00 0.02 -1.18 -4.88 135.00 127.84 1uwk s PRO 99 Ca 0.50 2.04 0.20 0.00 0.02 0.00 0.00 61.00 63.77 1uwk s PRO 99 Cb -0.10 -2.11 0.23 0.00 0.02 0.00 0.00 34.50 32.53 1uwk s PRO 99 CO 0.37 -1.20 1.52 0.00 -0.33 0.00 0.00 177.00 177.36 1uwk h ARG 100 N 1.21 0.00 -3.66 5.54 2.47 -1.13 -3.43 114.38 115.38 1uwk h ARG 100 Ca -0.51 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 57.93 1uwk h ARG 100 Cb 1.30 0.00 -0.32 0.00 -1.65 0.00 0.00 29.97 29.30 1uwk h ARG 100 CO 0.56 0.18 -0.73 0.08 0.56 0.00 0.00 179.97 180.62 1uwk s VAL 101 N -3.12 0.02 -0.12 2.04 1.01 -1.16 -0.91 120.40 118.16 1uwk s VAL 101 Ca 0.06 0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.16 1uwk s VAL 101 Cb 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 36.34 1uwk s VAL 101 CO 0.70 0.07 -0.21 -0.76 0.00 0.00 0.00 175.10 174.90 1uwk s LEU 102 N 0.66 2.20 -0.07 3.92 1.43 -0.26 -2.06 118.68 124.49 1uwk s LEU 102 Ca -0.06 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.53 1uwk s LEU 102 Cb -0.08 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.68 1uwk s LEU 102 CO -0.02 0.13 -0.18 -0.63 0.23 0.00 0.00 176.35 175.88 1uwk s ILE 103 N 0.55 1.55 -0.15 -0.59 1.01 -0.05 -0.75 121.20 122.77 1uwk s ILE 103 Ca -0.13 -0.74 -0.02 0.00 0.00 0.00 0.00 60.65 59.76 1uwk s ILE 103 Cb -0.17 -1.36 0.05 0.00 0.01 0.00 0.00 42.46 40.99 1uwk s ILE 103 CO 0.04 0.45 0.03 0.00 0.00 0.00 0.00 174.94 175.45 1uwk s ALA 104 N 0.40 0.86 -0.08 9.38 0.00 0.06 -0.55 121.76 131.83 1uwk s ALA 104 Ca -0.14 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.39 1uwk s ALA 104 Cb -0.16 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 21.95 1uwk s ALA 104 CO 0.05 -0.92 -0.20 -0.80 0.00 0.00 0.00 175.76 173.90 1uwk s ASN 105 N 1.92 2.61 -0.07 0.00 0.01 -0.56 -0.52 114.94 118.32 1uwk s ASN 105 Ca 0.01 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 51.71 1uwk s ASN 105 Cb -0.15 -1.10 0.00 0.00 0.41 0.00 0.00 41.25 40.40 1uwk s ASN 105 CO -0.07 0.13 0.00 -1.20 -1.51 0.00 0.00 177.10 174.45 1uwk n SER 106 N 3.51 -4.10 -4.71 -1.22 7.64 -1.24 -2.34 113.62 111.17 1uwk n SER 106 Ca -0.20 0.02 -0.42 0.00 1.01 0.00 0.00 58.87 59.28 1uwk n SER 106 Cb 0.53 -1.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.04 1uwk n SER 106 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1uwk s ASN 107 N -2.08 7.06 0.00 6.43 0.01 -1.26 -4.53 114.94 120.58 1uwk s ASN 107 Ca 0.00 2.00 0.05 0.00 -0.71 0.00 0.00 52.86 54.20 1uwk s ASN 107 Cb 0.00 -2.58 -0.01 0.00 0.41 0.00 0.00 41.25 39.07 1uwk s ASN 107 CO 0.00 -0.50 -0.14 -0.76 -1.51 0.00 0.00 177.10 174.18 1uwk s LEU 108 N 1.29 2.07 0.25 0.60 1.43 -1.26 -5.07 118.68 117.99 1uwk s LEU 108 Ca 0.59 -0.32 -0.31 0.00 -1.03 0.00 0.00 54.13 53.06 1uwk s LEU 108 Cb -0.29 -0.71 -0.13 0.00 0.03 0.00 0.00 46.19 45.09 1uwk s LEU 108 CO 0.28 0.14 1.49 0.52 0.23 0.00 0.00 176.35 179.01 1uwk n VAL 109 N 2.48 0.90 -0.33 -1.59 0.31 -1.26 -4.60 118.33 114.22 1uwk n VAL 109 Ca -0.15 -0.22 0.10 0.00 -0.01 0.00 0.00 64.34 64.05 1uwk n VAL 109 Cb 0.55 -1.65 0.28 0.00 -0.91 0.00 0.00 33.84 32.10 1uwk n VAL 109 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1uwk h PRO 110 N 4.57 0.72 0.00 5.55 0.11 -1.99 0.47 132.00 141.42 1uwk h PRO 110 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1uwk h PRO 110 Cb 1.26 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1uwk h PRO 110 CO 0.78 0.48 0.00 1.25 -0.21 0.00 0.00 178.00 180.30 1uwk h HIS 111 N 0.74 0.00 -0.51 0.65 -0.00 -2.04 -1.07 115.15 112.92 1uwk h HIS 111 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.90 1uwk h HIS 111 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.17 1uwk h HIS 111 CO -0.04 0.00 0.00 0.91 -0.00 0.00 0.00 177.93 178.80 1uwk n TRP 112 N -3.08 0.69 -2.84 5.26 8.01 0.13 -4.87 117.44 120.72 1uwk n TRP 112 Ca -0.02 -0.50 -0.44 0.00 -1.31 0.00 0.00 57.50 55.24 1uwk n TRP 112 Cb 0.16 -0.02 -0.00 0.00 -2.01 0.00 0.00 31.31 29.44 1uwk n TRP 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1uwk s ALA 113 N -1.00 3.78 0.16 6.99 0.00 -0.41 -4.61 121.76 126.66 1uwk s ALA 113 Ca 0.34 -3.20 -0.13 0.00 0.00 0.00 0.00 51.96 48.97 1uwk s ALA 113 Cb 0.18 -4.26 0.01 0.00 0.00 0.00 0.00 23.12 19.05 1uwk s ALA 113 CO 0.23 -2.93 0.37 0.54 0.00 0.00 0.00 175.76 173.97 1uwk s ASN 114 N 3.26 -0.10 0.36 0.00 2.20 -1.26 -3.02 114.94 116.38 1uwk s ASN 114 Ca 0.45 -0.60 0.08 0.00 -0.94 0.00 0.00 52.86 51.86 1uwk s ASN 114 Cb -0.01 0.48 0.69 0.00 -2.00 0.00 0.00 41.25 40.41 1uwk s ASN 114 CO 0.02 -0.91 1.87 -0.50 -2.94 0.00 0.00 177.10 174.63 1uwk h TRP 115 N 2.42 0.31 -0.44 1.54 4.06 -1.90 -1.49 115.95 120.46 1uwk h TRP 115 Ca -0.32 -0.04 -0.01 0.00 2.06 0.00 0.00 58.89 60.58 1uwk h TRP 115 Cb 1.24 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 29.30 1uwk h TRP 115 CO 0.37 0.44 0.22 0.93 -3.56 0.00 0.00 178.44 176.84 1uwk h GLU 116 N 0.27 0.62 -0.26 0.49 3.07 -1.97 0.19 114.58 116.99 1uwk h GLU 116 Ca 0.05 -0.09 -0.19 0.00 -0.50 0.00 0.00 59.36 58.63 1uwk h GLU 116 Cb 0.45 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1uwk h GLU 116 CO 0.03 0.53 -0.59 1.25 -1.40 0.00 0.00 179.01 178.82 1uwk h HIS 117 N 0.56 1.10 -0.48 4.33 2.76 -1.77 -1.76 115.15 119.89 1uwk h HIS 117 Ca 0.15 -0.41 0.08 0.00 -2.20 0.00 0.00 60.37 57.99 1uwk h HIS 117 Cb 0.10 -0.20 -0.06 0.00 1.55 0.00 0.00 27.41 28.80 1uwk h HIS 117 CO -0.01 1.24 0.11 0.35 -1.30 0.00 0.00 177.93 178.32 1uwk h PHE 118 N 0.65 0.19 -0.10 5.26 3.04 -1.01 -0.94 116.94 124.02 1uwk h PHE 118 Ca 0.00 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.89 1uwk h PHE 118 Cb 1.21 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.69 1uwk h PHE 118 CO 0.07 0.02 -0.33 -0.91 -2.02 0.00 0.00 178.31 175.14 1uwk h ASN 119 N 0.25 0.20 -0.42 0.41 -0.26 -0.38 0.20 115.58 115.58 1uwk h ASN 119 Ca 0.24 -0.07 -0.01 0.00 -0.56 0.00 0.00 56.30 55.90 1uwk h ASN 119 Cb 0.31 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.49 1uwk h ASN 119 CO -0.30 0.53 0.23 -0.08 -1.06 0.00 0.00 177.43 176.75 1uwk h GLU 120 N 0.18 0.59 -0.47 0.81 4.81 -0.63 -1.25 114.58 118.61 1uwk h GLU 120 Ca 0.02 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.07 1uwk h GLU 120 Cb 0.67 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1uwk h GLU 120 CO 0.05 0.47 -0.15 -0.07 -0.73 0.00 0.00 179.01 178.58 1uwk h LEU 121 N 0.55 0.91 -0.70 1.64 3.38 -0.66 -2.98 115.31 117.44 1uwk h LEU 121 Ca 0.15 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1uwk h LEU 121 Cb 0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1uwk h LEU 121 CO -0.02 1.05 0.33 -0.78 0.09 0.00 0.00 178.44 179.10 1uwk h ASP 122 N 0.80 0.93 0.10 -0.43 3.58 -0.38 0.88 116.42 121.91 1uwk h ASP 122 Ca 0.12 -0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 1uwk h ASP 122 Cb 0.69 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.50 1uwk h ASP 122 CO 0.05 0.81 -0.04 0.00 -2.88 0.00 0.00 179.24 177.19 1uwk h ALA 123 N 1.16 1.45 -0.13 -0.78 0.00 -1.11 -0.16 119.26 119.69 1uwk h ALA 123 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1uwk h ALA 123 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1uwk h ALA 123 CO -0.03 0.04 0.00 1.63 0.00 0.00 0.00 179.25 180.90 1uwk n LYS 124 N -3.79 1.76 -1.22 0.00 5.02 -0.58 -4.92 118.16 114.43 1uwk n LYS 124 Ca -0.03 -1.14 -0.04 0.00 -2.02 0.00 0.00 58.31 55.09 1uwk n LYS 124 Cb 0.13 -1.43 -0.02 0.00 -0.02 0.00 0.00 35.03 33.70 1uwk n LYS 124 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uwk n GLY 125 N 1.17 0.64 0.91 0.72 0.00 -0.07 -4.95 105.19 103.61 1uwk n GLY 125 Ca 0.17 -0.87 0.09 0.00 0.00 0.00 0.00 46.02 45.41 1uwk n GLY 125 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uwk n LEU 126 N -0.48 3.20 -4.07 0.99 4.77 0.20 -5.00 117.00 116.61 1uwk n LEU 126 Ca -0.04 -1.77 -0.07 0.00 -0.03 0.00 0.00 56.01 54.09 1uwk n LEU 126 Cb 0.18 -0.27 -0.10 0.00 -2.33 0.00 0.00 43.42 40.89 1uwk n LEU 126 CO 0.06 0.76 -0.36 0.00 -1.33 0.00 0.00 177.39 176.52 1uwk s ALA 127 N -1.10 0.43 -0.23 -1.18 0.00 -1.25 -4.84 121.76 113.60 1uwk s ALA 127 Ca 0.32 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.04 1uwk s ALA 127 Cb 0.18 0.24 0.07 0.00 0.00 0.00 0.00 23.12 23.61 1uwk s ALA 127 CO 0.24 -0.33 0.57 1.41 0.00 0.00 0.00 175.76 177.65 1uwk s MET 128 N -3.40 0.61 -0.21 0.00 1.75 -1.26 -4.80 119.30 112.00 1uwk s MET 128 Ca 0.02 0.95 -0.23 0.00 -1.25 0.00 0.00 55.69 55.18 1uwk s MET 128 Cb 0.04 0.17 -0.02 0.00 2.84 0.00 0.00 34.83 37.87 1uwk s MET 128 CO -0.08 -0.13 0.75 -0.47 -0.65 0.00 0.00 175.02 174.45 1uwk s TYR 129 N 1.06 3.36 -0.86 4.11 5.04 -1.26 -3.62 117.35 125.19 1uwk s TYR 129 Ca -0.06 1.09 0.27 0.00 -2.44 0.00 0.00 57.07 55.92 1uwk s TYR 129 Cb -0.06 -2.94 0.81 0.00 0.35 0.00 0.00 41.96 40.12 1uwk s TYR 129 CO -0.10 -0.27 1.67 0.41 -1.34 0.00 0.00 175.55 175.92 1uwk n GLY 130 N 3.70 -1.49 7.00 8.97 0.00 -1.26 -1.01 105.19 121.10 1uwk n GLY 130 Ca 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1uwk n GLY 130 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1uwk n GLN 131 N -1.82 0.00 -0.02 1.61 1.13 -1.26 -0.99 117.38 116.02 1uwk n GLN 131 Ca 0.06 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.09 1uwk n GLN 131 Cb 0.38 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.72 1uwk n GLN 131 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1uwk n MET 132 N 14.00 0.15 -0.03 -1.09 2.81 -1.26 -4.15 117.12 127.54 1uwk n MET 132 Ca 0.00 0.06 0.11 0.00 -1.81 0.00 0.00 57.70 56.06 1uwk n MET 132 Cb 0.00 -0.71 0.11 0.00 -0.71 0.00 0.00 33.22 31.91 1uwk n MET 132 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1uwk n THR 133 N -3.08 0.09 0.04 2.03 -2.24 -1.26 -4.11 114.28 105.75 1uwk n THR 133 Ca -0.04 -0.54 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 1uwk n THR 133 Cb 0.14 1.39 -0.09 0.00 -2.10 0.00 0.00 70.33 69.68 1uwk n THR 133 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uwk h ALA 134 N 4.46 -0.15 -0.00 6.98 0.00 -1.80 -2.47 119.26 126.27 1uwk h ALA 134 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1uwk h ALA 134 Cb 0.95 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1uwk h ALA 134 CO 0.00 -0.32 -0.11 0.41 0.00 0.00 0.00 179.25 179.24 1uwk n GLY 135 N 0.31 -1.30 0.37 0.00 0.00 -0.16 -3.58 105.19 100.83 1uwk n GLY 135 Ca -0.08 -0.19 0.04 0.00 0.00 0.00 0.00 46.02 45.79 1uwk n GLY 135 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uwk n SER 136 N -1.34 2.58 -3.35 1.61 3.41 -1.23 -4.93 113.62 110.37 1uwk n SER 136 Ca 0.10 -2.13 -0.16 0.00 -0.26 0.00 0.00 58.87 56.42 1uwk n SER 136 Cb 0.31 -0.17 0.08 0.00 -0.26 0.00 0.00 64.21 64.17 1uwk n SER 136 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1uwk n TRP 137 N -0.07 -2.25 -2.25 7.33 8.01 -0.95 -4.91 117.44 122.35 1uwk n TRP 137 Ca 0.08 0.91 -0.00 0.00 -1.31 0.00 0.00 57.50 57.17 1uwk n TRP 137 Cb 0.40 -4.77 -0.01 0.00 -2.01 0.00 0.00 31.31 24.91 1uwk n TRP 137 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.69 178.19 1uwk n ILE 138 N -3.83 0.00 -3.14 -0.99 0.13 -1.12 -4.58 119.36 105.84 1uwk n ILE 138 Ca -0.22 -0.49 -0.39 0.00 -1.10 0.00 0.00 62.75 60.55 1uwk n ILE 138 Cb 0.65 0.71 -0.06 0.00 -0.84 0.00 0.00 39.64 40.11 1uwk n ILE 138 CO 0.00 0.00 0.00 -0.47 2.80 0.00 0.00 176.55 178.88 1uwk s TYR 139 N 0.00 3.74 -0.25 9.51 5.04 -1.23 -4.88 117.35 129.29 1uwk s TYR 139 Ca 0.17 1.33 0.13 0.00 -2.44 0.00 0.00 57.07 56.25 1uwk s TYR 139 Cb 0.19 -2.66 0.46 0.00 0.35 0.00 0.00 41.96 40.30 1uwk s TYR 139 CO -0.08 0.39 1.18 0.44 -1.34 0.00 0.00 175.55 176.13 1uwk n ILE 140 N 2.45 2.00 -4.15 3.14 -5.35 -1.26 -4.60 119.36 111.60 1uwk n ILE 140 Ca -0.06 -3.51 0.00 0.00 -0.27 0.00 0.00 62.75 58.91 1uwk n ILE 140 Cb 0.50 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.13 1uwk n ILE 140 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1uwk n GLY 141 N -0.67 -0.86 0.16 3.28 0.00 -1.26 -3.66 105.19 102.18 1uwk n GLY 141 Ca 0.28 -1.18 0.13 0.00 0.00 0.00 0.00 46.02 45.26 1uwk n GLY 141 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1uwk h SER 142 N 2.44 0.00 0.22 1.61 0.02 -1.88 -2.94 113.55 113.03 1uwk h SER 142 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1uwk h SER 142 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1uwk h SER 142 CO 0.00 0.00 -0.10 -0.61 -1.14 0.00 0.00 176.83 174.98 1uwk h GLN 143 N 0.00 0.00 -0.62 3.45 4.15 -1.90 -2.85 115.11 117.34 1uwk h GLN 143 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.46 1uwk h GLN 143 Cb 0.49 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.15 1uwk h GLN 143 CO 0.00 0.10 0.41 0.78 -1.93 0.00 0.00 178.83 178.19 1uwk h GLY 144 N 0.54 0.80 0.00 2.39 0.00 -1.69 -2.84 103.07 102.28 1uwk h GLY 144 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1uwk h GLY 144 CO 0.01 0.23 -1.12 4.51 0.00 0.00 0.00 176.54 180.17 1uwk n ILE 145 N -4.47 0.00 -0.01 2.60 3.06 -1.12 -4.66 119.36 114.77 1uwk n ILE 145 Ca 0.08 -0.17 -0.02 0.00 -2.50 0.00 0.00 62.75 60.14 1uwk n ILE 145 Cb 0.17 0.75 0.25 0.00 0.54 0.00 0.00 39.64 41.34 1uwk n ILE 145 CO 0.00 0.00 0.00 1.62 -2.50 0.00 0.00 176.55 175.67 1uwk h VAL 146 N 0.00 1.23 -0.38 9.51 3.04 -1.27 -0.71 116.25 127.66 1uwk h VAL 146 Ca 0.00 -0.97 -0.14 0.00 -1.01 0.00 0.00 66.70 64.58 1uwk h VAL 146 Cb 0.54 1.07 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 1uwk h VAL 146 CO 0.00 0.32 -0.30 -0.61 -1.01 0.00 0.00 177.57 175.97 1uwk h GLN 147 N 0.51 0.83 -0.66 4.17 4.15 -1.83 -0.41 115.11 121.87 1uwk h GLN 147 Ca 0.10 -0.38 -0.01 0.00 0.77 0.00 0.00 58.65 59.12 1uwk h GLN 147 Cb 0.46 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.10 1uwk h GLN 147 CO 0.02 1.02 0.36 0.78 -1.93 0.00 0.00 178.83 179.08 1uwk h GLY 148 N 0.91 0.98 1.21 2.39 0.00 -1.57 0.88 103.07 107.88 1uwk h GLY 148 Ca 0.08 -0.44 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 1uwk h GLY 148 CO 0.07 0.43 -0.23 -0.84 0.00 0.00 0.00 176.54 175.97 1uwk h THR 149 N 0.90 1.27 -0.25 4.70 2.02 -0.98 -0.52 112.91 120.05 1uwk h THR 149 Ca 0.23 -1.38 0.01 0.00 0.77 0.00 0.00 66.41 66.04 1uwk h THR 149 Cb 0.04 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1uwk h THR 149 CO -0.04 0.47 0.15 0.22 0.37 0.00 0.00 175.52 176.69 1uwk h TYR 150 N 0.77 0.28 -0.52 3.16 3.20 -0.75 -0.83 116.97 122.27 1uwk h TYR 150 Ca 0.10 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 1uwk h TYR 150 Cb 0.79 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 1uwk h TYR 150 CO 0.05 0.17 0.21 0.93 -1.64 0.00 0.00 178.16 177.87 1uwk h GLU 151 N 0.31 0.76 -0.16 1.82 4.39 -0.64 0.22 114.58 121.28 1uwk h GLU 151 Ca 0.09 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1uwk h GLU 151 Cb -0.01 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.49 1uwk h GLU 151 CO -0.04 0.63 -0.00 1.15 -1.16 0.00 0.00 179.01 179.58 1uwk h THR 152 N 0.75 1.26 -0.68 1.13 2.02 -0.70 -1.21 112.91 115.47 1uwk h THR 152 Ca 0.18 -0.86 -0.06 0.00 0.77 0.00 0.00 66.41 66.44 1uwk h THR 152 Cb 0.15 1.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.05 1uwk h THR 152 CO -0.02 0.26 0.19 -0.26 0.37 0.00 0.00 175.52 176.06 1uwk h PHE 153 N 0.02 1.12 -0.24 3.16 0.04 -0.61 -0.78 116.94 119.66 1uwk h PHE 153 Ca 0.04 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.69 1uwk h PHE 153 Cb 0.39 -0.32 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1uwk h PHE 153 CO 0.04 0.91 0.15 0.28 -0.60 0.00 0.00 178.31 179.09 1uwk h VAL 154 N 1.01 1.08 -0.54 -0.55 2.07 -0.53 -0.20 116.25 118.59 1uwk h VAL 154 Ca 0.22 -0.19 -0.11 0.00 0.82 0.00 0.00 66.70 67.44 1uwk h VAL 154 Cb 0.34 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1uwk h VAL 154 CO -0.00 0.08 -0.11 -0.08 0.02 0.00 0.00 177.57 177.48 1uwk h GLU 155 N 0.31 1.02 -0.91 1.57 4.57 -1.02 0.12 114.58 120.23 1uwk h GLU 155 Ca 0.09 -0.38 0.06 0.00 -1.18 0.00 0.00 59.36 57.94 1uwk h GLU 155 Cb 0.00 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 28.47 1uwk h GLU 155 CO -0.02 1.06 0.58 0.00 -1.18 0.00 0.00 179.01 179.45 1uwk h ALA 156 N 0.92 1.24 -0.58 2.92 0.00 -1.04 0.46 119.26 123.18 1uwk h ALA 156 Ca 0.14 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1uwk h ALA 156 Cb 0.67 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1uwk h ALA 156 CO 0.05 0.36 0.13 0.78 0.00 0.00 0.00 179.25 180.56 1uwk h GLY 157 N 1.06 1.01 1.18 0.00 0.00 -0.32 -0.49 103.07 105.52 1uwk h GLY 157 Ca 0.39 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1uwk h GLY 157 CO -0.16 0.60 0.30 3.21 0.00 0.00 0.00 176.54 180.49 1uwk h ARG 158 N 0.84 1.04 -0.04 4.80 3.08 -0.21 0.22 114.38 124.12 1uwk h ARG 158 Ca 0.18 -0.17 -0.18 0.00 0.07 0.00 0.00 59.98 59.88 1uwk h ARG 158 Cb 0.37 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1uwk h ARG 158 CO 0.01 0.84 -0.76 1.96 -1.07 0.00 0.00 179.97 180.95 1uwk h GLN 159 N 1.03 0.30 0.00 0.04 4.20 -0.53 -3.35 115.11 116.79 1uwk h GLN 159 Ca 0.24 -0.26 -0.09 0.00 0.06 0.00 0.00 58.65 58.60 1uwk h GLN 159 Cb 0.17 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 1uwk h GLN 159 CO -0.02 0.92 -1.49 0.72 -0.67 0.00 0.00 178.83 178.28 1uwk n HIS 160 N -3.79 0.00 -0.71 2.96 8.25 -0.23 -4.83 115.22 116.88 1uwk n HIS 160 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1uwk n HIS 160 Cb 0.72 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.51 1uwk n HIS 160 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1uwk n TYR 161 N -2.11 0.00 -1.01 4.41 0.53 0.67 -5.03 117.16 114.61 1uwk n TYR 161 Ca -0.09 -0.16 -0.00 0.00 -1.02 0.00 0.00 57.90 56.63 1uwk n TYR 161 Cb 0.56 -0.02 -0.00 0.00 -1.03 0.00 0.00 39.34 38.85 1uwk n TYR 161 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1uwk n GLY 162 N -0.16 0.42 0.00 2.72 0.00 -0.76 -4.72 105.19 102.69 1uwk n GLY 162 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1uwk n GLY 162 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uwk n GLY 163 N -2.94 1.63 3.76 -0.02 0.00 -0.52 -4.86 105.19 102.25 1uwk n GLY 163 Ca -0.00 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 1uwk n GLY 163 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1uwk n SER 164 N 1.28 3.52 -1.78 1.61 2.88 -1.26 -3.75 113.62 116.12 1uwk n SER 164 Ca 0.00 1.19 0.02 0.00 -1.33 0.00 0.00 58.87 58.75 1uwk n SER 164 Cb 0.00 -1.60 0.33 0.00 -0.75 0.00 0.00 64.21 62.19 1uwk n SER 164 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1uwk n LEU 165 N 0.31 5.35 -4.68 2.46 4.77 -0.89 -4.97 117.00 119.34 1uwk n LEU 165 Ca 0.03 -2.74 -0.45 0.00 -0.03 0.00 0.00 56.01 52.82 1uwk n LEU 165 Cb 0.39 -0.69 -0.04 0.00 -2.33 0.00 0.00 43.42 40.76 1uwk n LEU 165 CO 0.62 0.64 1.26 1.17 -1.33 0.00 0.00 177.39 179.75 1uwk n LYS 166 N 0.33 2.29 -0.75 3.23 4.81 -1.15 -0.70 118.16 126.21 1uwk n LYS 166 Ca 0.29 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.55 1uwk n LYS 166 Cb 1.15 -2.62 0.00 0.00 0.02 0.00 0.00 35.03 33.58 1uwk n LYS 166 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uwk n GLY 167 N 3.62 0.85 3.75 3.14 0.00 -1.26 -5.03 105.19 110.26 1uwk n GLY 167 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1uwk n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwk s LYS 168 N -0.25 2.52 0.02 1.61 -0.14 0.12 -4.81 119.74 118.81 1uwk s LYS 168 Ca 0.00 -1.37 0.00 0.00 -1.36 0.00 0.00 55.97 53.24 1uwk s LYS 168 Cb 0.00 -2.30 -0.02 0.00 -1.68 0.00 0.00 37.83 33.83 1uwk s LYS 168 CO 0.00 0.23 -0.03 1.67 -0.76 0.00 0.00 175.35 176.46 1uwk s TRP 169 N -2.32 0.26 -0.15 3.18 1.48 -1.26 -1.27 118.94 118.87 1uwk s TRP 169 Ca 0.36 -0.45 -0.08 0.00 -1.06 0.00 0.00 56.10 54.87 1uwk s TRP 169 Cb -0.05 -0.18 -0.04 0.00 -1.16 0.00 0.00 33.47 32.03 1uwk s TRP 169 CO 0.23 -0.16 0.12 0.08 -4.06 0.00 0.00 176.95 173.17 1uwk s VAL 170 N -1.25 5.36 -0.17 -0.66 1.01 -0.51 -0.74 120.40 123.45 1uwk s VAL 170 Ca -0.13 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 1uwk s VAL 170 Cb -0.09 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1uwk s VAL 170 CO -0.01 0.56 -0.03 -0.22 0.00 0.00 0.00 175.10 175.40 1uwk s LEU 171 N -0.53 3.23 0.00 3.92 2.96 -0.11 -0.75 118.68 127.41 1uwk s LEU 171 Ca 0.12 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.80 1uwk s LEU 171 Cb -0.12 -1.79 0.03 0.00 0.50 0.00 0.00 46.19 44.81 1uwk s LEU 171 CO 0.02 0.13 0.50 1.07 -1.32 0.00 0.00 176.35 176.74 1uwk n THR 172 N 3.80 0.00 -3.92 3.68 5.66 -0.53 -1.90 114.28 121.07 1uwk n THR 172 Ca -0.17 -1.06 -0.08 0.00 -3.05 0.00 0.00 64.05 59.68 1uwk n THR 172 Cb 0.52 0.80 -0.08 0.00 -1.55 0.00 0.00 70.33 70.02 1uwk n THR 172 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uwk s ALA 173 N -2.16 -0.02 0.00 1.79 0.00 -1.26 -1.30 121.76 118.81 1uwk s ALA 173 Ca 0.17 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.35 1uwk s ALA 173 Cb -0.02 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.52 1uwk s ALA 173 CO 0.13 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 175.83 1uwk n GLY 174 N -0.01 -0.67 2.59 0.00 0.00 0.33 -0.83 105.19 106.60 1uwk n GLY 174 Ca -0.15 -0.81 -0.27 0.00 0.00 0.00 0.00 46.02 44.79 1uwk n GLY 174 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uwk n LEU 175 N 0.00 4.59 0.00 0.99 4.77 -1.26 -3.95 117.00 122.14 1uwk n LEU 175 Ca 0.00 -5.30 0.00 0.00 -0.03 0.00 0.00 56.01 50.68 1uwk n LEU 175 Cb 0.00 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 1uwk n LEU 175 CO 0.00 2.26 0.00 0.61 -1.33 0.00 0.00 177.39 178.93 1uwk n GLY 176 N -0.42 0.04 0.26 -0.72 0.00 -1.26 -4.43 105.19 98.67 1uwk n GLY 176 Ca 0.37 -1.65 -0.16 0.00 0.00 0.00 0.00 46.02 44.57 1uwk n GLY 176 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1uwk h GLY 177 N 0.00 -0.62 1.10 -0.02 0.00 -1.96 0.17 103.07 101.74 1uwk h GLY 177 Ca 0.00 0.23 -0.33 0.00 0.00 0.00 0.00 47.33 47.23 1uwk h GLY 177 CO 0.00 -0.23 -1.51 -0.33 0.00 0.00 0.00 176.54 174.47 1uwk h MET 178 N -0.64 0.48 0.00 4.80 2.86 -1.92 -3.31 114.93 117.20 1uwk h MET 178 Ca -0.06 -0.82 -0.01 0.00 -2.06 0.00 0.00 59.70 56.74 1uwk h MET 178 Cb 0.48 0.31 -0.00 0.00 0.06 0.00 0.00 31.60 32.44 1uwk h MET 178 CO 0.10 1.39 -0.06 0.78 1.06 0.00 0.00 176.91 180.18 1uwk h GLY 179 N 0.25 0.00 2.00 8.32 0.00 -1.77 -1.88 103.07 109.99 1uwk h GLY 179 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1uwk h GLY 179 CO 0.24 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.45 1uwk h GLY 180 N 0.19 0.00 2.00 4.60 0.00 -0.74 -0.84 103.07 108.28 1uwk h GLY 180 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1uwk h GLY 180 CO 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.45 1uwk h ALA 181 N 2.06 1.01 -0.07 3.60 0.00 -1.50 -3.35 119.26 121.00 1uwk h ALA 181 Ca 0.00 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1uwk h ALA 181 Cb 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1uwk h ALA 181 CO 0.00 0.12 -0.05 1.96 0.00 0.00 0.00 179.25 181.29 1uwk h GLN 182 N 0.00 -0.04 -0.48 0.00 4.20 -1.30 -0.59 115.11 116.89 1uwk h GLN 182 Ca -0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.75 1uwk h GLN 182 Cb 0.65 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.40 1uwk h GLN 182 CO 0.01 -0.03 0.26 -1.00 -0.67 0.00 0.00 178.83 177.40 1uwk h PRO 183 N -0.05 0.49 -0.45 1.46 0.13 -1.77 0.29 132.00 132.10 1uwk h PRO 183 Ca 0.05 -0.03 -0.12 0.00 -0.87 0.00 0.00 66.00 65.03 1uwk h PRO 183 Cb 0.11 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1uwk h PRO 183 CO -0.10 0.33 -0.18 1.25 -0.23 0.00 0.00 178.00 179.06 1uwk h LEU 184 N 0.51 0.94 -0.65 1.56 5.85 -1.22 -1.09 115.31 121.20 1uwk h LEU 184 Ca 0.20 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.59 1uwk h LEU 184 Cb 0.08 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 1uwk h LEU 184 CO -0.13 1.12 0.36 0.00 -0.34 0.00 0.00 178.44 179.46 1uwk h ALA 185 N 0.85 0.86 -0.30 1.25 0.00 -0.81 0.63 119.26 121.75 1uwk h ALA 185 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1uwk h ALA 185 Cb 0.75 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1uwk h ALA 185 CO 0.06 0.05 0.18 0.00 0.00 0.00 0.00 179.25 179.54 1uwk h ALA 186 N 1.33 0.38 -0.52 0.00 0.00 -0.69 -1.45 119.26 118.31 1uwk h ALA 186 Ca 0.29 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1uwk h ALA 186 Cb 0.16 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1uwk h ALA 186 CO -0.17 -0.13 0.23 1.15 0.00 0.00 0.00 179.25 180.33 1uwk h THR 187 N 0.39 0.88 0.00 0.00 2.02 -0.68 -0.15 112.91 115.37 1uwk h THR 187 Ca 0.11 -0.15 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 1uwk h THR 187 Cb -0.01 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1uwk h THR 187 CO -0.02 0.08 -0.32 -0.07 0.37 0.00 0.00 175.52 175.56 1uwk h LEU 188 N 0.44 0.00 0.00 2.58 3.38 -0.54 -0.40 115.31 120.76 1uwk h LEU 188 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1uwk h LEU 188 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1uwk h LEU 188 CO -0.21 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.64 1uwk n ALA 189 N -2.45 2.23 0.00 1.53 0.00 -0.58 -4.91 120.51 116.35 1uwk n ALA 189 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1uwk n ALA 189 Cb 0.37 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1uwk n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwk n GLY 190 N 0.98 0.72 3.88 0.00 0.00 -0.16 -2.10 105.19 108.50 1uwk n GLY 190 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1uwk n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwk s ALA 191 N -2.00 3.82 0.82 4.61 0.00 -0.15 -2.94 121.76 125.92 1uwk s ALA 191 Ca 0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 1uwk s ALA 191 Cb 0.00 -1.64 0.08 0.00 0.00 0.00 0.00 23.12 21.56 1uwk s ALA 191 CO 0.00 0.64 1.14 0.00 0.00 0.00 0.00 175.76 177.55 1uwk s SER 193 N -4.31 -0.37 -0.20 0.00 1.04 -0.87 -1.42 113.70 107.57 1uwk s SER 193 Ca 0.62 0.49 -0.02 0.00 0.48 0.00 0.00 55.95 57.52 1uwk s SER 193 Cb -0.12 0.57 -0.00 0.00 0.10 0.00 0.00 66.02 66.56 1uwk s SER 193 CO 0.51 -0.37 -0.09 -0.22 0.98 0.00 0.00 173.24 174.05 1uwk s LEU 194 N -0.74 2.70 -0.26 2.42 2.96 0.08 -0.40 118.68 125.44 1uwk s LEU 194 Ca -0.08 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1uwk s LEU 194 Cb -0.04 -1.66 0.07 0.00 0.50 0.00 0.00 46.19 45.06 1uwk s LEU 194 CO 0.04 0.01 -0.03 0.20 -1.32 0.00 0.00 176.35 175.25 1uwk s ASN 195 N 1.26 4.09 -0.07 3.68 0.01 0.12 -1.45 114.94 122.58 1uwk s ASN 195 Ca 0.03 -1.39 -0.22 0.00 -0.71 0.00 0.00 52.86 50.57 1uwk s ASN 195 Cb -0.14 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.21 1uwk s ASN 195 CO -0.04 -0.26 0.63 -0.63 -1.51 0.00 0.00 177.10 175.28 1uwk s ILE 196 N 1.30 5.07 -0.05 0.60 -1.09 -0.42 -0.98 121.20 125.63 1uwk s ILE 196 Ca -0.03 1.29 -0.03 0.00 -2.23 0.00 0.00 60.65 59.66 1uwk s ILE 196 Cb -0.19 -3.97 0.03 0.00 -1.58 0.00 0.00 42.46 36.75 1uwk s ILE 196 CO -0.08 0.29 0.11 -0.70 -1.23 0.00 0.00 174.94 173.34 1uwk s GLU 197 N 0.62 0.08 0.13 2.79 2.56 -0.31 -0.51 118.70 124.05 1uwk s GLU 197 Ca 0.34 0.27 0.25 0.00 0.00 0.00 0.00 54.97 55.83 1uwk s GLU 197 Cb -0.17 -0.12 0.62 0.00 2.00 0.00 0.00 34.13 36.47 1uwk s GLU 197 CO 0.16 -0.12 1.56 0.43 -0.56 0.00 0.00 175.26 176.73 1uwk n SER 198 N 3.84 0.64 -4.26 -1.70 7.64 -1.04 -1.50 113.62 117.24 1uwk n SER 198 Ca -0.22 0.28 -0.34 0.00 1.01 0.00 0.00 58.87 59.60 1uwk n SER 198 Cb 0.54 -0.24 -0.15 0.00 -1.01 0.00 0.00 64.21 63.35 1uwk n SER 198 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1uwk s GLN 199 N -3.11 3.26 0.36 1.43 -0.21 -1.26 -4.70 119.66 115.43 1uwk s GLN 199 Ca 0.09 -0.69 0.07 0.00 0.02 0.00 0.00 55.36 54.85 1uwk s GLN 199 Cb 0.14 -2.84 0.78 0.00 1.00 0.00 0.00 33.01 32.09 1uwk s GLN 199 CO 0.65 -0.16 1.92 0.37 -2.12 0.00 0.00 175.29 175.95 1uwk h GLN 200 N 7.94 0.70 0.00 2.91 5.75 -2.01 -1.34 115.11 129.06 1uwk h GLN 200 Ca -0.41 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.01 1uwk h GLN 200 Cb 1.16 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 29.55 1uwk h GLN 200 CO 0.61 0.46 -0.17 0.66 -2.65 0.00 0.00 178.83 177.75 1uwk h SER 201 N 0.72 0.00 0.08 -0.69 4.64 -1.99 0.08 113.55 116.39 1uwk h SER 201 Ca 0.37 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.41 1uwk h SER 201 Cb 0.48 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.60 1uwk h SER 201 CO -0.15 0.17 -1.16 0.03 -0.87 0.00 0.00 176.83 174.85 1uwk h ARG 202 N 0.00 0.66 -0.72 4.77 2.47 -1.57 -1.43 114.38 118.56 1uwk h ARG 202 Ca -0.00 -0.80 0.06 0.00 -1.26 0.00 0.00 59.98 57.98 1uwk h ARG 202 Cb 0.36 0.25 -0.06 0.00 -1.65 0.00 0.00 29.97 28.87 1uwk h ARG 202 CO 0.02 1.36 0.42 0.82 0.56 0.00 0.00 179.97 183.15 1uwk h ILE 203 N 0.33 0.98 -0.77 2.04 2.04 -0.95 -1.55 117.51 119.63 1uwk h ILE 203 Ca -0.16 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 1uwk h ILE 203 Cb 1.83 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 1uwk h ILE 203 CO 0.22 0.14 0.37 0.44 0.00 0.00 0.00 178.15 179.32 1uwk h ASP 204 N 0.76 0.99 -0.60 1.72 3.32 -0.90 0.40 116.42 122.11 1uwk h ASP 204 Ca 0.33 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1uwk h ASP 204 Cb 0.20 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1uwk h ASP 204 CO -0.19 0.84 0.09 0.15 -1.72 0.00 0.00 179.24 178.41 1uwk h PHE 205 N 1.09 1.07 -0.16 4.55 3.04 -0.72 0.24 116.94 126.04 1uwk h PHE 205 Ca 0.26 -0.15 -0.08 0.00 3.98 0.00 0.00 57.97 61.98 1uwk h PHE 205 Cb 0.11 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.32 1uwk h PHE 205 CO 0.01 0.93 -0.25 0.00 -2.02 0.00 0.00 178.31 176.97 1uwk h ARG 206 N 0.91 0.30 -0.32 1.11 -0.00 -0.74 -1.88 114.38 113.75 1uwk h ARG 206 Ca 0.18 -0.10 -0.08 0.00 -0.50 0.00 0.00 59.98 59.48 1uwk h ARG 206 Cb 0.44 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.38 1uwk h ARG 206 CO 0.01 0.54 -0.12 -0.07 0.00 0.00 0.00 179.97 180.33 1uwk h LEU 207 N 0.27 0.67 -1.57 3.04 3.38 -0.45 -0.03 115.31 120.61 1uwk h LEU 207 Ca 0.04 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 1uwk h LEU 207 Cb 0.60 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1uwk h LEU 207 CO 0.04 0.90 -0.05 -0.33 0.09 0.00 0.00 178.44 179.09 1uwk h GLU 208 N 0.43 0.21 -0.15 1.13 5.08 -0.72 -1.94 114.58 118.62 1uwk h GLU 208 Ca 0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1uwk h GLU 208 Cb 0.63 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1uwk h GLU 208 CO 0.04 0.28 0.00 0.25 -1.00 0.00 0.00 179.01 178.58 1uwk n THR 209 N -4.36 0.17 -3.20 1.13 -2.24 -0.73 -4.95 114.28 100.09 1uwk n THR 209 Ca -0.01 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.07 1uwk n THR 209 Cb 0.20 0.97 0.05 0.00 -2.10 0.00 0.00 70.33 69.45 1uwk n THR 209 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1uwk n ARG 210 N 0.98 -5.79 0.04 -0.78 1.74 -0.73 -4.57 116.66 107.55 1uwk n ARG 210 Ca 0.17 0.80 0.11 0.00 -0.77 0.00 0.00 57.85 58.16 1uwk n ARG 210 Cb 0.51 -5.57 -0.05 0.00 -1.02 0.00 0.00 32.46 26.33 1uwk n ARG 210 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1uwk n TYR 211 N -4.59 0.44 -4.20 -1.55 4.01 -0.10 -4.93 117.16 106.25 1uwk n TYR 211 Ca -0.05 0.13 -0.17 0.00 -0.16 0.00 0.00 57.90 57.64 1uwk n TYR 211 Cb 0.59 -0.64 -0.11 0.00 -0.31 0.00 0.00 39.34 38.86 1uwk n TYR 211 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1uwk s VAL 212 N -3.35 1.17 -0.21 -0.72 0.11 -1.08 -2.06 120.40 114.25 1uwk s VAL 212 Ca -0.01 -1.54 -0.11 0.00 -2.93 0.00 0.00 61.98 57.39 1uwk s VAL 212 Cb 0.12 -1.32 -0.19 0.00 -1.53 0.00 0.00 36.38 33.46 1uwk s VAL 212 CO 0.83 -0.37 0.04 0.47 -3.33 0.00 0.00 175.10 172.75 1uwk n ASP 213 N 0.83 1.99 -3.95 3.54 8.00 -1.03 -4.53 116.55 121.39 1uwk n ASP 213 Ca -0.18 0.23 -0.10 0.00 0.71 0.00 0.00 54.79 55.45 1uwk n ASP 213 Cb 0.56 -0.79 -0.06 0.00 -0.02 0.00 0.00 41.12 40.81 1uwk n ASP 213 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1uwk s GLU 214 N -2.48 1.33 -0.13 -1.24 -1.05 -0.79 -5.03 118.70 109.30 1uwk s GLU 214 Ca -0.30 -1.18 0.02 0.00 -0.15 0.00 0.00 54.97 53.35 1uwk s GLU 214 Cb 0.09 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.20 1uwk s GLU 214 CO 0.62 -0.53 -0.19 -1.14 0.95 0.00 0.00 175.26 174.98 1uwk s GLN 215 N -3.98 3.14 0.71 -4.83 0.74 -1.26 -0.23 119.66 113.95 1uwk s GLN 215 Ca 0.19 -0.80 -0.11 0.00 0.05 0.00 0.00 55.36 54.69 1uwk s GLN 215 Cb 0.01 -2.49 0.02 0.00 1.10 0.00 0.00 33.01 31.65 1uwk s GLN 215 CO 0.04 0.07 1.07 0.00 -0.55 0.00 0.00 175.29 175.91 1uwk s ALA 216 N 0.65 2.58 -0.49 1.58 0.00 0.05 -4.93 121.76 121.20 1uwk s ALA 216 Ca -0.10 0.12 0.24 0.00 0.00 0.00 0.00 51.96 52.22 1uwk s ALA 216 Cb -0.16 -3.20 0.27 0.00 0.00 0.00 0.00 23.12 20.03 1uwk s ALA 216 CO 0.02 -1.35 1.31 1.79 0.00 0.00 0.00 175.76 177.52 1uwk h THR 217 N -0.82 0.00 -1.28 0.00 1.35 -1.90 -3.44 112.91 106.83 1uwk h THR 217 Ca -0.44 -0.73 0.36 0.00 -0.55 0.00 0.00 66.41 65.06 1uwk h THR 217 Cb 1.22 1.37 -0.13 0.00 -1.73 0.00 0.00 68.15 68.88 1uwk h THR 217 CO 0.56 0.00 0.91 1.51 -0.25 0.00 0.00 175.52 178.25 1uwk s ASP 218 N -4.90 -0.03 0.20 5.36 1.47 -1.26 -5.01 116.67 112.50 1uwk s ASP 218 Ca 0.04 -0.07 -0.11 0.00 1.18 0.00 0.00 52.55 53.59 1uwk s ASP 218 Cb 0.11 0.08 0.16 0.00 -0.34 0.00 0.00 42.92 42.93 1uwk s ASP 218 CO 0.73 -0.16 1.86 0.25 0.68 0.00 0.00 175.17 178.52 1uwk h LEU 219 N 2.00 0.74 -0.64 2.11 5.85 -1.94 0.17 115.31 123.60 1uwk h LEU 219 Ca -0.32 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 1uwk h LEU 219 Cb 1.20 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1uwk h LEU 219 CO 0.29 0.52 0.30 0.44 -0.34 0.00 0.00 178.44 179.65 1uwk h ASP 220 N 0.88 0.85 -0.63 1.25 3.32 -2.00 -1.25 116.42 118.84 1uwk h ASP 220 Ca 0.27 -0.14 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1uwk h ASP 220 Cb -0.03 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1uwk h ASP 220 CO -0.09 0.76 0.21 -0.78 -1.72 0.00 0.00 179.24 177.62 1uwk h ASP 221 N 0.89 0.94 -0.79 6.45 3.58 -1.85 -1.06 116.42 124.58 1uwk h ASP 221 Ca 0.22 -0.16 0.03 0.00 0.42 0.00 0.00 57.03 57.54 1uwk h ASP 221 Cb 0.14 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 40.90 1uwk h ASP 221 CO -0.03 0.88 0.50 0.00 -2.88 0.00 0.00 179.24 177.71 1uwk h ALA 222 N 1.25 1.03 -0.07 -0.78 0.00 -0.45 -1.53 119.26 118.72 1uwk h ALA 222 Ca 0.22 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1uwk h ALA 222 Cb 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1uwk h ALA 222 CO -0.01 0.32 -0.49 -0.07 0.00 0.00 0.00 179.25 179.00 1uwk h LEU 223 N 0.98 0.18 -0.33 0.00 3.38 -0.65 -0.63 115.31 118.24 1uwk h LEU 223 Ca 0.31 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.22 1uwk h LEU 223 Cb 0.00 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1uwk h LEU 223 CO -0.11 0.64 0.16 0.58 0.09 0.00 0.00 178.44 179.80 1uwk h VAL 224 N 0.14 0.97 -0.36 1.22 2.07 -0.81 -0.33 116.25 119.15 1uwk h VAL 224 Ca 0.01 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 1uwk h VAL 224 Cb 0.91 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1uwk h VAL 224 CO 0.07 0.06 0.03 0.03 0.02 0.00 0.00 177.57 177.78 1uwk h ARG 225 N 0.33 0.62 -0.63 1.57 3.08 -0.99 -0.85 114.38 117.50 1uwk h ARG 225 Ca 0.14 -0.18 0.04 0.00 0.07 0.00 0.00 59.98 60.04 1uwk h ARG 225 Cb 0.06 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1uwk h ARG 225 CO -0.10 0.71 0.38 0.82 -1.07 0.00 0.00 179.97 180.70 1uwk h ILE 226 N 0.44 1.05 -0.50 2.04 1.08 -1.00 0.58 117.51 121.20 1uwk h ILE 226 Ca 0.11 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1uwk h ILE 226 Cb 0.41 0.25 -0.02 0.00 -3.07 0.00 0.00 36.82 34.39 1uwk h ILE 226 CO 0.01 0.13 0.32 0.00 -0.69 0.00 0.00 178.15 177.93 1uwk h ALA 227 N 1.29 0.64 0.13 1.87 0.00 -0.80 -1.22 119.26 121.17 1uwk h ALA 227 Ca 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1uwk h ALA 227 Cb 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1uwk h ALA 227 CO -0.12 0.10 -0.06 -0.22 0.00 0.00 0.00 179.25 178.94 1uwk h LYS 228 N 0.68 -0.17 -0.30 0.00 3.64 -0.68 -2.41 116.57 117.33 1uwk h LYS 228 Ca 0.18 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.44 1uwk h LYS 228 Cb -0.05 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1uwk h LYS 228 CO -0.04 0.11 -0.37 1.88 -2.27 0.00 0.00 179.45 178.76 1uwk h TYR 229 N -0.45 0.80 -0.59 1.91 0.05 -0.84 -2.22 116.97 115.63 1uwk h TYR 229 Ca -0.02 -0.23 -0.09 0.00 0.05 0.00 0.00 58.73 58.44 1uwk h TYR 229 Cb 0.36 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 1uwk h TYR 229 CO 0.01 0.95 -0.00 1.79 -1.05 0.00 0.00 178.16 179.86 1uwk h THR 230 N 0.56 1.26 -0.24 -2.88 1.35 -1.29 0.48 112.91 112.17 1uwk h THR 230 Ca 0.05 -1.14 -0.01 0.00 -0.55 0.00 0.00 66.41 64.76 1uwk h THR 230 Cb 0.89 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 68.11 1uwk h THR 230 CO 0.08 0.41 0.09 0.00 -0.25 0.00 0.00 175.52 175.85 1uwk h ALA 231 N 1.04 1.71 -0.00 6.62 0.00 -1.15 -1.22 119.26 126.26 1uwk h ALA 231 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1uwk h ALA 231 Cb 0.55 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1uwk h ALA 231 CO 0.03 0.23 -0.27 0.39 0.00 0.00 0.00 179.25 179.64 1uwk n GLU 232 N -4.43 0.54 -1.68 0.00 1.02 -0.86 -4.93 120.64 110.30 1uwk n GLU 232 Ca 0.01 -0.27 -0.09 0.00 -0.02 0.00 0.00 57.16 56.78 1uwk n GLU 232 Cb 0.13 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.03 1uwk n GLU 232 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1uwk n GLY 233 N 1.38 0.58 3.89 0.62 0.00 -0.46 -5.03 105.19 106.17 1uwk n GLY 233 Ca 0.11 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 1uwk n GLY 233 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwk s LYS 234 N -3.53 3.38 -0.54 1.61 1.02 0.06 -4.68 119.74 117.07 1uwk s LYS 234 Ca 0.00 0.40 0.04 0.00 0.02 0.00 0.00 55.97 56.43 1uwk s LYS 234 Cb 0.00 -2.21 0.13 0.00 -0.52 0.00 0.00 37.83 35.24 1uwk s LYS 234 CO 0.00 -0.52 0.29 0.00 -0.92 0.00 0.00 175.35 174.20 1uwk s ALA 235 N -3.02 3.32 -0.06 5.17 0.00 -1.26 -4.34 121.76 121.57 1uwk s ALA 235 Ca 0.52 -3.32 0.06 0.00 0.00 0.00 0.00 51.96 49.23 1uwk s ALA 235 Cb -0.11 -2.15 -0.01 0.00 0.00 0.00 0.00 23.12 20.85 1uwk s ALA 235 CO 0.49 -2.03 -0.24 0.42 0.00 0.00 0.00 175.76 174.40 1uwk s ILE 236 N -0.41 2.13 -0.16 0.00 1.01 -1.26 -4.79 121.20 117.72 1uwk s ILE 236 Ca 0.18 -1.04 -0.10 0.00 0.00 0.00 0.00 60.65 59.69 1uwk s ILE 236 Cb -0.23 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 1uwk s ILE 236 CO -0.02 0.57 0.17 -0.94 0.00 0.00 0.00 174.94 174.72 1uwk s SER 237 N -0.16 6.33 -0.11 3.58 1.04 -1.26 -2.05 113.70 121.07 1uwk s SER 237 Ca -0.03 0.39 0.02 0.00 0.48 0.00 0.00 55.95 56.81 1uwk s SER 237 Cb -0.14 -2.11 -0.01 0.00 0.10 0.00 0.00 66.02 63.87 1uwk s SER 237 CO 0.04 0.25 -0.20 -0.63 0.98 0.00 0.00 173.24 173.68 1uwk s ILE 238 N -0.14 2.43 0.02 -1.02 1.01 0.46 -1.89 121.20 122.08 1uwk s ILE 238 Ca 0.12 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.80 1uwk s ILE 238 Cb -0.12 -1.97 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1uwk s ILE 238 CO 0.02 0.55 0.32 0.00 0.00 0.00 0.00 174.94 175.82 1uwk s ALA 239 N 0.35 3.79 -0.11 9.38 0.00 0.68 -0.70 121.76 135.15 1uwk s ALA 239 Ca -0.16 -0.46 -0.00 0.00 0.00 0.00 0.00 51.96 51.34 1uwk s ALA 239 Cb -0.17 -2.17 0.02 0.00 0.00 0.00 0.00 23.12 20.80 1uwk s ALA 239 CO 0.08 0.59 -0.08 -1.17 0.00 0.00 0.00 175.76 175.18 1uwk s LEU 240 N -1.64 1.26 -0.20 0.00 2.96 -0.15 -0.77 118.68 120.14 1uwk s LEU 240 Ca 0.28 -0.30 -0.29 0.00 -0.22 0.00 0.00 54.13 53.59 1uwk s LEU 240 Cb -0.14 -0.84 -0.01 0.00 0.50 0.00 0.00 46.19 45.69 1uwk s LEU 240 CO 0.15 -0.10 1.35 -2.28 -1.32 0.00 0.00 176.35 174.16 1uwk s HIS 241 N 1.56 2.63 -2.36 5.38 5.65 -1.26 -1.16 115.29 125.73 1uwk s HIS 241 Ca 0.02 0.84 0.00 0.00 0.25 0.00 0.00 55.06 56.17 1uwk s HIS 241 Cb -0.13 -3.71 0.00 0.00 -1.18 0.00 0.00 32.58 27.56 1uwk s HIS 241 CO -0.07 -2.05 0.00 0.41 -0.65 0.00 0.00 174.74 172.38 1uwk n GLY 242 N 3.98 -1.25 3.28 1.59 0.00 -0.56 -4.91 105.19 107.32 1uwk n GLY 242 Ca 0.15 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 1uwk n GLY 242 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uwk s ASN 243 N -4.00 3.82 0.40 1.61 3.84 -1.26 -2.48 114.94 116.86 1uwk s ASN 243 Ca 0.00 -0.44 0.07 0.00 0.21 0.00 0.00 52.86 52.70 1uwk s ASN 243 Cb 0.00 -1.60 0.83 0.00 -0.55 0.00 0.00 41.25 39.93 1uwk s ASN 243 CO 0.00 0.07 2.02 0.00 -2.79 0.00 0.00 177.10 176.40 1uwk h ALA 244 N 7.44 1.65 0.00 1.71 0.00 -1.93 -0.03 119.26 128.10 1uwk h ALA 244 Ca -0.35 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1uwk h ALA 244 Cb 1.18 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1uwk h ALA 244 CO 0.58 0.29 0.00 0.00 0.00 0.00 0.00 179.25 180.13 1uwk n ALA 245 N -2.48 1.91 -0.11 0.00 0.00 -1.26 -0.97 120.51 117.60 1uwk n ALA 245 Ca 0.02 -0.02 -0.23 0.00 0.00 0.00 0.00 53.44 53.22 1uwk n ALA 245 Cb 0.11 -1.37 -0.12 0.00 0.00 0.00 0.00 19.45 18.07 1uwk n ALA 245 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uwk n GLU 246 N -1.86 0.64 0.03 0.00 1.02 -0.46 -4.58 120.64 115.43 1uwk n GLU 246 Ca 0.04 0.26 -0.20 0.00 -0.02 0.00 0.00 57.16 57.24 1uwk n GLU 246 Cb 0.27 -1.57 -0.11 0.00 -0.02 0.00 0.00 31.44 30.01 1uwk n GLU 246 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1uwk h ILE 247 N -0.43 1.31 -0.29 -3.67 2.04 -0.94 -2.81 117.51 112.72 1uwk h ILE 247 Ca -0.57 -2.20 -0.02 0.00 1.00 0.00 0.00 64.86 63.07 1uwk h ILE 247 Cb 1.76 2.42 -0.01 0.00 -0.74 0.00 0.00 36.82 40.25 1uwk h ILE 247 CO -0.18 0.67 0.09 -0.07 0.00 0.00 0.00 178.15 178.66 1uwk h LEU 248 N 0.29 0.43 -1.49 1.44 4.07 -1.30 0.70 115.31 119.45 1uwk h LEU 248 Ca -0.12 -0.21 0.01 0.00 0.08 0.00 0.00 57.88 57.64 1uwk h LEU 248 Cb 1.61 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 43.21 1uwk h LEU 248 CO 0.19 0.52 0.35 -0.65 -1.08 0.00 0.00 178.44 177.77 1uwk h PRO 249 N 0.31 0.67 -0.63 1.13 0.11 -1.77 -1.49 132.00 130.33 1uwk h PRO 249 Ca 0.09 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.10 1uwk h PRO 249 Cb 0.25 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.18 1uwk h PRO 249 CO -0.00 0.45 0.16 1.49 -0.21 0.00 0.00 178.00 179.89 1uwk h GLU 250 N 0.69 1.00 -0.74 1.05 4.57 -1.15 -1.20 114.58 118.81 1uwk h GLU 250 Ca 0.20 -0.23 -0.06 0.00 -1.18 0.00 0.00 59.36 58.09 1uwk h GLU 250 Cb -0.05 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.38 1uwk h GLU 250 CO -0.05 0.90 0.24 -0.07 -1.18 0.00 0.00 179.01 178.85 1uwk h LEU 251 N 0.92 1.07 -0.60 1.64 3.38 -0.23 -0.62 115.31 120.87 1uwk h LEU 251 Ca 0.20 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1uwk h LEU 251 Cb 0.34 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1uwk h LEU 251 CO 0.00 0.98 0.40 0.58 0.09 0.00 0.00 178.44 180.49 1uwk h VAL 252 N 1.10 1.14 -0.41 1.22 2.07 -1.10 -1.46 116.25 118.81 1uwk h VAL 252 Ca 0.24 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 1uwk h VAL 252 Cb 0.30 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1uwk h VAL 252 CO -0.01 0.15 0.15 0.11 0.02 0.00 0.00 177.57 177.99 1uwk h LYS 253 N 0.81 0.58 -0.00 1.57 1.57 -0.54 -0.93 116.57 119.62 1uwk h LYS 253 Ca 0.22 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1uwk h LYS 253 Cb -0.08 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1uwk h LYS 253 CO -0.06 0.49 -0.00 0.54 -0.57 0.00 0.00 179.45 179.85 1uwk n ARG 254 N -4.37 0.40 -1.56 3.15 1.74 -0.30 -4.92 116.66 110.80 1uwk n ARG 254 Ca 0.03 -0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.99 1uwk n ARG 254 Cb 0.15 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.05 1uwk n ARG 254 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwk n GLY 255 N 1.30 0.94 3.76 -0.13 0.00 -0.35 -5.00 105.19 105.70 1uwk n GLY 255 Ca 0.14 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 1uwk n GLY 255 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwk s VAL 256 N -2.48 3.20 -0.39 1.61 1.01 -0.59 -5.00 120.40 117.77 1uwk s VAL 256 Ca 0.00 1.15 0.02 0.00 0.00 0.00 0.00 61.98 63.16 1uwk s VAL 256 Cb 0.00 -3.73 0.11 0.00 0.00 0.00 0.00 36.38 32.76 1uwk s VAL 256 CO 0.00 0.25 0.14 -0.60 0.00 0.00 0.00 175.10 174.89 1uwk s ARG 257 N -1.23 1.35 1.00 2.72 3.52 -1.26 -4.65 118.95 120.40 1uwk s ARG 257 Ca 0.49 -1.85 -0.13 0.00 -0.13 0.00 0.00 55.73 54.11 1uwk s ARG 257 Cb -0.35 -2.76 0.19 0.00 -1.56 0.00 0.00 34.95 30.46 1uwk s ARG 257 CO 0.44 -1.03 1.10 -2.14 -0.81 0.00 0.00 175.30 172.87 1uwk s PRO 258 N 0.74 0.43 0.07 5.12 0.02 -1.26 -4.97 135.00 135.14 1uwk s PRO 258 Ca 0.13 0.42 0.23 0.00 0.02 0.00 0.00 61.00 61.80 1uwk s PRO 258 Cb -0.21 -1.75 0.09 0.00 0.02 0.00 0.00 34.50 32.66 1uwk s PRO 258 CO -0.09 -2.71 1.07 -0.25 -0.33 0.00 0.00 177.00 174.69 1uwk n ASP 259 N -4.14 0.63 -3.66 2.53 8.00 0.09 -4.85 116.55 115.14 1uwk n ASP 259 Ca 0.06 -0.11 -0.15 0.00 0.71 0.00 0.00 54.79 55.30 1uwk n ASP 259 Cb 0.58 0.69 -0.08 0.00 -0.02 0.00 0.00 41.12 42.29 1uwk n ASP 259 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1uwk s MET 260 N -3.21 0.77 -0.03 -1.24 -1.94 -1.07 -4.14 119.30 108.44 1uwk s MET 260 Ca 0.04 0.34 0.01 0.00 -1.71 0.00 0.00 55.69 54.37 1uwk s MET 260 Cb 0.14 0.36 0.01 0.00 2.01 0.00 0.00 34.83 37.36 1uwk s MET 260 CO 0.79 -0.18 -0.05 0.08 -0.01 0.00 0.00 175.02 175.64 1uwk s VAL 261 N -0.61 0.53 0.00 -6.03 1.01 -0.04 -0.93 120.40 114.33 1uwk s VAL 261 Ca -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1uwk s VAL 261 Cb -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.82 1uwk s VAL 261 CO 0.05 0.20 0.00 1.07 0.00 0.00 0.00 175.10 176.42 1uwk n THR 262 N 3.69 0.00 -3.63 3.92 5.66 -0.80 -1.85 114.28 121.27 1uwk n THR 262 Ca -0.22 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.63 1uwk n THR 262 Cb 0.53 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.23 1uwk n THR 262 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1uwk s ASP 263 N -0.32 -0.66 -0.19 1.09 -1.08 -1.26 -4.17 116.67 110.08 1uwk s ASP 263 Ca 0.00 1.14 0.21 0.00 -0.52 0.00 0.00 52.55 53.39 1uwk s ASP 263 Cb 0.00 1.13 0.45 0.00 -1.46 0.00 0.00 42.92 43.04 1uwk s ASP 263 CO 0.00 -0.32 1.17 1.67 0.52 0.00 0.00 175.17 178.21 1uwk n GLN 264 N 2.27 1.14 -0.93 4.34 7.27 -0.01 -4.10 117.38 127.37 1uwk n GLN 264 Ca -0.15 -2.72 -0.29 0.00 0.07 0.00 0.00 57.00 53.91 1uwk n GLN 264 Cb 0.56 -0.84 0.18 0.00 2.41 0.00 0.00 30.24 32.55 1uwk n GLN 264 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1uwk s THR 265 N -2.15 2.30 -1.29 1.69 -4.23 -1.20 -4.48 115.64 106.27 1uwk s THR 265 Ca 0.25 0.10 -0.06 0.00 -1.18 0.00 0.00 61.69 60.80 1uwk s THR 265 Cb 0.34 -2.39 0.06 0.00 1.34 0.00 0.00 72.50 71.85 1uwk s THR 265 CO -0.08 -0.13 2.56 -1.20 -0.54 0.00 0.00 174.62 175.23 1uwk n SER 266 N -4.29 8.03 0.08 3.99 7.64 -1.03 -4.61 113.62 123.43 1uwk n SER 266 Ca 0.06 -3.02 0.09 0.00 1.01 0.00 0.00 58.87 57.01 1uwk n SER 266 Cb 0.55 -1.39 0.38 0.00 -1.01 0.00 0.00 64.21 62.74 1uwk n SER 266 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uwk n ALA 267 N 2.05 1.44 0.32 -0.43 0.00 -1.26 -2.37 120.51 120.27 1uwk n ALA 267 Ca 0.65 0.06 0.15 0.00 0.00 0.00 0.00 53.44 54.29 1uwk n ALA 267 Cb 0.28 -1.27 0.65 0.00 0.00 0.00 0.00 19.45 19.11 1uwk n ALA 267 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 1uwk h HIS 268 N 0.00 0.00 -2.66 0.00 2.07 -1.49 -3.34 115.15 109.72 1uwk h HIS 268 Ca 0.00 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.93 1uwk h HIS 268 Cb 0.20 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 29.79 1uwk h HIS 268 CO 0.00 0.00 -0.84 0.34 -3.07 0.00 0.00 177.93 174.36 1uwk s ASP 269 N -4.88 2.85 0.55 3.10 3.68 -1.00 -4.34 116.67 116.63 1uwk s ASP 269 Ca 0.01 -2.65 0.24 0.00 2.13 0.00 0.00 52.55 52.28 1uwk s ASP 269 Cb 0.09 -0.65 1.46 0.00 -1.45 0.00 0.00 42.92 42.37 1uwk s ASP 269 CO 0.43 -0.25 2.09 -0.65 0.13 0.00 0.00 175.17 176.93 1uwk h PRO 270 N 6.46 0.00 -0.01 4.34 0.11 -1.79 0.83 132.00 141.94 1uwk h PRO 270 Ca 0.10 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.03 1uwk h PRO 270 Cb 0.93 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 1uwk h PRO 270 CO 0.38 0.00 -0.81 1.25 -0.21 0.00 0.00 178.00 178.61 1uwk h LEU 271 N 0.00 0.22 0.00 2.35 5.85 -1.91 -3.40 115.31 118.42 1uwk h LEU 271 Ca 0.11 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1uwk h LEU 271 Cb 0.48 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 1uwk h LEU 271 CO -0.00 0.93 -1.17 0.59 -0.34 0.00 0.00 178.44 178.45 1uwk n ASN 272 N -3.69 4.20 -0.23 1.25 3.02 -0.91 -4.85 115.26 114.05 1uwk n ASN 272 Ca -0.03 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.56 1uwk n ASN 272 Cb 0.76 1.03 0.02 0.00 -0.61 0.00 0.00 39.78 40.98 1uwk n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uwk n GLY 273 N 2.41 -0.56 2.68 7.41 0.00 0.24 -4.95 105.19 112.42 1uwk n GLY 273 Ca -0.02 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1uwk n GLY 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1uwk s TYR 274 N -0.76 0.36 -0.22 1.61 5.04 -1.25 -2.46 117.35 119.68 1uwk s TYR 274 Ca 0.07 -0.16 -0.29 0.00 -2.44 0.00 0.00 57.07 54.25 1uwk s TYR 274 Cb 0.06 -0.69 0.00 0.00 0.35 0.00 0.00 41.96 41.68 1uwk s TYR 274 CO 0.12 -0.37 1.11 -1.17 -1.34 0.00 0.00 175.55 173.90 1uwk s LEU 275 N 2.08 4.11 0.57 6.97 2.96 -1.26 -4.75 118.68 129.35 1uwk s LEU 275 Ca 0.03 1.45 -0.20 0.00 -0.22 0.00 0.00 54.13 55.20 1uwk s LEU 275 Cb -0.14 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1uwk s LEU 275 CO -0.06 -0.72 1.26 -2.84 -1.32 0.00 0.00 176.35 172.67 1uwk s PRO 276 N 3.33 3.08 0.19 0.98 0.02 -1.26 -4.90 135.00 136.44 1uwk s PRO 276 Ca 0.48 1.97 -0.33 0.00 0.02 0.00 0.00 61.00 63.13 1uwk s PRO 276 Cb -0.17 -2.08 -0.14 0.00 0.02 0.00 0.00 34.50 32.13 1uwk s PRO 276 CO 0.09 -1.16 1.55 0.00 -0.33 0.00 0.00 177.00 177.16 1uwk n ALA 277 N -1.30 1.43 0.00 -1.55 0.00 -1.26 -1.56 120.51 116.27 1uwk n ALA 277 Ca 0.12 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1uwk n ALA 277 Cb 0.48 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1uwk n ALA 277 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwk n GLY 278 N 3.11 2.23 3.93 0.00 0.00 -1.26 -5.04 105.19 108.16 1uwk n GLY 278 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1uwk n GLY 278 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uwk s TRP 279 N -2.30 3.30 0.24 1.61 0.52 -0.60 -5.09 118.94 116.62 1uwk s TRP 279 Ca 0.00 0.55 0.05 0.00 0.02 0.00 0.00 56.10 56.72 1uwk s TRP 279 Cb 0.00 -2.53 -0.03 0.00 -1.15 0.00 0.00 33.47 29.76 1uwk s TRP 279 CO 0.00 -0.59 0.35 0.95 0.02 0.00 0.00 176.95 177.68 1uwk s THR 280 N -2.81 5.20 0.34 2.01 -4.23 -1.26 -4.89 115.64 109.99 1uwk s THR 280 Ca 0.51 -1.02 0.02 0.00 -1.18 0.00 0.00 61.69 60.02 1uwk s THR 280 Cb -0.10 -3.83 0.27 0.00 1.34 0.00 0.00 72.50 70.18 1uwk s THR 280 CO 0.43 -0.33 1.99 -0.25 -0.54 0.00 0.00 174.62 175.92 1uwk h TRP 281 N 1.19 0.86 -0.36 3.99 2.91 -1.98 0.19 115.95 122.76 1uwk h TRP 281 Ca -0.52 0.02 -0.05 0.00 1.13 0.00 0.00 58.89 59.48 1uwk h TRP 281 Cb 1.23 -0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 29.58 1uwk h TRP 281 CO 0.46 0.52 0.04 0.93 -1.03 0.00 0.00 178.44 179.36 1uwk h GLU 282 N 0.91 0.61 -0.78 2.65 3.07 -1.99 -0.16 114.58 118.89 1uwk h GLU 282 Ca 0.27 -0.18 0.01 0.00 -0.50 0.00 0.00 59.36 58.97 1uwk h GLU 282 Cb -0.03 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 27.77 1uwk h GLU 282 CO -0.07 0.70 0.51 1.96 -1.40 0.00 0.00 179.01 180.71 1uwk h GLN 283 N 0.44 1.01 -0.02 2.33 4.20 -1.79 -2.15 115.11 119.13 1uwk h GLN 283 Ca 0.11 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1uwk h GLN 283 Cb 0.39 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 1uwk h GLN 283 CO 0.01 0.67 0.01 -0.92 -0.67 0.00 0.00 178.83 177.93 1uwk h TYR 284 N 1.04 0.03 -0.80 2.96 -0.00 -0.63 0.99 116.97 120.57 1uwk h TYR 284 Ca 0.29 -0.00 -0.04 0.00 -0.00 0.00 0.00 58.73 58.98 1uwk h TYR 284 Cb -0.11 -0.01 -0.04 0.00 -0.00 0.00 0.00 36.73 36.58 1uwk h TYR 284 CO -0.02 0.12 0.34 0.00 -0.00 0.00 0.00 178.16 178.59 1uwk h ARG 285 N -0.07 1.18 -0.16 1.82 2.47 -0.96 -1.74 114.38 116.92 1uwk h ARG 285 Ca 0.01 -0.20 -0.06 0.00 -1.26 0.00 0.00 59.98 58.47 1uwk h ARG 285 Cb 0.10 -0.20 -0.00 0.00 -1.65 0.00 0.00 29.97 28.22 1uwk h ARG 285 CO -0.00 0.94 -0.12 -0.44 0.56 0.00 0.00 179.97 180.92 1uwk h ASP 286 N 1.16 0.38 1.02 7.04 3.45 -1.11 -3.20 116.42 125.16 1uwk h ASP 286 Ca 0.27 -0.44 -0.02 0.00 0.43 0.00 0.00 57.03 57.26 1uwk h ASP 286 Cb 0.19 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 38.85 1uwk h ASP 286 CO -0.03 0.75 -0.11 0.03 -1.57 0.00 0.00 179.24 178.32 1uwk h ARG 287 N 0.03 0.00 0.00 3.56 3.08 -0.75 -2.26 114.38 118.04 1uwk h ARG 287 Ca 0.03 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1uwk h ARG 287 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 1uwk h ARG 287 CO 0.03 0.11 -0.02 0.00 -1.07 0.00 0.00 179.97 179.01 1uwk h ALA 288 N 1.89 1.15 0.02 0.04 0.00 -1.30 0.04 119.26 121.10 1uwk h ALA 288 Ca -0.00 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.60 1uwk h ALA 288 Cb 0.64 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1uwk h ALA 288 CO 0.01 0.03 -1.63 1.96 0.00 0.00 0.00 179.25 179.62 1uwk h GLN 289 N 0.00 0.03 0.11 0.00 1.08 -1.50 -3.30 115.11 111.53 1uwk h GLN 289 Ca -0.00 -0.06 -0.34 0.00 -1.45 0.00 0.00 58.65 56.80 1uwk h GLN 289 Cb 0.14 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 1uwk h GLN 289 CO 0.00 0.65 -1.85 1.79 -0.95 0.00 0.00 178.83 178.47 1uwk h THR 290 N 0.01 0.70 -2.04 -0.54 1.35 -1.43 -3.43 112.91 107.53 1uwk h THR 290 Ca -0.26 -2.33 -0.53 0.00 -0.55 0.00 0.00 66.41 62.75 1uwk h THR 290 Cb 1.98 2.49 -0.40 0.00 -1.73 0.00 0.00 68.15 70.49 1uwk h THR 290 CO 0.09 0.80 -1.07 -0.62 -0.25 0.00 0.00 175.52 174.48 1uwk n GLU 291 N -3.65 1.23 -0.33 4.72 -0.58 -0.05 -4.97 120.64 117.01 1uwk n GLU 291 Ca -0.31 -3.58 -0.01 0.00 -0.42 0.00 0.00 57.16 52.85 1uwk n GLU 291 Cb 0.99 -1.63 0.16 0.00 -0.57 0.00 0.00 31.44 30.39 1uwk n GLU 291 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1uwk h PRO 292 N 3.43 1.20 -0.93 3.49 0.13 -1.68 -1.28 132.00 136.36 1uwk h PRO 292 Ca 0.10 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 65.15 1uwk h PRO 292 Cb 0.87 -0.27 -0.04 0.00 0.13 0.00 0.00 31.00 31.68 1uwk h PRO 292 CO 0.54 0.79 0.54 0.00 -0.23 0.00 0.00 178.00 179.65 1uwk h ALA 293 N 1.43 1.19 -0.13 -0.56 0.00 -1.93 -0.19 119.26 119.07 1uwk h ALA 293 Ca 0.35 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.99 1uwk h ALA 293 Cb -0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 1uwk h ALA 293 CO -0.08 0.67 -0.57 0.00 0.00 0.00 0.00 179.25 179.27 1uwk h ALA 294 N 1.30 0.79 -0.25 0.00 0.00 -1.81 -1.82 119.26 117.47 1uwk h ALA 294 Ca 0.33 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1uwk h ALA 294 Cb -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1uwk h ALA 294 CO -0.06 0.70 -0.02 0.28 0.00 0.00 0.00 179.25 180.15 1uwk h VAL 295 N 0.30 1.27 -0.60 0.00 2.07 -0.72 -1.07 116.25 117.49 1uwk h VAL 295 Ca 0.00 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.62 1uwk h VAL 295 Cb 1.08 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 32.19 1uwk h VAL 295 CO 0.10 0.30 0.30 0.58 0.02 0.00 0.00 177.57 178.87 1uwk h VAL 296 N 0.22 0.92 -0.37 2.57 2.07 -0.90 -0.09 116.25 120.68 1uwk h VAL 296 Ca 0.07 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1uwk h VAL 296 Cb 0.45 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1uwk h VAL 296 CO 0.02 0.10 0.14 0.50 0.02 0.00 0.00 177.57 178.35 1uwk h LYS 297 N 0.57 0.55 -0.81 1.57 1.63 -1.19 0.23 116.57 119.12 1uwk h LYS 297 Ca 0.28 -0.11 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1uwk h LYS 297 Cb 0.21 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.71 1uwk h LYS 297 CO -0.20 0.55 0.49 0.00 -3.45 0.00 0.00 179.45 176.84 1uwk h ALA 298 N 0.98 1.03 -0.11 5.00 0.00 -0.73 0.10 119.26 125.52 1uwk h ALA 298 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1uwk h ALA 298 Cb 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1uwk h ALA 298 CO -0.01 0.49 0.04 0.00 0.00 0.00 0.00 179.25 179.78 1uwk h ALA 299 N 1.26 0.15 -0.35 0.00 0.00 -0.74 -2.24 119.26 117.35 1uwk h ALA 299 Ca 0.29 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1uwk h ALA 299 Cb -0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1uwk h ALA 299 CO -0.05 -0.26 -0.06 0.87 0.00 0.00 0.00 179.25 179.75 1uwk h LYS 300 N 0.02 0.58 -0.84 0.00 1.57 -0.71 0.15 116.57 117.34 1uwk h LYS 300 Ca 0.04 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1uwk h LYS 300 Cb 0.18 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 1uwk h LYS 300 CO -0.00 0.65 0.47 1.96 -0.57 0.00 0.00 179.45 181.95 1uwk h GLN 301 N 0.54 1.16 -0.15 3.15 4.20 -0.85 -1.25 115.11 121.91 1uwk h GLN 301 Ca 0.11 -0.13 -0.18 0.00 0.06 0.00 0.00 58.65 58.51 1uwk h GLN 301 Cb 0.44 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 1uwk h GLN 301 CO 0.02 0.84 -0.65 0.77 -0.67 0.00 0.00 178.83 179.14 1uwk h SER 302 N 1.17 0.64 -0.71 1.46 0.02 -0.78 -2.75 113.55 112.59 1uwk h SER 302 Ca 0.30 -0.38 0.05 0.00 -0.84 0.00 0.00 61.79 60.92 1uwk h SER 302 Cb 0.01 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.32 1uwk h SER 302 CO -0.05 1.12 0.47 0.24 -1.14 0.00 0.00 176.83 177.47 1uwk h MET 303 N 0.40 0.78 -0.71 3.45 2.86 -0.54 -0.33 114.93 120.84 1uwk h MET 303 Ca -0.01 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 1uwk h MET 303 Cb 1.22 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.67 1uwk h MET 303 CO 0.12 0.52 0.26 0.00 1.06 0.00 0.00 176.91 178.86 1uwk h ALA 304 N 1.60 0.92 -0.63 6.32 0.00 -0.96 0.15 119.26 126.66 1uwk h ALA 304 Ca 0.29 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1uwk h ALA 304 Cb 0.16 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1uwk h ALA 304 CO -0.09 0.57 0.18 0.28 0.00 0.00 0.00 179.25 180.19 1uwk h VAL 305 N 1.02 1.25 -0.14 0.00 2.07 -1.13 -1.26 116.25 118.06 1uwk h VAL 305 Ca 0.23 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1uwk h VAL 305 Cb 0.25 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1uwk h VAL 305 CO -0.01 0.33 -0.01 -0.74 0.02 0.00 0.00 177.57 177.16 1uwk h HIS 306 N 0.91 0.28 -0.22 1.57 6.17 -0.71 -2.05 115.15 121.09 1uwk h HIS 306 Ca 0.20 -0.05 -0.08 0.00 0.71 0.00 0.00 60.37 61.15 1uwk h HIS 306 Cb 0.32 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 30.17 1uwk h HIS 306 CO 0.02 0.50 -0.19 0.28 0.71 0.00 0.00 177.93 179.25 1uwk h VAL 307 N -0.02 1.24 -0.54 5.26 2.07 -0.66 -1.70 116.25 121.89 1uwk h VAL 307 Ca 0.04 -1.08 -0.03 0.00 0.82 0.00 0.00 66.70 66.44 1uwk h VAL 307 Cb 0.39 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1uwk h VAL 307 CO 0.01 0.34 0.21 -0.61 0.02 0.00 0.00 177.57 177.55 1uwk h GLN 308 N 0.36 0.78 -0.50 1.57 5.75 -1.00 -0.03 115.11 122.04 1uwk h GLN 308 Ca 0.06 -0.12 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 1uwk h GLN 308 Cb 0.54 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 1uwk h GLN 308 CO 0.04 0.65 0.18 0.00 -2.65 0.00 0.00 178.83 177.04 1uwk h ALA 309 N 1.46 0.65 -0.71 3.38 0.00 -0.75 0.12 119.26 123.41 1uwk h ALA 309 Ca 0.19 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1uwk h ALA 309 Cb 0.16 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1uwk h ALA 309 CO -0.02 0.29 0.45 0.52 0.00 0.00 0.00 179.25 180.49 1uwk h MET 310 N 0.67 0.87 -0.68 0.00 2.86 -0.62 0.27 114.93 118.31 1uwk h MET 310 Ca 0.16 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1uwk h MET 310 Cb 0.24 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 1uwk h MET 310 CO -0.01 0.58 0.30 -0.07 1.06 0.00 0.00 176.91 178.76 1uwk h LEU 311 N 0.90 0.89 -0.55 1.22 3.38 -0.69 -0.88 115.31 119.57 1uwk h LEU 311 Ca 0.28 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 1uwk h LEU 311 Cb -0.02 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1uwk h LEU 311 CO -0.09 0.77 -0.00 0.44 0.09 0.00 0.00 178.44 179.65 1uwk h ASP 312 N 0.96 0.96 -0.58 -0.43 3.32 -0.04 0.22 116.42 120.84 1uwk h ASP 312 Ca 0.23 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1uwk h ASP 312 Cb 0.14 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1uwk h ASP 312 CO -0.03 1.03 0.38 -0.26 -1.72 0.00 0.00 179.24 178.64 1uwk h PHE 313 N 0.86 0.73 -0.99 4.55 0.04 -0.58 -2.66 116.94 118.90 1uwk h PHE 313 Ca 0.16 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.97 1uwk h PHE 313 Cb 0.54 -0.25 -0.05 0.00 2.20 0.00 0.00 35.95 38.39 1uwk h PHE 313 CO 0.04 0.47 0.65 0.37 -0.60 0.00 0.00 178.31 179.24 1uwk h GLN 314 N 0.78 1.24 0.00 1.51 4.15 -0.76 -0.98 115.11 121.05 1uwk h GLN 314 Ca 0.21 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 1uwk h GLN 314 Cb -0.08 -0.28 -0.00 0.00 0.21 0.00 0.00 27.48 27.33 1uwk h GLN 314 CO -0.04 0.82 -0.11 -0.22 -1.93 0.00 0.00 178.83 177.35 1uwk h LYS 315 N 1.28 0.00 0.00 1.69 3.64 -0.63 0.16 116.57 122.70 1uwk h LYS 315 Ca 0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 1uwk h LYS 315 Cb -0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1uwk h LYS 315 CO -0.11 0.11 0.00 1.04 -2.27 0.00 0.00 179.45 178.22 1uwk n GLN 316 N -3.78 0.93 -0.39 1.90 1.13 -0.44 -4.88 117.38 111.84 1uwk n GLN 316 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1uwk n GLN 316 Cb 0.21 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.17 1uwk n GLN 316 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1uwk n GLY 317 N 0.76 0.73 3.69 1.08 0.00 0.55 -5.04 105.19 106.95 1uwk n GLY 317 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1uwk n GLY 317 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwk s VAL 318 N -2.52 4.65 -0.05 1.61 1.01 -0.80 -4.99 120.40 119.32 1uwk s VAL 318 Ca 0.00 1.92 -0.34 0.00 0.00 0.00 0.00 61.98 63.56 1uwk s VAL 318 Cb 0.00 -4.24 -0.12 0.00 0.00 0.00 0.00 36.38 32.02 1uwk s VAL 318 CO 0.00 0.02 1.81 -2.65 0.00 0.00 0.00 175.10 174.28 1uwk n PRO 319 N 4.91 2.12 -4.11 2.72 -0.02 -1.26 -4.04 135.00 135.33 1uwk n PRO 319 Ca 0.09 0.77 -0.18 0.00 -2.02 0.00 0.00 63.50 62.17 1uwk n PRO 319 Cb 0.48 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.21 1uwk n PRO 319 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1uwk s THR 320 N 3.38 0.40 0.08 3.45 2.01 -1.26 -0.86 115.64 122.84 1uwk s THR 320 Ca 0.90 -0.10 -0.15 0.00 0.31 0.00 0.00 61.69 62.65 1uwk s THR 320 Cb -0.71 -0.41 0.03 0.00 0.01 0.00 0.00 72.50 71.41 1uwk s THR 320 CO 0.49 0.17 0.35 0.72 -0.69 0.00 0.00 174.62 175.66 1uwk s PHE 321 N 0.59 -0.14 -0.08 4.92 -0.71 -0.77 -4.24 117.98 117.54 1uwk s PHE 321 Ca -0.07 -0.07 -0.17 0.00 -1.04 0.00 0.00 56.93 55.58 1uwk s PHE 321 Cb -0.10 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.82 1uwk s PHE 321 CO -0.00 -0.59 0.46 0.34 -1.34 0.00 0.00 175.22 174.09 1uwk s ASP 322 N -2.39 6.72 -0.47 1.98 2.15 -0.04 -4.26 116.67 120.36 1uwk s ASP 322 Ca -0.01 0.86 0.03 0.00 0.43 0.00 0.00 52.55 53.86 1uwk s ASP 322 Cb 0.01 -2.28 0.46 0.00 -0.30 0.00 0.00 42.92 40.81 1uwk s ASP 322 CO -0.07 0.08 1.61 0.00 -0.17 0.00 0.00 175.17 176.62 1uwk n TYR 323 N 3.19 2.92 -0.95 -5.34 -0.00 -1.26 -1.03 117.16 114.69 1uwk n TYR 323 Ca -0.09 -2.58 0.00 0.00 -0.00 0.00 0.00 57.90 55.23 1uwk n TYR 323 Cb 0.52 -0.88 0.00 0.00 -0.00 0.00 0.00 39.34 38.98 1uwk n TYR 323 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1uwk n GLY 324 N -0.83 0.58 0.74 2.98 0.00 -1.26 -4.94 105.19 102.46 1uwk n GLY 324 Ca 0.53 -0.80 0.06 0.00 0.00 0.00 0.00 46.02 45.81 1uwk n GLY 324 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uwk n ASN 325 N 1.53 3.20 -1.03 1.61 6.94 -1.26 -3.90 115.26 122.35 1uwk n ASN 325 Ca 0.00 -2.21 -0.13 0.00 -0.02 0.00 0.00 54.58 52.21 1uwk n ASN 325 Cb 0.09 -0.31 -0.06 0.00 -2.36 0.00 0.00 39.78 37.14 1uwk n ASN 325 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1uwk n ASN 326 N 0.36 -4.73 0.15 0.53 5.15 -1.26 -1.42 115.26 114.04 1uwk n ASN 326 Ca 0.14 0.33 0.01 0.00 -0.60 0.00 0.00 54.58 54.46 1uwk n ASN 326 Cb 0.54 -3.41 0.31 0.00 -0.53 0.00 0.00 39.78 36.69 1uwk n ASN 326 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1uwk h ILE 327 N 0.00 1.28 -0.66 -1.44 2.10 -1.94 -2.12 117.51 114.73 1uwk h ILE 327 Ca -0.27 -1.34 -0.08 0.00 1.08 0.00 0.00 64.86 64.24 1uwk h ILE 327 Cb 0.91 1.66 -0.03 0.00 -1.09 0.00 0.00 36.82 38.28 1uwk h ILE 327 CO 0.40 0.39 0.11 0.03 -1.08 0.00 0.00 178.15 178.00 1uwk h ARG 328 N 0.08 1.10 -0.62 2.19 3.08 -1.90 -1.73 114.38 116.56 1uwk h ARG 328 Ca 0.01 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 1uwk h ARG 328 Cb 0.70 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 1uwk h ARG 328 CO 0.05 1.00 0.39 0.37 -1.07 0.00 0.00 179.97 180.71 1uwk h GLN 329 N 1.03 0.84 -0.56 0.04 5.75 -1.78 0.39 115.11 120.82 1uwk h GLN 329 Ca 0.20 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.60 1uwk h GLN 329 Cb 0.44 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1uwk h GLN 329 CO 0.01 0.59 0.21 0.52 -2.65 0.00 0.00 178.83 177.52 1uwk h MET 330 N 0.85 0.85 -0.61 1.69 2.86 -1.17 -1.47 114.93 117.93 1uwk h MET 330 Ca 0.23 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 1uwk h MET 330 Cb -0.04 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 1uwk h MET 330 CO -0.04 0.74 0.17 0.00 1.06 0.00 0.00 176.91 178.84 1uwk h ALA 331 N 1.06 0.80 -0.94 6.32 0.00 -1.07 -2.35 119.26 123.08 1uwk h ALA 331 Ca 0.19 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1uwk h ALA 331 Cb 0.22 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1uwk h ALA 331 CO -0.01 0.49 0.62 -0.22 0.00 0.00 0.00 179.25 180.13 1uwk h LYS 332 N 0.88 1.22 0.00 0.00 3.64 -0.53 -1.25 116.57 120.53 1uwk h LYS 332 Ca 0.19 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1uwk h LYS 332 Cb 0.32 -0.28 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1uwk h LYS 332 CO -0.00 0.81 -0.17 0.93 -2.27 0.00 0.00 179.45 178.75 1uwk h GLU 333 N 1.26 0.00 -0.64 1.90 5.08 -0.95 -1.41 114.58 119.81 1uwk h GLU 333 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 1uwk h GLU 333 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1uwk h GLU 333 CO -0.09 0.17 0.00 0.39 -1.00 0.00 0.00 179.01 178.48 1uwk n GLU 334 N -3.39 3.26 0.00 2.33 4.71 -0.64 -4.94 120.64 121.98 1uwk n GLU 334 Ca -0.00 -2.13 0.00 0.00 -0.01 0.00 0.00 57.16 55.02 1uwk n GLU 334 Cb 0.37 -1.83 0.00 0.00 -1.01 0.00 0.00 31.44 28.96 1uwk n GLU 334 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1uwk n GLY 335 N 0.75 0.69 3.47 0.62 0.00 -0.53 -4.99 105.19 105.20 1uwk n GLY 335 Ca 0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 1uwk n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwk s VAL 336 N -2.00 4.68 0.26 1.61 1.01 -0.57 -4.84 120.40 120.55 1uwk s VAL 336 Ca 0.00 -1.72 0.31 0.00 0.00 0.00 0.00 61.98 60.57 1uwk s VAL 336 Cb 0.00 -4.85 0.33 0.00 0.00 0.00 0.00 36.38 31.86 1uwk s VAL 336 CO 0.00 -1.60 2.01 0.00 0.00 0.00 0.00 175.10 175.52 1uwk h ALA 337 N 8.55 1.08 -0.77 5.51 0.00 -1.87 -1.65 119.26 130.11 1uwk h ALA 337 Ca 0.20 -0.08 -0.33 0.00 0.00 0.00 0.00 54.91 54.71 1uwk h ALA 337 Cb 0.99 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.57 1uwk h ALA 337 CO 1.18 0.11 0.37 -0.40 0.00 0.00 0.00 179.25 180.51 1uwk n ASP 338 N -3.31 3.99 0.04 0.00 5.75 -1.26 -4.63 116.55 117.13 1uwk n ASP 338 Ca -0.01 -3.46 0.16 0.00 -0.01 0.00 0.00 54.79 51.47 1uwk n ASP 338 Cb 0.29 -0.76 0.64 0.00 -1.03 0.00 0.00 41.12 40.27 1uwk n ASP 338 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1uwk h ALA 339 N 1.69 2.29 -0.23 2.12 0.00 -1.61 -0.66 119.26 122.86 1uwk h ALA 339 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1uwk h ALA 339 Cb 2.42 0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.22 1uwk h ALA 339 CO 0.82 -0.41 0.00 1.19 0.00 0.00 0.00 179.25 180.85 1uwk n PHE 340 N -4.43 0.75 0.61 0.00 3.01 -1.26 -3.86 117.46 112.27 1uwk n PHE 340 Ca 0.07 -0.27 0.11 0.00 1.01 0.00 0.00 57.45 58.37 1uwk n PHE 340 Cb 0.44 -0.22 0.44 0.00 -0.01 0.00 0.00 39.48 40.13 1uwk n PHE 340 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1uwk n ASP 341 N 0.26 0.29 -4.56 4.37 10.43 -0.25 -4.56 116.55 122.52 1uwk n ASP 341 Ca 0.11 0.55 -0.30 0.00 2.57 0.00 0.00 54.79 57.71 1uwk n ASP 341 Cb 0.56 -0.62 -0.10 0.00 1.84 0.00 0.00 41.12 42.80 1uwk n ASP 341 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 177.20 176.85 1uwk s PHE 342 N -3.10 2.75 0.56 1.24 -0.71 -1.25 -5.13 117.98 112.35 1uwk s PHE 342 Ca 0.08 -0.14 -0.03 0.00 -1.04 0.00 0.00 56.93 55.80 1uwk s PHE 342 Cb 0.12 -1.48 0.02 0.00 -1.21 0.00 0.00 43.02 40.46 1uwk s PHE 342 CO 0.41 0.39 0.83 -1.25 -1.34 0.00 0.00 175.22 174.26 1uwk s PRO 343 N -1.88 2.81 0.56 1.99 0.04 -1.26 -4.75 135.00 132.51 1uwk s PRO 343 Ca 0.19 -0.29 -0.17 0.00 0.04 0.00 0.00 61.00 60.78 1uwk s PRO 343 Cb -0.11 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 32.01 1uwk s PRO 343 CO 0.11 -0.66 1.05 0.20 0.04 0.00 0.00 177.00 177.74 1uwk s GLY 344 N -4.33 2.22 0.54 0.56 0.00 -1.26 -0.86 107.32 104.19 1uwk s GLY 344 Ca 0.54 0.44 0.25 0.00 0.00 0.00 0.00 44.72 45.95 1uwk s GLY 344 CO 0.42 0.76 2.15 0.27 0.00 0.00 0.00 173.10 176.69 1uwk h PHE 345 N 0.73 0.00 0.08 1.90 -5.15 -1.43 -2.11 116.94 110.96 1uwk h PHE 345 Ca -0.47 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.29 1uwk h PHE 345 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.39 1uwk h PHE 345 CO 0.58 0.06 -0.04 0.28 -2.00 0.00 0.00 178.31 177.20 1uwk h VAL 346 N 0.00 0.75 -0.18 0.88 2.07 -1.86 0.58 116.25 118.49 1uwk h VAL 346 Ca -0.00 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1uwk h VAL 346 Cb 0.15 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1uwk h VAL 346 CO 0.01 0.23 0.06 1.55 0.02 0.00 0.00 177.57 179.44 1uwk h PRO 347 N -0.97 0.24 -0.05 1.57 0.13 -1.77 -0.25 132.00 130.90 1uwk h PRO 347 Ca -0.01 -0.02 -0.19 0.00 -0.87 0.00 0.00 66.00 64.91 1uwk h PRO 347 Cb 0.46 -0.05 0.01 0.00 0.13 0.00 0.00 31.00 31.55 1uwk h PRO 347 CO 0.02 0.22 -0.70 0.00 -0.23 0.00 0.00 178.00 177.31 1uwk h ALA 348 N 1.83 0.16 0.00 -0.56 0.00 -1.40 -3.45 119.26 115.84 1uwk h ALA 348 Ca 0.06 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1uwk h ALA 348 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1uwk h ALA 348 CO -0.01 0.48 -0.59 0.66 0.00 0.00 0.00 179.25 179.80 1uwk n TYR 349 N -4.10 0.00 -0.00 0.00 4.01 0.15 -4.95 117.16 112.27 1uwk n TYR 349 Ca -0.09 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.68 1uwk n TYR 349 Cb 0.71 0.16 -0.12 0.00 -0.31 0.00 0.00 39.34 39.78 1uwk n TYR 349 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1uwk n ILE 350 N -2.63 0.70 -0.27 -0.72 2.08 -0.89 -4.48 119.36 113.15 1uwk n ILE 350 Ca 0.00 -0.63 0.16 0.00 0.56 0.00 0.00 62.75 62.83 1uwk n ILE 350 Cb 0.29 -0.34 0.44 0.00 -0.75 0.00 0.00 39.64 39.28 1uwk n ILE 350 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 1uwk h ARG 351 N 0.00 0.54 0.00 0.38 2.43 -1.33 -0.69 114.38 115.71 1uwk h ARG 351 Ca -0.16 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1uwk h ARG 351 Cb 1.42 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.84 1uwk h ARG 351 CO 0.02 0.36 -0.04 -1.35 -1.51 0.00 0.00 179.97 177.44 1uwk h PRO 352 N 0.56 0.00 -0.28 0.20 0.11 -1.86 -0.96 132.00 129.76 1uwk h PRO 352 Ca 0.49 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.54 1uwk h PRO 352 Cb 0.99 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1uwk h PRO 352 CO -0.23 0.04 -0.06 -0.07 -0.21 0.00 0.00 178.00 177.48 1uwk h LEU 353 N 0.00 0.54 -1.71 2.35 3.38 -1.44 -2.94 115.31 115.49 1uwk h LEU 353 Ca -0.00 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1uwk h LEU 353 Cb 0.09 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1uwk h LEU 353 CO 0.01 0.77 0.09 -0.26 0.09 0.00 0.00 178.44 179.14 1uwk h PHE 354 N 0.30 0.26 0.00 1.13 0.04 -1.18 -0.93 116.94 116.58 1uwk h PHE 354 Ca 0.07 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 1uwk h PHE 354 Cb 0.53 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.59 1uwk h PHE 354 CO 0.05 0.21 0.00 0.00 -0.60 0.00 0.00 178.31 177.97 1uwk n ARG 356 N -3.05 3.38 -1.00 0.00 1.74 -0.47 -3.97 116.66 113.30 1uwk n ARG 356 Ca -0.02 -2.69 0.00 0.00 -0.77 0.00 0.00 57.85 54.36 1uwk n ARG 356 Cb 0.13 -1.75 0.00 0.00 -1.02 0.00 0.00 32.46 29.82 1uwk n ARG 356 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwk n GLY 357 N 0.59 0.35 3.74 -0.13 0.00 -0.03 -1.90 105.19 107.82 1uwk n GLY 357 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 1uwk n GLY 357 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwk s VAL 358 N -1.71 4.14 0.00 1.61 1.01 -0.51 -3.98 120.40 120.96 1uwk s VAL 358 Ca 0.00 1.93 -0.00 0.00 0.00 0.00 0.00 61.98 63.91 1uwk s VAL 358 Cb 0.00 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1uwk s VAL 358 CO 0.00 0.37 0.02 0.61 0.00 0.00 0.00 175.10 176.10 1uwk n GLY 359 N 1.87 0.73 2.22 4.51 0.00 -1.21 -3.68 105.19 109.63 1uwk n GLY 359 Ca 0.01 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.95 1uwk n GLY 359 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uwk n PRO 360 N -0.01 2.54 -1.69 1.61 -0.04 -1.26 -3.57 135.00 132.57 1uwk n PRO 360 Ca 0.00 -1.45 -0.44 0.00 -0.04 0.00 0.00 63.50 61.57 1uwk n PRO 360 Cb 0.01 -2.33 -0.02 0.00 -0.04 0.00 0.00 33.50 31.12 1uwk n PRO 360 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1uwk n PHE 361 N 3.15 2.29 -3.70 0.54 7.35 -1.26 -3.09 117.46 122.74 1uwk n PHE 361 Ca 0.54 0.44 -0.10 0.00 -0.76 0.00 0.00 57.45 57.57 1uwk n PHE 361 Cb 0.51 -2.47 -0.04 0.00 0.35 0.00 0.00 39.48 37.83 1uwk n PHE 361 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 1uwk s ARG 362 N -0.84 1.22 0.10 -4.13 1.70 -0.82 -1.37 118.95 114.82 1uwk s ARG 362 Ca 0.64 -0.81 -0.14 0.00 -0.47 0.00 0.00 55.73 54.95 1uwk s ARG 362 Cb -0.60 0.49 0.02 0.00 -0.57 0.00 0.00 34.95 34.29 1uwk s ARG 362 CO 0.53 -0.50 0.33 1.67 -1.08 0.00 0.00 175.30 176.25 1uwk s TRP 363 N -3.85 -0.09 0.02 5.89 -2.14 -0.65 -0.85 118.94 117.26 1uwk s TRP 363 Ca 0.07 -0.21 0.02 0.00 2.66 0.00 0.00 56.10 58.64 1uwk s TRP 363 Cb 0.01 0.14 -0.01 0.00 -3.10 0.00 0.00 33.47 30.51 1uwk s TRP 363 CO -0.07 -0.62 -0.06 0.00 -2.66 0.00 0.00 176.95 173.54 1uwk s ALA 364 N -3.54 0.48 -0.48 2.67 0.00 -0.26 -0.68 121.76 119.95 1uwk s ALA 364 Ca 0.02 -0.46 -0.21 0.00 0.00 0.00 0.00 51.96 51.30 1uwk s ALA 364 Cb 0.02 -0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1uwk s ALA 364 CO -0.10 0.05 0.72 0.00 0.00 0.00 0.00 175.76 176.42 1uwk s ALA 365 N -0.68 3.31 0.52 0.00 0.00 0.05 -1.53 121.76 123.43 1uwk s ALA 365 Ca -0.03 -1.35 0.30 0.00 0.00 0.00 0.00 51.96 50.88 1uwk s ALA 365 Cb -0.06 -3.42 1.72 0.00 0.00 0.00 0.00 23.12 21.36 1uwk s ALA 365 CO 0.00 -1.99 2.19 -0.07 0.00 0.00 0.00 175.76 175.89 1uwk h LEU 366 N 10.01 0.00 -1.99 0.00 3.38 -1.80 -1.30 115.31 123.61 1uwk h LEU 366 Ca -0.26 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1uwk h LEU 366 Cb 1.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 1uwk h LEU 366 CO 0.96 0.05 0.02 0.77 0.09 0.00 0.00 178.44 180.33 1uwk h SER 367 N 0.00 0.01 0.00 -0.43 4.64 -1.81 -3.37 113.55 112.59 1uwk h SER 367 Ca -0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uwk h SER 367 Cb 0.14 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1uwk h SER 367 CO 0.01 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1uwk n GLY 368 N -1.54 0.81 3.64 -0.77 0.00 -0.49 -0.86 105.19 105.97 1uwk n GLY 368 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1uwk n GLY 368 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uwk s GLU 369 N -0.63 4.13 0.29 1.61 0.41 -1.26 -4.58 118.70 118.66 1uwk s GLU 369 Ca 0.00 0.43 0.02 0.00 -0.41 0.00 0.00 54.97 55.01 1uwk s GLU 369 Cb 0.00 -3.62 0.57 0.00 -1.78 0.00 0.00 34.13 29.30 1uwk s GLU 369 CO 0.00 -0.29 1.84 0.00 -0.49 0.00 0.00 175.26 176.32 1uwk h ALA 370 N 7.76 1.54 0.00 5.21 0.00 -1.96 -1.03 119.26 130.78 1uwk h ALA 370 Ca -0.30 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1uwk h ALA 370 Cb 1.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1uwk h ALA 370 CO 0.74 0.21 -0.12 0.93 0.00 0.00 0.00 179.25 181.02 1uwk h GLU 371 N 0.98 0.00 -0.57 0.00 4.39 -1.99 -1.25 114.58 116.14 1uwk h GLU 371 Ca 0.50 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 60.15 1uwk h GLU 371 Cb 0.50 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 1uwk h GLU 371 CO -0.26 0.12 0.17 -0.44 -1.16 0.00 0.00 179.01 177.43 1uwk h ASP 372 N 0.00 0.85 -0.48 1.42 3.32 -1.56 -0.40 116.42 119.57 1uwk h ASP 372 Ca -0.00 -0.22 -0.13 0.00 0.02 0.00 0.00 57.03 56.70 1uwk h ASP 372 Cb 0.37 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1uwk h ASP 372 CO 0.02 0.84 -0.22 0.40 -1.72 0.00 0.00 179.24 178.56 1uwk h ILE 373 N 0.81 1.27 -0.53 0.35 1.08 -1.32 -1.80 117.51 117.37 1uwk h ILE 373 Ca 0.18 -1.39 -0.03 0.00 -0.39 0.00 0.00 64.86 63.24 1uwk h ILE 373 Cb 0.31 1.13 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 1uwk h ILE 373 CO -0.00 0.48 0.20 1.88 -0.69 0.00 0.00 178.15 180.02 1uwk h TYR 374 N 0.86 0.76 -0.64 1.37 0.05 -1.07 0.24 116.97 118.54 1uwk h TYR 374 Ca 0.11 -0.04 -0.08 0.00 0.05 0.00 0.00 58.73 58.77 1uwk h TYR 374 Cb 0.80 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.28 1uwk h TYR 374 CO 0.05 0.60 0.08 0.87 -1.05 0.00 0.00 178.16 178.71 1uwk h LYS 375 N 0.75 1.07 -0.41 4.88 1.57 -0.92 -1.85 116.57 121.67 1uwk h LYS 375 Ca 0.18 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 1uwk h LYS 375 Cb 0.16 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1uwk h LYS 375 CO -0.02 0.99 -0.12 1.79 -0.57 0.00 0.00 179.45 181.53 1uwk h THR 376 N 1.00 1.26 -0.75 -0.16 1.35 -0.38 -1.42 112.91 113.80 1uwk h THR 376 Ca 0.19 -1.16 0.03 0.00 -0.55 0.00 0.00 66.41 64.93 1uwk h THR 376 Cb 0.46 1.07 -0.05 0.00 -1.73 0.00 0.00 68.15 67.90 1uwk h THR 376 CO 0.02 0.39 0.47 0.44 -0.25 0.00 0.00 175.52 176.59 1uwk h ASP 377 N 0.66 0.78 -0.52 5.36 3.32 -0.69 0.56 116.42 125.90 1uwk h ASP 377 Ca 0.11 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.06 1uwk h ASP 377 Cb 0.59 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1uwk h ASP 377 CO 0.04 0.53 -0.05 0.00 -1.72 0.00 0.00 179.24 178.04 1uwk h ALA 378 N 1.32 0.87 -0.74 3.45 0.00 -1.05 -1.98 119.26 121.13 1uwk h ALA 378 Ca 0.30 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1uwk h ALA 378 Cb 0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1uwk h ALA 378 CO -0.11 0.65 0.29 -0.22 0.00 0.00 0.00 179.25 179.85 1uwk h LYS 379 N 0.89 1.11 -0.50 0.00 1.63 -0.65 -1.70 116.57 117.34 1uwk h LYS 379 Ca 0.15 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1uwk h LYS 379 Cb 0.59 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 32.02 1uwk h LYS 379 CO 0.04 0.91 0.31 0.28 -3.45 0.00 0.00 179.45 177.54 1uwk h VAL 380 N 1.06 1.14 -0.52 2.00 2.07 -0.46 -1.19 116.25 120.36 1uwk h VAL 380 Ca 0.24 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1uwk h VAL 380 Cb 0.23 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1uwk h VAL 380 CO -0.02 0.14 0.23 0.11 0.02 0.00 0.00 177.57 178.05 1uwk h LYS 381 N 0.67 0.74 -0.39 1.57 1.57 -1.11 0.11 116.57 119.72 1uwk h LYS 381 Ca 0.18 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 1uwk h LYS 381 Cb -0.04 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1uwk h LYS 381 CO -0.04 0.59 -0.16 1.49 -0.57 0.00 0.00 179.45 180.77 1uwk h GLU 382 N 0.73 0.72 0.00 3.15 4.81 -0.63 -3.07 114.58 120.30 1uwk h GLU 382 Ca 0.18 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1uwk h GLU 382 Cb 0.12 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1uwk h GLU 382 CO -0.02 0.84 -0.45 -0.07 -0.73 0.00 0.00 179.01 178.58 1uwk h LEU 383 N 0.64 0.00 -5.96 1.64 3.38 -0.71 -3.36 115.31 110.95 1uwk h LEU 383 Ca 0.10 -0.01 -0.57 0.00 0.09 0.00 0.00 57.88 57.49 1uwk h LEU 383 Cb 0.63 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.97 1uwk h LEU 383 CO 0.04 0.00 -0.84 -0.38 0.09 0.00 0.00 178.44 177.36 1uwk n ILE 384 N -2.85 1.21 0.31 1.22 5.41 -0.02 -4.97 119.36 119.66 1uwk n ILE 384 Ca 0.02 -4.83 0.15 0.00 1.00 0.00 0.00 62.75 59.10 1uwk n ILE 384 Cb 0.53 -1.71 0.57 0.00 -0.71 0.00 0.00 39.64 38.32 1uwk n ILE 384 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1uwk h PRO 385 N 3.77 0.00 -0.15 0.38 0.13 -1.69 -3.29 132.00 131.16 1uwk h PRO 385 Ca 0.14 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.21 1uwk h PRO 385 Cb 0.74 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.84 1uwk h PRO 385 CO 0.67 0.00 -0.17 -0.25 -0.23 0.00 0.00 178.00 178.03 1uwk n ASP 386 N -2.91 2.45 -4.02 1.44 10.43 -1.26 -4.84 116.55 117.85 1uwk n ASP 386 Ca 0.02 -3.52 -0.32 0.00 2.57 0.00 0.00 54.79 53.53 1uwk n ASP 386 Cb 0.33 -0.54 -0.13 0.00 1.84 0.00 0.00 41.12 42.62 1uwk n ASP 386 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1uwk s ASP 387 N -2.73 4.72 0.35 -2.24 -1.08 -1.24 -4.95 116.67 109.49 1uwk s ASP 387 Ca 0.39 -2.63 0.12 0.00 -0.52 0.00 0.00 52.55 49.90 1uwk s ASP 387 Cb 0.35 -1.70 0.63 0.00 -1.46 0.00 0.00 42.92 40.74 1uwk s ASP 387 CO 0.00 -0.33 1.78 0.00 0.52 0.00 0.00 175.17 177.13 1uwk h ALA 388 N 7.08 1.29 -0.78 3.66 0.00 -1.91 -0.78 119.26 127.82 1uwk h ALA 388 Ca -0.06 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 1uwk h ALA 388 Cb 0.96 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1uwk h ALA 388 CO 0.65 0.53 0.35 1.25 0.00 0.00 0.00 179.25 182.02 1uwk h HIS 389 N 0.03 1.16 -0.27 0.00 -0.00 -1.99 0.09 115.15 114.16 1uwk h HIS 389 Ca -0.00 -0.07 -0.10 0.00 -0.00 0.00 0.00 60.37 60.19 1uwk h HIS 389 Cb 0.74 -0.35 -0.00 0.00 -0.00 0.00 0.00 27.41 27.80 1uwk h HIS 389 CO 0.00 0.86 -0.24 1.25 -0.00 0.00 0.00 177.93 179.80 1uwk h LEU 390 N 1.12 0.68 -0.70 0.26 6.46 -1.91 0.30 115.31 121.53 1uwk h LEU 390 Ca 0.27 -0.46 0.05 0.00 -0.12 0.00 0.00 57.88 57.61 1uwk h LEU 390 Cb 0.16 -0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 39.85 1uwk h LEU 390 CO -0.03 1.00 0.42 0.45 -0.62 0.00 0.00 178.44 179.66 1uwk h HIS 391 N 0.37 0.77 -0.84 1.25 3.86 -0.97 -0.73 115.15 118.86 1uwk h HIS 391 Ca 0.05 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 1uwk h HIS 391 Cb 0.79 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.98 1uwk h HIS 391 CO 0.07 0.41 0.39 -0.09 0.86 0.00 0.00 177.93 179.56 1uwk h ARG 392 N 0.79 1.21 -0.17 2.45 9.65 -0.78 -0.28 114.38 127.25 1uwk h ARG 392 Ca 0.30 -0.19 0.03 0.00 -1.10 0.00 0.00 59.98 59.02 1uwk h ARG 392 Cb 0.11 -0.21 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1uwk h ARG 392 CO -0.15 0.94 -0.03 2.35 2.80 0.00 0.00 179.97 185.89 1uwk h TRP 393 N 1.20 -0.07 -0.08 2.20 2.91 -0.39 0.18 115.95 121.90 1uwk h TRP 393 Ca 0.29 0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.24 1uwk h TRP 393 Cb 0.14 0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 28.84 1uwk h TRP 393 CO 0.02 -0.06 -0.31 -0.07 -1.03 0.00 0.00 178.44 176.99 1uwk h LEU 394 N 0.01 0.14 -0.39 0.65 3.38 -0.64 0.16 115.31 118.63 1uwk h LEU 394 Ca 0.08 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1uwk h LEU 394 Cb 0.12 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1uwk h LEU 394 CO -0.17 0.45 0.05 0.44 0.09 0.00 0.00 178.44 179.31 1uwk h ASP 395 N 0.13 0.63 -0.26 -0.43 3.32 -0.56 -1.33 116.42 117.93 1uwk h ASP 395 Ca 0.02 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 1uwk h ASP 395 Cb 0.62 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1uwk h ASP 395 CO 0.04 0.74 0.01 0.24 -1.72 0.00 0.00 179.24 178.56 1uwk h MET 396 N 0.50 0.56 -0.23 3.56 2.86 -0.03 -1.25 114.93 120.89 1uwk h MET 396 Ca 0.12 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1uwk h MET 396 Cb 0.38 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1uwk h MET 396 CO 0.01 0.57 0.02 0.00 1.06 0.00 0.00 176.91 178.57 1uwk h ALA 397 N 1.49 0.30 -0.37 6.32 0.00 -0.56 0.26 119.26 126.70 1uwk h ALA 397 Ca 0.12 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1uwk h ALA 397 Cb 0.32 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1uwk h ALA 397 CO 0.01 0.01 0.01 -0.09 0.00 0.00 0.00 179.25 179.19 1uwk h ARG 398 N 0.17 0.57 0.00 0.00 9.65 -0.97 -0.85 114.38 122.96 1uwk h ARG 398 Ca 0.07 -0.12 -0.13 0.00 -1.10 0.00 0.00 59.98 58.69 1uwk h ARG 398 Cb 0.37 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 1uwk h ARG 398 CO 0.01 0.59 -1.12 0.93 2.80 0.00 0.00 179.97 183.17 1uwk h GLU 399 N 0.55 0.00 0.00 0.20 5.08 -0.96 -3.41 114.58 116.04 1uwk h GLU 399 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1uwk h GLU 399 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1uwk h GLU 399 CO 0.01 0.30 0.00 0.54 -1.00 0.00 0.00 179.01 178.86 1uwk n ARG 400 N -2.95 2.56 -3.80 2.33 5.12 0.89 -4.99 116.66 115.83 1uwk n ARG 400 Ca -0.05 -0.03 -0.37 0.00 -1.93 0.00 0.00 57.85 55.47 1uwk n ARG 400 Cb 0.77 -0.30 -0.13 0.00 -1.16 0.00 0.00 32.46 31.65 1uwk n ARG 400 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1uwk s ILE 401 N -0.38 3.80 0.10 0.55 1.01 -0.33 -4.93 121.20 121.02 1uwk s ILE 401 Ca 0.00 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 59.79 1uwk s ILE 401 Cb 0.00 -2.93 -0.07 0.00 0.01 0.00 0.00 42.46 39.47 1uwk s ILE 401 CO 0.00 0.13 0.52 -0.44 0.00 0.00 0.00 174.94 175.15 1uwk s SER 402 N 1.48 6.87 0.59 3.58 0.01 -1.26 -4.73 113.70 120.24 1uwk s SER 402 Ca 0.03 1.08 -0.19 0.00 1.31 0.00 0.00 55.95 58.17 1uwk s SER 402 Cb -0.17 -2.29 -0.03 0.00 0.21 0.00 0.00 66.02 63.74 1uwk s SER 402 CO 0.01 0.19 1.26 -0.36 0.41 0.00 0.00 173.24 174.75 1uwk s PHE 403 N -1.30 2.32 -0.14 2.43 0.08 -1.26 -4.99 117.98 115.12 1uwk s PHE 403 Ca 0.33 1.48 0.01 0.00 0.12 0.00 0.00 56.93 58.87 1uwk s PHE 403 Cb -0.16 -3.59 0.02 0.00 -0.57 0.00 0.00 43.02 38.71 1uwk s PHE 403 CO 0.18 -2.48 -0.17 -0.65 -0.10 0.00 0.00 175.22 172.00 1uwk s GLN 404 N -3.21 2.48 5.68 0.44 -0.21 -1.26 -5.04 119.66 118.53 1uwk s GLN 404 Ca 0.77 -0.64 0.00 0.00 0.02 0.00 0.00 55.36 55.50 1uwk s GLN 404 Cb -0.34 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.53 1uwk s GLN 404 CO 0.38 -0.13 0.00 0.41 -2.12 0.00 0.00 175.29 173.83 1uwk n GLY 405 N 4.41 2.60 3.72 3.09 0.00 -1.26 -4.64 105.19 113.10 1uwk n GLY 405 Ca -0.19 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1uwk n GLY 405 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uwk n LEU 406 N 0.00 3.93 -4.65 0.99 4.77 -1.26 -4.89 117.00 115.89 1uwk n LEU 406 Ca 0.00 1.09 -0.46 0.00 -0.03 0.00 0.00 56.01 56.61 1uwk n LEU 406 Cb 0.00 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 39.51 1uwk n LEU 406 CO 0.00 0.07 0.98 -2.65 -1.33 0.00 0.00 177.39 174.46 1uwk n PRO 407 N 3.23 1.83 -3.93 3.23 -0.02 -1.26 -4.81 135.00 133.27 1uwk n PRO 407 Ca 0.14 0.65 -0.09 0.00 -2.02 0.00 0.00 63.50 62.18 1uwk n PRO 407 Cb 0.34 -2.30 -0.07 0.00 -0.02 0.00 0.00 33.50 31.45 1uwk n PRO 407 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uwk s ALA 408 N 0.13 -0.05 -0.02 3.55 0.00 -1.26 -0.77 121.76 123.34 1uwk s ALA 408 Ca 0.72 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1uwk s ALA 408 Cb -0.71 0.76 0.02 0.00 0.00 0.00 0.00 23.12 23.19 1uwk s ALA 408 CO 0.48 -0.61 0.00 0.50 0.00 0.00 0.00 175.76 176.13 1uwk s ARG 409 N -3.94 0.21 -0.02 0.00 6.06 0.14 -4.98 118.95 116.42 1uwk s ARG 409 Ca 0.14 0.07 -0.18 0.00 -2.50 0.00 0.00 55.73 53.26 1uwk s ARG 409 Cb 0.04 -0.37 -0.05 0.00 0.06 0.00 0.00 34.95 34.62 1uwk s ARG 409 CO -0.03 -0.11 0.49 -1.50 -2.50 0.00 0.00 175.30 171.66 1uwk s ILE 410 N 0.81 4.99 -0.29 4.11 1.10 -1.26 -1.64 121.20 129.02 1uwk s ILE 410 Ca -0.08 1.02 0.04 0.00 -0.51 0.00 0.00 60.65 61.12 1uwk s ILE 410 Cb -0.11 -3.82 0.18 0.00 0.15 0.00 0.00 42.46 38.87 1uwk s ILE 410 CO -0.02 0.48 0.52 0.00 -2.11 0.00 0.00 174.94 173.82 1uwk s TRP 412 N 2.73 1.83 0.11 0.00 0.52 -1.26 -4.34 118.94 118.52 1uwk s TRP 412 Ca 0.11 0.22 -0.08 0.00 0.02 0.00 0.00 56.10 56.37 1uwk s TRP 412 Cb -0.11 -3.99 -0.01 0.00 -1.15 0.00 0.00 33.47 28.21 1uwk s TRP 412 CO -0.27 -3.89 0.19 0.14 0.02 0.00 0.00 176.95 173.14 1uwk s VAL 413 N 4.83 0.13 0.00 4.03 -7.23 -1.23 -4.85 120.40 116.07 1uwk s VAL 413 Ca 0.78 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 59.63 1uwk s VAL 413 Cb -0.32 -1.51 0.00 0.00 0.56 0.00 0.00 36.38 35.11 1uwk s VAL 413 CO 0.32 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 175.13 1uwk n GLY 414 N -0.08 6.84 3.70 2.32 0.00 -1.26 -3.30 105.19 113.41 1uwk n GLY 414 Ca -0.13 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 1uwk n GLY 414 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uwk s LEU 415 N 0.00 4.38 0.00 0.99 2.96 -0.80 -2.07 118.68 124.14 1uwk s LEU 415 Ca 0.00 2.66 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 1uwk s LEU 415 Cb 0.00 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.11 1uwk s LEU 415 CO 0.00 -0.91 0.00 0.61 -1.32 0.00 0.00 176.35 174.73 1uwk n GLY 416 N 3.99 2.55 0.16 7.98 0.00 -1.26 -4.82 105.19 113.79 1uwk n GLY 416 Ca 0.16 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.46 1uwk n GLY 416 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uwk h LEU 417 N 0.00 0.00 -0.33 0.99 3.38 -1.90 -2.96 115.31 114.48 1uwk h LEU 417 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1uwk h LEU 417 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1uwk h LEU 417 CO 0.00 0.51 0.18 0.03 0.09 0.00 0.00 178.44 179.24 1uwk h ARG 418 N 0.00 0.36 -0.45 1.13 3.08 -1.68 -1.04 114.38 115.78 1uwk h ARG 418 Ca -0.01 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1uwk h ARG 418 Cb 1.03 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 1uwk h ARG 418 CO 0.07 0.24 -0.04 0.00 -1.07 0.00 0.00 179.97 179.16 1uwk h ALA 419 N 1.16 1.09 -0.50 0.04 0.00 -1.63 -0.54 119.26 118.87 1uwk h ALA 419 Ca 0.14 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1uwk h ALA 419 Cb 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1uwk h ALA 419 CO -0.08 0.57 0.29 -0.22 0.00 0.00 0.00 179.25 179.81 1uwk h LYS 420 N 0.70 0.69 -0.24 0.00 3.64 -1.27 -0.75 116.57 119.34 1uwk h LYS 420 Ca 0.13 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1uwk h LYS 420 Cb 0.49 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1uwk h LYS 420 CO 0.03 0.53 0.04 -0.07 -2.27 0.00 0.00 179.45 177.71 1uwk h LEU 421 N 0.67 0.38 -0.78 5.20 4.07 -1.01 -2.20 115.31 121.64 1uwk h LEU 421 Ca 0.18 -0.25 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 1uwk h LEU 421 Cb 0.03 -0.10 -0.04 0.00 1.08 0.00 0.00 40.66 41.63 1uwk h LEU 421 CO -0.03 0.54 0.40 1.23 -1.08 0.00 0.00 178.44 179.50 1uwk h GLY 422 N 0.21 1.18 1.18 0.83 0.00 -0.83 0.24 103.07 105.87 1uwk h GLY 422 Ca 0.07 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 46.75 1uwk h GLY 422 CO 0.00 0.54 -0.02 1.41 0.00 0.00 0.00 176.54 178.47 1uwk h LEU 423 N 1.09 0.96 -0.71 3.11 3.38 -1.13 -1.05 115.31 120.96 1uwk h LEU 423 Ca 0.27 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1uwk h LEU 423 Cb 0.08 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 1uwk h LEU 423 CO -0.04 1.03 0.10 0.00 0.09 0.00 0.00 178.44 179.62 1uwk h ALA 424 N 1.06 0.93 -0.66 1.53 0.00 -0.91 -1.28 119.26 119.94 1uwk h ALA 424 Ca 0.16 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1uwk h ALA 424 Cb 0.56 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1uwk h ALA 424 CO 0.03 0.66 0.11 0.74 0.00 0.00 0.00 179.25 180.79 1uwk h PHE 425 N 1.01 1.15 -0.94 0.00 0.04 -0.73 -1.16 116.94 116.33 1uwk h PHE 425 Ca 0.20 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1uwk h PHE 425 Cb 0.45 -0.32 -0.05 0.00 2.20 0.00 0.00 35.95 38.23 1uwk h PHE 425 CO 0.03 0.97 0.60 -0.97 -0.60 0.00 0.00 178.31 178.34 1uwk h ASN 426 N 1.01 1.10 0.29 2.17 -1.24 -0.84 -1.09 115.58 116.98 1uwk h ASN 426 Ca 0.20 -0.05 -0.11 0.00 0.71 0.00 0.00 56.30 57.06 1uwk h ASN 426 Cb 0.43 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 1uwk h ASN 426 CO 0.01 0.82 -0.43 -0.08 -1.29 0.00 0.00 177.43 176.46 1uwk h GLU 427 N 1.28 0.18 -0.09 6.67 4.57 -0.77 -0.90 114.58 125.52 1uwk h GLU 427 Ca 0.34 -0.09 -0.10 0.00 -1.18 0.00 0.00 59.36 58.34 1uwk h GLU 427 Cb -0.11 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.47 1uwk h GLU 427 CO -0.07 0.58 -0.37 0.52 -1.18 0.00 0.00 179.01 178.49 1uwk h MET 428 N 0.15 0.19 -0.26 1.92 2.86 -0.46 -0.77 114.93 118.55 1uwk h MET 428 Ca 0.01 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 1uwk h MET 428 Cb 0.83 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 1uwk h MET 428 CO 0.06 0.54 -0.08 0.28 1.06 0.00 0.00 176.91 178.78 1uwk h VAL 429 N 0.16 1.29 -0.87 -2.22 2.07 -0.89 -1.48 116.25 114.31 1uwk h VAL 429 Ca 0.02 -1.11 0.01 0.00 0.82 0.00 0.00 66.70 66.44 1uwk h VAL 429 Cb 0.74 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 1uwk h VAL 429 CO 0.06 0.35 0.57 -0.09 0.02 0.00 0.00 177.57 178.48 1uwk h ARG 430 N 0.26 1.15 0.00 1.57 2.43 -0.84 -2.57 114.38 116.38 1uwk h ARG 430 Ca 0.06 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1uwk h ARG 430 Cb 0.56 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1uwk h ARG 430 CO 0.03 0.76 -0.08 -1.13 -1.51 0.00 0.00 179.97 178.04 1uwk n SER 431 N -4.40 0.68 0.00 -3.80 3.41 -0.32 -4.90 113.62 104.28 1uwk n SER 431 Ca 0.10 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1uwk n SER 431 Cb 0.02 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1uwk n SER 431 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwk n GLY 432 N 1.34 0.77 0.27 5.00 0.00 -0.97 -4.93 105.19 106.68 1uwk n GLY 432 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.05 1uwk n GLY 432 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1uwk h GLU 433 N 3.05 0.78 -6.01 1.61 4.81 -1.64 -3.39 114.58 113.79 1uwk h GLU 433 Ca 0.00 -0.05 -0.61 0.00 -0.13 0.00 0.00 59.36 58.58 1uwk h GLU 433 Cb 0.00 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.15 1uwk h GLU 433 CO 0.00 0.52 -0.19 -0.51 -0.73 0.00 0.00 179.01 178.10 1uwk s LEU 434 N -10.21 4.47 0.38 1.64 1.43 -0.63 -4.97 118.68 110.79 1uwk s LEU 434 Ca -0.13 0.97 0.26 0.00 -1.03 0.00 0.00 54.13 54.21 1uwk s LEU 434 Cb 0.16 -2.61 0.72 0.00 0.03 0.00 0.00 46.19 44.49 1uwk s LEU 434 CO 0.77 0.31 1.73 0.77 0.23 0.00 0.00 176.35 180.16 1uwk h SER 435 N 4.77 0.00 -5.01 2.29 4.64 -1.89 -3.43 113.55 114.92 1uwk h SER 435 Ca -0.51 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 60.83 1uwk h SER 435 Cb 1.22 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.22 1uwk h SER 435 CO 0.62 0.00 0.19 0.00 -0.87 0.00 0.00 176.83 176.77 1uwk s ALA 436 N -3.27 -1.34 0.92 5.18 0.00 -1.26 -4.83 121.76 117.16 1uwk s ALA 436 Ca 0.07 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.95 1uwk s ALA 436 Cb 0.08 0.87 0.08 0.00 0.00 0.00 0.00 23.12 24.15 1uwk s ALA 436 CO 0.60 -0.89 0.74 -2.30 0.00 0.00 0.00 175.76 173.91 1uwk n PRO 437 N -0.41 -0.29 -4.41 0.00 -0.02 -1.26 -4.73 135.00 123.89 1uwk n PRO 437 Ca -0.10 -0.03 -0.24 0.00 -2.02 0.00 0.00 63.50 61.10 1uwk n PRO 437 Cb 0.62 -2.09 -0.11 0.00 -0.02 0.00 0.00 33.50 31.90 1uwk n PRO 437 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1uwk s VAL 438 N -2.44 2.23 -0.02 -1.45 -7.23 -1.01 -2.58 120.40 107.90 1uwk s VAL 438 Ca 0.62 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.69 1uwk s VAL 438 Cb -0.23 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.57 1uwk s VAL 438 CO 0.62 -0.26 -0.02 0.68 -0.31 0.00 0.00 175.10 175.81 1uwk s VAL 439 N -2.05 4.03 -0.11 1.32 -7.23 -0.59 -0.55 120.40 115.23 1uwk s VAL 439 Ca 0.22 -0.57 0.03 0.00 -1.81 0.00 0.00 61.98 59.85 1uwk s VAL 439 Cb -0.06 -2.76 -0.00 0.00 0.56 0.00 0.00 36.38 34.12 1uwk s VAL 439 CO 0.10 0.44 -0.22 -0.63 -0.31 0.00 0.00 175.10 174.48 1uwk s ILE 440 N -1.01 2.26 0.00 -0.62 1.01 0.17 -1.10 121.20 121.90 1uwk s ILE 440 Ca 0.17 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.88 1uwk s ILE 440 Cb -0.11 -1.88 0.00 0.00 0.01 0.00 0.00 42.46 40.48 1uwk s ILE 440 CO 0.08 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.18 1uwk n GLY 441 N 3.53 4.48 3.61 6.18 0.00 -0.03 -0.47 105.19 122.48 1uwk n GLY 441 Ca -0.19 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 44.95 1uwk n GLY 441 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uwk s ARG 442 N 1.92 0.32 1.05 1.61 1.70 -1.26 -1.94 118.95 122.35 1uwk s ARG 442 Ca 0.00 -0.14 -0.12 0.00 -0.47 0.00 0.00 55.73 54.99 1uwk s ARG 442 Cb 0.00 0.13 0.22 0.00 -0.57 0.00 0.00 34.95 34.73 1uwk s ARG 442 CO 0.00 -0.14 1.07 0.34 -1.08 0.00 0.00 175.30 175.48 1uwk s ASP 443 N -2.44 2.04 0.29 -2.89 2.15 -1.18 -4.80 116.67 109.84 1uwk s ASP 443 Ca 0.11 1.45 0.26 0.00 0.43 0.00 0.00 52.55 54.79 1uwk s ASP 443 Cb 0.01 -2.15 0.80 0.00 -0.30 0.00 0.00 42.92 41.28 1uwk s ASP 443 CO -0.04 -3.53 1.75 0.45 -0.17 0.00 0.00 175.17 173.63 1uwk h HIS 444 N -2.16 0.00 -2.65 -5.34 3.86 -1.88 -3.40 115.15 103.57 1uwk h HIS 444 Ca -0.56 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.10 1uwk h HIS 444 Cb 1.32 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.75 1uwk h HIS 444 CO 0.31 0.00 1.21 -1.17 0.86 0.00 0.00 177.93 179.14 1uwk s LEU 445 N -4.95 3.43 0.08 2.43 0.20 -1.26 -4.22 118.68 114.40 1uwk s LEU 445 Ca 0.08 0.67 -0.27 0.00 0.69 0.00 0.00 54.13 55.30 1uwk s LEU 445 Cb 0.10 -3.14 0.08 0.00 -0.43 0.00 0.00 46.19 42.81 1uwk s LEU 445 CO 0.57 -1.82 0.99 -0.62 -0.29 0.00 0.00 176.35 175.17 1uwk s ASP 446 N 5.70 -0.21 0.41 3.68 2.15 -1.26 -4.30 116.67 122.83 1uwk s ASP 446 Ca 0.65 -0.25 0.11 0.00 0.43 0.00 0.00 52.55 53.49 1uwk s ASP 446 Cb -0.15 0.41 0.85 0.00 -0.30 0.00 0.00 42.92 43.73 1uwk s ASP 446 CO 0.28 -0.73 1.94 0.77 -0.17 0.00 0.00 175.17 177.26 1uwk h SER 447 N 2.00 0.16 -0.16 -0.34 4.64 -1.86 -3.02 113.55 114.97 1uwk h SER 447 Ca -0.24 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1uwk h SER 447 Cb 1.23 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1uwk h SER 447 CO 0.27 0.32 0.00 0.61 -0.87 0.00 0.00 176.83 177.16 1uwk n GLY 448 N -0.93 1.86 0.03 -0.77 0.00 -1.26 -4.44 105.19 99.68 1uwk n GLY 448 Ca -0.01 -0.23 0.03 0.00 0.00 0.00 0.00 46.02 45.81 1uwk n GLY 448 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uwk n SER 449 N 0.22 2.03 -3.71 1.61 3.41 -1.14 -4.09 113.62 111.95 1uwk n SER 449 Ca 0.07 -2.33 -0.12 0.00 -0.26 0.00 0.00 58.87 56.22 1uwk n SER 449 Cb 0.31 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.02 1uwk n SER 449 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1uwk s VAL 450 N -1.58 -0.00 -0.15 -3.33 0.11 -1.26 -0.71 120.40 113.48 1uwk s VAL 450 Ca 0.11 0.02 0.02 0.00 -2.93 0.00 0.00 61.98 59.20 1uwk s VAL 450 Cb 0.09 -0.66 0.01 0.00 -1.53 0.00 0.00 36.38 34.29 1uwk s VAL 450 CO 0.01 0.01 -0.22 -0.44 -3.33 0.00 0.00 175.10 171.13 1uwk s SER 451 N 0.53 3.10 -0.42 3.54 0.01 -0.32 -4.75 113.70 115.40 1uwk s SER 451 Ca -0.02 -0.61 0.05 0.00 1.31 0.00 0.00 55.95 56.67 1uwk s SER 451 Cb -0.04 -1.45 0.18 0.00 0.21 0.00 0.00 66.02 64.93 1uwk s SER 451 CO -0.03 0.07 0.73 -0.55 0.41 0.00 0.00 173.24 173.87 1uwk s SER 452 N 0.89 -1.28 0.35 2.44 0.15 -1.26 -1.69 113.70 113.31 1uwk s SER 452 Ca -0.05 -0.87 0.25 0.00 0.70 0.00 0.00 55.95 55.98 1uwk s SER 452 Cb -0.15 1.65 1.28 0.00 -1.71 0.00 0.00 66.02 67.09 1uwk s SER 452 CO -0.04 -0.12 1.75 -0.65 1.20 0.00 0.00 173.24 175.39 1uwk h PRO 453 N 6.22 0.00 -0.60 5.44 0.11 -1.72 0.43 132.00 141.88 1uwk h PRO 453 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1uwk h PRO 453 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1uwk h PRO 453 CO 0.05 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.93 1uwk n ASN 454 N -2.36 3.72 0.00 -2.05 3.02 -1.26 -3.54 115.26 112.78 1uwk n ASN 454 Ca -0.01 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.48 1uwk n ASN 454 Cb 0.08 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 1uwk n ASN 454 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uwk n ALA 455 N 1.20 0.00 0.25 5.41 0.00 -0.01 -4.70 120.51 122.66 1uwk n ALA 455 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.75 1uwk n ALA 455 Cb 0.59 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.68 1uwk n ALA 455 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1uwk h GLU 456 N 0.00 0.00 -0.26 0.00 3.07 -1.86 -2.19 114.58 113.34 1uwk h GLU 456 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 1uwk h GLU 456 Cb 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 1uwk h GLU 456 CO 0.00 0.16 -0.09 0.25 -1.40 0.00 0.00 179.01 177.94 1uwk n THR 457 N -3.77 2.38 -1.95 1.13 -2.24 -0.31 -4.84 114.28 104.68 1uwk n THR 457 Ca -0.02 -2.51 -0.42 0.00 -2.27 0.00 0.00 64.05 58.84 1uwk n THR 457 Cb 0.27 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.19 1uwk n THR 457 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1uwk s GLU 458 N -3.10 4.23 -1.30 -0.78 2.12 -0.82 -3.58 118.70 115.47 1uwk s GLU 458 Ca 0.42 2.35 -0.05 0.00 0.36 0.00 0.00 54.97 58.06 1uwk s GLU 458 Cb 0.37 -3.13 0.01 0.00 0.26 0.00 0.00 34.13 31.65 1uwk s GLU 458 CO 0.02 -0.53 1.06 0.00 -0.54 0.00 0.00 175.26 175.27 1uwk n ALA 459 N 3.15 -1.66 -1.76 6.30 0.00 -1.26 -4.46 120.51 120.82 1uwk n ALA 459 Ca 0.10 0.16 -0.41 0.00 0.00 0.00 0.00 53.44 53.28 1uwk n ALA 459 Cb 0.39 -3.89 -0.01 0.00 0.00 0.00 0.00 19.45 15.94 1uwk n ALA 459 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1uwk n MET 460 N -4.57 2.61 0.31 0.00 2.81 -1.23 -4.86 117.12 112.19 1uwk n MET 460 Ca -0.14 0.92 0.19 0.00 -1.81 0.00 0.00 57.70 56.86 1uwk n MET 460 Cb 0.61 -2.65 1.01 0.00 -0.71 0.00 0.00 33.22 31.48 1uwk n MET 460 CO 0.00 0.00 0.00 0.07 1.51 0.00 0.00 175.97 177.55 1uwk h ARG 461 N 3.42 0.00 -0.23 0.03 0.11 -1.92 -0.73 114.38 115.05 1uwk h ARG 461 Ca -0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.59 1uwk h ARG 461 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 1uwk h ARG 461 CO 0.68 0.02 0.00 -0.40 0.10 0.00 0.00 179.97 180.37 1uwk n ASP 462 N -3.39 3.25 0.00 0.08 5.75 -1.26 -4.95 116.55 116.03 1uwk n ASP 462 Ca -0.02 -1.99 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 1uwk n ASP 462 Cb 0.12 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 1uwk n ASP 462 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uwk n GLY 463 N 1.42 0.70 1.30 6.12 0.00 -0.28 -4.94 105.19 109.51 1uwk n GLY 463 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1uwk n GLY 463 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uwk n SER 464 N 0.00 3.61 -0.33 1.61 3.41 -1.26 -4.62 113.62 116.04 1uwk n SER 464 Ca 0.00 -2.54 0.13 0.00 -0.26 0.00 0.00 58.87 56.20 1uwk n SER 464 Cb 0.00 -0.61 0.27 0.00 -0.26 0.00 0.00 64.21 63.61 1uwk n SER 464 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uwk h ASP 465 N 2.08 -0.42 -0.00 4.04 5.19 -1.87 -1.30 116.42 124.13 1uwk h ASP 465 Ca 0.03 0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 1uwk h ASP 465 Cb 1.38 0.45 0.00 0.00 0.18 0.00 0.00 39.33 41.34 1uwk h ASP 465 CO 0.30 -0.32 -0.01 0.00 -3.12 0.00 0.00 179.24 176.09 1uwk n ALA 466 N -3.08 2.59 -2.22 3.45 0.00 -1.26 -4.17 120.51 115.83 1uwk n ALA 466 Ca 0.22 -0.46 -0.43 0.00 0.00 0.00 0.00 53.44 52.77 1uwk n ALA 466 Cb 0.72 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 1uwk n ALA 466 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1uwk s VAL 467 N -2.02 3.91 -0.42 0.00 1.01 -0.49 -4.87 120.40 117.51 1uwk s VAL 467 Ca 0.37 1.08 0.13 0.00 0.00 0.00 0.00 61.98 63.56 1uwk s VAL 467 Cb 0.21 -3.78 0.39 0.00 0.00 0.00 0.00 36.38 33.20 1uwk s VAL 467 CO 0.34 -0.19 1.31 -1.54 0.00 0.00 0.00 175.10 175.02 1uwk n SER 468 N 7.32 3.26 -0.13 3.32 3.41 -1.26 -4.42 113.62 125.11 1uwk n SER 468 Ca 0.16 -2.59 0.04 0.00 -0.26 0.00 0.00 58.87 56.23 1uwk n SER 468 Cb 0.44 -0.38 0.35 0.00 -0.26 0.00 0.00 64.21 64.37 1uwk n SER 468 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uwk h ASP 469 N 1.57 0.64 0.20 4.04 3.32 -2.00 -3.29 116.42 120.91 1uwk h ASP 469 Ca 0.00 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1uwk h ASP 469 Cb 1.08 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1uwk h ASP 469 CO 0.11 0.44 -0.10 -0.50 -1.72 0.00 0.00 179.24 177.47 1uwk h TRP 470 N 0.74 -0.25 -0.28 4.55 4.06 -1.92 -0.59 115.95 122.26 1uwk h TRP 470 Ca 0.25 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 61.18 1uwk h TRP 470 Cb 0.07 0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.30 1uwk h TRP 470 CO -0.00 -0.02 0.14 -1.00 -3.56 0.00 0.00 178.44 173.99 1uwk h PRO 471 N -0.45 0.38 -0.48 0.49 0.13 -1.71 -0.35 132.00 130.01 1uwk h PRO 471 Ca -0.03 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.02 1uwk h PRO 471 Cb 0.35 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.38 1uwk h PRO 471 CO 0.05 0.30 0.12 -0.07 -0.23 0.00 0.00 178.00 178.16 1uwk h LEU 472 N 0.39 0.72 -0.99 1.56 4.07 -1.53 -1.26 115.31 118.26 1uwk h LEU 472 Ca 0.10 -0.23 -0.06 0.00 0.08 0.00 0.00 57.88 57.77 1uwk h LEU 472 Cb 0.04 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.57 1uwk h LEU 472 CO -0.01 0.77 0.10 -0.07 -1.08 0.00 0.00 178.44 178.14 1uwk h LEU 473 N 0.65 0.78 -0.61 1.67 3.38 -0.60 -1.29 115.31 119.28 1uwk h LEU 473 Ca 0.15 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1uwk h LEU 473 Cb 0.32 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1uwk h LEU 473 CO 0.00 0.78 0.34 -1.13 0.09 0.00 0.00 178.44 178.53 1uwk h ASN 474 N 0.79 0.76 -0.45 -0.43 -0.73 -0.66 0.92 115.58 115.77 1uwk h ASN 474 Ca 0.17 -0.09 -0.11 0.00 1.87 0.00 0.00 56.30 58.14 1uwk h ASN 474 Cb 0.33 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 38.72 1uwk h ASN 474 CO 0.00 0.63 -0.13 0.00 -0.37 0.00 0.00 177.43 177.56 1uwk h ALA 475 N 1.16 0.63 -0.52 1.57 0.00 -0.93 0.35 119.26 121.52 1uwk h ALA 475 Ca 0.22 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1uwk h ALA 475 Cb 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1uwk h ALA 475 CO -0.04 0.54 0.31 -0.07 0.00 0.00 0.00 179.25 180.00 1uwk h LEU 476 N 0.73 0.50 -0.49 0.00 3.38 -0.99 -1.55 115.31 116.88 1uwk h LEU 476 Ca 0.11 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1uwk h LEU 476 Cb 0.68 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1uwk h LEU 476 CO 0.05 0.36 -0.39 0.25 0.09 0.00 0.00 178.44 178.80 1uwk h LEU 477 N 0.62 0.87 -1.50 1.67 5.85 -0.60 -0.86 115.31 121.36 1uwk h LEU 477 Ca 0.21 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.54 1uwk h LEU 477 Cb 0.02 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 1uwk h LEU 477 CO -0.09 1.15 0.34 0.78 -0.34 0.00 0.00 178.44 180.28 1uwk h ASN 478 N 0.67 0.58 -0.25 1.25 2.35 -0.71 -0.33 115.58 119.14 1uwk h ASN 478 Ca 0.06 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 1uwk h ASN 478 Cb 0.95 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.17 1uwk h ASN 478 CO 0.09 0.42 -0.12 0.74 -1.65 0.00 0.00 177.43 176.91 1uwk h THR 479 N 0.69 1.30 -0.20 2.81 2.02 -0.86 -1.38 112.91 117.28 1uwk h THR 479 Ca 0.19 -1.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.13 1uwk h THR 479 Cb -0.07 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1uwk h THR 479 CO -0.04 0.37 -0.04 0.00 0.37 0.00 0.00 175.52 176.19 1uwk h ALA 480 N 0.72 1.57 0.00 6.16 0.00 -0.79 -3.08 119.26 123.84 1uwk h ALA 480 Ca 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1uwk h ALA 480 Cb 0.63 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1uwk h ALA 480 CO 0.04 0.32 -0.85 0.78 0.00 0.00 0.00 179.25 179.54 1uwk h GLY 481 N 0.65 0.00 0.00 0.00 0.00 -0.96 -3.49 103.07 99.28 1uwk h GLY 481 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1uwk h GLY 481 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 1uwk n GLY 482 N 1.21 1.82 3.60 4.60 0.00 -0.75 -4.63 105.19 111.04 1uwk n GLY 482 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1uwk n GLY 482 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwk n ALA 483 N -0.69 -1.03 0.06 4.61 0.00 -0.60 -4.77 120.51 118.09 1uwk n ALA 483 Ca 0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 53.44 52.82 1uwk n ALA 483 Cb 0.00 -2.10 -0.14 0.00 0.00 0.00 0.00 19.45 17.21 1uwk n ALA 483 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1uwk h THR 484 N -1.40 1.26 -3.47 0.00 2.02 -0.96 -3.12 112.91 107.24 1uwk h THR 484 Ca -0.44 -2.91 -0.15 0.00 0.77 0.00 0.00 66.41 63.67 1uwk h THR 484 Cb 1.29 2.77 -0.22 0.00 -1.74 0.00 0.00 68.15 70.25 1uwk h THR 484 CO 0.41 0.82 -0.49 -1.66 0.37 0.00 0.00 175.52 174.97 1uwk s TRP 485 N -2.63 -0.01 0.01 3.16 -2.14 -0.82 -0.65 118.94 115.85 1uwk s TRP 485 Ca -0.07 -0.01 0.03 0.00 2.66 0.00 0.00 56.10 58.72 1uwk s TRP 485 Cb 0.07 -0.02 -0.01 0.00 -3.10 0.00 0.00 33.47 30.41 1uwk s TRP 485 CO 0.85 -0.25 -0.11 0.08 -2.66 0.00 0.00 176.95 174.86 1uwk s VAL 486 N -1.08 0.86 0.02 -0.66 1.01 -0.88 -1.30 120.40 118.38 1uwk s VAL 486 Ca -0.12 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1uwk s VAL 486 Cb -0.06 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.55 1uwk s VAL 486 CO 0.01 0.14 -0.06 -0.94 0.00 0.00 0.00 175.10 174.25 1uwk s SER 487 N -0.52 0.71 -0.14 3.32 1.04 -0.51 -0.87 113.70 116.72 1uwk s SER 487 Ca 0.03 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.08 1uwk s SER 487 Cb -0.05 0.00 0.02 0.00 0.10 0.00 0.00 66.02 66.09 1uwk s SER 487 CO 0.00 -0.12 -0.14 -0.76 0.98 0.00 0.00 173.24 173.20 1uwk s LEU 488 N -1.04 1.67 0.20 2.42 1.43 0.29 -0.78 118.68 122.87 1uwk s LEU 488 Ca -0.06 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 52.64 1uwk s LEU 488 Cb -0.07 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.94 1uwk s LEU 488 CO 0.00 -0.05 -0.14 -1.00 0.23 0.00 0.00 176.35 175.39 1uwk s HIS 489 N 1.44 1.68 -0.02 0.29 3.76 0.30 -1.50 115.29 121.23 1uwk s HIS 489 Ca 0.04 -0.59 0.05 0.00 -0.15 0.00 0.00 55.06 54.41 1uwk s HIS 489 Cb -0.13 -0.79 -0.01 0.00 1.11 0.00 0.00 32.58 32.76 1uwk s HIS 489 CO -0.10 0.34 -0.17 -1.58 -0.85 0.00 0.00 174.74 172.38 1uwk s HIS 490 N -3.00 1.57 0.00 1.40 5.04 -0.99 -1.27 115.29 118.04 1uwk s HIS 490 Ca 0.22 -0.35 0.00 0.00 -1.54 0.00 0.00 55.06 53.39 1uwk s HIS 490 Cb -0.00 -1.03 0.00 0.00 0.04 0.00 0.00 32.58 31.59 1uwk s HIS 490 CO 0.06 -0.07 0.00 0.41 -2.34 0.00 0.00 174.74 172.80 1uwk n GLY 491 N 2.83 0.70 3.74 1.59 0.00 -0.03 -4.77 105.19 109.25 1uwk n GLY 491 Ca -0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 1uwk n GLY 491 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uwk s GLY 492 N -1.93 2.77 0.00 -0.02 0.00 -1.26 -0.35 107.32 106.53 1uwk s GLY 492 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 44.72 45.82 1uwk s GLY 492 CO 0.00 1.51 0.00 0.61 0.00 0.00 0.00 173.10 175.22 1uwk n GLY 493 N 0.68 2.16 0.04 0.20 0.00 -1.26 -4.11 105.19 102.90 1uwk n GLY 493 Ca 0.15 -0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1uwk n GLY 493 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uwk n VAL 494 N 0.00 0.00 0.00 1.61 0.24 -1.25 -4.39 118.33 114.54 1uwk n VAL 494 Ca 0.00 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1uwk n VAL 494 Cb 0.00 1.02 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 1uwk n VAL 494 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1uwk n GLY 495 N 1.46 0.77 3.64 7.63 0.00 0.53 -4.64 105.19 114.58 1uwk n GLY 495 Ca 0.04 -1.91 -0.50 0.00 0.00 0.00 0.00 46.02 43.65 1uwk n GLY 495 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1uwk n MET 496 N 1.22 1.63 0.00 1.61 0.00 -1.26 -1.83 117.12 118.48 1uwk n MET 496 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 57.70 58.29 1uwk n MET 496 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 33.22 30.92 1uwk n MET 496 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1uwk n GLY 497 N 3.13 1.51 0.15 3.03 0.00 -1.17 -4.63 105.19 107.21 1uwk n GLY 497 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.23 1uwk n GLY 497 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uwk n PHE 498 N -2.00 0.00 -3.55 1.61 3.72 -0.76 -5.02 117.46 111.45 1uwk n PHE 498 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.26 1uwk n PHE 498 Cb 0.00 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.49 1uwk n PHE 498 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1uwk s SER 499 N -0.69 -0.49 0.00 4.37 1.04 -1.26 -4.16 113.70 112.52 1uwk s SER 499 Ca 0.05 0.25 0.02 0.00 0.48 0.00 0.00 55.95 56.75 1uwk s SER 499 Cb 0.04 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 1uwk s SER 499 CO 0.10 -0.72 -0.08 -1.10 0.98 0.00 0.00 173.24 172.42 1uwk s GLN 500 N -2.34 0.59 0.08 4.02 -0.21 -0.68 -0.85 119.66 120.27 1uwk s GLN 500 Ca -0.06 -0.36 -0.26 0.00 0.02 0.00 0.00 55.36 54.71 1uwk s GLN 500 Cb -0.01 -0.55 0.08 0.00 1.00 0.00 0.00 33.01 33.54 1uwk s GLN 500 CO -0.01 0.14 0.78 -3.38 -2.12 0.00 0.00 175.29 170.71 1uwk s HIS 501 N -0.37 -0.40 0.18 0.91 -3.43 -0.40 -1.17 115.29 110.61 1uwk s HIS 501 Ca 0.01 0.21 0.08 0.00 -0.80 0.00 0.00 55.06 54.56 1uwk s HIS 501 Cb -0.04 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.63 1uwk s HIS 501 CO -0.00 -0.71 -0.17 -1.54 -2.00 0.00 0.00 174.74 170.32 1uwk s SER 502 N -2.63 2.70 0.13 7.38 1.04 0.12 -0.54 113.70 121.90 1uwk s SER 502 Ca 0.04 -0.92 0.04 0.00 0.48 0.00 0.00 55.95 55.60 1uwk s SER 502 Cb -0.01 -0.16 -0.04 0.00 0.10 0.00 0.00 66.02 65.91 1uwk s SER 502 CO -0.09 -0.07 -0.10 -0.83 0.98 0.00 0.00 173.24 173.12 1uwk s GLY 503 N -2.91 1.02 -0.04 7.32 0.00 0.04 -4.46 107.32 108.29 1uwk s GLY 503 Ca 0.19 -1.41 -0.13 0.00 0.00 0.00 0.00 44.72 43.36 1uwk s GLY 503 CO 0.07 -1.51 0.29 -3.16 0.00 0.00 0.00 173.10 168.79 1uwk s MET 504 N -3.47 0.57 0.00 2.90 0.23 -1.26 -1.42 119.30 116.86 1uwk s MET 504 Ca 0.14 -0.07 0.01 0.00 -1.03 0.00 0.00 55.69 54.74 1uwk s MET 504 Cb 0.01 0.25 -0.01 0.00 -1.53 0.00 0.00 34.83 33.56 1uwk s MET 504 CO 0.01 -0.14 -0.03 0.08 -2.03 0.00 0.00 175.02 172.91 1uwk s VAL 505 N -0.97 0.19 -0.02 5.16 1.01 -0.42 -4.07 120.40 121.27 1uwk s VAL 505 Ca -0.10 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.63 1uwk s VAL 505 Cb -0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 36.38 36.13 1uwk s VAL 505 CO 0.03 -0.06 -0.11 -0.51 0.00 0.00 0.00 175.10 174.45 1uwk s ILE 506 N -0.35 0.91 -0.06 2.22 2.07 0.38 -0.25 121.20 126.12 1uwk s ILE 506 Ca -0.02 -0.44 -0.22 0.00 -1.41 0.00 0.00 60.65 58.56 1uwk s ILE 506 Cb -0.03 -0.79 -0.04 0.00 0.13 0.00 0.00 42.46 41.73 1uwk s ILE 506 CO -0.00 0.27 0.63 -0.69 -1.91 0.00 0.00 174.94 173.24 1uwk s VAL 507 N 0.07 5.04 -0.60 4.00 1.01 -1.26 -0.66 120.40 127.99 1uwk s VAL 507 Ca -0.02 1.30 -0.15 0.00 0.00 0.00 0.00 61.98 63.12 1uwk s VAL 507 Cb -0.08 -3.97 0.15 0.00 0.00 0.00 0.00 36.38 32.48 1uwk s VAL 507 CO 0.00 0.31 0.55 0.00 0.00 0.00 0.00 175.10 175.97 1uwk n ASP 509 N 4.92 3.75 0.00 0.00 3.85 -1.26 -2.39 116.55 125.42 1uwk n ASP 509 Ca -0.07 -2.16 0.00 0.00 -0.71 0.00 0.00 54.79 51.85 1uwk n ASP 509 Cb 0.42 -0.42 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 1uwk n ASP 509 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1uwk n GLY 510 N 0.99 0.84 3.90 6.12 0.00 -1.25 -4.74 105.19 111.06 1uwk n GLY 510 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1uwk n GLY 510 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uwk s THR 511 N -3.36 4.91 0.28 2.61 -4.23 -1.26 -4.42 115.64 110.17 1uwk s THR 511 Ca 0.00 0.23 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 1uwk s THR 511 Cb 0.00 -3.82 0.13 0.00 1.34 0.00 0.00 72.50 70.15 1uwk s THR 511 CO 0.00 -0.70 1.79 0.44 -0.54 0.00 0.00 174.62 175.62 1uwk h ASP 512 N 0.66 0.67 -0.57 3.99 3.32 -1.99 -1.53 116.42 120.98 1uwk h ASP 512 Ca -0.47 -0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.40 1uwk h ASP 512 Cb 1.20 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.55 1uwk h ASP 512 CO 0.63 0.74 0.24 -0.33 -1.72 0.00 0.00 179.24 178.79 1uwk h GLU 513 N 0.66 0.85 -0.73 3.56 3.07 -2.01 -2.20 114.58 117.79 1uwk h GLU 513 Ca 0.13 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 58.80 1uwk h GLU 513 Cb 0.41 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.15 1uwk h GLU 513 CO 0.02 0.72 0.26 0.00 -1.40 0.00 0.00 179.01 178.61 1uwk h ALA 514 N 1.08 1.09 -0.90 3.43 0.00 -1.83 -2.38 119.26 119.75 1uwk h ALA 514 Ca 0.19 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1uwk h ALA 514 Cb 0.19 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 1uwk h ALA 514 CO -0.02 0.64 0.58 0.00 0.00 0.00 0.00 179.25 180.45 1uwk h ALA 515 N 1.22 1.21 -0.58 0.00 0.00 -0.88 0.28 119.26 120.50 1uwk h ALA 515 Ca 0.24 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1uwk h ALA 515 Cb 0.24 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1uwk h ALA 515 CO -0.02 0.40 0.19 0.93 0.00 0.00 0.00 179.25 180.75 1uwk h GLU 516 N 1.10 0.90 -0.30 0.00 4.39 -1.06 -1.49 114.58 118.13 1uwk h GLU 516 Ca 0.37 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.85 1uwk h GLU 516 Cb 0.07 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1uwk h GLU 516 CO -0.14 0.81 0.06 0.00 -1.16 0.00 0.00 179.01 178.58 1uwk h ARG 517 N 0.82 0.48 -0.47 2.33 3.08 -0.87 -3.14 114.38 116.61 1uwk h ARG 517 Ca 0.19 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.15 1uwk h ARG 517 Cb 0.27 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 1uwk h ARG 517 CO -0.01 0.56 0.26 0.82 -1.07 0.00 0.00 179.97 180.54 1uwk h ILE 518 N 0.31 1.02 -0.96 2.04 2.04 -0.31 0.13 117.51 121.77 1uwk h ILE 518 Ca 0.09 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 65.82 1uwk h ILE 518 Cb 0.31 0.45 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 1uwk h ILE 518 CO 0.00 0.10 0.62 0.00 0.00 0.00 0.00 178.15 178.87 1uwk h ALA 519 N 1.23 1.30 0.18 1.87 0.00 -1.24 -0.16 119.26 122.43 1uwk h ALA 519 Ca 0.19 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.72 1uwk h ALA 519 Cb 0.05 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.53 1uwk h ALA 519 CO -0.11 0.47 -1.76 0.07 0.00 0.00 0.00 179.25 177.91 1uwk h ARG 520 N 1.18 0.38 -0.60 0.00 0.11 -1.44 -3.15 114.38 110.86 1uwk h ARG 520 Ca 0.40 -0.64 -0.08 0.00 0.10 0.00 0.00 59.98 59.75 1uwk h ARG 520 Cb 0.06 0.24 -0.02 0.00 1.11 0.00 0.00 29.97 31.36 1uwk h ARG 520 CO -0.14 1.30 0.06 0.28 0.10 0.00 0.00 179.97 181.56 1uwk h VAL 521 N 0.10 1.26 -0.00 0.08 2.07 -0.55 0.21 116.25 119.43 1uwk h VAL 521 Ca -0.35 -1.06 0.00 0.00 0.82 0.00 0.00 66.70 66.11 1uwk h VAL 521 Cb 2.09 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1uwk h VAL 521 CO 0.17 0.39 -0.07 0.18 0.02 0.00 0.00 177.57 178.26 1uwk n LEU 522 N -4.25 0.26 -0.08 2.57 4.77 -0.09 -0.96 117.00 119.21 1uwk n LEU 522 Ca 0.03 0.13 -0.18 0.00 -0.03 0.00 0.00 56.01 55.97 1uwk n LEU 522 Cb 0.31 -0.23 -0.12 0.00 -2.33 0.00 0.00 43.42 41.04 1uwk n LEU 522 CO 0.43 0.05 -0.01 0.74 -1.33 0.00 0.00 177.39 177.26 1uwk h THR 523 N 0.29 1.41 -0.29 -5.08 2.02 -1.41 -3.31 112.91 106.54 1uwk h THR 523 Ca 0.00 -2.28 -0.15 0.00 0.77 0.00 0.00 66.41 64.76 1uwk h THR 523 Cb 0.32 2.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.61 1uwk h THR 523 CO 0.00 0.48 -0.41 0.78 0.37 0.00 0.00 175.52 176.74 1uwk h ASN 524 N -0.98 0.75 0.30 4.18 2.35 -0.36 -0.66 115.58 121.16 1uwk h ASN 524 Ca -0.15 -0.35 -0.01 0.00 -0.55 0.00 0.00 56.30 55.24 1uwk h ASN 524 Cb 1.15 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.31 1uwk h ASN 524 CO -0.09 1.07 -0.14 -0.78 -1.65 0.00 0.00 177.43 175.84 1uwk h ASP 525 N 0.58 -0.34 0.60 5.81 -0.00 -1.28 0.49 116.42 122.29 1uwk h ASP 525 Ca 0.05 -0.13 -0.08 0.00 -0.00 0.00 0.00 57.03 56.87 1uwk h ASP 525 Cb 0.95 0.09 -0.01 0.00 -0.00 0.00 0.00 39.33 40.36 1uwk h ASP 525 CO 0.09 -0.06 -0.37 1.55 -0.00 0.00 0.00 179.24 180.45 1uwk h PRO 526 N -0.62 0.00 -0.75 0.28 0.13 -1.78 -2.95 132.00 126.31 1uwk h PRO 526 Ca -0.04 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.16 1uwk h PRO 526 Cb 0.45 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.53 1uwk h PRO 526 CO 0.07 0.37 0.49 0.78 -0.23 0.00 0.00 178.00 179.47 1uwk h GLY 527 N 1.57 1.00 2.00 1.56 0.00 -0.49 -0.84 103.07 107.88 1uwk h GLY 527 Ca -0.00 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 1uwk h GLY 527 CO 0.05 0.22 -0.28 -0.91 0.00 0.00 0.00 176.54 175.61 1uwk h THR 528 N 0.77 0.86 0.17 4.70 1.35 -0.73 0.11 112.91 120.14 1uwk h THR 528 Ca 0.33 -1.12 -0.30 0.00 -0.55 0.00 0.00 66.41 64.77 1uwk h THR 528 Cb 0.30 1.67 0.02 0.00 -1.73 0.00 0.00 68.15 68.41 1uwk h THR 528 CO -0.11 0.28 -1.32 1.23 -0.25 0.00 0.00 175.52 175.34 1uwk h GLY 529 N 1.44 0.52 0.97 5.82 0.00 -1.26 -0.63 103.07 109.94 1uwk h GLY 529 Ca -0.00 -1.25 -0.02 0.00 0.00 0.00 0.00 47.33 46.06 1uwk h GLY 529 CO 0.04 1.10 0.24 -2.08 0.00 0.00 0.00 176.54 175.84 1uwk h VAL 530 N 0.15 1.18 -0.58 4.60 2.07 -1.20 -0.94 116.25 121.54 1uwk h VAL 530 Ca -0.19 -0.51 0.08 0.00 0.82 0.00 0.00 66.70 66.90 1uwk h VAL 530 Cb 2.02 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 32.35 1uwk h VAL 530 CO 0.24 0.20 0.22 -0.03 0.02 0.00 0.00 177.57 178.22 1uwk h MET 531 N 0.64 0.40 -0.51 1.57 -1.53 -0.72 0.17 114.93 114.95 1uwk h MET 531 Ca 0.17 -0.02 -0.10 0.00 -3.44 0.00 0.00 59.70 56.30 1uwk h MET 531 Cb 0.10 -0.09 -0.02 0.00 -0.55 0.00 0.00 31.60 31.04 1uwk h MET 531 CO -0.02 0.26 -0.09 -0.09 0.14 0.00 0.00 176.91 177.11 1uwk h ARG 532 N 0.41 0.94 0.00 0.39 1.12 -0.75 0.52 114.38 117.01 1uwk h ARG 532 Ca 0.28 -0.33 -0.15 0.00 -1.11 0.00 0.00 59.98 58.68 1uwk h ARG 532 Cb 0.32 -0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.19 1uwk h ARG 532 CO -0.28 0.99 -0.71 0.45 -3.11 0.00 0.00 179.97 177.32 1uwk h HIS 533 N 0.85 0.00 -0.40 2.20 3.86 -0.89 -2.61 115.15 118.16 1uwk h HIS 533 Ca 0.14 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.23 1uwk h HIS 533 Cb 0.63 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 1uwk h HIS 533 CO 0.04 0.71 -0.24 0.00 0.86 0.00 0.00 177.93 179.30 1uwk h ALA 534 N 1.29 0.84 -0.72 2.45 0.00 -0.34 -2.18 119.26 120.60 1uwk h ALA 534 Ca -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1uwk h ALA 534 Cb 1.48 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 1uwk h ALA 534 CO 0.09 0.64 0.39 0.22 0.00 0.00 0.00 179.25 180.59 1uwk h ASP 535 N 0.69 0.89 0.76 0.00 1.82 -0.81 -0.27 116.42 119.51 1uwk h ASP 535 Ca 0.09 -0.07 0.00 0.00 -0.39 0.00 0.00 57.03 56.66 1uwk h ASP 535 Cb 0.76 -0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.54 1uwk h ASP 535 CO 0.06 0.72 0.00 0.00 -1.61 0.00 0.00 179.24 178.41 1uwk n ALA 536 N -2.43 1.75 -0.09 -0.78 0.00 -0.99 -4.89 120.51 113.08 1uwk n ALA 536 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1uwk n ALA 536 Cb 0.10 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1uwk n ALA 536 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwk n GLY 537 N 0.20 0.95 3.66 0.00 0.00 -0.11 -4.25 105.19 105.64 1uwk n GLY 537 Ca 0.03 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1uwk n GLY 537 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uwk s TYR 538 N -2.00 2.81 0.36 1.61 2.02 -0.85 -4.90 117.35 116.39 1uwk s TYR 538 Ca 0.00 0.98 0.03 0.00 -0.37 0.00 0.00 57.07 57.71 1uwk s TYR 538 Cb 0.00 -3.53 0.66 0.00 -0.40 0.00 0.00 41.96 38.69 1uwk s TYR 538 CO 0.00 -1.77 1.99 -0.44 -1.57 0.00 0.00 175.55 173.76 1uwk h ASP 539 N 8.27 0.66 0.21 2.29 3.32 -1.94 -0.49 116.42 128.74 1uwk h ASP 539 Ca -0.27 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 56.66 1uwk h ASP 539 Cb 1.10 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1uwk h ASP 539 CO 0.97 0.51 -0.32 0.16 -1.72 0.00 0.00 179.24 178.84 1uwk h ILE 540 N 0.76 1.26 -0.07 0.35 3.07 -1.93 0.08 117.51 121.02 1uwk h ILE 540 Ca 0.20 -1.26 -0.23 0.00 1.55 0.00 0.00 64.86 65.12 1uwk h ILE 540 Cb -0.02 1.56 0.01 0.00 -0.27 0.00 0.00 36.82 38.09 1uwk h ILE 540 CO -0.04 0.38 -0.86 0.00 -1.05 0.00 0.00 178.15 176.57 1uwk h ALA 541 N 1.51 0.34 -0.77 0.16 0.00 -1.31 -1.82 119.26 117.36 1uwk h ALA 541 Ca 0.02 -0.65 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 1uwk h ALA 541 Cb 0.66 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1uwk h ALA 541 CO 0.05 0.73 0.34 0.82 0.00 0.00 0.00 179.25 181.19 1uwk h ILE 542 N 0.39 1.25 -0.50 0.00 2.04 -0.80 0.62 117.51 120.51 1uwk h ILE 542 Ca -0.07 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 1uwk h ILE 542 Cb 1.49 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1uwk h ILE 542 CO 0.16 0.31 0.26 0.44 0.00 0.00 0.00 178.15 179.32 1uwk h ASP 543 N 1.10 0.65 -0.57 1.72 3.32 -0.95 -1.34 116.42 120.34 1uwk h ASP 543 Ca 0.26 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1uwk h ASP 543 Cb 0.16 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1uwk h ASP 543 CO -0.03 0.57 0.23 0.00 -1.72 0.00 0.00 179.24 178.30 1uwk h ALA 545 N 1.08 0.97 -0.34 0.00 0.00 -0.56 -0.10 119.26 120.29 1uwk h ALA 545 Ca 0.19 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1uwk h ALA 545 Cb 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1uwk h ALA 545 CO -0.02 0.01 -0.19 0.87 0.00 0.00 0.00 179.25 179.93 1uwk h LYS 546 N 0.66 0.73 -0.83 0.00 1.57 -0.71 -0.94 116.57 117.04 1uwk h LYS 546 Ca 0.33 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1uwk h LYS 546 Cb 0.28 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1uwk h LYS 546 CO -0.23 0.94 0.49 0.93 -0.57 0.00 0.00 179.45 181.01 1uwk h GLU 547 N 0.51 1.13 -0.01 3.15 5.08 -0.55 -2.63 114.58 121.26 1uwk h GLU 547 Ca 0.07 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1uwk h GLU 547 Cb 0.74 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1uwk h GLU 547 CO 0.05 0.80 -0.05 1.04 -1.00 0.00 0.00 179.01 179.86 1uwk n GLN 548 N -4.36 1.50 -2.22 2.33 1.13 -0.10 -4.96 117.38 110.70 1uwk n GLN 548 Ca 0.09 -0.87 -0.10 0.00 -1.94 0.00 0.00 57.00 54.18 1uwk n GLN 548 Cb 0.07 -1.48 -0.00 0.00 0.11 0.00 0.00 30.24 28.94 1uwk n GLN 548 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1uwk n GLY 549 N 1.21 -0.03 3.76 1.08 0.00 -0.68 -4.99 105.19 105.53 1uwk n GLY 549 Ca 0.18 -0.46 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 1uwk n GLY 549 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwk s LEU 550 N -2.91 3.77 -0.63 0.99 1.43 -0.45 -4.97 118.68 115.92 1uwk s LEU 550 Ca 0.01 2.33 -0.12 0.00 -1.03 0.00 0.00 54.13 55.32 1uwk s LEU 550 Cb -0.00 -4.50 0.16 0.00 0.03 0.00 0.00 46.19 41.87 1uwk s LEU 550 CO 0.01 -1.34 0.55 -0.62 0.23 0.00 0.00 176.35 175.18 1uwk s ASP 551 N -1.56 6.17 -0.54 2.29 -1.08 -1.26 -4.86 116.67 115.82 1uwk s ASP 551 Ca 0.73 -2.24 0.00 0.00 -0.52 0.00 0.00 52.55 50.52 1uwk s ASP 551 Cb -0.29 -2.13 0.14 0.00 -1.46 0.00 0.00 42.92 39.19 1uwk s ASP 551 CO 0.32 -0.67 0.32 -0.76 0.52 0.00 0.00 175.17 174.91 1uwk s LEU 552 N 0.88 4.88 0.47 -1.34 1.43 -1.26 -5.01 118.68 118.72 1uwk s LEU 552 Ca 0.10 -2.78 0.21 0.00 -1.03 0.00 0.00 54.13 50.64 1uwk s LEU 552 Cb -0.21 -1.76 1.21 0.00 0.03 0.00 0.00 46.19 45.46 1uwk s LEU 552 CO -0.03 -0.34 1.91 -0.65 0.23 0.00 0.00 176.35 177.48 1uwk h PRO 553 N 6.99 0.25 -0.00 1.29 0.11 -1.93 0.33 132.00 139.03 1uwk h PRO 553 Ca -0.05 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1uwk h PRO 553 Cb 0.94 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1uwk h PRO 553 CO 0.69 0.16 -0.14 -1.33 -0.21 0.00 0.00 178.00 177.17 1uwk n MET 554 N -4.43 0.43 -0.02 1.05 2.81 -1.26 -2.10 117.12 113.60 1uwk n MET 554 Ca 0.16 -0.14 -0.05 0.00 -1.81 0.00 0.00 57.70 55.86 1uwk n MET 554 Cb 0.67 -1.50 -0.02 0.00 -0.71 0.00 0.00 33.22 31.67 1uwk n MET 554 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1uwk n ILE 555 N -1.17 0.24 1.01 2.02 5.41 0.44 -4.77 119.36 122.55 1uwk n ILE 555 Ca 0.12 -0.06 0.11 0.00 1.00 0.00 0.00 62.75 63.91 1uwk n ILE 555 Cb 0.30 -1.52 -0.03 0.00 -0.71 0.00 0.00 39.64 37.68 1uwk n ILE 555 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1uwk n THR 556 N -3.17 0.00 0.00 1.39 -2.24 0.86 -5.04 114.28 106.07 1uwk n THR 556 Ca -0.09 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1uwk n THR 556 Cb 0.56 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.84 1uwk n THR 556 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11