#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uwu s TYR 2 N 0.00 2.33 0.01 1.12 2.02 -0.63 -4.99 117.35 117.21 1uwu s TYR 2 Ca 0.00 -1.97 -0.13 0.00 -0.37 0.00 0.00 57.07 54.60 1uwu s TYR 2 Cb 0.00 -1.91 -0.06 0.00 -0.40 0.00 0.00 41.96 39.59 1uwu s TYR 2 CO 0.00 -0.85 0.38 -1.12 -1.57 0.00 0.00 175.55 172.39 1uwu s SER 3 N 1.41 6.73 0.20 2.29 0.01 -1.26 -1.04 113.70 122.04 1uwu s SER 3 Ca 0.05 0.87 0.04 0.00 1.31 0.00 0.00 55.95 58.23 1uwu s SER 3 Cb -0.18 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 63.80 1uwu s SER 3 CO -0.15 0.30 0.30 -0.36 0.41 0.00 0.00 173.24 173.74 1uwu s PHE 4 N -1.15 3.40 0.58 2.43 0.40 -0.47 -5.00 117.98 118.18 1uwu s PHE 4 Ca 0.25 0.02 -0.18 0.00 -0.60 0.00 0.00 56.93 56.42 1uwu s PHE 4 Cb -0.16 -1.58 -0.09 0.00 0.51 0.00 0.00 43.02 41.71 1uwu s PHE 4 CO 0.13 0.48 0.47 -2.30 0.70 0.00 0.00 175.22 174.71 1uwu n PRO 5 N -1.00 0.46 0.29 0.24 -0.02 -1.26 -4.86 135.00 128.85 1uwu n PRO 5 Ca -0.08 0.18 0.16 0.00 -2.02 0.00 0.00 63.50 61.74 1uwu n PRO 5 Cb 0.56 -1.66 0.91 0.00 -0.02 0.00 0.00 33.50 33.28 1uwu n PRO 5 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1uwu h ASN 6 N 0.17 0.00 0.58 2.55 2.35 -1.98 -2.37 115.58 116.88 1uwu h ASN 6 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 1uwu h ASN 6 Cb 1.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.77 1uwu h ASN 6 CO 0.46 0.04 -0.62 -1.54 -1.65 0.00 0.00 177.43 174.12 1uwu n SER 7 N -3.60 0.58 -4.75 5.81 3.41 -1.26 -4.94 113.62 108.87 1uwu n SER 7 Ca -0.02 -0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.02 1uwu n SER 7 Cb 0.14 0.32 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 1uwu n SER 7 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1uwu s PHE 8 N -3.07 3.13 -0.02 7.33 2.19 -0.90 -4.99 117.98 121.66 1uwu s PHE 8 Ca 0.09 1.27 0.07 0.00 0.33 0.00 0.00 56.93 58.68 1uwu s PHE 8 Cb 0.16 -3.67 -0.02 0.00 -1.31 0.00 0.00 43.02 38.17 1uwu s PHE 8 CO 0.72 -2.01 -0.22 1.03 1.83 0.00 0.00 175.22 176.58 1uwu s ARG 9 N -0.89 2.20 -0.13 10.12 0.52 -1.01 -4.97 118.95 124.79 1uwu s ARG 9 Ca 0.54 -0.88 -0.06 0.00 -0.52 0.00 0.00 55.73 54.81 1uwu s ARG 9 Cb -0.39 -2.15 -0.04 0.00 0.52 0.00 0.00 34.95 32.89 1uwu s ARG 9 CO 0.45 0.57 0.08 -0.06 0.02 0.00 0.00 175.30 176.36 1uwu s PHE 10 N -0.69 3.37 0.00 -0.53 0.08 -1.26 -1.60 117.98 117.34 1uwu s PHE 10 Ca 0.11 0.30 0.00 0.00 0.12 0.00 0.00 56.93 57.46 1uwu s PHE 10 Cb -0.10 -1.95 0.00 0.00 -0.57 0.00 0.00 43.02 40.40 1uwu s PHE 10 CO 0.00 0.47 0.00 0.41 -0.10 0.00 0.00 175.22 176.01 1uwu n GLY 11 N 2.55 3.63 3.30 4.36 0.00 0.12 -0.49 105.19 118.66 1uwu n GLY 11 Ca -0.18 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 1uwu n GLY 11 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1uwu s TRP 12 N -0.67 0.17 0.18 1.61 -2.14 -1.07 -1.50 118.94 115.52 1uwu s TRP 12 Ca 0.00 -0.55 0.11 0.00 2.66 0.00 0.00 56.10 58.32 1uwu s TRP 12 Cb 0.00 0.03 -0.04 0.00 -3.10 0.00 0.00 33.47 30.35 1uwu s TRP 12 CO 0.00 -0.67 -0.24 -1.12 -2.66 0.00 0.00 176.95 172.26 1uwu s SER 13 N -2.90 3.44 0.04 -2.66 0.01 -0.72 -1.66 113.70 109.24 1uwu s SER 13 Ca 0.10 -0.84 -0.23 0.00 1.31 0.00 0.00 55.95 56.29 1uwu s SER 13 Cb 0.03 -0.26 0.05 0.00 0.21 0.00 0.00 66.02 66.06 1uwu s SER 13 CO -0.06 0.13 0.53 -1.58 0.41 0.00 0.00 173.24 172.67 1uwu s GLN 14 N -2.57 1.03 0.11 12.44 0.74 -0.75 -4.27 119.66 126.39 1uwu s GLN 14 Ca 0.20 -0.18 0.09 0.00 0.05 0.00 0.00 55.36 55.52 1uwu s GLN 14 Cb -0.08 0.47 -0.04 0.00 1.10 0.00 0.00 33.01 34.46 1uwu s GLN 14 CO 0.09 -0.36 -0.24 0.00 -0.55 0.00 0.00 175.29 174.23 1uwu s ALA 15 N -2.28 2.08 0.06 1.58 0.00 -1.26 -4.02 121.76 117.93 1uwu s ALA 15 Ca -0.06 -1.34 -0.26 0.00 0.00 0.00 0.00 51.96 50.30 1uwu s ALA 15 Cb -0.01 -0.32 -0.17 0.00 0.00 0.00 0.00 23.12 22.63 1uwu s ALA 15 CO -0.00 0.45 1.60 0.78 0.00 0.00 0.00 175.76 178.58 1uwu h GLY 16 N 4.05 -0.33 1.64 0.00 0.00 -1.91 -2.13 103.07 104.40 1uwu h GLY 16 Ca -0.48 0.12 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 1uwu h GLY 16 CO 0.40 -0.12 -0.00 -2.75 0.00 0.00 0.00 176.54 174.06 1uwu h PHE 17 N -0.40 0.46 0.00 5.60 3.57 -1.94 0.03 116.94 124.26 1uwu h PHE 17 Ca -0.03 -0.04 -0.21 0.00 3.53 0.00 0.00 57.97 61.22 1uwu h PHE 17 Cb 0.31 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1uwu h PHE 17 CO -0.04 0.46 -1.02 1.96 -2.23 0.00 0.00 178.31 177.45 1uwu h GLN 18 N 0.43 0.01 0.00 1.11 4.20 -1.79 -3.40 115.11 115.67 1uwu h GLN 18 Ca 0.10 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1uwu h GLN 18 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.08 1uwu h GLN 18 CO 0.01 1.00 -1.12 0.43 -0.67 0.00 0.00 178.83 178.48 1uwu n SER 19 N -3.35 4.42 0.00 1.46 7.64 -0.81 -1.77 113.62 121.20 1uwu n SER 19 Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 1uwu n SER 19 Cb 0.94 1.10 -0.09 0.00 -1.01 0.00 0.00 64.21 65.15 1uwu n SER 19 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1uwu h GLU 20 N 0.00 0.02 -7.26 1.43 5.08 -1.18 0.95 114.58 113.61 1uwu h GLU 20 Ca -0.00 -0.01 -0.50 0.00 -1.00 0.00 0.00 59.36 57.85 1uwu h GLU 20 Cb 0.15 -0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.46 1uwu h GLU 20 CO 0.00 0.34 0.38 -1.64 -1.00 0.00 0.00 179.01 177.09 1uwu s MET 21 N -4.91 3.37 0.00 2.33 -1.94 -1.26 -1.35 119.30 115.53 1uwu s MET 21 Ca -0.15 1.01 0.00 0.00 -1.71 0.00 0.00 55.69 54.84 1uwu s MET 21 Cb 0.03 -2.05 0.00 0.00 2.01 0.00 0.00 34.83 34.83 1uwu s MET 21 CO 0.67 -0.76 0.00 0.41 -0.01 0.00 0.00 175.02 175.33 1uwu n GLY 22 N -1.67 1.20 3.92 -0.03 0.00 -1.22 -1.06 105.19 106.32 1uwu n GLY 22 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1uwu n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uwu s THR 23 N -0.22 5.33 0.13 2.61 -4.23 -1.26 -4.74 115.64 113.27 1uwu s THR 23 Ca 0.00 -0.35 -0.35 0.00 -1.18 0.00 0.00 61.69 59.81 1uwu s THR 23 Cb 0.00 -3.65 -0.16 0.00 1.34 0.00 0.00 72.50 70.03 1uwu s THR 23 CO 0.00 0.08 1.33 -2.65 -0.54 0.00 0.00 174.62 172.84 1uwu n PRO 24 N 0.10 1.37 -0.88 3.99 -0.02 -1.26 -1.58 135.00 136.72 1uwu n PRO 24 Ca -0.05 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1uwu n PRO 24 Cb 0.52 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1uwu n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uwu n GLY 25 N 2.48 0.76 0.29 -1.23 0.00 -1.26 -4.91 105.19 101.32 1uwu n GLY 25 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1uwu n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uwu n SER 26 N 0.00 1.37 -4.75 1.61 3.41 -0.61 -4.99 113.62 109.66 1uwu n SER 26 Ca 0.00 -1.09 -0.42 0.00 -0.26 0.00 0.00 58.87 57.11 1uwu n SER 26 Cb 0.00 0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.34 1uwu n SER 26 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1uwu s GLU 27 N -2.62 4.16 -0.45 4.33 2.12 -1.26 -4.67 118.70 120.32 1uwu s GLU 27 Ca 0.18 2.51 0.03 0.00 0.36 0.00 0.00 54.97 58.05 1uwu s GLU 27 Cb 0.18 -3.05 0.12 0.00 0.26 0.00 0.00 34.13 31.64 1uwu s GLU 27 CO 0.61 -0.59 0.20 0.34 -0.54 0.00 0.00 175.26 175.28 1uwu s ASP 28 N 0.55 4.17 0.00 -1.70 2.15 -1.26 -4.96 116.67 115.61 1uwu s ASP 28 Ca 0.64 -2.63 0.20 0.00 0.43 0.00 0.00 52.55 51.18 1uwu s ASP 28 Cb -0.46 -1.39 1.02 0.00 -0.30 0.00 0.00 42.92 41.78 1uwu s ASP 28 CO 0.45 -0.28 1.68 -0.81 -0.17 0.00 0.00 175.17 176.03 1uwu n PRO 29 N 3.58 1.23 -1.17 4.34 -0.04 -1.26 -4.48 135.00 137.20 1uwu n PRO 29 Ca 0.05 -0.34 -0.21 0.00 -0.04 0.00 0.00 63.50 62.96 1uwu n PRO 29 Cb 0.35 -1.33 0.19 0.00 -0.04 0.00 0.00 33.50 32.67 1uwu n PRO 29 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1uwu n ASN 30 N -0.45 3.87 -4.52 3.54 5.03 -1.26 -4.67 115.26 116.80 1uwu n ASN 30 Ca 0.15 -3.51 -0.25 0.00 0.87 0.00 0.00 54.58 51.84 1uwu n ASN 30 Cb 0.15 -0.82 -0.09 0.00 -1.02 0.00 0.00 39.78 38.00 1uwu n ASN 30 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1uwu s THR 31 N -3.17 2.82 0.23 3.41 -4.23 -1.26 -1.03 115.64 112.42 1uwu s THR 31 Ca 0.55 -2.11 -0.06 0.00 -1.18 0.00 0.00 61.69 58.90 1uwu s THR 31 Cb 0.46 -2.46 0.21 0.00 1.34 0.00 0.00 72.50 72.05 1uwu s THR 31 CO 0.11 -0.31 1.71 -2.24 -0.54 0.00 0.00 174.62 173.35 1uwu h ASP 32 N 2.41 0.12 -0.59 3.99 3.04 -1.36 -2.18 116.42 121.86 1uwu h ASP 32 Ca -0.43 0.12 -0.09 0.00 -3.24 0.00 0.00 57.03 53.39 1uwu h ASP 32 Cb 1.24 0.14 -0.02 0.00 -1.04 0.00 0.00 39.33 39.65 1uwu h ASP 32 CO 0.57 0.04 0.01 -0.50 -2.04 0.00 0.00 179.24 177.32 1uwu h TRP 33 N 0.34 1.13 -0.16 4.15 4.06 -1.93 0.74 115.95 124.28 1uwu h TRP 33 Ca 0.39 -0.19 0.01 0.00 2.06 0.00 0.00 58.89 61.16 1uwu h TRP 33 Cb 0.61 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1uwu h TRP 33 CO -0.22 1.00 0.09 -0.92 -3.56 0.00 0.00 178.44 174.83 1uwu h TYR 34 N 0.96 0.17 -0.71 0.49 5.03 -1.82 -1.62 116.97 119.47 1uwu h TYR 34 Ca 0.17 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.46 1uwu h TYR 34 Cb 0.54 -0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.73 1uwu h TYR 34 CO 0.04 0.10 0.34 -0.22 -1.32 0.00 0.00 178.16 177.10 1uwu h LYS 35 N 0.19 1.03 -0.32 1.82 3.64 -1.04 -2.72 116.57 119.17 1uwu h LYS 35 Ca 0.06 -0.15 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1uwu h LYS 35 Cb -0.00 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 1uwu h LYS 35 CO -0.03 0.81 0.17 2.35 -2.27 0.00 0.00 179.45 180.48 1uwu h TRP 36 N 1.00 0.31 0.00 1.91 2.91 -0.52 -1.51 115.95 120.04 1uwu h TRP 36 Ca 0.24 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.28 1uwu h TRP 36 Cb 0.12 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 1uwu h TRP 36 CO 0.01 0.17 0.00 1.33 -1.03 0.00 0.00 178.44 178.92 1uwu n VAL 37 N -4.94 0.64 1.01 2.65 0.24 -0.64 -2.75 118.33 114.54 1uwu n VAL 37 Ca -0.00 -0.21 0.11 0.00 -2.04 0.00 0.00 64.34 62.20 1uwu n VAL 37 Cb 0.07 -0.68 0.14 0.00 -1.47 0.00 0.00 33.84 31.91 1uwu n VAL 37 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1uwu n HIS 38 N -2.27 0.00 -1.98 6.34 8.25 -0.94 -4.72 115.22 119.90 1uwu n HIS 38 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 1uwu n HIS 38 Cb 0.40 -0.17 -0.03 0.00 1.12 0.00 0.00 29.99 31.31 1uwu n HIS 38 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1uwu s ASP 39 N -2.97 6.64 0.24 0.41 2.15 -0.61 -4.91 116.67 117.62 1uwu s ASP 39 Ca 0.11 2.42 -0.05 0.00 0.43 0.00 0.00 52.55 55.46 1uwu s ASP 39 Cb 0.17 -2.56 0.35 0.00 -0.30 0.00 0.00 42.92 40.58 1uwu s ASP 39 CO 0.74 -0.86 1.83 -0.65 -0.17 0.00 0.00 175.17 176.05 1uwu h PRO 40 N 8.27 0.82 -0.37 4.34 0.11 -1.91 -1.25 132.00 142.01 1uwu h PRO 40 Ca -0.42 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 1uwu h PRO 40 Cb 1.20 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1uwu h PRO 40 CO 0.93 0.55 -0.22 0.93 -0.21 0.00 0.00 178.00 179.97 1uwu h GLU 41 N 0.85 0.81 -0.78 1.05 5.08 -1.97 -1.06 114.58 118.55 1uwu h GLU 41 Ca 0.37 -0.37 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1uwu h GLU 41 Cb 0.26 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.45 1uwu h GLU 41 CO -0.21 1.00 0.50 -0.91 -1.00 0.00 0.00 179.01 178.40 1uwu h ASN 42 N 0.61 0.84 -0.21 1.42 2.35 -1.80 -1.40 115.58 117.38 1uwu h ASN 42 Ca 0.08 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 1uwu h ASN 42 Cb 0.78 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 1uwu h ASN 42 CO 0.06 0.58 0.09 0.24 -1.65 0.00 0.00 177.43 176.75 1uwu h MET 43 N 0.98 0.31 0.00 0.81 2.86 -1.10 -1.02 114.93 117.77 1uwu h MET 43 Ca 0.31 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.83 1uwu h MET 43 Cb -0.01 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1uwu h MET 43 CO -0.11 0.36 -0.32 0.00 1.06 0.00 0.00 176.91 177.90 1uwu h ALA 44 N 0.93 1.47 0.00 6.32 0.00 -0.91 -1.69 119.26 125.38 1uwu h ALA 44 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1uwu h ALA 44 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1uwu h ALA 44 CO -0.01 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.65 1uwu n ALA 45 N -2.48 2.18 -1.16 0.00 0.00 -0.55 -4.90 120.51 113.59 1uwu n ALA 45 Ca -0.02 -0.07 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 1uwu n ALA 45 Cb 0.36 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 1uwu n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwu n GLY 46 N 1.15 0.79 0.22 0.00 0.00 -0.64 -4.91 105.19 101.79 1uwu n GLY 46 Ca 0.06 -0.45 0.01 0.00 0.00 0.00 0.00 46.02 45.64 1uwu n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uwu h LEU 47 N 0.00 0.20 -8.86 0.99 3.38 -1.44 -3.43 115.31 106.16 1uwu h LEU 47 Ca -0.12 -0.06 -0.49 0.00 0.09 0.00 0.00 57.88 57.30 1uwu h LEU 47 Cb 0.50 -0.06 -0.16 0.00 0.09 0.00 0.00 40.66 41.03 1uwu h LEU 47 CO 0.17 0.48 -0.76 0.68 0.09 0.00 0.00 178.44 179.10 1uwu s VAL 48 N -4.42 1.79 0.02 1.22 -7.23 -1.21 -4.12 120.40 106.44 1uwu s VAL 48 Ca -0.05 -2.05 0.19 0.00 -1.81 0.00 0.00 61.98 58.27 1uwu s VAL 48 Cb 0.14 -1.92 0.15 0.00 0.56 0.00 0.00 36.38 35.31 1uwu s VAL 48 CO 0.75 -0.44 1.66 0.77 -0.31 0.00 0.00 175.10 177.53 1uwu h SER 49 N 2.95 0.00 0.00 4.85 4.64 -1.41 -3.42 113.55 121.16 1uwu h SER 49 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1uwu h SER 49 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1uwu h SER 49 CO 0.56 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 177.48 1uwu n GLY 50 N 0.58 3.29 3.77 -0.77 0.00 -1.26 -5.03 105.19 105.77 1uwu n GLY 50 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1uwu n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uwu s ASP 51 N -1.13 5.99 -0.04 1.61 1.01 -1.26 -5.05 116.67 117.80 1uwu s ASP 51 Ca 0.00 2.29 0.07 0.00 0.71 0.00 0.00 52.55 55.62 1uwu s ASP 51 Cb 0.00 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 1uwu s ASP 51 CO 0.00 -1.04 -0.24 -0.76 0.21 0.00 0.00 175.17 173.33 1uwu s LEU 52 N -3.28 2.05 0.51 1.23 1.43 -1.26 -4.91 118.68 114.45 1uwu s LEU 52 Ca 0.67 -0.47 0.26 0.00 -1.03 0.00 0.00 54.13 53.56 1uwu s LEU 52 Cb -0.28 -1.30 1.37 0.00 0.03 0.00 0.00 46.19 46.01 1uwu s LEU 52 CO 0.33 0.27 2.04 1.55 0.23 0.00 0.00 176.35 180.77 1uwu h PRO 53 N 5.82 0.00 0.00 1.29 0.13 -1.97 -2.08 132.00 135.20 1uwu h PRO 53 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1uwu h PRO 53 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1uwu h PRO 53 CO 0.47 0.14 0.00 -0.85 -0.23 0.00 0.00 178.00 177.53 1uwu n GLU 54 N -3.63 0.15 -1.02 0.86 0.00 -1.26 -1.54 120.64 114.20 1uwu n GLU 54 Ca -0.02 0.18 -0.09 0.00 0.00 0.00 0.00 57.16 57.24 1uwu n GLU 54 Cb 0.26 -1.50 0.27 0.00 0.00 0.00 0.00 31.44 30.47 1uwu n GLU 54 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1uwu n ASN 55 N -1.33 4.35 -2.00 -1.84 5.03 -0.78 -3.44 115.26 115.25 1uwu n ASN 55 Ca 0.06 -3.35 0.00 0.00 0.87 0.00 0.00 54.58 52.16 1uwu n ASN 55 Cb 0.12 -0.75 0.00 0.00 -1.02 0.00 0.00 39.78 38.13 1uwu n ASN 55 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1uwu n GLY 56 N -0.48 0.02 0.05 7.41 0.00 -0.59 -4.89 105.19 106.71 1uwu n GLY 56 Ca 0.43 -1.79 0.11 0.00 0.00 0.00 0.00 46.02 44.77 1uwu n GLY 56 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uwu n PRO 57 N -0.46 0.09 -2.79 1.61 -0.04 -1.13 -4.24 135.00 128.04 1uwu n PRO 57 Ca 0.00 0.24 -0.08 0.00 -0.04 0.00 0.00 63.50 63.62 1uwu n PRO 57 Cb 0.00 -1.64 0.03 0.00 -0.04 0.00 0.00 33.50 31.85 1uwu n PRO 57 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uwu n GLY 58 N 0.50 0.31 0.27 0.55 0.00 -0.22 -4.89 105.19 101.71 1uwu n GLY 58 Ca 0.04 -0.31 0.02 0.00 0.00 0.00 0.00 46.02 45.77 1uwu n GLY 58 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1uwu h TYR 59 N -0.92 0.45 -0.49 1.61 3.20 -0.34 0.25 116.97 120.73 1uwu h TYR 59 Ca -0.22 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.72 1uwu h TYR 59 Cb 1.14 -0.14 -0.08 0.00 1.54 0.00 0.00 36.73 39.19 1uwu h TYR 59 CO 0.18 0.43 0.01 2.35 -1.64 0.00 0.00 178.16 179.50 1uwu h TRP 60 N 0.43 -0.01 0.00 -3.82 2.91 -1.42 -0.82 115.95 113.22 1uwu h TRP 60 Ca 0.10 0.04 -0.22 0.00 1.13 0.00 0.00 58.89 59.93 1uwu h TRP 60 Cb 0.25 0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 28.94 1uwu h TRP 60 CO 0.01 -0.10 -1.42 0.78 -1.03 0.00 0.00 178.44 176.68 1uwu h GLY 61 N 0.13 0.00 -1.95 2.65 0.00 -1.75 -3.40 103.07 98.74 1uwu h GLY 61 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1uwu h GLY 61 CO -0.40 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.84 1uwu n ASN 62 N -3.03 3.61 -0.36 0.19 3.02 0.06 -4.72 115.26 114.02 1uwu n ASN 62 Ca -0.11 -2.21 0.28 0.00 -0.03 0.00 0.00 54.58 52.51 1uwu n ASN 62 Cb 0.93 -0.39 0.55 0.00 -0.61 0.00 0.00 39.78 40.26 1uwu n ASN 62 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 1uwu h TYR 63 N 2.87 0.65 -0.55 3.10 -0.00 -1.36 -1.00 116.97 120.69 1uwu h TYR 63 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.75 1uwu h TYR 63 Cb 1.01 -0.18 -0.03 0.00 -0.00 0.00 0.00 36.73 37.54 1uwu h TYR 63 CO 0.42 -0.06 0.30 0.87 -0.00 0.00 0.00 178.16 179.70 1uwu h LYS 64 N 0.28 0.76 -0.77 0.10 1.57 -1.87 -1.13 116.57 115.50 1uwu h LYS 64 Ca 0.69 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 59.36 1uwu h LYS 64 Cb 1.88 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 34.00 1uwu h LYS 64 CO -0.38 0.58 0.40 1.15 -0.57 0.00 0.00 179.45 180.63 1uwu h THR 65 N 0.73 1.24 -0.32 -0.16 2.02 -1.57 0.96 112.91 115.82 1uwu h THR 65 Ca 0.19 -0.63 0.02 0.00 0.77 0.00 0.00 66.41 66.77 1uwu h THR 65 Cb 0.04 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 1uwu h THR 65 CO -0.03 0.27 0.15 -0.26 0.37 0.00 0.00 175.52 176.02 1uwu h PHE 66 N 1.08 0.28 -0.08 3.16 -1.00 -1.22 -2.46 116.94 116.69 1uwu h PHE 66 Ca 0.27 0.01 -0.15 0.00 2.81 0.00 0.00 57.97 60.91 1uwu h PHE 66 Cb 0.07 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 1uwu h PHE 66 CO 0.01 0.15 -0.61 0.45 -1.61 0.00 0.00 178.31 176.70 1uwu h HIS 67 N 0.32 0.36 -0.40 -0.55 3.86 -0.97 -1.23 115.15 116.54 1uwu h HIS 67 Ca 0.13 -0.14 0.03 0.00 -1.16 0.00 0.00 60.37 59.23 1uwu h HIS 67 Cb 0.05 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.43 1uwu h HIS 67 CO -0.10 0.82 0.20 -0.44 0.86 0.00 0.00 177.93 179.27 1uwu h ASP 68 N 0.21 0.30 -0.41 2.45 3.32 -0.64 -0.54 116.42 121.10 1uwu h ASP 68 Ca -0.01 0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.93 1uwu h ASP 68 Cb 1.12 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1uwu h ASP 68 CO 0.10 0.22 -0.27 0.78 -1.72 0.00 0.00 179.24 178.34 1uwu h ASN 69 N 0.41 0.95 -0.95 6.45 2.35 -1.20 -0.73 115.58 122.86 1uwu h ASN 69 Ca 0.17 -0.43 0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1uwu h ASN 69 Cb 0.07 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.13 1uwu h ASN 69 CO -0.11 1.18 0.63 0.00 -1.65 0.00 0.00 177.43 177.47 1uwu h ALA 70 N 0.81 1.21 -0.25 -0.83 0.00 -1.10 -0.97 119.26 118.12 1uwu h ALA 70 Ca 0.08 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1uwu h ALA 70 Cb 0.85 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1uwu h ALA 70 CO 0.08 0.60 -0.04 0.37 0.00 0.00 0.00 179.25 180.25 1uwu h GLN 71 N 1.29 0.46 -0.34 0.00 4.15 -0.84 -1.99 115.11 117.84 1uwu h GLN 71 Ca 0.35 -0.17 0.10 0.00 0.77 0.00 0.00 58.65 59.70 1uwu h GLN 71 Cb -0.15 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 1uwu h GLN 71 CO -0.08 0.67 0.25 0.87 -1.93 0.00 0.00 178.83 178.62 1uwu h LYS 72 N 0.21 0.00 -0.01 1.69 1.57 -0.99 -0.89 116.57 118.16 1uwu h LYS 72 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1uwu h LYS 72 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1uwu h LYS 72 CO 0.02 0.00 -0.05 -0.12 -0.57 0.00 0.00 179.45 178.73 1uwu n MET 73 N -4.36 1.42 -0.97 3.15 1.56 -0.38 -4.91 117.12 112.63 1uwu n MET 73 Ca 0.05 -0.77 0.00 0.00 -0.27 0.00 0.00 57.70 56.71 1uwu n MET 73 Cb 0.42 -1.48 0.00 0.00 2.15 0.00 0.00 33.22 34.31 1uwu n MET 73 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1uwu n GLY 74 N 1.19 0.46 3.78 -5.12 0.00 -0.34 -4.16 105.19 101.00 1uwu n GLY 74 Ca 0.18 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 1uwu n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwu s LEU 75 N 0.00 3.80 0.00 0.99 1.43 -0.78 -4.45 118.68 119.66 1uwu s LEU 75 Ca 0.00 2.08 0.00 0.00 -1.03 0.00 0.00 54.13 55.18 1uwu s LEU 75 Cb 0.00 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.66 1uwu s LEU 75 CO 0.00 -1.03 0.37 0.29 0.23 0.00 0.00 176.35 176.21 1uwu n LYS 76 N -1.13 0.23 -3.79 1.70 4.01 0.35 -4.74 118.16 114.79 1uwu n LYS 76 Ca 0.11 -0.44 -0.13 0.00 -0.51 0.00 0.00 58.31 57.34 1uwu n LYS 76 Cb 0.51 -0.65 -0.09 0.00 -0.51 0.00 0.00 35.03 34.29 1uwu n LYS 76 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1uwu s ILE 77 N -0.13 0.05 -0.06 -0.18 2.07 -1.21 -0.69 121.20 121.05 1uwu s ILE 77 Ca 0.00 -0.44 -0.08 0.00 -1.41 0.00 0.00 60.65 58.72 1uwu s ILE 77 Cb 0.00 -0.52 0.02 0.00 0.13 0.00 0.00 42.46 42.08 1uwu s ILE 77 CO 0.00 -0.24 0.19 0.00 -1.91 0.00 0.00 174.94 172.98 1uwu s ALA 78 N -1.06 -0.48 -0.12 1.50 0.00 -0.26 -2.61 121.76 118.73 1uwu s ALA 78 Ca -0.11 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.26 1uwu s ALA 78 Cb -0.05 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1uwu s ALA 78 CO 0.03 -0.13 -0.12 0.50 0.00 0.00 0.00 175.76 176.03 1uwu s ARG 79 N -0.30 1.98 0.20 0.00 3.00 -0.66 -1.09 118.95 122.07 1uwu s ARG 79 Ca -0.04 -0.45 0.03 0.00 -1.00 0.00 0.00 55.73 54.26 1uwu s ARG 79 Cb -0.03 -1.81 -0.05 0.00 0.00 0.00 0.00 34.95 33.06 1uwu s ARG 79 CO 0.01 -0.17 0.00 -0.51 0.00 0.00 0.00 175.30 174.63 1uwu s LEU 80 N 1.32 2.13 0.25 -0.88 1.02 -1.07 -1.80 118.68 119.63 1uwu s LEU 80 Ca -0.01 -1.20 0.11 0.00 0.02 0.00 0.00 54.13 53.06 1uwu s LEU 80 Cb -0.14 -0.14 -0.05 0.00 0.02 0.00 0.00 46.19 45.89 1uwu s LEU 80 CO -0.06 -0.55 -0.16 0.54 0.02 0.00 0.00 176.35 176.15 1uwu s ASN 81 N -3.23 3.81 0.10 2.29 4.22 -1.26 -1.13 114.94 119.75 1uwu s ASN 81 Ca 0.26 -0.87 -0.22 0.00 -2.14 0.00 0.00 52.86 49.89 1uwu s ASN 81 Cb 0.06 -0.44 -0.07 0.00 1.28 0.00 0.00 41.25 42.08 1uwu s ASN 81 CO 0.06 0.06 0.67 0.68 -2.04 0.00 0.00 177.10 176.52 1uwu s VAL 82 N -2.19 4.60 -0.48 3.54 -7.23 -1.18 -4.41 120.40 113.05 1uwu s VAL 82 Ca 0.28 1.44 -0.25 0.00 -1.81 0.00 0.00 61.98 61.63 1uwu s VAL 82 Cb -0.06 -4.01 0.03 0.00 0.56 0.00 0.00 36.38 32.90 1uwu s VAL 82 CO 0.15 0.52 0.94 -1.61 -0.31 0.00 0.00 175.10 174.79 1uwu s GLU 83 N -0.99 3.51 0.20 4.82 0.41 -1.26 -4.53 118.70 120.84 1uwu s GLU 83 Ca 0.32 0.11 -0.09 0.00 -0.41 0.00 0.00 54.97 54.91 1uwu s GLU 83 Cb -0.21 -3.94 0.28 0.00 -1.78 0.00 0.00 34.13 28.48 1uwu s GLU 83 CO 0.22 -1.27 1.18 1.87 -0.49 0.00 0.00 175.26 176.77 1uwu n TRP 84 N 7.25 0.18 0.07 1.61 -0.00 -1.26 -0.88 117.44 124.40 1uwu n TRP 84 Ca 0.06 0.93 0.11 0.00 -0.00 0.00 0.00 57.50 58.59 1uwu n TRP 84 Cb 0.48 -0.88 0.58 0.00 -0.00 0.00 0.00 31.31 31.49 1uwu n TRP 84 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 177.69 178.35 1uwu h SER 85 N 0.00 0.18 0.54 5.87 4.64 -1.88 0.04 113.55 122.95 1uwu h SER 85 Ca 0.32 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.48 1uwu h SER 85 Cb 0.51 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 1uwu h SER 85 CO -0.77 0.12 -0.75 0.03 -0.87 0.00 0.00 176.83 174.59 1uwu h ARG 86 N 0.20 0.16 0.13 4.77 3.08 -1.39 -2.56 114.38 118.78 1uwu h ARG 86 Ca 0.15 -0.15 -0.20 0.00 0.07 0.00 0.00 59.98 59.86 1uwu h ARG 86 Cb 0.36 0.04 0.02 0.00 0.08 0.00 0.00 29.97 30.46 1uwu h ARG 86 CO -0.03 0.84 -0.92 0.82 -1.07 0.00 0.00 179.97 179.62 1uwu h ILE 87 N 0.11 1.42 -2.38 2.04 1.08 -1.18 -3.41 117.51 115.19 1uwu h ILE 87 Ca -0.02 -2.51 -0.60 0.00 -0.39 0.00 0.00 64.86 61.34 1uwu h ILE 87 Cb 1.32 3.11 -0.42 0.00 -3.07 0.00 0.00 36.82 37.76 1uwu h ILE 87 CO 0.11 0.71 -0.61 0.49 -0.69 0.00 0.00 178.15 178.16 1uwu n PHE 88 N -4.10 3.35 0.27 1.37 3.72 -0.10 -0.30 117.46 121.66 1uwu n PHE 88 Ca -0.16 -4.16 0.14 0.00 -0.05 0.00 0.00 57.45 53.22 1uwu n PHE 88 Cb 0.83 -0.56 0.73 0.00 -0.94 0.00 0.00 39.48 39.55 1uwu n PHE 88 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1uwu h PRO 89 N 4.45 0.00 -6.24 -1.08 0.13 -1.67 -3.43 132.00 124.16 1uwu h PRO 89 Ca 0.18 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.74 1uwu h PRO 89 Cb 0.69 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.72 1uwu h PRO 89 CO 0.79 0.10 -0.66 -0.80 -0.23 0.00 0.00 178.00 177.20 1uwu s ASN 90 N -5.97 4.44 0.63 1.44 -0.87 -1.26 -4.84 114.94 108.50 1uwu s ASN 90 Ca -0.02 -0.66 -0.17 0.00 -1.57 0.00 0.00 52.86 50.44 1uwu s ASN 90 Cb 0.12 -0.79 -0.02 0.00 -0.02 0.00 0.00 41.25 40.54 1uwu s ASN 90 CO 0.57 0.02 1.17 -2.84 -2.57 0.00 0.00 177.10 173.45 1uwu s PRO 91 N -3.54 2.83 0.34 -0.60 0.02 -1.26 -5.03 135.00 127.76 1uwu s PRO 91 Ca 0.30 1.67 0.01 0.00 0.02 0.00 0.00 61.00 63.01 1uwu s PRO 91 Cb -0.07 -1.93 -0.03 0.00 0.02 0.00 0.00 34.50 32.49 1uwu s PRO 91 CO 0.19 -1.28 0.53 -0.51 -0.33 0.00 0.00 177.00 175.60 1uwu s LEU 92 N -4.42 4.04 0.34 -5.54 1.43 -1.26 -5.06 118.68 108.21 1uwu s LEU 92 Ca 0.74 0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 53.92 1uwu s LEU 92 Cb -0.27 -3.23 -0.11 0.00 0.03 0.00 0.00 46.19 42.61 1uwu s LEU 92 CO 0.36 -0.29 1.52 -2.65 0.23 0.00 0.00 176.35 175.53 1uwu n PRO 93 N -1.75 2.66 -1.70 1.29 -0.01 -1.26 -4.91 135.00 129.32 1uwu n PRO 93 Ca -0.05 0.94 -0.43 0.00 -0.01 0.00 0.00 63.50 63.95 1uwu n PRO 93 Cb 0.56 -2.69 -0.03 0.00 -0.01 0.00 0.00 33.50 31.34 1uwu n PRO 93 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 175.50 178.38 1uwu n ARG 94 N 1.13 2.74 0.00 -0.52 0.00 -1.26 -5.20 116.66 113.56 1uwu n ARG 94 Ca 0.04 0.99 0.00 0.00 -0.00 0.00 0.00 57.85 58.89 1uwu n ARG 94 Cb 0.38 -2.86 0.00 0.00 -0.00 0.00 0.00 32.46 29.98 1uwu n ARG 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1uwu n PRO 95 N 4.69 0.00 0.00 2.89 -0.04 -1.26 -5.26 135.00 136.03 1uwu n PRO 95 Ca 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1uwu n PRO 95 Cb 0.35 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.81 1uwu n PRO 95 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1uwu n PHE 98 N 0.00 0.00 -3.59 0.54 7.35 -1.26 -5.15 117.46 115.35 1uwu n PHE 98 Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 1uwu n PHE 98 Cb 0.00 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 39.73 1uwu n PHE 98 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1uwu s ASP 99 N 0.00 5.68 0.48 -2.13 2.15 -1.26 -4.96 116.67 116.62 1uwu s ASP 99 Ca 0.00 -1.52 0.32 0.00 0.43 0.00 0.00 52.55 51.78 1uwu s ASP 99 Cb 0.00 -2.00 1.58 0.00 -0.30 0.00 0.00 42.92 42.20 1uwu s ASP 99 CO 0.00 -0.56 1.98 -0.33 -0.17 0.00 0.00 175.17 176.09 1uwu h GLU 100 N 8.43 0.00 0.00 4.34 3.07 -2.01 -2.17 114.58 126.25 1uwu h GLU 100 Ca -0.23 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.63 1uwu h GLU 100 Cb 1.08 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.99 1uwu h GLU 100 CO 0.77 0.00 -0.02 0.66 -1.40 0.00 0.00 179.01 179.02 1uwu h SER 101 N 0.00 0.00 -2.98 1.42 4.64 -2.01 -3.44 113.55 111.18 1uwu h SER 101 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1uwu h SER 101 Cb 0.20 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1uwu h SER 101 CO 0.00 0.02 0.75 -0.54 -0.87 0.00 0.00 176.83 176.19 1uwu s LYS 102 N -3.27 4.31 0.09 4.77 3.01 -0.82 -4.95 119.74 122.88 1uwu s LYS 102 Ca 0.06 2.04 -0.19 0.00 -1.01 0.00 0.00 55.97 56.88 1uwu s LYS 102 Cb 0.06 -3.34 -0.08 0.00 -1.01 0.00 0.00 37.83 33.46 1uwu s LYS 102 CO 0.65 -0.47 1.55 0.37 0.51 0.00 0.00 175.35 177.97 1uwu h GLN 103 N 7.10 0.41 -5.98 1.68 4.15 -1.89 -3.45 115.11 117.14 1uwu h GLN 103 Ca -0.41 -0.11 -0.61 0.00 0.77 0.00 0.00 58.65 58.28 1uwu h GLN 103 Cb 1.20 -0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.79 1uwu h GLN 103 CO 0.87 0.55 -0.29 -0.51 -1.93 0.00 0.00 178.83 177.52 1uwu s ASP 104 N -5.85 6.64 -0.45 -0.69 1.11 -1.26 -5.00 116.67 111.16 1uwu s ASP 104 Ca -0.14 0.76 -0.00 0.00 0.18 0.00 0.00 52.55 53.35 1uwu s ASP 104 Cb 0.08 -2.17 0.12 0.00 1.07 0.00 0.00 42.92 42.02 1uwu s ASP 104 CO 0.74 0.27 0.22 -0.69 1.18 0.00 0.00 175.17 176.89 1uwu s VAL 105 N -1.23 3.02 -0.21 -1.27 1.01 -1.26 -4.96 120.40 115.51 1uwu s VAL 105 Ca 0.27 -2.50 0.21 0.00 0.00 0.00 0.00 61.98 59.95 1uwu s VAL 105 Cb -0.14 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 1uwu s VAL 105 CO 0.14 -0.72 0.99 0.71 0.00 0.00 0.00 175.10 176.22 1uwu h THR 106 N 6.07 0.13 -2.68 3.92 1.35 -1.97 -3.47 112.91 116.27 1uwu h THR 106 Ca -0.08 -1.26 -0.11 0.00 -0.55 0.00 0.00 66.41 64.41 1uwu h THR 106 Cb 1.00 1.64 -0.22 0.00 -1.73 0.00 0.00 68.15 68.84 1uwu h THR 106 CO 0.66 0.07 -0.17 -0.70 -0.25 0.00 0.00 175.52 175.13 1uwu s GLU 107 N -3.25 0.61 -0.20 4.72 2.12 -1.26 -4.89 118.70 116.55 1uwu s GLU 107 Ca -0.01 0.41 -0.02 0.00 0.36 0.00 0.00 54.97 55.71 1uwu s GLU 107 Cb 0.09 0.29 0.06 0.00 0.26 0.00 0.00 34.13 34.83 1uwu s GLU 107 CO 0.80 -0.11 0.02 0.08 -0.54 0.00 0.00 175.26 175.50 1uwu s VAL 108 N -0.24 0.70 -0.13 3.70 1.01 -1.26 -5.12 120.40 119.06 1uwu s VAL 108 Ca -0.04 -0.68 -0.29 0.00 0.00 0.00 0.00 61.98 60.96 1uwu s VAL 108 Cb -0.03 -1.17 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 1uwu s VAL 108 CO 0.02 -0.20 1.14 -0.70 0.00 0.00 0.00 175.10 175.37 1uwu s GLU 109 N 1.78 4.32 -0.06 2.72 2.12 -1.26 -4.90 118.70 123.42 1uwu s GLU 109 Ca -0.02 1.55 0.02 0.00 0.36 0.00 0.00 54.97 56.88 1uwu s GLU 109 Cb -0.17 -3.62 0.02 0.00 0.26 0.00 0.00 34.13 30.61 1uwu s GLU 109 CO -0.08 -0.52 -0.09 0.42 -0.54 0.00 0.00 175.26 174.45 1uwu s ILE 110 N 2.70 0.89 0.38 -3.70 1.01 -1.26 -5.07 121.20 116.14 1uwu s ILE 110 Ca 0.52 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.88 1uwu s ILE 110 Cb -0.21 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 1uwu s ILE 110 CO 0.16 0.31 0.12 0.54 0.00 0.00 0.00 174.94 176.07 1uwu s ASN 111 N 0.85 2.50 0.30 3.58 2.20 -1.26 -5.03 114.94 118.07 1uwu s ASN 111 Ca -0.12 -1.61 -0.02 0.00 -0.94 0.00 0.00 52.86 50.18 1uwu s ASN 111 Cb -0.15 0.39 0.44 0.00 -2.00 0.00 0.00 41.25 39.94 1uwu s ASN 111 CO 0.01 -0.88 1.94 -0.33 -2.94 0.00 0.00 177.10 174.91 1uwu h GLU 112 N 1.91 1.03 -0.32 3.55 5.08 -1.99 -1.18 114.58 122.66 1uwu h GLU 112 Ca -0.36 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 57.90 1uwu h GLU 112 Cb 1.26 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1uwu h GLU 112 CO 0.58 0.72 0.14 -0.91 -1.00 0.00 0.00 179.01 178.53 1uwu h ASN 113 N 1.05 0.43 -0.61 1.42 2.35 -1.99 -1.34 115.58 116.89 1uwu h ASN 113 Ca 0.28 -0.15 0.07 0.00 -0.55 0.00 0.00 56.30 55.94 1uwu h ASN 113 Cb -0.05 -0.11 -0.06 0.00 0.05 0.00 0.00 38.32 38.15 1uwu h ASN 113 CO -0.05 0.46 0.30 -0.08 -1.65 0.00 0.00 177.43 176.40 1uwu h GLU 114 N 0.37 0.53 -0.70 0.81 4.22 -1.82 -1.79 114.58 116.20 1uwu h GLU 114 Ca 0.11 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 59.51 1uwu h GLU 114 Cb 0.16 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1uwu h GLU 114 CO -0.01 0.35 0.42 -0.07 -2.18 0.00 0.00 179.01 177.53 1uwu h LEU 115 N 0.55 0.85 -1.12 1.64 3.38 -0.94 -1.12 115.31 118.55 1uwu h LEU 115 Ca 0.28 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 1uwu h LEU 115 Cb 0.24 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1uwu h LEU 115 CO -0.22 0.66 -0.06 0.11 0.09 0.00 0.00 178.44 179.03 1uwu h LYS 116 N 0.96 0.55 -0.08 1.13 1.57 -0.87 -0.49 116.57 119.33 1uwu h LYS 116 Ca 0.25 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1uwu h LYS 116 Cb -0.03 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1uwu h LYS 116 CO -0.05 0.62 -0.01 0.00 -0.57 0.00 0.00 179.45 179.44 1uwu h ARG 117 N 0.52 0.15 -0.89 3.15 3.08 -0.86 -2.96 114.38 116.57 1uwu h ARG 117 Ca 0.10 -0.05 0.15 0.00 0.07 0.00 0.00 59.98 60.25 1uwu h ARG 117 Cb 0.43 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.37 1uwu h ARG 117 CO 0.02 0.44 0.49 -0.07 -1.07 0.00 0.00 179.97 179.78 1uwu h LEU 118 N -0.15 0.63 -2.11 3.04 3.38 -1.06 0.08 115.31 119.11 1uwu h LEU 118 Ca 0.02 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.16 1uwu h LEU 118 Cb 0.38 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1uwu h LEU 118 CO 0.01 0.27 0.26 -0.78 0.09 0.00 0.00 178.44 178.28 1uwu h ASP 119 N 0.70 0.00 0.55 -0.43 3.58 -0.92 -0.09 116.42 119.81 1uwu h ASP 119 Ca 0.49 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.88 1uwu h ASP 119 Cb 0.67 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 1uwu h ASP 119 CO -0.35 0.00 -0.28 -0.33 -2.88 0.00 0.00 179.24 175.40 1uwu h GLU 120 N 0.00 0.00 0.00 0.28 5.08 -0.95 -3.11 114.58 115.88 1uwu h GLU 120 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1uwu h GLU 120 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1uwu h GLU 120 CO -0.00 0.28 -0.87 0.66 -1.00 0.00 0.00 179.01 178.08 1uwu n TYR 121 N -3.74 0.13 -2.53 4.33 4.01 -0.06 -4.97 117.16 114.33 1uwu n TYR 121 Ca -0.01 0.04 -0.38 0.00 -0.16 0.00 0.00 57.90 57.39 1uwu n TYR 121 Cb 0.38 -0.28 -0.04 0.00 -0.31 0.00 0.00 39.34 39.09 1uwu n TYR 121 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1uwu s ALA 122 N -3.10 3.21 -0.19 -0.72 0.00 -1.13 -4.80 121.76 115.02 1uwu s ALA 122 Ca 0.07 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 1uwu s ALA 122 Cb 0.16 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 1uwu s ALA 122 CO 0.79 -0.18 1.27 1.21 0.00 0.00 0.00 175.76 178.84 1uwu s ASN 123 N -1.31 6.90 0.11 0.00 3.84 0.59 -4.92 114.94 120.15 1uwu s ASN 123 Ca 0.53 1.60 -0.04 0.00 0.21 0.00 0.00 52.86 55.15 1uwu s ASN 123 Cb -0.26 -2.54 -0.15 0.00 -0.55 0.00 0.00 41.25 37.75 1uwu s ASN 123 CO 0.32 -0.82 1.25 0.11 -2.79 0.00 0.00 177.10 175.17 1uwu h LYS 124 N 8.39 0.37 -0.42 0.43 1.79 -1.93 -1.99 116.57 123.21 1uwu h LYS 124 Ca -0.26 -0.46 -0.01 0.00 -2.18 0.00 0.00 60.65 57.74 1uwu h LYS 124 Cb 1.10 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.88 1uwu h LYS 124 CO 0.98 1.14 0.21 -0.44 -1.08 0.00 0.00 179.45 180.27 1uwu h ASP 125 N 0.18 0.55 -0.20 0.86 3.32 -1.97 0.44 116.42 119.59 1uwu h ASP 125 Ca -0.10 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 1uwu h ASP 125 Cb 1.71 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 1uwu h ASP 125 CO 0.18 0.51 0.09 0.00 -1.72 0.00 0.00 179.24 178.30 1uwu h ALA 126 N 1.06 0.26 -0.32 3.45 0.00 -1.84 0.09 119.26 121.95 1uwu h ALA 126 Ca 0.15 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1uwu h ALA 126 Cb 0.10 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1uwu h ALA 126 CO -0.02 -0.17 0.17 -0.07 0.00 0.00 0.00 179.25 179.17 1uwu h LEU 127 N 0.19 0.27 -0.73 0.00 3.38 -1.20 -1.00 115.31 116.23 1uwu h LEU 127 Ca 0.07 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1uwu h LEU 127 Cb 0.14 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1uwu h LEU 127 CO -0.01 0.20 0.11 0.78 0.09 0.00 0.00 178.44 179.61 1uwu h ASN 128 N 0.36 1.03 -0.31 -0.43 -0.26 -0.71 -1.41 115.58 113.84 1uwu h ASN 128 Ca 0.13 -0.24 -0.02 0.00 -0.56 0.00 0.00 56.30 55.61 1uwu h ASN 128 Cb 0.03 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.00 1uwu h ASN 128 CO -0.08 1.02 0.13 -0.74 -1.06 0.00 0.00 177.43 176.71 1uwu h HIS 129 N 1.01 0.47 -0.88 1.19 2.76 -0.60 -0.95 115.15 118.15 1uwu h HIS 129 Ca 0.20 -0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.38 1uwu h HIS 129 Cb 0.43 -0.14 -0.06 0.00 1.55 0.00 0.00 27.41 29.19 1uwu h HIS 129 CO 0.03 0.45 0.56 1.88 -1.30 0.00 0.00 177.93 179.55 1uwu h TYR 130 N 0.36 1.05 -0.72 5.26 0.05 -1.03 -0.21 116.97 121.74 1uwu h TYR 130 Ca 0.11 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.95 1uwu h TYR 130 Cb 0.17 -0.34 -0.05 0.00 1.01 0.00 0.00 36.73 37.52 1uwu h TYR 130 CO -0.01 0.58 0.44 -0.09 -1.05 0.00 0.00 178.16 178.03 1uwu h ARG 131 N 1.06 0.82 -0.63 4.88 2.43 -0.91 0.94 114.38 122.97 1uwu h ARG 131 Ca 0.37 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.41 1uwu h ARG 131 Cb 0.07 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1uwu h ARG 131 CO -0.14 0.54 0.11 0.93 -1.51 0.00 0.00 179.97 179.91 1uwu h GLU 132 N 0.85 1.02 0.14 0.20 5.08 0.06 -0.12 114.58 121.82 1uwu h GLU 132 Ca 0.30 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1uwu h GLU 132 Cb 0.07 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1uwu h GLU 132 CO -0.13 0.93 -0.07 0.82 -1.00 0.00 0.00 179.01 179.56 1uwu h ILE 133 N 0.96 0.99 -0.31 3.13 2.04 -0.54 -2.52 117.51 121.26 1uwu h ILE 133 Ca 0.20 -0.61 -0.08 0.00 1.00 0.00 0.00 64.86 65.37 1uwu h ILE 133 Cb 0.40 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 1uwu h ILE 133 CO 0.01 0.14 -0.14 -0.26 0.00 0.00 0.00 178.15 177.90 1uwu h PHE 134 N -0.48 0.59 -0.51 1.37 0.04 -0.68 -0.77 116.94 116.51 1uwu h PHE 134 Ca -0.02 -0.10 -0.08 0.00 2.80 0.00 0.00 57.97 60.57 1uwu h PHE 134 Cb 0.38 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 1uwu h PHE 134 CO 0.02 0.67 0.02 -0.22 -0.60 0.00 0.00 178.31 178.20 1uwu h LYS 135 N 0.50 0.89 -0.75 1.51 1.63 -1.05 -1.17 116.57 118.13 1uwu h LYS 135 Ca 0.09 -0.28 -0.01 0.00 -0.85 0.00 0.00 60.65 59.60 1uwu h LYS 135 Cb 0.54 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.05 1uwu h LYS 135 CO 0.03 0.91 0.41 0.22 -3.45 0.00 0.00 179.45 177.58 1uwu h ASP 136 N 0.76 0.94 0.05 4.20 3.58 -1.08 -0.67 116.42 124.20 1uwu h ASP 136 Ca 0.15 -0.10 0.01 0.00 0.42 0.00 0.00 57.03 57.51 1uwu h ASP 136 Cb 0.50 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1uwu h ASP 136 CO 0.02 0.77 -0.09 0.25 -2.88 0.00 0.00 179.24 177.31 1uwu h LEU 137 N 1.04 -0.26 -1.63 2.28 5.85 -0.85 -2.00 115.31 119.74 1uwu h LEU 137 Ca 0.26 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 1uwu h LEU 137 Cb 0.04 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 1uwu h LEU 137 CO -0.04 -0.14 -0.17 0.11 -0.34 0.00 0.00 178.44 177.86 1uwu h LYS 138 N -0.19 0.02 0.00 1.25 1.79 -1.04 -1.60 116.57 116.81 1uwu h LYS 138 Ca 0.02 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1uwu h LYS 138 Cb 0.21 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1uwu h LYS 138 CO -0.06 0.19 0.00 -1.13 -1.08 0.00 0.00 179.45 177.37 1uwu n SER 139 N -4.33 0.65 -0.54 0.86 3.41 -0.28 -1.65 113.62 111.75 1uwu n SER 139 Ca -0.02 0.70 0.10 0.00 -0.26 0.00 0.00 58.87 59.39 1uwu n SER 139 Cb 0.24 -0.82 0.38 0.00 -0.26 0.00 0.00 64.21 63.74 1uwu n SER 139 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1uwu n ARG 140 N -2.26 1.71 -1.46 4.33 5.12 -0.60 -4.91 116.66 118.59 1uwu n ARG 140 Ca 0.01 -1.07 -0.07 0.00 -1.93 0.00 0.00 57.85 54.79 1uwu n ARG 140 Cb 0.18 -1.39 -0.02 0.00 -1.16 0.00 0.00 32.46 30.06 1uwu n ARG 140 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1uwu n GLY 141 N 1.12 0.67 3.67 -0.13 0.00 -0.66 -4.93 105.19 104.94 1uwu n GLY 141 Ca 0.16 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 1uwu n GLY 141 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwu s LEU 142 N -1.65 4.19 0.35 0.99 1.43 -1.23 -4.75 118.68 118.01 1uwu s LEU 142 Ca 0.00 1.09 -0.28 0.00 -1.03 0.00 0.00 54.13 53.91 1uwu s LEU 142 Cb 0.00 -3.12 -0.09 0.00 0.03 0.00 0.00 46.19 43.00 1uwu s LEU 142 CO 0.00 -0.33 1.22 -0.47 0.23 0.00 0.00 176.35 177.00 1uwu s TYR 143 N 1.90 3.15 -0.24 0.29 5.04 0.13 -4.45 117.35 123.17 1uwu s TYR 143 Ca 0.36 1.52 0.02 0.00 -2.44 0.00 0.00 57.07 56.53 1uwu s TYR 143 Cb -0.17 -3.50 0.05 0.00 0.35 0.00 0.00 41.96 38.69 1uwu s TYR 143 CO 0.13 -1.42 -0.13 0.12 -1.34 0.00 0.00 175.55 172.91 1uwu s PHE 144 N -1.24 3.15 -0.41 4.97 5.36 -1.26 -1.10 117.98 127.45 1uwu s PHE 144 Ca 0.51 -2.14 -0.18 0.00 -0.96 0.00 0.00 56.93 54.17 1uwu s PHE 144 Cb -0.35 -1.94 0.02 0.00 -0.34 0.00 0.00 43.02 40.41 1uwu s PHE 144 CO 0.46 -0.86 0.47 0.42 -1.46 0.00 0.00 175.22 174.25 1uwu s ILE 145 N 1.16 5.05 -0.24 3.12 1.01 -0.25 -1.07 121.20 129.97 1uwu s ILE 145 Ca -0.05 -0.19 -0.18 0.00 0.00 0.00 0.00 60.65 60.23 1uwu s ILE 145 Cb -0.18 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 1uwu s ILE 145 CO -0.07 -0.41 0.51 -0.22 0.00 0.00 0.00 174.94 174.76 1uwu s LEU 146 N 2.25 4.09 -0.09 2.97 2.96 -0.14 -2.60 118.68 128.12 1uwu s LEU 146 Ca 0.14 0.57 -0.04 0.00 -0.22 0.00 0.00 54.13 54.58 1uwu s LEU 146 Cb -0.16 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 1uwu s LEU 146 CO 0.14 -0.24 0.09 0.21 -1.32 0.00 0.00 176.35 175.23 1uwu s ASN 147 N 1.39 5.95 0.16 3.68 2.47 -0.29 -1.03 114.94 127.27 1uwu s ASN 147 Ca 0.22 0.32 0.17 0.00 0.42 0.00 0.00 52.86 53.99 1uwu s ASN 147 Cb -0.15 -1.83 -0.04 0.00 -1.45 0.00 0.00 41.25 37.78 1uwu s ASN 147 CO 0.09 0.37 1.08 0.24 -3.72 0.00 0.00 177.10 175.16 1uwu h MET 148 N 4.85 0.00 -2.61 0.43 2.86 -1.11 -3.13 114.93 116.22 1uwu h MET 148 Ca -0.53 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.01 1uwu h MET 148 Cb 1.21 0.00 -0.26 0.00 0.06 0.00 0.00 31.60 32.61 1uwu h MET 148 CO 0.58 0.31 -0.29 -0.47 1.06 0.00 0.00 176.91 178.10 1uwu s TYR 149 N -3.00 -0.64 -0.34 -0.22 5.04 -1.11 -4.56 117.35 112.52 1uwu s TYR 149 Ca -0.00 1.34 0.16 0.00 -2.44 0.00 0.00 57.07 56.13 1uwu s TYR 149 Cb 0.08 0.28 0.44 0.00 0.35 0.00 0.00 41.96 43.11 1uwu s TYR 149 CO 0.78 -0.36 1.03 1.58 -1.34 0.00 0.00 175.55 177.24 1uwu n HIS 150 N 4.37 0.28 0.00 4.97 -0.00 -1.26 -0.74 115.22 122.83 1uwu n HIS 150 Ca -0.22 -2.64 0.00 0.00 -0.00 0.00 0.00 57.72 54.86 1uwu n HIS 150 Cb 0.55 0.07 0.00 0.00 -0.00 0.00 0.00 29.99 30.61 1uwu n HIS 150 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 1uwu n TRP 151 N -0.15 0.00 -1.86 1.57 8.01 -1.26 -4.88 117.44 118.87 1uwu n TRP 151 Ca 0.07 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.85 1uwu n TRP 151 Cb 0.82 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.10 1uwu n TRP 151 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.69 174.54 1uwu s PRO 152 N 0.00 4.17 0.10 -0.99 0.02 -1.26 -4.96 135.00 132.08 1uwu s PRO 152 Ca 0.00 2.49 0.06 0.00 0.02 0.00 0.00 61.00 63.57 1uwu s PRO 152 Cb 0.00 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.44 1uwu s PRO 152 CO 0.00 -0.54 -0.07 -0.51 -0.33 0.00 0.00 177.00 175.55 1uwu s LEU 153 N -0.81 3.16 0.33 -5.54 1.43 -1.26 -4.80 118.68 111.18 1uwu s LEU 153 Ca 0.60 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 53.08 1uwu s LEU 153 Cb -0.46 -1.94 -0.12 0.00 0.03 0.00 0.00 46.19 43.70 1uwu s LEU 153 CO 0.50 0.18 1.33 -2.65 0.23 0.00 0.00 176.35 175.93 1uwu n PRO 154 N 0.66 2.17 -0.05 1.29 -0.02 -1.26 -1.24 135.00 136.56 1uwu n PRO 154 Ca -0.13 0.76 0.23 0.00 -2.02 0.00 0.00 63.50 62.35 1uwu n PRO 154 Cb 0.52 -2.37 0.71 0.00 -0.02 0.00 0.00 33.50 32.34 1uwu n PRO 154 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1uwu h LEU 155 N 2.91 0.00 -0.09 2.45 3.38 -1.28 0.73 115.31 123.42 1uwu h LEU 155 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1uwu h LEU 155 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1uwu h LEU 155 CO 0.65 0.00 0.00 -2.67 0.09 0.00 0.00 178.44 176.51 1uwu n TRP 156 N -4.21 0.17 0.21 1.13 4.27 -1.26 -2.08 117.44 115.67 1uwu n TRP 156 Ca 0.12 0.06 0.08 0.00 -3.89 0.00 0.00 57.50 53.88 1uwu n TRP 156 Cb 0.74 -0.60 -0.12 0.00 -1.36 0.00 0.00 31.31 29.97 1uwu n TRP 156 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1uwu n LEU 157 N -1.65 0.22 -3.36 5.67 4.77 0.21 -4.82 117.00 118.04 1uwu n LEU 157 Ca 0.05 -0.14 -0.02 0.00 -0.03 0.00 0.00 56.01 55.86 1uwu n LEU 157 Cb 0.25 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 1uwu n LEU 157 CO 0.20 0.05 0.10 -2.28 -1.33 0.00 0.00 177.39 174.13 1uwu s HIS 158 N -2.98 -1.25 -0.51 -1.77 2.46 -0.88 -0.52 115.29 109.84 1uwu s HIS 158 Ca -0.03 1.56 -0.15 0.00 0.47 0.00 0.00 55.06 56.92 1uwu s HIS 158 Cb 0.11 0.43 0.11 0.00 -0.13 0.00 0.00 32.58 33.10 1uwu s HIS 158 CO 0.69 -0.75 0.45 0.34 -2.47 0.00 0.00 174.74 172.99 1uwu s ASP 159 N 2.75 6.11 0.44 9.88 -1.08 -0.66 -4.30 116.67 129.81 1uwu s ASP 159 Ca 0.11 -1.65 0.24 0.00 -0.52 0.00 0.00 52.55 50.73 1uwu s ASP 159 Cb -0.14 -2.18 0.85 0.00 -1.46 0.00 0.00 42.92 39.99 1uwu s ASP 159 CO -0.18 -0.77 1.79 1.55 0.52 0.00 0.00 175.17 178.08 1uwu h PRO 160 N 8.79 0.00 -0.15 4.34 0.13 -1.87 -3.00 132.00 140.25 1uwu h PRO 160 Ca -0.28 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 1uwu h PRO 160 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1uwu h PRO 160 CO 0.96 0.21 -0.49 0.82 -0.23 0.00 0.00 178.00 179.27 1uwu h ILE 161 N 0.00 1.34 -0.39 -3.56 1.08 -1.92 -0.09 117.51 113.97 1uwu h ILE 161 Ca -0.00 -1.76 0.07 0.00 -0.39 0.00 0.00 64.86 62.78 1uwu h ILE 161 Cb 0.80 2.03 -0.06 0.00 -3.07 0.00 0.00 36.82 36.52 1uwu h ILE 161 CO 0.03 0.54 -0.00 -0.09 -0.69 0.00 0.00 178.15 177.93 1uwu h ARG 162 N 0.24 0.10 -0.46 2.37 2.43 -1.87 -1.43 114.38 115.76 1uwu h ARG 162 Ca -0.02 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 1uwu h ARG 162 Cb 1.11 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 1uwu h ARG 162 CO 0.10 0.06 -0.24 0.28 -1.51 0.00 0.00 179.97 178.67 1uwu h VAL 163 N 0.10 1.27 -0.91 0.20 2.07 -1.46 -1.81 116.25 115.70 1uwu h VAL 163 Ca 0.19 -1.40 0.16 0.00 0.82 0.00 0.00 66.70 66.47 1uwu h VAL 163 Cb 0.27 1.17 -0.08 0.00 -1.52 0.00 0.00 31.29 31.14 1uwu h VAL 163 CO -0.32 0.48 0.59 -0.09 0.02 0.00 0.00 177.57 178.25 1uwu h ARG 164 N 0.83 0.65 0.00 1.57 2.43 -0.69 0.63 114.38 119.79 1uwu h ARG 164 Ca 0.10 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1uwu h ARG 164 Cb 0.82 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1uwu h ARG 164 CO 0.07 0.43 0.00 0.54 -1.51 0.00 0.00 179.97 179.50 1uwu n ARG 165 N -4.58 0.73 -0.67 0.20 1.74 -0.57 -4.84 116.66 108.66 1uwu n ARG 165 Ca 0.19 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1uwu n ARG 165 Cb 0.52 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 1uwu n ARG 165 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwu n GLY 166 N 1.00 0.59 3.39 -0.13 0.00 0.21 -5.03 105.19 105.23 1uwu n GLY 166 Ca 0.19 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1uwu n GLY 166 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uwu s ASP 167 N -2.59 5.91 -0.18 1.61 -1.08 -0.73 -4.96 116.67 114.65 1uwu s ASP 167 Ca 0.00 -1.09 0.16 0.00 -0.52 0.00 0.00 52.55 51.09 1uwu s ASP 167 Cb 0.00 -2.09 0.76 0.00 -1.46 0.00 0.00 42.92 40.14 1uwu s ASP 167 CO 0.00 -0.47 1.67 0.49 0.52 0.00 0.00 175.17 177.38 1uwu n PHE 168 N 5.07 1.79 0.91 -5.34 3.72 -1.26 -3.70 117.46 118.64 1uwu n PHE 168 Ca -0.11 -0.65 0.12 0.00 -0.05 0.00 0.00 57.45 56.76 1uwu n PHE 168 Cb 0.45 -0.39 0.28 0.00 -0.94 0.00 0.00 39.48 38.88 1uwu n PHE 168 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1uwu n THR 169 N 0.84 0.08 -2.51 4.37 -2.24 -1.26 -4.91 114.28 108.65 1uwu n THR 169 Ca 0.26 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1uwu n THR 169 Cb 1.04 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 1uwu n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uwu n GLY 170 N 1.46 1.87 3.67 3.38 0.00 -1.26 -5.03 105.19 109.29 1uwu n GLY 170 Ca 0.05 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 1uwu n GLY 170 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1uwu s PRO 171 N 0.23 4.19 -0.01 1.61 0.02 -1.26 -4.90 135.00 134.87 1uwu s PRO 171 Ca 0.00 2.27 0.11 0.00 0.02 0.00 0.00 61.00 63.40 1uwu s PRO 171 Cb 0.00 -3.82 0.33 0.00 0.02 0.00 0.00 34.50 31.03 1uwu s PRO 171 CO 0.00 -0.79 1.27 0.43 -0.33 0.00 0.00 177.00 177.58 1uwu n SER 172 N 6.43 3.01 0.00 2.53 7.64 -1.15 -1.65 113.62 130.43 1uwu n SER 172 Ca 0.17 -2.04 0.00 0.00 1.01 0.00 0.00 58.87 58.00 1uwu n SER 172 Cb 0.42 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 1uwu n SER 172 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uwu n GLY 173 N 0.52 3.21 0.00 0.23 0.00 0.32 -2.24 105.19 107.23 1uwu n GLY 173 Ca 0.12 -0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.00 1uwu n GLY 173 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1uwu n TRP 174 N 13.83 0.00 1.12 1.61 7.02 -1.26 -1.47 117.44 138.30 1uwu n TRP 174 Ca 0.00 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.61 1uwu n TRP 174 Cb 0.00 -0.19 0.64 0.00 -2.42 0.00 0.00 31.31 29.35 1uwu n TRP 174 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1uwu n LEU 175 N -1.19 0.00 -4.30 -0.99 4.77 -0.95 -4.29 117.00 110.05 1uwu n LEU 175 Ca 0.08 0.40 -0.32 0.00 -0.03 0.00 0.00 56.01 56.14 1uwu n LEU 175 Cb 0.09 -0.40 -0.16 0.00 -2.33 0.00 0.00 43.42 40.62 1uwu n LEU 175 CO 0.09 -0.03 -0.53 -0.55 -1.33 0.00 0.00 177.39 175.05 1uwu s SER 176 N -2.80 3.36 0.44 -1.43 0.15 -0.54 -4.98 113.70 107.90 1uwu s SER 176 Ca 0.19 -0.45 0.30 0.00 0.70 0.00 0.00 55.95 56.70 1uwu s SER 176 Cb 0.18 -1.11 1.53 0.00 -1.71 0.00 0.00 66.02 64.91 1uwu s SER 176 CO 0.47 0.22 1.92 0.71 1.20 0.00 0.00 173.24 177.76 1uwu h THR 177 N 5.19 0.00 -0.75 6.45 1.35 -1.86 -1.72 112.91 121.57 1uwu h THR 177 Ca -0.29 -0.12 0.03 0.00 -0.55 0.00 0.00 66.41 65.47 1uwu h THR 177 Cb 1.19 0.88 -0.05 0.00 -1.73 0.00 0.00 68.15 68.45 1uwu h THR 177 CO 0.49 0.00 0.48 -0.09 -0.25 0.00 0.00 175.52 176.15 1uwu h ARG 178 N 0.00 0.90 -0.50 4.72 9.65 -1.92 0.74 114.38 127.97 1uwu h ARG 178 Ca 0.00 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.78 1uwu h ARG 178 Cb 0.15 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 28.50 1uwu h ARG 178 CO 0.00 0.60 0.14 1.15 2.80 0.00 0.00 179.97 184.66 1uwu h THR 179 N 0.93 1.21 -0.23 0.20 2.02 -1.55 0.13 112.91 115.63 1uwu h THR 179 Ca 0.30 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 1uwu h THR 179 Cb 0.01 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1uwu h THR 179 CO -0.11 0.27 0.06 0.58 0.37 0.00 0.00 175.52 176.70 1uwu h VAL 180 N 0.74 1.20 0.08 3.16 2.07 -1.34 0.67 116.25 122.83 1uwu h VAL 180 Ca 0.17 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 1uwu h VAL 180 Cb 0.25 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1uwu h VAL 180 CO -0.01 0.21 -0.04 0.22 0.02 0.00 0.00 177.57 177.98 1uwu h TYR 181 N 0.20 -0.10 -0.40 1.57 5.03 -0.53 -2.46 116.97 120.28 1uwu h TYR 181 Ca 0.07 -0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.29 1uwu h TYR 181 Cb 0.26 0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.56 1uwu h TYR 181 CO 0.01 -0.01 -0.13 0.93 -1.32 0.00 0.00 178.16 177.64 1uwu h GLU 182 N -0.16 0.72 -0.47 1.82 4.39 -0.65 -2.81 114.58 117.42 1uwu h GLU 182 Ca -0.01 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 59.45 1uwu h GLU 182 Cb 0.13 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1uwu h GLU 182 CO 0.02 0.81 0.29 0.35 -1.16 0.00 0.00 179.01 179.32 1uwu h PHE 183 N 0.65 0.61 -0.33 4.33 3.57 -0.72 0.12 116.94 125.15 1uwu h PHE 183 Ca 0.11 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.68 1uwu h PHE 183 Cb 0.59 -0.20 -0.07 0.00 2.79 0.00 0.00 35.95 39.06 1uwu h PHE 183 CO 0.03 0.41 -0.12 0.00 -2.23 0.00 0.00 178.31 176.40 1uwu h ALA 184 N 1.14 0.17 -0.70 2.41 0.00 -1.30 -0.14 119.26 120.84 1uwu h ALA 184 Ca 0.17 0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1uwu h ALA 184 Cb -0.03 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1uwu h ALA 184 CO -0.03 -0.50 0.30 0.00 0.00 0.00 0.00 179.25 179.02 1uwu h ARG 185 N -0.05 1.04 -0.38 0.00 3.08 -1.21 -1.93 114.38 114.93 1uwu h ARG 185 Ca 0.17 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1uwu h ARG 185 Cb 0.30 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1uwu h ARG 185 CO -0.37 0.85 0.24 0.35 -1.07 0.00 0.00 179.97 179.97 1uwu h PHE 186 N 1.00 0.49 -0.03 3.04 3.57 -0.36 -0.52 116.94 124.13 1uwu h PHE 186 Ca 0.24 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.74 1uwu h PHE 186 Cb 0.19 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1uwu h PHE 186 CO 0.01 0.33 0.01 0.77 -2.23 0.00 0.00 178.31 177.20 1uwu h SER 187 N 0.50 0.04 -0.60 0.41 0.02 -0.83 -0.67 113.55 112.42 1uwu h SER 187 Ca 0.14 -0.23 0.11 0.00 -0.84 0.00 0.00 61.79 60.97 1uwu h SER 187 Cb -0.03 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.42 1uwu h SER 187 CO -0.03 0.26 0.16 0.00 -1.14 0.00 0.00 176.83 176.08 1uwu h ALA 188 N 0.78 0.74 -0.37 3.77 0.00 -1.31 -1.75 119.26 121.12 1uwu h ALA 188 Ca 0.01 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1uwu h ALA 188 Cb 0.23 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1uwu h ALA 188 CO 0.00 -0.27 0.19 -0.92 0.00 0.00 0.00 179.25 178.25 1uwu h TYR 189 N 0.31 0.36 -0.50 0.00 3.20 -0.65 0.09 116.97 119.77 1uwu h TYR 189 Ca 0.31 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.12 1uwu h TYR 189 Cb 0.44 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1uwu h TYR 189 CO -0.22 0.19 -0.01 0.82 -1.64 0.00 0.00 178.16 177.30 1uwu h ILE 190 N 0.39 1.26 -0.40 1.81 1.08 -0.77 -0.98 117.51 119.91 1uwu h ILE 190 Ca 0.15 -1.09 0.03 0.00 -0.39 0.00 0.00 64.86 63.56 1uwu h ILE 190 Cb 0.05 0.98 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 1uwu h ILE 190 CO -0.10 0.38 0.20 0.00 -0.69 0.00 0.00 178.15 177.95 1uwu h ALA 191 N 0.93 0.49 -0.61 1.87 0.00 -1.10 0.84 119.26 121.68 1uwu h ALA 191 Ca 0.14 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1uwu h ALA 191 Cb 0.53 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 1uwu h ALA 191 CO 0.03 -0.16 0.28 2.35 0.00 0.00 0.00 179.25 181.75 1uwu h TRP 192 N 0.41 0.51 0.04 0.00 7.01 -0.59 -0.48 115.95 122.84 1uwu h TRP 192 Ca 0.17 0.03 -0.22 0.00 2.11 0.00 0.00 58.89 60.98 1uwu h TRP 192 Cb 0.07 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 1uwu h TRP 192 CO -0.10 0.19 -1.01 0.87 -2.79 0.00 0.00 178.44 175.61 1uwu h LYS 193 N 0.51 0.16 -0.01 2.65 1.79 -0.79 -3.39 116.57 117.49 1uwu h LYS 193 Ca 0.29 -0.22 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1uwu h LYS 193 Cb 0.29 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1uwu h LYS 193 CO -0.24 1.03 -0.02 1.19 -1.08 0.00 0.00 179.45 180.33 1uwu n PHE 194 N -3.54 0.00 -0.16 -1.35 3.72 0.25 -4.76 117.46 111.62 1uwu n PHE 194 Ca -0.04 0.00 0.28 0.00 -0.05 0.00 0.00 57.45 57.64 1uwu n PHE 194 Cb 0.90 0.00 0.72 0.00 -0.94 0.00 0.00 39.48 40.16 1uwu n PHE 194 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1uwu h ASP 195 N 1.25 0.00 0.70 4.37 3.58 -1.29 0.52 116.42 125.56 1uwu h ASP 195 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1uwu h ASP 195 Cb 0.27 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 1uwu h ASP 195 CO 0.00 0.00 -0.02 -2.24 -2.88 0.00 0.00 179.24 174.10 1uwu h ASP 196 N 0.00 0.00 0.00 2.28 2.03 -1.86 -3.08 116.42 115.79 1uwu h ASP 196 Ca 0.41 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.67 1uwu h ASP 196 Cb 1.68 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.17 1uwu h ASP 196 CO -0.00 0.02 -2.00 0.18 -1.03 0.00 0.00 179.24 176.40 1uwu n LEU 197 N -3.13 0.00 -4.83 0.15 4.77 0.18 -4.99 117.00 109.14 1uwu n LEU 197 Ca -0.01 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.60 1uwu n LEU 197 Cb 0.24 0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.33 1uwu n LEU 197 CO 0.26 0.06 0.16 -0.69 -1.33 0.00 0.00 177.39 175.85 1uwu s VAL 198 N -3.33 4.94 -0.25 4.08 1.01 -1.11 -4.77 120.40 120.96 1uwu s VAL 198 Ca -0.08 0.89 -0.13 0.00 0.00 0.00 0.00 61.98 62.66 1uwu s VAL 198 Cb 0.12 -3.75 -0.15 0.00 0.00 0.00 0.00 36.38 32.60 1uwu s VAL 198 CO 0.86 0.49 -0.18 0.47 0.00 0.00 0.00 175.10 176.74 1uwu n ASP 199 N 1.53 1.95 -4.11 3.32 8.00 -0.23 -4.95 116.55 122.06 1uwu n ASP 199 Ca -0.11 0.28 -0.09 0.00 0.71 0.00 0.00 54.79 55.58 1uwu n ASP 199 Cb 0.52 -0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 40.72 1uwu n ASP 199 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1uwu s GLU 200 N -2.48 0.66 0.08 -1.24 2.02 -0.81 -4.42 118.70 112.50 1uwu s GLU 200 Ca -0.35 -1.18 0.07 0.00 0.02 0.00 0.00 54.97 53.53 1uwu s GLU 200 Cb 0.12 0.03 -0.04 0.00 0.10 0.00 0.00 34.13 34.34 1uwu s GLU 200 CO 0.54 -0.07 -0.16 0.71 0.02 0.00 0.00 175.26 176.31 1uwu s TYR 201 N -3.47 2.61 -0.01 1.61 2.02 0.13 -0.97 117.35 119.27 1uwu s TYR 201 Ca 0.06 -0.22 0.08 0.00 -0.37 0.00 0.00 57.07 56.61 1uwu s TYR 201 Cb 0.05 -1.42 -0.02 0.00 -0.40 0.00 0.00 41.96 40.16 1uwu s TYR 201 CO -0.07 0.34 -0.24 0.45 -1.57 0.00 0.00 175.55 174.46 1uwu s SER 202 N -1.85 3.24 -0.02 2.29 0.15 -0.20 -0.86 113.70 116.46 1uwu s SER 202 Ca 0.17 -0.45 -0.24 0.00 0.70 0.00 0.00 55.95 56.14 1uwu s SER 202 Cb -0.11 -0.42 -0.20 0.00 -1.71 0.00 0.00 66.02 63.59 1uwu s SER 202 CO 0.09 0.31 1.19 0.71 1.20 0.00 0.00 173.24 176.74 1uwu h THR 203 N 4.41 1.45 -3.68 6.45 1.35 -1.54 -1.58 112.91 119.76 1uwu h THR 203 Ca -0.44 -1.51 -0.07 0.00 -0.55 0.00 0.00 66.41 63.83 1uwu h THR 203 Cb 1.13 2.33 -0.13 0.00 -1.73 0.00 0.00 68.15 69.74 1uwu h THR 203 CO 0.47 0.42 -0.27 0.00 -0.25 0.00 0.00 175.52 175.89 1uwu s MET 204 N -3.81 0.95 -0.28 4.72 0.23 -1.26 -2.77 119.30 117.08 1uwu s MET 204 Ca -0.15 -0.90 -0.09 0.00 -1.03 0.00 0.00 55.69 53.52 1uwu s MET 204 Cb 0.02 0.39 -0.02 0.00 -1.53 0.00 0.00 34.83 33.69 1uwu s MET 204 CO 0.72 -0.33 0.11 1.21 -2.03 0.00 0.00 175.02 174.71 1uwu s ASN 205 N -2.85 5.39 -1.07 -1.18 2.47 0.08 -1.51 114.94 116.27 1uwu s ASN 205 Ca 0.05 -0.32 -0.19 0.00 0.42 0.00 0.00 52.86 52.83 1uwu s ASN 205 Cb 0.04 -1.97 0.01 0.00 -1.45 0.00 0.00 41.25 37.87 1uwu s ASN 205 CO -0.10 -0.10 0.73 -0.62 -3.72 0.00 0.00 177.10 173.29 1uwu n GLU 206 N 4.96 -1.05 0.00 0.43 1.02 0.10 -4.73 120.64 121.37 1uwu n GLU 206 Ca -0.15 0.51 0.13 0.00 -0.02 0.00 0.00 57.16 57.63 1uwu n GLU 206 Cb 0.51 -3.58 0.56 0.00 -0.02 0.00 0.00 31.44 28.91 1uwu n GLU 206 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1uwu h PRO 207 N -1.59 0.25 -0.01 3.49 0.13 -1.89 -2.04 132.00 130.34 1uwu h PRO 207 Ca -0.61 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.45 1uwu h PRO 207 Cb 1.35 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1uwu h PRO 207 CO 0.45 0.16 -0.23 -2.95 -0.23 0.00 0.00 178.00 175.21 1uwu h ASN 208 N 0.26 0.02 -0.14 1.44 -1.07 -1.93 -1.54 115.58 112.62 1uwu h ASN 208 Ca 0.21 -0.00 -0.16 0.00 0.07 0.00 0.00 56.30 56.42 1uwu h ASN 208 Cb 0.51 -0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.76 1uwu h ASN 208 CO -0.04 0.25 -0.55 0.58 0.07 0.00 0.00 177.43 177.73 1uwu h VAL 209 N 0.02 1.33 -0.01 6.14 2.07 -1.74 0.11 116.25 124.17 1uwu h VAL 209 Ca 0.00 -1.82 0.02 0.00 0.82 0.00 0.00 66.70 65.72 1uwu h VAL 209 Cb 0.42 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1uwu h VAL 209 CO 0.03 0.56 -0.13 0.58 0.02 0.00 0.00 177.57 178.63 1uwu h VAL 210 N 0.27 0.66 -0.28 2.57 2.07 -1.28 0.04 116.25 120.30 1uwu h VAL 210 Ca -0.03 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.37 1uwu h VAL 210 Cb 1.19 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1uwu h VAL 210 CO 0.12 0.00 -0.29 1.23 0.02 0.00 0.00 177.57 178.64 1uwu h GLY 211 N -0.22 0.75 0.62 2.17 0.00 -1.35 -2.23 103.07 102.81 1uwu h GLY 211 Ca 0.05 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 1uwu h GLY 211 CO -0.14 0.70 -0.07 -1.33 0.00 0.00 0.00 176.54 175.70 1uwu h GLY 212 N 0.43 -0.20 1.92 4.60 0.00 -0.62 -2.90 103.07 106.30 1uwu h GLY 212 Ca 0.04 0.07 -0.19 0.00 0.00 0.00 0.00 47.33 47.26 1uwu h GLY 212 CO 0.07 -0.07 -0.89 1.41 0.00 0.00 0.00 176.54 177.06 1uwu h LEU 213 N -0.57 0.09 -1.35 3.11 3.38 -1.13 -0.76 115.31 118.07 1uwu h LEU 213 Ca -0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1uwu h LEU 213 Cb 0.44 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1uwu h LEU 213 CO 0.03 0.93 0.15 1.23 0.09 0.00 0.00 178.44 180.87 1uwu h GLY 214 N 2.34 0.63 0.00 0.83 0.00 -1.47 -3.33 103.07 102.08 1uwu h GLY 214 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1uwu h GLY 214 CO 0.12 0.29 0.00 -1.72 0.00 0.00 0.00 176.54 175.24 1uwu n TYR 215 N -4.36 0.00 0.09 5.60 4.01 -1.10 -1.72 117.16 119.68 1uwu n TYR 215 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1uwu n TYR 215 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1uwu n TYR 215 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1uwu n VAL 216 N -0.19 0.62 -1.33 -0.72 0.31 -0.45 -0.21 118.33 116.36 1uwu n VAL 216 Ca 0.00 0.21 -0.38 0.00 -0.01 0.00 0.00 64.34 64.16 1uwu n VAL 216 Cb 0.08 -1.07 -0.02 0.00 -0.91 0.00 0.00 33.84 31.92 1uwu n VAL 216 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uwu n GLY 217 N 2.53 4.09 0.27 2.92 0.00 -0.42 -4.70 105.19 109.87 1uwu n GLY 217 Ca 0.00 -1.43 0.17 0.00 0.00 0.00 0.00 46.02 44.76 1uwu n GLY 217 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1uwu h VAL 218 N 3.32 0.00 0.00 1.61 -1.51 -1.86 -1.55 116.25 116.26 1uwu h VAL 218 Ca 0.75 -0.49 0.00 0.00 -1.23 0.00 0.00 66.70 65.73 1uwu h VAL 218 Cb 0.36 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1uwu h VAL 218 CO 1.78 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 178.41 1uwu n LYS 219 N -3.01 0.20 0.10 5.19 5.02 -1.26 -2.61 118.16 121.78 1uwu n LYS 219 Ca 0.01 0.48 0.11 0.00 -2.02 0.00 0.00 58.31 56.88 1uwu n LYS 219 Cb 0.30 -1.91 0.45 0.00 -0.02 0.00 0.00 35.03 33.84 1uwu n LYS 219 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1uwu n SER 220 N -2.29 0.51 -1.88 4.39 3.41 -0.58 -4.91 113.62 112.27 1uwu n SER 220 Ca 0.01 0.62 -0.12 0.00 -0.26 0.00 0.00 58.87 59.13 1uwu n SER 220 Cb 0.19 -0.73 0.03 0.00 -0.26 0.00 0.00 64.21 63.44 1uwu n SER 220 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwu n GLY 221 N 0.04 0.12 3.83 5.00 0.00 -1.07 -4.71 105.19 108.39 1uwu n GLY 221 Ca 0.03 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1uwu n GLY 221 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uwu s PHE 222 N -3.01 3.42 0.44 1.61 0.40 -1.26 -4.65 117.98 114.92 1uwu s PHE 222 Ca 0.23 0.32 -0.22 0.00 -0.60 0.00 0.00 56.93 56.66 1uwu s PHE 222 Cb -0.10 -1.81 -0.10 0.00 0.51 0.00 0.00 43.02 41.52 1uwu s PHE 222 CO 0.28 0.61 0.99 -1.25 0.70 0.00 0.00 175.22 176.55 1uwu s PRO 223 N -1.56 4.11 0.00 0.24 0.04 -1.26 -1.54 135.00 135.03 1uwu s PRO 223 Ca 0.21 1.26 0.22 0.00 0.04 0.00 0.00 61.00 62.73 1uwu s PRO 223 Cb -0.12 -2.25 0.90 0.00 0.04 0.00 0.00 34.50 33.07 1uwu s PRO 223 CO 0.12 -0.15 1.63 -0.35 0.04 0.00 0.00 177.00 178.29 1uwu n PRO 224 N -0.58 1.54 -3.55 0.56 -0.04 -1.25 -4.45 135.00 127.24 1uwu n PRO 224 Ca 0.07 -0.81 -0.23 0.00 -0.04 0.00 0.00 63.50 62.49 1uwu n PRO 224 Cb 0.53 -1.39 0.08 0.00 -0.04 0.00 0.00 33.50 32.68 1uwu n PRO 224 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uwu n GLY 225 N 1.06 -0.48 3.38 0.55 0.00 -0.59 -3.64 105.19 105.46 1uwu n GLY 225 Ca 0.16 0.22 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 1uwu n GLY 225 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1uwu s TYR 226 N -3.31 3.08 -0.48 1.61 5.04 -1.06 -4.86 117.35 117.37 1uwu s TYR 226 Ca 0.54 -0.74 -0.28 0.00 -2.44 0.00 0.00 57.07 54.14 1uwu s TYR 226 Cb -0.24 -2.22 0.03 0.00 0.35 0.00 0.00 41.96 39.88 1uwu s TYR 226 CO 0.70 -0.48 1.11 -1.17 -1.34 0.00 0.00 175.55 174.36 1uwu s LEU 227 N 1.54 3.69 -0.30 6.97 2.96 -1.26 -4.18 118.68 128.11 1uwu s LEU 227 Ca 0.05 0.40 -0.05 0.00 -0.22 0.00 0.00 54.13 54.31 1uwu s LEU 227 Cb -0.16 -3.49 0.18 0.00 0.50 0.00 0.00 46.19 43.22 1uwu s LEU 227 CO 0.02 -1.23 0.73 -0.55 -1.32 0.00 0.00 176.35 174.00 1uwu s SER 228 N 2.44 -1.11 0.14 3.68 0.15 0.70 -5.02 113.70 114.69 1uwu s SER 228 Ca 0.46 0.78 -0.19 0.00 0.70 0.00 0.00 55.95 57.70 1uwu s SER 228 Cb -0.08 1.96 0.02 0.00 -1.71 0.00 0.00 66.02 66.22 1uwu s SER 228 CO 0.31 -0.21 1.70 -0.26 1.20 0.00 0.00 173.24 175.98 1uwu h PHE 229 N 7.98 -0.09 -0.71 3.44 0.04 -1.93 -0.67 116.94 125.00 1uwu h PHE 229 Ca -0.20 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.62 1uwu h PHE 229 Cb 1.16 0.08 -0.04 0.00 2.20 0.00 0.00 35.95 39.35 1uwu h PHE 229 CO 0.10 -0.09 0.45 1.49 -0.60 0.00 0.00 178.31 179.66 1uwu h GLU 230 N 0.03 0.86 0.00 1.51 4.81 -1.95 -1.49 114.58 118.35 1uwu h GLU 230 Ca 0.13 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.18 1uwu h GLU 230 Cb 0.19 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1uwu h GLU 230 CO -0.26 0.57 -0.62 -0.07 -0.73 0.00 0.00 179.01 177.90 1uwu h LEU 231 N 0.89 0.00 -0.62 1.64 3.38 -1.89 -1.69 115.31 117.01 1uwu h LEU 231 Ca 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1uwu h LEU 231 Cb -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1uwu h LEU 231 CO -0.10 0.62 0.38 -1.28 0.09 0.00 0.00 178.44 178.15 1uwu h SER 232 N 0.00 0.75 -0.29 -0.43 0.87 -0.62 0.51 113.55 114.32 1uwu h SER 232 Ca -0.01 -0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1uwu h SER 232 Cb 1.14 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 1uwu h SER 232 CO 0.08 0.58 0.18 0.03 -0.53 0.00 0.00 176.83 177.17 1uwu h ARG 233 N 0.84 0.40 -0.35 2.24 3.08 -0.97 -1.36 114.38 118.26 1uwu h ARG 233 Ca 0.22 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.26 1uwu h ARG 233 Cb -0.03 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 1uwu h ARG 233 CO -0.04 0.31 0.18 -0.09 -1.07 0.00 0.00 179.97 179.26 1uwu h ARG 234 N 0.37 0.36 -0.72 0.04 2.43 -1.09 -0.43 114.38 115.35 1uwu h ARG 234 Ca 0.11 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1uwu h ARG 234 Cb 0.02 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1uwu h ARG 234 CO -0.02 0.24 0.25 0.00 -1.51 0.00 0.00 179.97 178.93 1uwu h ALA 235 N 1.17 1.09 -0.57 2.80 0.00 -0.69 -1.83 119.26 121.23 1uwu h ALA 235 Ca 0.14 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1uwu h ALA 235 Cb 0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1uwu h ALA 235 CO -0.09 0.63 -0.05 0.52 0.00 0.00 0.00 179.25 180.26 1uwu h MET 236 N 1.05 1.04 -0.41 0.00 2.86 -0.85 -0.88 114.93 117.75 1uwu h MET 236 Ca 0.24 -0.36 0.03 0.00 -2.06 0.00 0.00 59.70 57.54 1uwu h MET 236 Cb 0.25 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1uwu h MET 236 CO -0.01 1.05 0.21 -0.92 1.06 0.00 0.00 176.91 178.30 1uwu h TYR 237 N 0.93 0.39 -0.51 -0.22 3.20 -0.84 -1.16 116.97 118.76 1uwu h TYR 237 Ca 0.16 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 1uwu h TYR 237 Cb 0.62 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 1uwu h TYR 237 CO 0.04 0.21 0.09 -0.91 -1.64 0.00 0.00 178.16 175.95 1uwu h ASN 238 N 0.43 0.82 -0.07 -2.11 2.35 -1.18 -2.44 115.58 113.37 1uwu h ASN 238 Ca 0.17 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.58 1uwu h ASN 238 Cb 0.06 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1uwu h ASN 238 CO -0.11 0.87 -0.18 -0.29 -1.65 0.00 0.00 177.43 176.07 1uwu h ILE 239 N 0.73 1.24 0.15 2.81 2.10 -0.95 0.21 117.51 123.80 1uwu h ILE 239 Ca 0.16 -1.10 -0.01 0.00 1.08 0.00 0.00 64.86 64.99 1uwu h ILE 239 Cb 0.40 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.38 1uwu h ILE 239 CO 0.01 0.35 -0.07 0.40 -1.08 0.00 0.00 178.15 177.76 1uwu h ILE 240 N 0.41 0.88 -0.09 2.19 2.04 -1.08 -0.72 117.51 121.13 1uwu h ILE 240 Ca 0.07 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 1uwu h ILE 240 Cb 0.56 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1uwu h ILE 240 CO 0.04 0.02 -0.35 0.06 0.00 0.00 0.00 178.15 177.92 1uwu h GLN 241 N -0.23 0.18 -0.94 2.37 3.07 -1.13 -1.87 115.11 116.56 1uwu h GLN 241 Ca -0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 58.65 58.65 1uwu h GLN 241 Cb 0.18 -0.01 -0.05 0.00 0.08 0.00 0.00 27.48 27.69 1uwu h GLN 241 CO 0.03 0.51 0.58 0.00 0.09 0.00 0.00 178.83 180.05 1uwu h ALA 242 N 1.49 1.27 -0.15 0.06 0.00 -0.45 0.24 119.26 121.72 1uwu h ALA 242 Ca 0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1uwu h ALA 242 Cb 0.69 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1uwu h ALA 242 CO 0.05 0.65 0.05 1.25 0.00 0.00 0.00 179.25 181.25 1uwu h HIS 243 N 1.28 0.23 -0.35 0.00 -0.00 -0.34 0.68 115.15 116.66 1uwu h HIS 243 Ca 0.34 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.70 1uwu h HIS 243 Cb -0.09 -0.07 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 1uwu h HIS 243 CO 0.00 0.33 0.20 0.00 -0.00 0.00 0.00 177.93 178.46 1uwu h ALA 244 N 0.88 0.43 -0.35 5.26 0.00 -1.05 0.91 119.26 125.34 1uwu h ALA 244 Ca 0.05 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1uwu h ALA 244 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1uwu h ALA 244 CO -0.00 -0.16 -0.20 -0.09 0.00 0.00 0.00 179.25 178.80 1uwu h ARG 245 N 0.40 0.67 -0.39 0.00 9.65 -0.89 -1.63 114.38 122.20 1uwu h ARG 245 Ca 0.14 -0.25 -0.11 0.00 -1.10 0.00 0.00 59.98 58.66 1uwu h ARG 245 Cb 0.01 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 1uwu h ARG 245 CO -0.07 0.83 -0.20 0.00 2.80 0.00 0.00 179.97 183.33 1uwu h ALA 246 N 1.18 0.93 -0.03 2.80 0.00 -0.49 -0.69 119.26 122.95 1uwu h ALA 246 Ca 0.09 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1uwu h ALA 246 Cb 0.67 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1uwu h ALA 246 CO 0.05 0.62 0.02 -0.92 0.00 0.00 0.00 179.25 179.02 1uwu h TYR 247 N 0.66 0.04 -0.85 0.00 5.03 -0.32 -0.25 116.97 121.28 1uwu h TYR 247 Ca 0.10 -0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.41 1uwu h TYR 247 Cb 0.69 -0.01 -0.04 0.00 1.55 0.00 0.00 36.73 38.92 1uwu h TYR 247 CO 0.03 0.08 0.56 -0.44 -1.32 0.00 0.00 178.16 177.07 1uwu h ASP 248 N 0.00 0.99 -0.38 -2.11 3.32 -1.23 -0.13 116.42 116.87 1uwu h ASP 248 Ca 0.01 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1uwu h ASP 248 Cb 0.04 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1uwu h ASP 248 CO -0.00 0.73 0.24 1.23 -1.72 0.00 0.00 179.24 179.72 1uwu h GLY 249 N 1.16 0.55 0.97 2.75 0.00 -0.93 -0.62 103.07 106.95 1uwu h GLY 249 Ca 0.31 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 1uwu h GLY 249 CO -0.07 0.21 0.03 -2.22 0.00 0.00 0.00 176.54 174.49 1uwu h ILE 250 N 0.51 1.26 0.00 2.60 2.04 -0.70 -2.91 117.51 120.31 1uwu h ILE 250 Ca 0.14 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 1uwu h ILE 250 Cb -0.03 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1uwu h ILE 250 CO -0.03 0.34 -0.15 0.11 0.00 0.00 0.00 178.15 178.42 1uwu h LYS 251 N 0.63 0.00 0.00 2.37 1.79 -0.78 0.13 116.57 120.71 1uwu h LYS 251 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1uwu h LYS 251 Cb 0.45 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1uwu h LYS 251 CO 0.02 0.15 0.00 0.66 -1.08 0.00 0.00 179.45 179.20 1uwu h SER 252 N 0.00 0.00 0.00 0.86 4.64 -0.90 -3.22 113.55 114.93 1uwu h SER 252 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uwu h SER 252 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1uwu h SER 252 CO 0.02 0.00 -0.07 0.52 -0.87 0.00 0.00 176.83 176.43 1uwu n VAL 253 N -2.72 0.00 -3.87 0.95 0.31 -0.45 -5.08 118.33 107.47 1uwu n VAL 253 Ca -0.00 -0.34 -0.11 0.00 -0.01 0.00 0.00 64.34 63.88 1uwu n VAL 253 Cb 0.19 0.94 -0.10 0.00 -0.91 0.00 0.00 33.84 33.96 1uwu n VAL 253 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1uwu s SER 254 N -0.82 0.02 0.00 4.52 0.15 0.32 -4.83 113.70 113.05 1uwu s SER 254 Ca 0.00 -0.20 0.24 0.00 0.70 0.00 0.00 55.95 56.69 1uwu s SER 254 Cb 0.00 0.21 0.27 0.00 -1.71 0.00 0.00 66.02 64.79 1uwu s SER 254 CO 0.00 -0.37 1.25 0.29 1.20 0.00 0.00 173.24 175.60 1uwu n LYS 255 N 1.44 0.13 -1.45 5.44 4.76 -1.26 -4.32 118.16 122.90 1uwu n LYS 255 Ca -0.23 -0.09 -0.32 0.00 -2.87 0.00 0.00 58.31 54.81 1uwu n LYS 255 Cb 0.56 -1.50 0.07 0.00 -1.84 0.00 0.00 35.03 32.32 1uwu n LYS 255 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1uwu s LYS 256 N -2.93 2.46 0.34 1.97 1.02 -1.26 -4.97 119.74 116.37 1uwu s LYS 256 Ca 0.12 1.25 -0.28 0.00 0.02 0.00 0.00 55.97 57.07 1uwu s LYS 256 Cb 0.17 -1.92 -0.10 0.00 -0.52 0.00 0.00 37.83 35.46 1uwu s LYS 256 CO 0.73 -1.50 1.34 -2.14 -0.92 0.00 0.00 175.35 172.87 1uwu s PRO 257 N -4.60 4.29 -0.14 -1.68 0.02 -1.26 -4.87 135.00 126.75 1uwu s PRO 257 Ca 0.63 2.29 -0.00 0.00 0.02 0.00 0.00 61.00 63.94 1uwu s PRO 257 Cb -0.18 -3.04 0.03 0.00 0.02 0.00 0.00 34.50 31.33 1uwu s PRO 257 CO 0.51 -0.27 -0.09 0.08 -0.33 0.00 0.00 177.00 176.89 1uwu s VAL 258 N -1.14 1.27 0.00 3.83 1.01 -1.26 -0.69 120.40 123.42 1uwu s VAL 258 Ca 0.50 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1uwu s VAL 258 Cb -0.41 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 34.68 1uwu s VAL 258 CO 0.55 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1uwu n GLY 259 N 4.85 6.69 3.18 4.51 0.00 -0.04 -1.24 105.19 123.14 1uwu n GLY 259 Ca -0.14 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 43.97 1uwu n GLY 259 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uwu s ILE 260 N 0.14 0.11 -0.11 -0.61 2.07 -1.16 -1.42 121.20 120.22 1uwu s ILE 260 Ca 0.00 -0.87 0.01 0.00 -1.41 0.00 0.00 60.65 58.38 1uwu s ILE 260 Cb 0.00 -0.86 -0.02 0.00 0.13 0.00 0.00 42.46 41.71 1uwu s ILE 260 CO 0.00 -0.48 -0.14 -0.63 -1.91 0.00 0.00 174.94 171.78 1uwu s ILE 261 N -2.43 3.02 0.04 2.00 1.01 -0.57 -0.05 121.20 124.21 1uwu s ILE 261 Ca -0.06 -0.69 0.04 0.00 0.00 0.00 0.00 60.65 59.94 1uwu s ILE 261 Cb -0.02 -2.24 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 1uwu s ILE 261 CO -0.03 0.54 -0.11 -0.47 0.00 0.00 0.00 174.94 174.87 1uwu s TYR 262 N 0.07 0.99 -0.19 3.97 5.04 -0.80 0.01 117.35 126.44 1uwu s TYR 262 Ca -0.05 -0.37 -0.27 0.00 -2.44 0.00 0.00 57.07 53.93 1uwu s TYR 262 Cb -0.15 -0.59 -0.00 0.00 0.35 0.00 0.00 41.96 41.57 1uwu s TYR 262 CO 0.04 0.00 0.94 0.00 -1.34 0.00 0.00 175.55 175.20 1uwu s ALA 263 N -0.94 3.58 0.08 3.97 0.00 -1.26 -2.54 121.76 124.65 1uwu s ALA 263 Ca -0.02 0.13 0.09 0.00 0.00 0.00 0.00 51.96 52.17 1uwu s ALA 263 Cb -0.08 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 1uwu s ALA 263 CO 0.01 -0.83 -0.22 -0.80 0.00 0.00 0.00 175.76 173.91 1uwu s ASN 264 N 1.19 3.53 0.06 0.00 0.01 -0.81 -4.99 114.94 113.93 1uwu s ASN 264 Ca 0.42 -0.58 0.05 0.00 -0.71 0.00 0.00 52.86 52.04 1uwu s ASN 264 Cb -0.16 -0.42 -0.03 0.00 0.41 0.00 0.00 41.25 41.06 1uwu s ASN 264 CO 0.10 0.22 -0.14 -0.55 -1.51 0.00 0.00 177.10 175.22 1uwu s SER 265 N -1.68 1.69 -0.30 -1.22 0.15 -1.26 -4.21 113.70 106.85 1uwu s SER 265 Ca 0.14 -0.54 -0.21 0.00 0.70 0.00 0.00 55.95 56.04 1uwu s SER 265 Cb -0.10 -0.08 -0.01 0.00 -1.71 0.00 0.00 66.02 64.12 1uwu s SER 265 CO 0.06 -0.02 0.69 -0.55 1.20 0.00 0.00 173.24 174.61 1uwu s SER 266 N -1.46 6.56 -0.19 5.45 0.15 -1.17 -4.84 113.70 118.19 1uwu s SER 266 Ca -0.00 0.52 -0.23 0.00 0.70 0.00 0.00 55.95 56.94 1uwu s SER 266 Cb -0.09 -2.36 -0.02 0.00 -1.71 0.00 0.00 66.02 61.84 1uwu s SER 266 CO 0.02 -0.53 0.72 -0.36 1.20 0.00 0.00 173.24 174.29 1uwu s PHE 267 N 2.74 3.39 -0.00 3.44 0.08 -1.26 -0.47 117.98 125.89 1uwu s PHE 267 Ca 0.28 1.06 0.07 0.00 0.12 0.00 0.00 56.93 58.46 1uwu s PHE 267 Cb -0.15 -2.90 -0.02 0.00 -0.57 0.00 0.00 43.02 39.39 1uwu s PHE 267 CO 0.12 -0.21 -0.22 -0.65 -0.10 0.00 0.00 175.22 174.16 1uwu s GLN 268 N 2.06 1.71 0.02 0.44 -1.52 0.74 -4.96 119.66 118.15 1uwu s GLN 268 Ca 0.33 -0.82 -0.29 0.00 -1.95 0.00 0.00 55.36 52.63 1uwu s GLN 268 Cb -0.16 -1.68 -0.04 0.00 -0.22 0.00 0.00 33.01 30.91 1uwu s GLN 268 CO 0.11 0.46 0.93 -1.25 -0.25 0.00 0.00 175.29 175.28 1uwu s PRO 269 N -0.64 4.57 0.11 2.91 0.04 -1.26 -0.87 135.00 139.87 1uwu s PRO 269 Ca 0.08 1.33 -0.22 0.00 0.04 0.00 0.00 61.00 62.24 1uwu s PRO 269 Cb -0.08 -3.43 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 1uwu s PRO 269 CO -0.00 0.05 1.71 1.25 0.04 0.00 0.00 177.00 180.04 1uwu h LEU 270 N 6.44 -0.20 -9.33 -3.56 5.85 -1.55 -3.45 115.31 109.50 1uwu h LEU 270 Ca -0.42 0.04 -0.51 0.00 0.84 0.00 0.00 57.88 57.83 1uwu h LEU 270 Cb 1.21 0.11 -0.14 0.00 0.37 0.00 0.00 40.66 42.21 1uwu h LEU 270 CO 0.74 -0.09 -0.61 0.42 -0.34 0.00 0.00 178.44 178.56 1uwu s THR 271 N -6.18 1.45 -1.06 1.05 -4.23 -1.26 -5.03 115.64 100.38 1uwu s THR 271 Ca -0.14 -2.01 0.08 0.00 -1.18 0.00 0.00 61.69 58.44 1uwu s THR 271 Cb 0.09 -2.81 0.08 0.00 1.34 0.00 0.00 72.50 71.19 1uwu s THR 271 CO 0.67 -0.03 1.23 -0.90 -0.54 0.00 0.00 174.62 175.05 1uwu n ASP 272 N -0.75 0.00 -0.91 3.99 5.75 -1.26 -1.48 116.55 121.89 1uwu n ASP 272 Ca -0.03 0.45 0.07 0.00 -0.01 0.00 0.00 54.79 55.27 1uwu n ASP 272 Cb 0.66 -0.47 0.21 0.00 -1.03 0.00 0.00 41.12 40.49 1uwu n ASP 272 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1uwu n LYS 273 N -1.47 2.25 -0.14 0.11 4.01 -1.26 -4.28 118.16 117.38 1uwu n LYS 273 Ca 0.02 -1.67 0.06 0.00 -0.51 0.00 0.00 58.31 56.21 1uwu n LYS 273 Cb 0.09 -1.44 0.13 0.00 -0.51 0.00 0.00 35.03 33.29 1uwu n LYS 273 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1uwu n ASP 274 N 0.76 2.63 -0.09 4.39 8.00 -0.55 -4.72 116.55 126.98 1uwu n ASP 274 Ca 0.15 -2.65 -0.03 0.00 0.71 0.00 0.00 54.79 52.98 1uwu n ASP 274 Cb 0.45 -0.31 0.20 0.00 -0.02 0.00 0.00 41.12 41.44 1uwu n ASP 274 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 1uwu h MET 275 N 0.61 0.74 -0.86 -1.24 2.86 -1.77 -1.97 114.93 113.29 1uwu h MET 275 Ca 0.00 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1uwu h MET 275 Cb 0.92 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.44 1uwu h MET 275 CO 0.04 0.73 0.48 0.93 1.06 0.00 0.00 176.91 180.15 1uwu h GLU 276 N 0.70 1.19 -0.99 1.72 4.39 -1.94 -2.71 114.58 116.94 1uwu h GLU 276 Ca 0.14 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.73 1uwu h GLU 276 Cb 0.39 -0.24 -0.05 0.00 -0.10 0.00 0.00 28.75 28.75 1uwu h GLU 276 CO 0.01 0.87 0.65 0.00 -1.16 0.00 0.00 179.01 179.38 1uwu h ALA 277 N 1.26 1.28 -0.28 3.43 0.00 -1.71 -1.49 119.26 121.75 1uwu h ALA 277 Ca 0.30 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1uwu h ALA 277 Cb 0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1uwu h ALA 277 CO -0.05 0.60 0.17 0.28 0.00 0.00 0.00 179.25 180.25 1uwu h VAL 278 N 1.30 1.10 -0.78 0.00 2.07 -1.17 -1.65 116.25 117.12 1uwu h VAL 278 Ca 0.38 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.65 1uwu h VAL 278 Cb -0.09 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 1uwu h VAL 278 CO -0.10 0.10 0.41 -0.33 0.02 0.00 0.00 177.57 177.67 1uwu h GLU 279 N 0.36 1.09 -0.76 1.57 5.08 -1.09 0.22 114.58 121.07 1uwu h GLU 279 Ca 0.10 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1uwu h GLU 279 Cb 0.01 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.01 1uwu h GLU 279 CO -0.02 0.82 0.29 0.52 -1.00 0.00 0.00 179.01 179.62 1uwu h MET 280 N 1.08 1.13 -0.44 2.33 2.86 -1.15 -0.46 114.93 120.28 1uwu h MET 280 Ca 0.27 -0.21 -0.14 0.00 -2.06 0.00 0.00 59.70 57.57 1uwu h MET 280 Cb 0.05 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 1uwu h MET 280 CO -0.04 0.93 -0.27 0.00 1.06 0.00 0.00 176.91 178.59 1uwu h ALA 281 N 1.21 0.63 -0.71 6.32 0.00 -0.72 -1.22 119.26 124.77 1uwu h ALA 281 Ca 0.25 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1uwu h ALA 281 Cb 0.22 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1uwu h ALA 281 CO -0.02 0.65 0.28 0.93 0.00 0.00 0.00 179.25 181.10 1uwu h GLU 282 N 0.80 1.06 0.40 0.00 5.08 -0.31 -1.23 114.58 120.38 1uwu h GLU 282 Ca 0.09 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1uwu h GLU 282 Cb 0.85 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1uwu h GLU 282 CO 0.08 0.87 -0.26 -0.91 -1.00 0.00 0.00 179.01 177.79 1uwu h ASN 283 N 1.01 -0.65 0.73 1.42 2.35 -1.00 -0.88 115.58 118.56 1uwu h ASN 283 Ca 0.24 0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.99 1uwu h ASN 283 Cb 0.21 0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1uwu h ASN 283 CO -0.02 -0.41 -0.19 0.44 -1.65 0.00 0.00 177.43 175.60 1uwu h ASP 284 N -0.64 0.00 -0.00 5.81 5.19 -1.10 -1.43 116.42 124.25 1uwu h ASP 284 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1uwu h ASP 284 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1uwu h ASP 284 CO 0.04 0.19 -0.20 0.59 -3.12 0.00 0.00 179.24 176.74 1uwu n ASN 285 N -3.46 0.76 0.16 6.45 3.02 -0.48 -4.86 115.26 116.85 1uwu n ASN 285 Ca -0.01 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 1uwu n ASN 285 Cb 0.37 0.65 0.00 0.00 -0.61 0.00 0.00 39.78 40.19 1uwu n ASN 285 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1uwu n ARG 286 N -0.61 0.00 -0.13 3.52 0.63 -0.46 -4.92 116.66 114.69 1uwu n ARG 286 Ca 0.02 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.86 1uwu n ARG 286 Cb 0.13 0.00 0.05 0.00 0.45 0.00 0.00 32.46 33.09 1uwu n ARG 286 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1uwu h TRP 287 N 0.00 1.01 -0.97 -0.14 -0.00 -1.11 -2.56 115.95 112.18 1uwu h TRP 287 Ca 0.00 -0.23 0.11 0.00 -0.00 0.00 0.00 58.89 58.77 1uwu h TRP 287 Cb 0.00 -0.24 -0.08 0.00 -0.00 0.00 0.00 29.16 28.84 1uwu h TRP 287 CO 0.00 1.00 0.62 0.11 -0.00 0.00 0.00 178.44 180.17 1uwu h TRP 288 N 0.78 1.09 0.08 0.49 5.08 -1.51 0.18 115.95 122.14 1uwu h TRP 288 Ca 0.11 0.03 -0.00 0.00 1.08 0.00 0.00 58.89 60.11 1uwu h TRP 288 Cb 0.73 -0.35 0.00 0.00 -3.00 0.00 0.00 29.16 26.54 1uwu h TRP 288 CO 0.04 0.46 -0.04 0.35 -1.28 0.00 0.00 178.44 177.98 1uwu h PHE 289 N 0.97 -0.09 0.00 0.12 3.04 -1.74 -2.83 116.94 116.40 1uwu h PHE 289 Ca 0.47 -0.00 -0.10 0.00 3.98 0.00 0.00 57.97 62.32 1uwu h PHE 289 Cb 0.46 0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.98 1uwu h PHE 289 CO -0.00 0.44 -0.47 0.74 -2.02 0.00 0.00 178.31 177.00 1uwu h PHE 290 N -0.71 0.00 0.00 0.41 0.04 -1.23 -2.14 116.94 113.31 1uwu h PHE 290 Ca -0.01 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.69 1uwu h PHE 290 Cb 0.57 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 1uwu h PHE 290 CO 0.11 0.47 -0.34 -0.44 -0.60 0.00 0.00 178.31 177.52 1uwu h ASP 291 N 0.00 0.00 -0.04 2.17 3.32 -0.71 -1.05 116.42 120.10 1uwu h ASP 291 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1uwu h ASP 291 Cb 1.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 1uwu h ASP 291 CO 0.06 0.34 -0.03 0.00 -1.72 0.00 0.00 179.24 177.89 1uwu h ALA 292 N 1.66 0.06 0.00 3.45 0.00 -1.13 -0.88 119.26 122.42 1uwu h ALA 292 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1uwu h ALA 292 Cb 0.64 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1uwu h ALA 292 CO 0.04 -0.19 -0.43 0.44 0.00 0.00 0.00 179.25 179.12 1uwu n ILE 293 N -4.80 0.16 -0.10 0.00 -5.35 -1.07 -1.47 119.36 106.72 1uwu n ILE 293 Ca -0.08 -0.11 -0.16 0.00 -0.27 0.00 0.00 62.75 62.13 1uwu n ILE 293 Cb 0.25 -0.06 -0.09 0.00 -1.74 0.00 0.00 39.64 38.00 1uwu n ILE 293 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1uwu n ILE 294 N -1.76 1.15 0.60 7.28 5.41 -0.41 -1.42 119.36 130.21 1uwu n ILE 294 Ca 0.05 -0.40 0.06 0.00 1.00 0.00 0.00 62.75 63.47 1uwu n ILE 294 Cb 0.38 -1.37 -0.01 0.00 -0.71 0.00 0.00 39.64 37.93 1uwu n ILE 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1uwu n ARG 295 N -3.32 2.00 -0.97 0.38 1.74 -0.55 -0.69 116.66 115.25 1uwu n ARG 295 Ca -0.37 -0.60 0.00 0.00 -0.77 0.00 0.00 57.85 56.10 1uwu n ARG 295 Cb 0.85 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 31.12 1uwu n ARG 295 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwu n GLY 296 N 1.08 0.42 3.71 -0.13 0.00 -0.54 -4.72 105.19 105.00 1uwu n GLY 296 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1uwu n GLY 296 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uwu s GLU 297 N -0.53 4.46 0.18 1.61 2.02 -0.45 -1.04 118.70 124.94 1uwu s GLU 297 Ca 0.00 1.10 -0.19 0.00 0.02 0.00 0.00 54.97 55.91 1uwu s GLU 297 Cb 0.00 -3.48 0.04 0.00 0.10 0.00 0.00 34.13 30.79 1uwu s GLU 297 CO 0.00 -0.05 0.53 -1.50 0.02 0.00 0.00 175.26 174.26 1uwu s ILE 298 N 1.14 0.03 -0.20 -1.63 2.07 -0.35 -2.81 121.20 119.44 1uwu s ILE 298 Ca 0.43 -0.60 -0.05 0.00 -1.41 0.00 0.00 60.65 59.03 1uwu s ILE 298 Cb -0.19 -1.41 -0.02 0.00 0.13 0.00 0.00 42.46 40.97 1uwu s ILE 298 CO 0.20 -0.12 -0.01 -0.89 -1.91 0.00 0.00 174.94 172.22 1uwu s THR 299 N -3.84 3.88 -0.19 4.00 2.01 -1.26 -0.52 115.64 119.72 1uwu s THR 299 Ca 0.07 -0.34 0.01 0.00 0.31 0.00 0.00 61.69 61.74 1uwu s THR 299 Cb -0.01 -2.75 0.02 0.00 0.01 0.00 0.00 72.50 69.78 1uwu s THR 299 CO -0.06 0.43 -0.18 -0.60 -0.69 0.00 0.00 174.62 173.53 1uwu s ARG 300 N 0.98 2.91 4.01 4.92 3.52 -0.22 -4.90 118.95 130.17 1uwu s ARG 300 Ca 0.01 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 54.73 1uwu s ARG 300 Cb -0.14 -2.65 0.00 0.00 -1.56 0.00 0.00 34.95 30.60 1uwu s ARG 300 CO 0.02 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 174.66 1uwu n GLY 301 N 4.61 0.48 2.04 8.12 0.00 -1.26 -2.07 105.19 117.11 1uwu n GLY 301 Ca -0.20 0.57 -0.05 0.00 0.00 0.00 0.00 46.02 46.35 1uwu n GLY 301 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uwu n ASN 302 N 7.91 2.36 -4.01 1.61 4.13 -1.26 -5.09 115.26 120.91 1uwu n ASN 302 Ca 0.00 -2.73 -0.13 0.00 1.68 0.00 0.00 54.58 53.40 1uwu n ASN 302 Cb 0.00 -0.41 -0.12 0.00 -1.54 0.00 0.00 39.78 37.70 1uwu n ASN 302 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 1uwu s GLU 303 N -2.89 0.44 -0.45 3.52 -1.05 -0.88 -5.13 118.70 112.26 1uwu s GLU 303 Ca 0.36 -0.54 -0.13 0.00 -0.15 0.00 0.00 54.97 54.52 1uwu s GLU 303 Cb 0.36 -0.26 0.07 0.00 -0.44 0.00 0.00 34.13 33.87 1uwu s GLU 303 CO -0.05 0.05 0.33 0.15 0.95 0.00 0.00 175.26 176.70 1uwu s LYS 304 N -1.07 2.84 0.30 -4.83 3.01 -1.26 -1.05 119.74 117.68 1uwu s LYS 304 Ca -0.07 -1.36 0.07 0.00 -1.01 0.00 0.00 55.97 53.61 1uwu s LYS 304 Cb -0.07 -3.98 -0.06 0.00 -1.01 0.00 0.00 37.83 32.70 1uwu s LYS 304 CO 0.00 -0.97 -0.06 0.96 0.51 0.00 0.00 175.35 175.79 1uwu s ILE 305 N 1.57 1.78 -0.16 2.17 -4.36 0.32 -4.95 121.20 117.56 1uwu s ILE 305 Ca 0.04 -2.14 -0.03 0.00 -0.26 0.00 0.00 60.65 58.26 1uwu s ILE 305 Cb -0.23 -2.52 -0.02 0.00 1.25 0.00 0.00 42.46 40.94 1uwu s ILE 305 CO 0.05 -0.26 -0.07 -0.69 0.24 0.00 0.00 174.94 174.21 1uwu s VAL 306 N -2.92 3.50 -0.30 8.37 1.01 -1.26 -1.21 120.40 127.59 1uwu s VAL 306 Ca 0.31 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1uwu s VAL 306 Cb 0.04 -2.53 0.01 0.00 0.00 0.00 0.00 36.38 33.89 1uwu s VAL 306 CO 0.13 0.48 0.10 -0.13 0.00 0.00 0.00 175.10 175.68 1uwu s ARG 307 N 0.66 3.11 0.61 2.72 0.52 -0.21 -4.97 118.95 121.38 1uwu s ARG 307 Ca -0.04 -0.85 0.36 0.00 -0.52 0.00 0.00 55.73 54.68 1uwu s ARG 307 Cb -0.15 -3.42 1.98 0.00 0.52 0.00 0.00 34.95 33.88 1uwu s ARG 307 CO 0.02 -0.46 2.25 -0.44 0.02 0.00 0.00 175.30 176.69 1uwu h ASP 308 N 8.26 0.00 1.60 0.23 3.32 -1.95 -1.33 116.42 126.55 1uwu h ASP 308 Ca -0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1uwu h ASP 308 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1uwu h ASP 308 CO 0.61 0.02 -0.03 -2.24 -1.72 0.00 0.00 179.24 175.88 1uwu h ASP 309 N 0.00 0.00 0.22 6.45 2.03 -1.93 -3.29 116.42 119.91 1uwu h ASP 309 Ca -0.00 -0.01 -0.34 0.00 -0.73 0.00 0.00 57.03 55.95 1uwu h ASP 309 Cb 0.12 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.57 1uwu h ASP 309 CO 0.00 0.00 -2.06 0.18 -1.03 0.00 0.00 179.24 176.34 1uwu n LEU 310 N -2.50 0.98 -4.70 0.15 4.77 -0.55 -4.87 117.00 110.28 1uwu n LEU 310 Ca 0.05 0.19 -0.44 0.00 -0.03 0.00 0.00 56.01 55.78 1uwu n LEU 310 Cb 0.46 0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1uwu n LEU 310 CO 0.32 0.54 1.22 1.17 -1.33 0.00 0.00 177.39 179.31 1uwu n LYS 311 N -3.01 2.42 -1.16 3.23 4.81 -0.91 -3.06 118.16 120.47 1uwu n LYS 311 Ca -0.27 0.87 -0.05 0.00 -0.87 0.00 0.00 58.31 57.98 1uwu n LYS 311 Cb 1.08 -2.64 -0.02 0.00 0.02 0.00 0.00 35.03 33.47 1uwu n LYS 311 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uwu n GLY 312 N 3.11 0.78 2.46 3.14 0.00 0.13 -4.90 105.19 109.91 1uwu n GLY 312 Ca 0.14 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 1uwu n GLY 312 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwu n ARG 313 N -2.50 4.12 -3.59 1.61 3.00 -0.51 -4.83 116.66 113.96 1uwu n ARG 313 Ca -0.05 -3.13 -0.02 0.00 -0.01 0.00 0.00 57.85 54.63 1uwu n ARG 313 Cb 0.22 -2.55 -0.06 0.00 0.00 0.00 0.00 32.46 30.07 1uwu n ARG 313 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1uwu s LEU 314 N -1.93 -0.61 -0.13 0.55 2.96 -1.26 -4.86 118.68 113.40 1uwu s LEU 314 Ca 0.56 0.93 0.17 0.00 -0.22 0.00 0.00 54.13 55.58 1uwu s LEU 314 Cb 0.22 1.83 -0.25 0.00 0.50 0.00 0.00 46.19 48.50 1uwu s LEU 314 CO -0.11 -0.14 0.18 0.47 -1.32 0.00 0.00 176.35 175.43 1uwu n ASP 315 N 4.14 0.60 -3.55 3.68 8.00 -0.37 -5.03 116.55 124.02 1uwu n ASP 315 Ca -0.16 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.23 1uwu n ASP 315 Cb 0.56 1.26 -0.03 0.00 -0.02 0.00 0.00 41.12 42.89 1uwu n ASP 315 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1uwu s TRP 316 N -2.74 -0.37 -0.12 1.24 1.48 -1.26 -4.47 118.94 112.71 1uwu s TRP 316 Ca -0.08 0.10 0.02 0.00 -1.06 0.00 0.00 56.10 55.08 1uwu s TRP 316 Cb 0.08 0.47 -0.00 0.00 -1.16 0.00 0.00 33.47 32.85 1uwu s TRP 316 CO 0.75 -0.85 -0.21 0.42 -4.06 0.00 0.00 176.95 173.01 1uwu s ILE 317 N -3.79 2.30 -0.33 0.66 1.01 -0.87 -2.97 121.20 117.21 1uwu s ILE 317 Ca 0.03 -0.92 -0.18 0.00 0.00 0.00 0.00 60.65 59.58 1uwu s ILE 317 Cb -0.01 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 1uwu s ILE 317 CO -0.10 0.55 0.51 -0.83 0.00 0.00 0.00 174.94 175.06 1uwu s GLY 318 N 0.51 1.82 -0.40 6.18 0.00 0.92 -2.47 107.32 113.89 1uwu s GLY 318 Ca -0.13 -0.92 -0.16 0.00 0.00 0.00 0.00 44.72 43.51 1uwu s GLY 318 CO 0.05 1.25 0.36 0.14 0.00 0.00 0.00 173.10 174.90 1uwu s VAL 319 N 2.37 5.17 -0.15 1.40 1.01 -0.16 -1.90 120.40 128.13 1uwu s VAL 319 Ca 0.19 -0.37 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 1uwu s VAL 319 Cb -0.15 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 1uwu s VAL 319 CO 0.12 -0.29 0.18 0.20 0.00 0.00 0.00 175.10 175.31 1uwu s ASN 320 N 1.75 6.35 -0.16 3.32 -0.87 -1.05 -0.90 114.94 123.37 1uwu s ASN 320 Ca 0.09 0.41 -0.09 0.00 -1.57 0.00 0.00 52.86 51.70 1uwu s ASN 320 Cb -0.18 -2.11 0.06 0.00 -0.02 0.00 0.00 41.25 39.01 1uwu s ASN 320 CO 0.12 0.26 0.39 -0.47 -2.57 0.00 0.00 177.10 174.82 1uwu s TYR 321 N -0.20 -0.58 0.00 2.20 5.04 -0.48 -1.93 117.35 121.40 1uwu s TYR 321 Ca 0.13 1.24 0.00 0.00 -2.44 0.00 0.00 57.07 55.99 1uwu s TYR 321 Cb -0.12 0.24 0.00 0.00 0.35 0.00 0.00 41.96 42.43 1uwu s TYR 321 CO 0.02 -0.34 0.00 0.66 -1.34 0.00 0.00 175.55 174.55 1uwu n TYR 322 N 4.35 0.00 -3.83 4.97 4.02 -1.26 -4.20 117.16 121.21 1uwu n TYR 322 Ca -0.22 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.61 1uwu n TYR 322 Cb 0.54 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.89 1uwu n TYR 322 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1uwu n THR 323 N -2.27 0.00 -2.85 -0.72 5.66 -1.26 -4.73 114.28 108.11 1uwu n THR 323 Ca 0.00 -0.72 -0.19 0.00 -3.05 0.00 0.00 64.05 60.08 1uwu n THR 323 Cb 0.44 0.84 0.04 0.00 -1.55 0.00 0.00 70.33 70.09 1uwu n THR 323 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uwu s ARG 324 N -2.06 2.54 -0.07 1.09 1.70 -1.26 -3.07 118.95 117.81 1uwu s ARG 324 Ca 0.19 -1.15 0.03 0.00 -0.47 0.00 0.00 55.73 54.33 1uwu s ARG 324 Cb -0.04 -2.61 0.01 0.00 -0.57 0.00 0.00 34.95 31.74 1uwu s ARG 324 CO 0.08 -0.62 -0.14 0.99 -1.08 0.00 0.00 175.30 174.53 1uwu s THR 325 N -2.61 1.31 -0.21 4.99 2.01 0.38 -3.85 115.64 117.66 1uwu s THR 325 Ca 0.58 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.87 1uwu s THR 325 Cb -0.09 -1.18 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 1uwu s THR 325 CO 0.37 0.39 0.29 -0.69 -0.69 0.00 0.00 174.62 174.29 1uwu s VAL 326 N 0.60 5.28 0.18 3.82 1.01 -1.26 -0.19 120.40 129.84 1uwu s VAL 326 Ca -0.15 0.49 0.11 0.00 0.00 0.00 0.00 61.98 62.42 1uwu s VAL 326 Cb -0.16 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1uwu s VAL 326 CO 0.05 0.32 -0.23 0.68 0.00 0.00 0.00 175.10 175.91 1uwu s VAL 327 N 1.02 2.23 0.06 2.92 -7.23 -0.04 -0.64 120.40 118.72 1uwu s VAL 327 Ca 0.14 -1.96 0.03 0.00 -1.81 0.00 0.00 61.98 58.39 1uwu s VAL 327 Cb -0.14 -2.04 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 1uwu s VAL 327 CO 0.06 -0.12 -0.10 -1.59 -0.31 0.00 0.00 175.10 173.03 1uwu s LYS 328 N -2.59 0.69 0.30 4.82 -2.85 0.15 -1.40 119.74 118.86 1uwu s LYS 328 Ca 0.18 -0.92 -0.29 0.00 -1.00 0.00 0.00 55.97 53.95 1uwu s LYS 328 Cb -0.08 -0.51 -0.09 0.00 -2.06 0.00 0.00 37.83 35.09 1uwu s LYS 328 CO 0.09 0.10 1.11 -0.98 0.10 0.00 0.00 175.35 175.76 1uwu s ARG 329 N -1.95 4.55 0.17 1.78 1.70 -1.26 -1.42 118.95 122.51 1uwu s ARG 329 Ca -0.04 1.80 0.08 0.00 -0.47 0.00 0.00 55.73 57.11 1uwu s ARG 329 Cb -0.08 -3.10 -0.04 0.00 -0.57 0.00 0.00 34.95 31.16 1uwu s ARG 329 CO 0.01 0.13 -0.17 0.99 -1.08 0.00 0.00 175.30 175.18 1uwu s THR 330 N -1.22 1.74 0.15 4.99 2.01 0.91 -4.86 115.64 119.36 1uwu s THR 330 Ca 0.47 -1.94 -0.29 0.00 0.31 0.00 0.00 61.69 60.24 1uwu s THR 330 Cb -0.31 -1.83 -0.07 0.00 0.01 0.00 0.00 72.50 70.30 1uwu s THR 330 CO 0.40 -0.37 1.50 -0.33 -0.69 0.00 0.00 174.62 175.13 1uwu h GLU 331 N 3.17 -0.01 -0.00 4.92 3.07 -2.00 -2.01 114.58 121.73 1uwu h GLU 331 Ca -0.41 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.45 1uwu h GLU 331 Cb 1.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1uwu h GLU 331 CO 0.53 -0.01 -0.05 1.63 -1.40 0.00 0.00 179.01 179.71 1uwu n LYS 332 N -5.08 0.18 0.00 2.33 5.02 -1.26 -5.01 118.16 114.35 1uwu n LYS 332 Ca 0.02 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1uwu n LYS 332 Cb 0.24 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1uwu n LYS 332 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1uwu n GLY 333 N 1.42 -1.03 3.17 0.72 0.00 -0.76 -5.15 105.19 103.56 1uwu n GLY 333 Ca 0.10 0.44 -0.09 0.00 0.00 0.00 0.00 46.02 46.46 1uwu n GLY 333 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1uwu s TYR 334 N 0.00 0.14 0.03 1.61 -0.85 -1.26 -0.06 117.35 116.96 1uwu s TYR 334 Ca 0.00 -0.48 0.01 0.00 -0.52 0.00 0.00 57.07 56.08 1uwu s TYR 334 Cb 0.00 -0.08 -0.02 0.00 0.38 0.00 0.00 41.96 42.24 1uwu s TYR 334 CO 0.00 -0.46 -0.05 0.14 -1.52 0.00 0.00 175.55 173.66 1uwu s VAL 335 N -3.14 0.33 0.21 -3.49 -7.23 -0.51 -4.86 120.40 101.71 1uwu s VAL 335 Ca -0.01 -0.96 -0.03 0.00 -1.81 0.00 0.00 61.98 59.18 1uwu s VAL 335 Cb 0.02 -0.43 -0.05 0.00 0.56 0.00 0.00 36.38 36.48 1uwu s VAL 335 CO -0.07 -0.42 0.42 -0.94 -0.31 0.00 0.00 175.10 173.79 1uwu s SER 336 N -1.46 6.43 -0.13 4.85 1.04 -1.26 -0.68 113.70 122.49 1uwu s SER 336 Ca -0.12 0.52 -0.03 0.00 0.48 0.00 0.00 55.95 56.80 1uwu s SER 336 Cb -0.10 -2.06 -0.03 0.00 0.10 0.00 0.00 66.02 63.93 1uwu s SER 336 CO -0.00 -0.05 -0.03 -0.76 0.98 0.00 0.00 173.24 173.38 1uwu s LEU 337 N -3.21 3.36 0.76 2.42 1.43 0.19 -4.95 118.68 118.69 1uwu s LEU 337 Ca 0.40 -0.03 -0.14 0.00 -1.03 0.00 0.00 54.13 53.34 1uwu s LEU 337 Cb -0.11 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.38 1uwu s LEU 337 CO 0.28 0.25 1.17 -0.83 0.23 0.00 0.00 176.35 177.46 1uwu s GLY 338 N -0.14 2.13 0.00 -3.19 0.00 -1.26 -3.83 107.32 101.02 1uwu s GLY 338 Ca 0.03 0.73 0.00 0.00 0.00 0.00 0.00 44.72 45.48 1uwu s GLY 338 CO 0.02 1.12 0.00 0.61 0.00 0.00 0.00 173.10 174.86 1uwu n GLY 339 N 0.10 0.77 3.30 0.20 0.00 -0.18 -4.96 105.19 104.42 1uwu n GLY 339 Ca 0.12 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 1uwu n GLY 339 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uwu s TYR 340 N -2.81 1.46 0.00 1.61 2.02 -1.25 -0.71 117.35 117.67 1uwu s TYR 340 Ca 0.00 -1.15 0.00 0.00 -0.37 0.00 0.00 57.07 55.55 1uwu s TYR 340 Cb 0.00 -0.84 0.00 0.00 -0.40 0.00 0.00 41.96 40.72 1uwu s TYR 340 CO 0.00 -0.31 0.00 0.41 -1.57 0.00 0.00 175.55 174.08 1uwu n GLY 341 N -0.41 3.48 0.34 0.71 0.00 -1.25 -1.73 105.19 106.34 1uwu n GLY 341 Ca -0.01 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 46.02 1uwu n GLY 341 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1uwu n HIS 342 N 14.00 0.03 -1.70 1.61 1.44 -1.25 -0.99 115.22 128.35 1uwu n HIS 342 Ca 0.00 -0.02 -0.33 0.00 -2.01 0.00 0.00 57.72 55.37 1uwu n HIS 342 Cb 0.00 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.16 1uwu n HIS 342 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1uwu n GLY 343 N 1.10 5.96 3.79 -1.39 0.00 -0.70 -4.65 105.19 109.30 1uwu n GLY 343 Ca 0.19 -2.47 -0.22 0.00 0.00 0.00 0.00 46.02 43.52 1uwu n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwu s GLU 345 N -3.93 3.60 0.36 0.00 2.02 -1.26 -4.53 118.70 114.95 1uwu s GLU 345 Ca 0.40 2.06 -0.27 0.00 0.02 0.00 0.00 54.97 57.18 1uwu s GLU 345 Cb -0.03 -2.46 -0.09 0.00 0.10 0.00 0.00 34.13 31.64 1uwu s GLU 345 CO 0.25 -0.76 1.20 1.03 0.02 0.00 0.00 175.26 176.99 1uwu s ARG 346 N -2.63 4.26 -1.20 1.61 0.52 -1.26 -3.77 118.95 116.48 1uwu s ARG 346 Ca 0.64 1.95 -0.17 0.00 -0.52 0.00 0.00 55.73 57.63 1uwu s ARG 346 Cb -0.36 -2.90 -0.00 0.00 0.52 0.00 0.00 34.95 32.21 1uwu s ARG 346 CO 0.44 -0.18 0.72 0.09 0.02 0.00 0.00 175.30 176.39 1uwu n ASN 347 N 0.51 -4.23 0.00 0.23 4.13 -0.47 -4.91 115.26 110.53 1uwu n ASN 347 Ca 0.02 -1.03 0.00 0.00 1.68 0.00 0.00 54.58 55.25 1uwu n ASN 347 Cb 0.45 -3.24 0.00 0.00 -1.54 0.00 0.00 39.78 35.45 1uwu n ASN 347 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1uwu n SER 348 N -2.71 0.71 -4.05 6.41 2.88 -1.25 -4.46 113.62 111.16 1uwu n SER 348 Ca -0.14 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.25 1uwu n SER 348 Cb 0.61 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.94 1uwu n SER 348 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1uwu s VAL 349 N 0.67 0.61 0.98 2.46 0.11 -1.26 -0.77 120.40 123.20 1uwu s VAL 349 Ca 0.00 -0.81 -0.16 0.00 -2.93 0.00 0.00 61.98 58.09 1uwu s VAL 349 Cb 0.00 -0.61 0.19 0.00 -1.53 0.00 0.00 36.38 34.43 1uwu s VAL 349 CO 0.00 -0.16 1.24 -0.94 -3.33 0.00 0.00 175.10 171.91 1uwu s SER 350 N -1.06 2.94 0.61 3.54 1.04 0.39 -4.77 113.70 116.40 1uwu s SER 350 Ca -0.04 0.51 0.32 0.00 0.48 0.00 0.00 55.95 57.22 1uwu s SER 350 Cb -0.07 -0.73 1.85 0.00 0.10 0.00 0.00 66.02 67.17 1uwu s SER 350 CO 0.00 -2.86 2.17 -0.07 0.98 0.00 0.00 173.24 173.46 1uwu h LEU 351 N -1.73 0.00 -1.31 2.42 3.38 -1.26 -0.08 115.31 116.73 1uwu h LEU 351 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1uwu h LEU 351 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1uwu h LEU 351 CO 0.45 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.98 1uwu n ALA 352 N -2.23 2.47 -1.08 1.53 0.00 -1.26 -4.93 120.51 115.01 1uwu n ALA 352 Ca -0.01 -0.62 -0.03 0.00 0.00 0.00 0.00 53.44 52.78 1uwu n ALA 352 Cb 0.23 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 1uwu n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwu n GLY 353 N 1.12 0.59 3.84 0.00 0.00 -0.04 -5.03 105.19 105.67 1uwu n GLY 353 Ca 0.14 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 1uwu n GLY 353 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwu s LEU 354 N -0.62 4.45 0.45 0.99 1.43 -1.26 -4.77 118.68 119.34 1uwu s LEU 354 Ca 0.00 0.99 -0.24 0.00 -1.03 0.00 0.00 54.13 53.85 1uwu s LEU 354 Cb 0.00 -2.78 -0.08 0.00 0.03 0.00 0.00 46.19 43.37 1uwu s LEU 354 CO 0.00 0.27 1.28 -2.16 0.23 0.00 0.00 176.35 175.97 1uwu s PRO 355 N -1.33 3.76 0.21 1.29 0.04 -1.26 -0.46 135.00 137.24 1uwu s PRO 355 Ca 0.28 2.08 0.07 0.00 0.04 0.00 0.00 61.00 63.47 1uwu s PRO 355 Cb -0.16 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 31.76 1uwu s PRO 355 CO 0.16 -0.64 0.10 0.95 0.04 0.00 0.00 177.00 177.60 1uwu s THR 356 N -1.34 4.13 0.76 1.26 -4.23 0.05 -2.04 115.64 114.24 1uwu s THR 356 Ca 0.61 -1.38 -0.09 0.00 -1.18 0.00 0.00 61.69 59.65 1uwu s THR 356 Cb -0.36 -3.15 0.17 0.00 1.34 0.00 0.00 72.50 70.50 1uwu s THR 356 CO 0.45 -0.21 1.04 -1.54 -0.54 0.00 0.00 174.62 173.82 1uwu n SER 357 N -0.59 0.45 0.32 3.99 3.41 -0.47 -3.93 113.62 116.78 1uwu n SER 357 Ca -0.08 -1.60 0.16 0.00 -0.26 0.00 0.00 58.87 57.09 1uwu n SER 357 Cb 0.56 -0.76 0.86 0.00 -0.26 0.00 0.00 64.21 64.61 1uwu n SER 357 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uwu h ASP 358 N -1.16 0.00 -0.02 4.04 5.19 -1.64 -0.17 116.42 122.66 1uwu h ASP 358 Ca -0.34 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 1uwu h ASP 358 Cb 1.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.53 1uwu h ASP 358 CO 0.27 0.00 -0.24 0.33 -3.12 0.00 0.00 179.24 176.48 1uwu n PHE 359 N -2.84 0.00 -2.02 4.55 -0.00 -1.26 -4.67 117.46 111.22 1uwu n PHE 359 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.45 57.42 1uwu n PHE 359 Cb 0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.78 1uwu n PHE 359 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1uwu n GLY 360 N 1.19 0.35 3.59 7.13 0.00 -0.20 -4.79 105.19 112.47 1uwu n GLY 360 Ca 0.09 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 1uwu n GLY 360 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uwu s TRP 361 N -2.04 3.13 0.28 1.61 0.51 -1.26 -1.95 118.94 119.23 1uwu s TRP 361 Ca 0.00 -0.04 -0.29 0.00 -2.12 0.00 0.00 56.10 53.65 1uwu s TRP 361 Cb -0.00 -1.95 -0.09 0.00 -0.81 0.00 0.00 33.47 30.62 1uwu s TRP 361 CO 0.00 0.17 1.03 -2.00 -0.51 0.00 0.00 176.95 175.64 1uwu s GLU 362 N 0.00 4.65 -0.39 4.98 2.12 -0.17 -1.37 118.70 128.52 1uwu s GLU 362 Ca 0.03 1.64 -0.29 0.00 0.36 0.00 0.00 54.97 56.71 1uwu s GLU 362 Cb -0.13 -3.11 0.02 0.00 0.26 0.00 0.00 34.13 31.17 1uwu s GLU 362 CO 0.02 0.27 1.22 0.12 -0.54 0.00 0.00 175.26 176.35 1uwu s PHE 363 N -1.26 2.78 -0.43 5.30 2.19 -0.87 -4.65 117.98 121.04 1uwu s PHE 363 Ca 0.45 0.85 0.08 0.00 0.33 0.00 0.00 56.93 58.64 1uwu s PHE 363 Cb -0.28 -4.13 0.27 0.00 -1.31 0.00 0.00 43.02 37.58 1uwu s PHE 363 CO 0.35 -1.41 0.77 0.34 1.83 0.00 0.00 175.22 177.11 1uwu n PHE 364 N 7.77 -1.74 0.28 10.12 7.35 -1.26 -4.82 117.46 135.16 1uwu n PHE 364 Ca 0.14 -2.73 0.15 0.00 -0.76 0.00 0.00 57.45 54.24 1uwu n PHE 364 Cb 0.48 0.63 0.83 0.00 0.35 0.00 0.00 39.48 41.76 1uwu n PHE 364 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1uwu h PRO 365 N 3.70 0.00 -0.28 -7.13 0.13 -1.92 -2.15 132.00 124.35 1uwu h PRO 365 Ca -0.03 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.15 1uwu h PRO 365 Cb 0.98 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 1uwu h PRO 365 CO 0.37 0.07 0.19 1.49 -0.23 0.00 0.00 178.00 179.89 1uwu h GLU 366 N 0.00 0.15 -0.02 0.86 4.57 -1.94 -1.73 114.58 116.47 1uwu h GLU 366 Ca -0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1uwu h GLU 366 Cb 0.24 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 1uwu h GLU 366 CO 0.01 0.10 0.01 0.78 -1.18 0.00 0.00 179.01 178.74 1uwu h GLY 367 N 0.16 0.00 1.08 1.92 0.00 -1.78 -1.68 103.07 102.77 1uwu h GLY 367 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.34 1uwu h GLY 367 CO -0.02 0.00 -0.09 -2.00 0.00 0.00 0.00 176.54 174.43 1uwu h LEU 368 N 0.00 1.02 -0.01 3.11 5.85 -1.51 -0.67 115.31 123.10 1uwu h LEU 368 Ca 0.01 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.39 1uwu h LEU 368 Cb 0.04 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 1uwu h LEU 368 CO -0.00 1.12 -0.02 0.22 -0.34 0.00 0.00 178.44 179.43 1uwu h TYR 369 N 0.89 -0.04 -0.34 1.25 3.20 -1.43 -1.52 116.97 118.98 1uwu h TYR 369 Ca 0.14 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.09 1uwu h TYR 369 Cb 0.66 0.02 -0.08 0.00 1.54 0.00 0.00 36.73 38.87 1uwu h TYR 369 CO 0.05 -0.03 -0.17 0.22 -1.64 0.00 0.00 178.16 176.59 1uwu h ASP 370 N -0.03 -0.58 -0.04 -2.11 3.58 -1.25 -2.08 116.42 113.92 1uwu h ASP 370 Ca 0.01 0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.59 1uwu h ASP 370 Cb 0.04 0.31 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 1uwu h ASP 370 CO -0.03 -0.21 0.01 0.58 -2.88 0.00 0.00 179.24 176.71 1uwu h VAL 371 N -0.12 1.19 -0.54 2.25 2.07 -0.96 -1.45 116.25 118.69 1uwu h VAL 371 Ca 0.17 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.18 1uwu h VAL 371 Cb 0.38 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1uwu h VAL 371 CO -0.41 0.15 0.28 -0.07 0.02 0.00 0.00 177.57 177.54 1uwu h LEU 372 N -0.16 0.41 -0.21 2.57 3.38 -1.20 -2.00 115.31 118.10 1uwu h LEU 372 Ca 0.01 0.03 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 1uwu h LEU 372 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1uwu h LEU 372 CO 0.00 0.28 -0.88 0.71 0.09 0.00 0.00 178.44 178.64 1uwu h THR 373 N 0.54 1.37 -0.52 0.22 1.35 -1.29 -1.27 112.91 113.30 1uwu h THR 373 Ca 0.23 -2.29 -0.00 0.00 -0.55 0.00 0.00 66.41 63.80 1uwu h THR 373 Cb 0.13 2.28 -0.03 0.00 -1.73 0.00 0.00 68.15 68.80 1uwu h THR 373 CO -0.15 0.69 0.31 0.11 -0.25 0.00 0.00 175.52 176.23 1uwu h LYS 374 N 0.30 0.72 -0.27 4.72 1.57 -1.13 -0.15 116.57 122.32 1uwu h LYS 374 Ca -0.07 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1uwu h LYS 374 Cb 1.50 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 1uwu h LYS 374 CO 0.16 0.53 0.16 1.88 -0.57 0.00 0.00 179.45 181.61 1uwu h TYR 375 N 0.70 0.36 -0.13 -1.35 0.05 -1.27 -1.99 116.97 113.34 1uwu h TYR 375 Ca 0.19 -0.00 0.03 0.00 0.05 0.00 0.00 58.73 59.00 1uwu h TYR 375 Cb 0.00 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 37.59 1uwu h TYR 375 CO -0.02 0.28 -0.06 2.35 -1.05 0.00 0.00 178.16 179.66 1uwu h TRP 376 N 0.34 -0.14 0.00 4.88 2.91 -0.93 -1.57 115.95 121.44 1uwu h TRP 376 Ca 0.10 0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.08 1uwu h TRP 376 Cb 0.02 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.75 1uwu h TRP 376 CO -0.04 -0.10 -0.27 -0.91 -1.03 0.00 0.00 178.44 176.09 1uwu h ASN 377 N -0.04 0.00 0.14 2.65 2.35 -0.93 0.15 115.58 119.90 1uwu h ASN 377 Ca 0.07 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.59 1uwu h ASN 377 Cb 0.15 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.55 1uwu h ASN 377 CO -0.16 0.27 -0.99 -0.09 -1.65 0.00 0.00 177.43 174.81 1uwu h ARG 378 N 0.00 0.42 0.00 0.81 2.43 -0.72 -3.42 114.38 113.90 1uwu h ARG 378 Ca -0.00 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.53 1uwu h ARG 378 Cb 0.51 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1uwu h ARG 378 CO 0.04 1.29 -0.70 0.66 -1.51 0.00 0.00 179.97 179.74 1uwu n TYR 379 N -4.00 0.00 -3.46 2.20 4.01 -0.65 -5.02 117.16 110.24 1uwu n TYR 379 Ca -0.14 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.35 1uwu n TYR 379 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.92 1uwu n TYR 379 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1uwu n HIS 380 N -1.18 -1.87 -3.81 -0.72 8.25 0.53 -4.97 115.22 111.45 1uwu n HIS 380 Ca 0.00 0.55 -0.37 0.00 -0.26 0.00 0.00 57.72 57.65 1uwu n HIS 380 Cb 0.00 -3.24 -0.06 0.00 1.12 0.00 0.00 29.99 27.81 1uwu n HIS 380 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1uwu s LEU 381 N -6.66 4.36 0.76 2.41 1.43 -1.26 -5.08 118.68 114.63 1uwu s LEU 381 Ca 0.45 0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 53.88 1uwu s LEU 381 Cb -0.23 -2.12 0.05 0.00 0.03 0.00 0.00 46.19 43.92 1uwu s LEU 381 CO 0.55 0.35 1.18 -0.72 0.23 0.00 0.00 176.35 177.95 1uwu s TYR 382 N -0.75 2.07 0.11 0.29 1.13 -1.26 -4.72 117.35 114.22 1uwu s TYR 382 Ca 0.15 1.63 0.04 0.00 -1.41 0.00 0.00 57.07 57.47 1uwu s TYR 382 Cb -0.12 -3.39 -0.04 0.00 -1.10 0.00 0.00 41.96 37.30 1uwu s TYR 382 CO 0.04 -2.50 -0.10 -1.64 -2.51 0.00 0.00 175.55 168.83 1uwu s MET 383 N -4.11 0.91 0.07 -3.49 -1.94 -0.03 -2.06 119.30 108.66 1uwu s MET 383 Ca 0.72 -1.25 0.09 0.00 -1.71 0.00 0.00 55.69 53.54 1uwu s MET 383 Cb -0.26 -0.55 -0.03 0.00 2.01 0.00 0.00 34.83 36.00 1uwu s MET 383 CO 0.48 0.08 -0.25 0.71 -0.01 0.00 0.00 175.02 176.03 1uwu s TYR 384 N -2.75 2.14 -0.54 -0.03 2.02 -1.03 -0.29 117.35 116.86 1uwu s TYR 384 Ca 0.09 -0.40 -0.26 0.00 -0.37 0.00 0.00 57.07 56.14 1uwu s TYR 384 Cb -0.01 -1.24 0.04 0.00 -0.40 0.00 0.00 41.96 40.35 1uwu s TYR 384 CO -0.00 0.18 1.01 0.08 -1.57 0.00 0.00 175.55 175.25 1uwu s VAL 385 N -0.91 4.30 -0.22 0.71 1.01 -0.23 -0.99 120.40 124.07 1uwu s VAL 385 Ca 0.11 0.55 0.22 0.00 0.00 0.00 0.00 61.98 62.86 1uwu s VAL 385 Cb -0.10 -4.58 -0.02 0.00 0.00 0.00 0.00 36.38 31.69 1uwu s VAL 385 CO 0.03 -1.13 1.02 0.35 0.00 0.00 0.00 175.10 175.37 1uwu n THR 386 N 6.38 0.69 -3.79 3.92 -2.24 -0.08 -0.51 114.28 118.65 1uwu n THR 386 Ca 0.05 -0.57 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 1uwu n THR 386 Cb 0.48 -0.39 -0.11 0.00 -2.10 0.00 0.00 70.33 68.21 1uwu n THR 386 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1uwu s GLU 387 N -3.31 0.31 -0.29 -0.78 2.02 -1.21 -4.48 118.70 110.97 1uwu s GLU 387 Ca -0.01 0.25 -0.15 0.00 0.02 0.00 0.00 54.97 55.08 1uwu s GLU 387 Cb 0.09 0.15 0.12 0.00 0.10 0.00 0.00 34.13 34.60 1uwu s GLU 387 CO 0.79 -0.05 0.84 1.21 0.02 0.00 0.00 175.26 178.08 1uwu s ASN 388 N -0.06 -0.74 0.00 -0.19 3.84 -1.21 -1.38 114.94 115.20 1uwu s ASN 388 Ca -0.02 1.14 0.00 0.00 0.21 0.00 0.00 52.86 54.20 1uwu s ASN 388 Cb -0.02 1.43 0.00 0.00 -0.55 0.00 0.00 41.25 42.10 1uwu s ASN 388 CO 0.01 -0.18 0.00 0.61 -2.79 0.00 0.00 177.10 174.75 1uwu n GLY 389 N 4.23 -1.25 3.22 1.21 0.00 -1.26 -0.92 105.19 110.42 1uwu n GLY 389 Ca -0.18 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 1uwu n GLY 389 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uwu s ILE 390 N -2.87 0.01 -0.41 -0.61 2.07 -1.26 -4.91 121.20 113.22 1uwu s ILE 390 Ca 0.00 -0.09 -0.29 0.00 -1.41 0.00 0.00 60.65 58.86 1uwu s ILE 390 Cb 0.00 -0.49 0.02 0.00 0.13 0.00 0.00 42.46 42.12 1uwu s ILE 390 CO 0.00 -0.05 1.19 0.00 -1.91 0.00 0.00 174.94 174.17 1uwu s ALA 391 N -0.09 3.25 -0.41 1.50 0.00 -1.26 -4.27 121.76 120.48 1uwu s ALA 391 Ca -0.02 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 51.71 1uwu s ALA 391 Cb -0.03 -3.84 0.19 0.00 0.00 0.00 0.00 23.12 19.44 1uwu s ALA 391 CO 0.01 -2.03 0.82 0.34 0.00 0.00 0.00 175.76 174.89 1uwu s ASP 392 N 2.56 -1.07 0.22 0.00 2.15 -0.09 -1.54 116.67 118.90 1uwu s ASP 392 Ca 0.51 -0.83 -0.07 0.00 0.43 0.00 0.00 52.55 52.58 1uwu s ASP 392 Cb -0.11 1.38 0.18 0.00 -0.30 0.00 0.00 42.92 44.07 1uwu s ASP 392 CO 0.27 -0.09 1.76 -0.78 -0.17 0.00 0.00 175.17 176.16 1uwu h ASP 393 N 5.72 1.05 1.42 -0.34 3.58 -1.92 -2.92 116.42 123.02 1uwu h ASP 393 Ca 0.03 -0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.28 1uwu h ASP 393 Cb 1.17 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.95 1uwu h ASP 393 CO 0.01 0.98 0.00 0.00 -2.88 0.00 0.00 179.24 177.34 1uwu h ALA 394 N 1.16 1.00 -0.82 -0.78 0.00 -1.95 -3.47 119.26 114.40 1uwu h ALA 394 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.91 1uwu h ALA 394 Cb 0.31 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1uwu h ALA 394 CO -0.01 0.00 -0.23 -3.47 0.00 0.00 0.00 179.25 175.54 1uwu n ASP 395 N -2.91 -4.16 -0.05 0.00 2.03 -1.10 -4.95 116.55 105.40 1uwu n ASP 395 Ca 0.03 0.20 -0.12 0.00 0.52 0.00 0.00 54.79 55.42 1uwu n ASP 395 Cb 0.40 -2.85 -0.06 0.00 -0.72 0.00 0.00 41.12 37.89 1uwu n ASP 395 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1uwu h TYR 396 N 0.00 0.30 0.00 -0.67 0.05 -1.91 -3.37 116.97 111.37 1uwu h TYR 396 Ca -0.24 -0.05 -0.29 0.00 0.05 0.00 0.00 58.73 58.20 1uwu h TYR 396 Cb 0.86 -0.08 -0.05 0.00 1.01 0.00 0.00 36.73 38.46 1uwu h TYR 396 CO 0.31 0.49 -2.12 1.04 -1.05 0.00 0.00 178.16 176.83 1uwu n GLN 397 N -4.75 0.67 -0.29 4.88 6.02 -1.26 -4.56 117.38 118.08 1uwu n GLN 397 Ca -0.05 0.05 0.06 0.00 -0.01 0.00 0.00 57.00 57.04 1uwu n GLN 397 Cb 0.21 -1.60 0.20 0.00 1.02 0.00 0.00 30.24 30.07 1uwu n GLN 397 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1uwu h ARG 398 N 0.00 0.64 -0.86 -1.09 2.43 -1.93 0.16 114.38 113.73 1uwu h ARG 398 Ca -0.40 -0.04 0.12 0.00 -0.81 0.00 0.00 59.98 58.86 1uwu h ARG 398 Cb 1.99 -0.14 -0.08 0.00 -0.42 0.00 0.00 29.97 31.31 1uwu h ARG 398 CO 0.04 0.42 0.48 -1.35 -1.51 0.00 0.00 179.97 178.05 1uwu h PRO 399 N 0.66 0.73 -0.26 0.20 0.11 -1.80 0.19 132.00 131.81 1uwu h PRO 399 Ca 0.44 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.41 1uwu h PRO 399 Cb 0.56 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 1uwu h PRO 399 CO -0.33 0.48 -0.20 1.88 -0.21 0.00 0.00 178.00 179.62 1uwu h TYR 400 N 0.75 0.71 -0.27 0.65 -1.99 -1.42 -2.45 116.97 112.95 1uwu h TYR 400 Ca 0.44 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.98 1uwu h TYR 400 Cb 0.52 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 1uwu h TYR 400 CO -0.06 0.89 0.17 -0.92 -0.00 0.00 0.00 178.16 178.23 1uwu h TYR 401 N 0.32 0.35 0.47 4.88 5.03 -0.22 -0.37 116.97 127.43 1uwu h TYR 401 Ca 0.05 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.34 1uwu h TYR 401 Cb 0.74 -0.11 0.00 0.00 1.55 0.00 0.00 36.73 38.91 1uwu h TYR 401 CO 0.07 0.25 -0.22 1.25 -1.32 0.00 0.00 178.16 178.18 1uwu h LEU 402 N 0.34 -0.53 -0.57 2.82 5.85 -0.71 -2.25 115.31 120.26 1uwu h LEU 402 Ca 0.10 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1uwu h LEU 402 Cb -0.00 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1uwu h LEU 402 CO -0.02 -0.31 0.28 0.58 -0.34 0.00 0.00 178.44 178.63 1uwu h VAL 403 N -0.72 1.20 -0.55 1.05 2.07 -1.35 -1.54 116.25 116.40 1uwu h VAL 403 Ca -0.06 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 1uwu h VAL 403 Cb 0.53 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1uwu h VAL 403 CO 0.11 0.23 0.22 0.28 0.02 0.00 0.00 177.57 178.42 1uwu h SER 404 N 0.77 0.77 -0.08 0.57 0.02 -1.08 -0.37 113.55 114.14 1uwu h SER 404 Ca 0.20 -0.17 -0.17 0.00 -0.84 0.00 0.00 61.79 60.81 1uwu h SER 404 Cb 0.10 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 1uwu h SER 404 CO -0.03 0.73 -0.53 0.45 -1.14 0.00 0.00 176.83 176.31 1uwu h HIS 405 N 0.76 0.83 -0.63 3.45 -0.00 -1.29 -2.18 115.15 116.09 1uwu h HIS 405 Ca 0.18 -0.29 -0.01 0.00 -0.00 0.00 0.00 60.37 60.26 1uwu h HIS 405 Cb 0.20 -0.16 -0.03 0.00 -0.00 0.00 0.00 27.41 27.42 1uwu h HIS 405 CO 0.01 1.05 0.36 0.28 -0.00 0.00 0.00 177.93 179.62 1uwu h VAL 406 N 0.51 1.19 -0.93 2.45 2.07 -1.02 -1.79 116.25 118.72 1uwu h VAL 406 Ca 0.02 -0.46 0.09 0.00 0.82 0.00 0.00 66.70 67.16 1uwu h VAL 406 Cb 1.09 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.15 1uwu h VAL 406 CO 0.11 0.21 0.58 0.22 0.02 0.00 0.00 177.57 178.70 1uwu h TYR 407 N 0.85 1.05 0.00 1.57 3.20 -0.95 -1.60 116.97 121.10 1uwu h TYR 407 Ca 0.22 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 1uwu h TYR 407 Cb 0.02 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 37.95 1uwu h TYR 407 CO -0.01 0.47 -0.16 1.96 -1.64 0.00 0.00 178.16 178.78 1uwu h GLN 408 N 0.97 0.00 0.06 1.82 1.08 -0.68 -0.27 115.11 118.10 1uwu h GLN 408 Ca 0.44 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.36 1uwu h GLN 408 Cb 0.34 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.79 1uwu h GLN 408 CO -0.23 0.16 -1.14 0.28 -0.95 0.00 0.00 178.83 176.95 1uwu h VAL 409 N 0.00 1.30 -0.99 -0.54 2.07 -0.87 -1.19 116.25 116.02 1uwu h VAL 409 Ca -0.00 -2.39 0.04 0.00 0.82 0.00 0.00 66.70 65.17 1uwu h VAL 409 Cb 0.41 2.55 -0.06 0.00 -1.52 0.00 0.00 31.29 32.66 1uwu h VAL 409 CO 0.02 0.73 0.65 -0.74 0.02 0.00 0.00 177.57 178.25 1uwu h HIS 410 N 0.32 1.21 -0.18 1.57 -0.00 -0.58 -0.97 115.15 116.52 1uwu h HIS 410 Ca -0.15 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.23 1uwu h HIS 410 Cb 1.80 -0.40 -0.01 0.00 -0.00 0.00 0.00 27.41 28.80 1uwu h HIS 410 CO 0.10 0.68 0.03 -0.09 -0.00 0.00 0.00 177.93 178.66 1uwu h ARG 411 N 1.24 0.30 -0.52 5.26 2.43 -0.97 -0.96 114.38 121.16 1uwu h ARG 411 Ca 0.40 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.55 1uwu h ARG 411 Cb 0.04 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.50 1uwu h ARG 411 CO -0.14 0.45 0.23 0.00 -1.51 0.00 0.00 179.97 179.01 1uwu h ALA 412 N 0.83 0.66 0.07 2.80 0.00 -0.75 -0.99 119.26 121.89 1uwu h ALA 412 Ca 0.06 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1uwu h ALA 412 Cb 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1uwu h ALA 412 CO 0.00 -0.14 -0.03 0.82 0.00 0.00 0.00 179.25 179.90 1uwu h ILE 413 N 0.45 0.93 -1.05 0.00 2.04 -1.06 -1.82 117.51 117.00 1uwu h ILE 413 Ca 0.24 -0.01 0.31 0.00 1.00 0.00 0.00 64.86 66.41 1uwu h ILE 413 Cb 0.21 0.94 -0.13 0.00 -0.74 0.00 0.00 36.82 37.09 1uwu h ILE 413 CO -0.20 0.00 0.63 -1.13 0.00 0.00 0.00 178.15 177.45 1uwu h ASN 414 N -0.10 0.50 0.00 1.72 -0.73 -0.75 0.68 115.58 116.90 1uwu h ASN 414 Ca -0.01 0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.32 1uwu h ASN 414 Cb 0.08 0.09 0.00 0.00 0.27 0.00 0.00 38.32 38.76 1uwu h ASN 414 CO 0.02 -0.06 0.00 -1.20 -0.37 0.00 0.00 177.43 175.82 1uwu n SER 415 N -4.90 0.00 0.00 1.15 7.64 -0.41 -4.88 113.62 112.22 1uwu n SER 415 Ca 0.30 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 59.24 1uwu n SER 415 Cb 0.98 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.18 1uwu n SER 415 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uwu n GLY 416 N 0.59 0.81 3.74 0.23 0.00 0.24 -5.09 105.19 105.71 1uwu n GLY 416 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1uwu n GLY 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwu s ALA 417 N -2.09 3.57 -0.85 4.61 0.00 -0.90 -4.96 121.76 121.14 1uwu s ALA 417 Ca 0.00 1.19 -0.21 0.00 0.00 0.00 0.00 51.96 52.94 1uwu s ALA 417 Cb 0.00 -3.51 0.09 0.00 0.00 0.00 0.00 23.12 19.70 1uwu s ALA 417 CO 0.00 -0.61 1.15 0.34 0.00 0.00 0.00 175.76 176.64 1uwu s ASP 418 N 0.36 6.43 -0.15 0.00 -1.08 -1.26 -4.22 116.67 116.76 1uwu s ASP 418 Ca 0.58 -1.49 0.02 0.00 -0.52 0.00 0.00 52.55 51.14 1uwu s ASP 418 Cb -0.38 -2.45 0.01 0.00 -1.46 0.00 0.00 42.92 38.63 1uwu s ASP 418 CO 0.40 -1.32 -0.19 -0.69 0.52 0.00 0.00 175.17 173.88 1uwu s VAL 419 N 3.78 2.29 -1.27 1.11 1.01 -1.26 -0.85 120.40 125.23 1uwu s VAL 419 Ca 0.32 -0.90 0.12 0.00 0.00 0.00 0.00 61.98 61.52 1uwu s VAL 419 Cb -0.08 -1.94 0.04 0.00 0.00 0.00 0.00 36.38 34.40 1uwu s VAL 419 CO -0.02 0.54 0.78 0.54 0.00 0.00 0.00 175.10 176.93 1uwu n ARG 420 N 4.07 1.43 -3.62 2.72 1.74 0.60 -4.96 116.66 118.64 1uwu n ARG 420 Ca -0.20 -0.91 -0.02 0.00 -0.77 0.00 0.00 57.85 55.96 1uwu n ARG 420 Cb 0.52 -1.18 -0.01 0.00 -1.02 0.00 0.00 32.46 30.77 1uwu n ARG 420 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1uwu s GLY 421 N -1.29 -0.36 -0.07 -0.13 0.00 -1.26 -2.40 107.32 101.81 1uwu s GLY 421 Ca 0.12 0.97 -0.01 0.00 0.00 0.00 0.00 44.72 45.80 1uwu s GLY 421 CO 0.23 0.27 -0.02 -0.47 0.00 0.00 0.00 173.10 173.11 1uwu s TYR 422 N -2.57 0.85 -0.23 1.90 6.14 -0.63 -1.07 117.35 121.74 1uwu s TYR 422 Ca 0.12 -0.29 0.02 0.00 0.64 0.00 0.00 57.07 57.56 1uwu s TYR 422 Cb 0.02 -0.86 0.05 0.00 0.42 0.00 0.00 41.96 41.58 1uwu s TYR 422 CO -0.04 -0.34 -0.13 -0.51 0.64 0.00 0.00 175.55 175.17 1uwu s LEU 423 N 1.69 3.00 0.31 6.97 1.02 0.34 -0.70 118.68 131.30 1uwu s LEU 423 Ca 0.01 -1.16 -0.28 0.00 0.02 0.00 0.00 54.13 52.72 1uwu s LEU 423 Cb -0.13 -1.50 -0.09 0.00 0.02 0.00 0.00 46.19 44.49 1uwu s LEU 423 CO -0.05 -0.14 1.08 -2.28 0.02 0.00 0.00 176.35 174.99 1uwu s HIS 424 N 1.18 3.51 -0.41 0.29 2.46 -0.56 -3.32 115.29 118.43 1uwu s HIS 424 Ca -0.05 1.69 -0.15 0.00 0.47 0.00 0.00 55.06 57.03 1uwu s HIS 424 Cb -0.18 -3.24 0.03 0.00 -0.13 0.00 0.00 32.58 29.05 1uwu s HIS 424 CO -0.07 -0.55 0.30 -0.46 -2.47 0.00 0.00 174.74 171.48 1uwu s TRP 425 N -1.28 3.24 0.30 3.88 -0.11 -0.10 -1.76 118.94 123.11 1uwu s TRP 425 Ca 0.48 -0.67 0.03 0.00 1.22 0.00 0.00 56.10 57.16 1uwu s TRP 425 Cb -0.30 -2.62 -0.03 0.00 -1.50 0.00 0.00 33.47 29.03 1uwu s TRP 425 CO 0.38 -0.62 0.28 0.45 -4.62 0.00 0.00 176.95 172.82 1uwu s SER 426 N 1.74 1.12 0.13 5.86 0.15 -0.62 -4.12 113.70 117.96 1uwu s SER 426 Ca 0.05 -1.60 -0.19 0.00 0.70 0.00 0.00 55.95 54.91 1uwu s SER 426 Cb -0.19 0.53 -0.02 0.00 -1.71 0.00 0.00 66.02 64.63 1uwu s SER 426 CO 0.09 -1.05 1.73 0.25 1.20 0.00 0.00 173.24 175.47 1uwu h LEU 427 N 2.26 -0.02 -8.74 3.45 5.85 -1.75 -0.99 115.31 115.37 1uwu h LEU 427 Ca -0.28 0.04 -0.33 0.00 0.84 0.00 0.00 57.88 58.14 1uwu h LEU 427 Cb 1.24 0.06 -0.14 0.00 0.37 0.00 0.00 40.66 42.18 1uwu h LEU 427 CO 0.41 0.02 -0.68 0.00 -0.34 0.00 0.00 178.44 177.85 1uwu s ALA 428 N -6.18 1.55 0.77 1.25 0.00 -1.26 -0.12 121.76 117.77 1uwu s ALA 428 Ca -0.13 -1.62 -0.15 0.00 0.00 0.00 0.00 51.96 50.06 1uwu s ALA 428 Cb 0.10 0.36 0.04 0.00 0.00 0.00 0.00 23.12 23.62 1uwu s ALA 428 CO 0.69 -0.22 1.02 -0.25 0.00 0.00 0.00 175.76 177.00 1uwu n ASP 429 N -0.29 0.52 -1.85 0.00 8.00 -1.00 -4.22 116.55 117.71 1uwu n ASP 429 Ca -0.07 0.61 -0.04 0.00 0.71 0.00 0.00 54.79 56.00 1uwu n ASP 429 Cb 0.63 -1.43 0.01 0.00 -0.02 0.00 0.00 41.12 40.30 1uwu n ASP 429 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1uwu n ASN 430 N -2.29 -1.07 -4.59 -2.24 0.23 -1.26 -4.77 115.26 99.27 1uwu n ASN 430 Ca 0.13 -1.77 -0.43 0.00 -0.53 0.00 0.00 54.58 51.98 1uwu n ASN 430 Cb 0.50 1.78 -0.02 0.00 -2.08 0.00 0.00 39.78 39.96 1uwu n ASN 430 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1uwu s TYR 431 N -5.65 2.75 -1.42 -2.53 5.04 -0.73 -4.66 117.35 110.15 1uwu s TYR 431 Ca 0.08 0.58 -0.11 0.00 -2.44 0.00 0.00 57.07 55.18 1uwu s TYR 431 Cb -0.02 -4.44 0.07 0.00 0.35 0.00 0.00 41.96 37.91 1uwu s TYR 431 CO 0.06 -1.38 2.26 -1.91 -1.34 0.00 0.00 175.55 173.24 1uwu n GLU 432 N 8.02 3.42 0.00 4.97 4.07 -0.05 -4.66 120.64 136.41 1uwu n GLU 432 Ca 0.10 -2.91 0.00 0.00 -0.06 0.00 0.00 57.16 54.29 1uwu n GLU 432 Cb 0.49 -3.02 0.00 0.00 -0.06 0.00 0.00 31.44 28.85 1uwu n GLU 432 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1uwu n TRP 433 N 4.51 0.00 0.30 4.31 7.02 -1.26 -1.01 117.44 131.31 1uwu n TRP 433 Ca 0.54 0.00 0.17 0.00 -1.02 0.00 0.00 57.50 57.19 1uwu n TRP 433 Cb 0.34 0.00 0.72 0.00 -2.42 0.00 0.00 31.31 29.95 1uwu n TRP 433 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1uwu h ALA 434 N -0.49 1.00 0.00 6.99 0.00 -1.84 -2.43 119.26 122.50 1uwu h ALA 434 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1uwu h ALA 434 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uwu h ALA 434 CO 0.00 0.00 -0.10 0.77 0.00 0.00 0.00 179.25 179.92 1uwu h SER 435 N 0.00 0.00 0.00 0.00 0.02 -1.41 -0.76 113.55 111.40 1uwu h SER 435 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1uwu h SER 435 Cb 0.41 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1uwu h SER 435 CO 0.00 0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 1uwu n GLY 436 N 1.28 -1.25 0.03 -3.77 0.00 -0.92 -4.12 105.19 96.46 1uwu n GLY 436 Ca 0.05 -1.26 0.13 0.00 0.00 0.00 0.00 46.02 44.94 1uwu n GLY 436 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uwu n PHE 437 N 0.00 0.25 0.25 1.61 3.72 -1.26 -0.87 117.46 121.16 1uwu n PHE 437 Ca 0.00 0.08 0.13 0.00 -0.05 0.00 0.00 57.45 57.61 1uwu n PHE 437 Cb 0.00 -0.62 0.64 0.00 -0.94 0.00 0.00 39.48 38.55 1uwu n PHE 437 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1uwu h SER 438 N 0.00 0.00 -3.60 4.37 4.64 -1.90 -3.39 113.55 113.67 1uwu h SER 438 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 1uwu h SER 438 Cb 0.54 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.49 1uwu h SER 438 CO 0.00 0.13 0.20 -0.04 -0.87 0.00 0.00 176.83 176.25 1uwu s MET 439 N -3.84 3.31 -0.34 4.77 -1.94 -1.26 -4.92 119.30 115.08 1uwu s MET 439 Ca -0.01 -0.30 -0.06 0.00 -1.71 0.00 0.00 55.69 53.62 1uwu s MET 439 Cb 0.11 -3.95 0.04 0.00 2.01 0.00 0.00 34.83 33.04 1uwu s MET 439 CO 0.59 -1.05 0.10 1.03 -0.01 0.00 0.00 175.02 175.68 1uwu s ARG 440 N 2.97 2.60 0.00 2.03 0.52 -1.26 -4.65 118.95 121.16 1uwu s ARG 440 Ca 0.25 -1.20 0.22 0.00 -0.52 0.00 0.00 55.73 54.47 1uwu s ARG 440 Cb -0.14 -3.45 0.39 0.00 0.52 0.00 0.00 34.95 32.27 1uwu s ARG 440 CO 0.20 -0.68 1.35 1.19 0.02 0.00 0.00 175.30 177.39 1uwu n PHE 441 N 4.80 0.45 -2.68 -0.53 3.01 -1.26 -0.91 117.46 120.33 1uwu n PHE 441 Ca -0.12 -0.24 -0.38 0.00 1.01 0.00 0.00 57.45 57.72 1uwu n PHE 441 Cb 0.44 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.86 1uwu n PHE 441 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1uwu s GLY 442 N -1.44 2.87 0.38 1.37 0.00 -1.26 -1.59 107.32 107.65 1uwu s GLY 442 Ca 0.36 0.63 0.06 0.00 0.00 0.00 0.00 44.72 45.77 1uwu s GLY 442 CO 0.29 1.11 1.96 1.41 0.00 0.00 0.00 173.10 177.88 1uwu h LEU 443 N 3.25 0.44 -9.13 0.66 3.38 -0.91 -3.42 115.31 109.57 1uwu h LEU 443 Ca -0.47 -0.05 -0.67 0.00 0.09 0.00 0.00 57.88 56.78 1uwu h LEU 443 Cb 1.20 -0.11 -0.17 0.00 0.09 0.00 0.00 40.66 41.66 1uwu h LEU 443 CO 0.65 0.44 -0.64 -0.76 0.09 0.00 0.00 178.44 178.22 1uwu s LEU 444 N -9.20 3.44 0.10 1.67 1.43 0.83 -2.19 118.68 114.76 1uwu s LEU 444 Ca -0.08 0.04 -0.22 0.00 -1.03 0.00 0.00 54.13 52.85 1uwu s LEU 444 Cb 0.16 -1.79 -0.07 0.00 0.03 0.00 0.00 46.19 44.52 1uwu s LEU 444 CO 0.75 0.31 0.67 -0.75 0.23 0.00 0.00 176.35 177.56 1uwu s LYS 445 N -0.49 4.38 -0.18 1.70 2.20 0.55 -2.38 119.74 125.52 1uwu s LYS 445 Ca 0.08 0.93 -0.06 0.00 -0.36 0.00 0.00 55.97 56.56 1uwu s LYS 445 Cb -0.12 -3.27 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1uwu s LYS 445 CO 0.02 0.56 0.04 0.08 -0.36 0.00 0.00 175.35 175.69 1uwu s VAL 446 N -0.97 4.47 -0.43 4.02 1.01 -1.26 -0.81 120.40 126.42 1uwu s VAL 446 Ca 0.33 -0.14 -0.24 0.00 0.00 0.00 0.00 61.98 61.92 1uwu s VAL 446 Cb -0.21 -3.01 0.02 0.00 0.00 0.00 0.00 36.38 33.18 1uwu s VAL 446 CO 0.22 0.45 0.82 -0.62 0.00 0.00 0.00 175.10 175.98 1uwu s ASP 447 N 0.55 6.47 0.27 3.32 -1.08 -0.61 -4.94 116.67 120.65 1uwu s ASP 447 Ca 0.01 0.06 0.25 0.00 -0.52 0.00 0.00 52.55 52.35 1uwu s ASP 447 Cb -0.13 -2.41 0.94 0.00 -1.46 0.00 0.00 42.92 39.86 1uwu s ASP 447 CO 0.02 -0.91 1.75 1.88 0.52 0.00 0.00 175.17 178.42 1uwu h TYR 448 N 8.89 0.00 -0.11 -5.34 0.05 -1.93 0.40 116.97 118.94 1uwu h TYR 448 Ca -0.24 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.42 1uwu h TYR 448 Cb 1.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.83 1uwu h TYR 448 CO 0.82 0.00 -0.36 -0.91 -1.05 0.00 0.00 178.16 176.65 1uwu h ASN 449 N 0.00 0.52 0.00 3.88 -0.26 -1.93 -3.38 115.58 114.41 1uwu h ASN 449 Ca 0.00 -0.61 0.00 0.00 -0.56 0.00 0.00 56.30 55.13 1uwu h ASN 449 Cb 0.50 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.61 1uwu h ASN 449 CO 0.00 1.04 -0.83 0.35 -1.06 0.00 0.00 177.43 176.92 1uwu n THR 450 N -4.35 0.00 -0.89 2.81 -2.24 -1.12 -4.97 114.28 103.52 1uwu n THR 450 Ca -0.07 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1uwu n THR 450 Cb 0.52 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1uwu n THR 450 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1uwu n LYS 451 N -1.45 -0.71 -2.00 -0.78 4.76 0.14 -5.01 118.16 113.12 1uwu n LYS 451 Ca 0.02 0.18 -0.39 0.00 -2.87 0.00 0.00 58.31 55.24 1uwu n LYS 451 Cb 0.25 -3.95 0.00 0.00 -1.84 0.00 0.00 35.03 29.49 1uwu n LYS 451 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1uwu s ARG 452 N -0.92 3.84 -0.12 1.97 0.52 -1.23 -4.81 118.95 118.19 1uwu s ARG 452 Ca 0.00 2.19 -0.03 0.00 -0.52 0.00 0.00 55.73 57.37 1uwu s ARG 452 Cb 0.00 -2.68 -0.03 0.00 0.52 0.00 0.00 34.95 32.76 1uwu s ARG 452 CO 0.00 -0.61 0.01 -0.51 0.02 0.00 0.00 175.30 174.21 1uwu s LEU 453 N -2.60 3.57 0.06 2.53 1.43 -1.26 -1.57 118.68 120.83 1uwu s LEU 453 Ca 0.59 0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.84 1uwu s LEU 453 Cb -0.39 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 1uwu s LEU 453 CO 0.49 0.29 -0.20 -0.31 0.23 0.00 0.00 176.35 176.85 1uwu s TYR 454 N -0.35 1.78 -0.35 0.29 1.51 0.01 -4.93 117.35 115.29 1uwu s TYR 454 Ca 0.07 -0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 55.52 1uwu s TYR 454 Cb -0.12 -1.03 0.01 0.00 -0.11 0.00 0.00 41.96 40.71 1uwu s TYR 454 CO 0.02 0.13 0.76 -1.58 -1.11 0.00 0.00 175.55 173.77 1uwu s TRP 455 N -0.93 3.13 0.61 2.71 0.52 -1.26 -0.33 118.94 123.39 1uwu s TRP 455 Ca 0.07 0.57 -0.15 0.00 0.02 0.00 0.00 56.10 56.60 1uwu s TRP 455 Cb -0.09 -3.33 -0.03 0.00 -1.15 0.00 0.00 33.47 28.87 1uwu s TRP 455 CO 0.03 -0.69 1.07 1.03 0.02 0.00 0.00 176.95 178.41 1uwu s ARG 456 N 3.01 3.19 0.44 4.98 0.52 -0.93 -4.92 118.95 125.25 1uwu s ARG 456 Ca 0.30 1.24 0.20 0.00 -0.52 0.00 0.00 55.73 56.95 1uwu s ARG 456 Cb -0.14 -2.01 1.17 0.00 0.52 0.00 0.00 34.95 34.49 1uwu s ARG 456 CO 0.16 -0.92 1.87 -1.35 0.02 0.00 0.00 175.30 175.08 1uwu h PRO 457 N 0.31 0.31 -0.24 3.54 0.11 -1.93 0.60 132.00 134.70 1uwu h PRO 457 Ca -0.47 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.70 1uwu h PRO 457 Cb 1.23 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1uwu h PRO 457 CO 0.57 0.20 0.21 0.77 -0.21 0.00 0.00 178.00 179.54 1uwu h SER 458 N 0.32 0.00 -0.45 -2.05 0.02 -1.89 -1.00 113.55 108.50 1uwu h SER 458 Ca 0.45 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.25 1uwu h SER 458 Cb 1.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 1uwu h SER 458 CO -0.14 0.00 -0.27 0.00 -1.14 0.00 0.00 176.83 175.28 1uwu h ALA 459 N 1.80 0.64 -0.72 3.77 0.00 -1.05 0.21 119.26 123.92 1uwu h ALA 459 Ca 0.12 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1uwu h ALA 459 Cb 0.54 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1uwu h ALA 459 CO -0.00 0.67 0.28 -0.07 0.00 0.00 0.00 179.25 180.13 1uwu h LEU 460 N 0.83 1.01 -0.35 0.00 3.38 -1.24 0.28 115.31 119.22 1uwu h LEU 460 Ca 0.09 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1uwu h LEU 460 Cb 0.86 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1uwu h LEU 460 CO 0.08 0.91 0.23 0.58 0.09 0.00 0.00 178.44 180.33 1uwu h VAL 461 N 1.04 1.09 -0.49 1.22 2.07 -1.12 -1.88 116.25 118.17 1uwu h VAL 461 Ca 0.24 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 1uwu h VAL 461 Cb 0.23 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1uwu h VAL 461 CO -0.02 0.09 0.09 0.22 0.02 0.00 0.00 177.57 177.97 1uwu h TYR 462 N 0.47 0.78 -0.72 1.57 3.20 -0.26 -1.97 116.97 120.04 1uwu h TYR 462 Ca 0.13 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 1uwu h TYR 462 Cb -0.05 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 37.96 1uwu h TYR 462 CO -0.05 0.68 0.23 -0.09 -1.64 0.00 0.00 178.16 177.29 1uwu h ARG 463 N 0.73 1.11 -0.57 1.82 2.43 -0.72 -0.17 114.38 119.01 1uwu h ARG 463 Ca 0.16 -0.23 0.05 0.00 -0.81 0.00 0.00 59.98 59.15 1uwu h ARG 463 Cb 0.31 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 1uwu h ARG 463 CO 0.00 0.94 0.29 0.93 -1.51 0.00 0.00 179.97 180.62 1uwu h GLU 464 N 1.07 0.53 -0.06 0.20 4.39 -0.62 -1.49 114.58 118.60 1uwu h GLU 464 Ca 0.24 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 1uwu h GLU 464 Cb 0.29 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1uwu h GLU 464 CO -0.01 0.35 0.02 0.82 -1.16 0.00 0.00 179.01 179.03 1uwu h ILE 465 N 0.55 1.17 -0.10 3.13 2.04 -0.82 -2.90 117.51 120.57 1uwu h ILE 465 Ca 0.26 -0.51 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 1uwu h ILE 465 Cb 0.18 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 1uwu h ILE 465 CO -0.18 0.14 -0.14 0.00 0.00 0.00 0.00 178.15 177.97 1uwu h ALA 466 N 0.83 0.15 -0.34 1.87 0.00 -0.89 0.19 119.26 121.07 1uwu h ALA 466 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1uwu h ALA 466 Cb 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1uwu h ALA 466 CO -0.00 0.04 0.16 1.79 0.00 0.00 0.00 179.25 181.23 1uwu h THR 467 N -0.16 1.12 0.00 0.00 1.35 -1.39 -2.74 112.91 111.10 1uwu h THR 467 Ca 0.01 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 1uwu h THR 467 Cb 0.69 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1uwu h THR 467 CO 0.03 0.14 -0.83 0.78 -0.25 0.00 0.00 175.52 175.39 1uwu h ASN 468 N 0.47 0.00 -3.62 5.36 2.35 -1.39 -3.48 115.58 115.26 1uwu h ASN 468 Ca 0.12 -0.14 -0.32 0.00 -0.55 0.00 0.00 56.30 55.41 1uwu h ASN 468 Cb 0.06 0.00 0.05 0.00 0.05 0.00 0.00 38.32 38.48 1uwu h ASN 468 CO -0.02 0.07 -0.48 0.61 -1.65 0.00 0.00 177.43 175.96 1uwu n GLY 469 N 1.27 -0.26 3.52 2.83 0.00 0.61 -4.94 105.19 108.22 1uwu n GLY 469 Ca 0.02 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.86 1uwu n GLY 469 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwu s ALA 470 N -3.04 -1.83 -0.40 4.61 0.00 -0.80 -1.37 121.76 118.93 1uwu s ALA 470 Ca 0.24 1.19 -0.29 0.00 0.00 0.00 0.00 51.96 53.10 1uwu s ALA 470 Cb -0.11 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.08 1uwu s ALA 470 CO 0.30 -0.53 1.16 0.42 0.00 0.00 0.00 175.76 177.11 1uwu s ILE 471 N -2.25 4.27 0.79 0.00 1.01 -0.20 -4.19 121.20 120.63 1uwu s ILE 471 Ca -0.00 1.38 -0.11 0.00 0.00 0.00 0.00 60.65 61.92 1uwu s ILE 471 Cb -0.01 -4.45 0.07 0.00 0.01 0.00 0.00 42.46 38.08 1uwu s ILE 471 CO -0.03 -0.74 1.10 0.42 0.00 0.00 0.00 174.94 175.69 1uwu s THR 472 N 4.26 3.06 0.29 2.92 -4.23 -1.26 -1.60 115.64 119.08 1uwu s THR 472 Ca 0.49 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 61.36 1uwu s THR 472 Cb -0.11 -3.12 0.28 0.00 1.34 0.00 0.00 72.50 70.89 1uwu s THR 472 CO 0.25 -0.45 1.88 0.44 -0.54 0.00 0.00 174.62 176.20 1uwu h ASP 473 N -1.05 0.93 0.69 3.99 3.32 -1.95 -2.70 116.42 119.65 1uwu h ASP 473 Ca -0.47 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 1uwu h ASP 473 Cb 1.27 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 1uwu h ASP 473 CO 0.60 0.56 -0.04 1.05 -1.72 0.00 0.00 179.24 179.69 1uwu h GLU 474 N 1.03 0.00 -0.13 3.56 9.09 -2.02 -3.01 114.58 123.10 1uwu h GLU 474 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 1uwu h GLU 474 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 1uwu h GLU 474 CO -0.19 0.04 0.00 0.44 0.05 0.00 0.00 179.01 179.35 1uwu n ILE 475 N -3.21 0.62 0.32 -1.06 -5.35 -1.07 -4.72 119.36 104.90 1uwu n ILE 475 Ca -0.01 -0.81 0.20 0.00 -0.27 0.00 0.00 62.75 61.86 1uwu n ILE 475 Cb 0.26 0.74 1.07 0.00 -1.74 0.00 0.00 39.64 39.97 1uwu n ILE 475 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1uwu h GLU 476 N 1.20 0.00 0.00 6.28 4.81 -1.34 -1.76 114.58 123.77 1uwu h GLU 476 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1uwu h GLU 476 Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1uwu h GLU 476 CO 0.00 0.01 0.00 1.12 -0.73 0.00 0.00 179.01 179.41 1uwu h HIS 477 N 0.00 0.00 0.00 0.92 2.07 -1.84 -2.49 115.15 113.81 1uwu h HIS 477 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1uwu h HIS 477 Cb 0.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.05 1uwu h HIS 477 CO 0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 1uwu n LEU 478 N -2.85 0.00 -3.69 6.12 4.77 -0.66 -4.00 117.00 116.68 1uwu n LEU 478 Ca 0.01 0.31 -0.42 0.00 -0.03 0.00 0.00 56.01 55.88 1uwu n LEU 478 Cb 0.26 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.03 1uwu n LEU 478 CO 0.24 -0.08 2.67 -3.20 -1.33 0.00 0.00 177.39 175.69 1uwu n ASN 479 N -1.31 4.00 -3.78 -1.43 4.05 -0.94 -3.91 115.26 111.95 1uwu n ASN 479 Ca 0.10 -2.81 -0.04 0.00 0.45 0.00 0.00 54.58 52.28 1uwu n ASN 479 Cb 0.19 -1.59 -0.01 0.00 1.23 0.00 0.00 39.78 39.59 1uwu n ASN 479 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1uwu s SER 480 N 3.33 -0.19 0.06 1.20 1.04 -1.26 -4.95 113.70 112.94 1uwu s SER 480 Ca 0.49 -0.46 -0.29 0.00 0.48 0.00 0.00 55.95 56.17 1uwu s SER 480 Cb 0.14 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.76 1uwu s SER 480 CO -0.07 -1.01 0.94 -0.69 0.98 0.00 0.00 173.24 173.40 1uwu s VAL 481 N -3.42 4.66 0.14 5.02 1.01 -1.26 -4.77 120.40 121.79 1uwu s VAL 481 Ca 0.12 2.00 -0.35 0.00 0.00 0.00 0.00 61.98 63.76 1uwu s VAL 481 Cb -0.02 -4.29 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 1uwu s VAL 481 CO 0.03 0.27 1.43 -2.65 0.00 0.00 0.00 175.10 174.18 1uwu n PRO 482 N 3.19 1.66 -1.67 2.72 -0.02 -1.26 -4.86 135.00 134.76 1uwu n PRO 482 Ca 0.03 0.60 -0.47 0.00 -2.02 0.00 0.00 63.50 61.63 1uwu n PRO 482 Cb 0.50 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.66 1uwu n PRO 482 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1uwu n PRO 483 N 2.75 2.08 0.05 0.52 -0.02 -1.26 -4.82 135.00 134.30 1uwu n PRO 483 Ca 0.17 0.76 -0.05 0.00 -2.02 0.00 0.00 63.50 62.36 1uwu n PRO 483 Cb 0.25 -2.54 -0.09 0.00 -0.02 0.00 0.00 33.50 31.10 1uwu n PRO 483 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1uwu h VAL 484 N 4.17 1.16 -0.61 -1.45 -1.51 -1.93 -3.38 116.25 112.70 1uwu h VAL 484 Ca -0.46 -2.80 0.12 0.00 -1.23 0.00 0.00 66.70 62.32 1uwu h VAL 484 Cb 1.26 2.54 -0.09 0.00 -2.13 0.00 0.00 31.29 32.88 1uwu h VAL 484 CO 0.90 0.66 0.12 0.50 -1.23 0.00 0.00 177.57 178.52 1uwu h LYS 485 N 0.00 0.24 0.00 5.19 3.64 -1.98 -1.08 116.57 122.58 1uwu h LYS 485 Ca -0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1uwu h LYS 485 Cb 1.73 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 1uwu h LYS 485 CO 0.09 0.16 0.00 -2.30 -2.27 0.00 0.00 179.45 175.13 1uwu n PRO 486 N -5.14 0.26 -2.96 1.90 -0.02 -1.26 -4.89 135.00 122.89 1uwu n PRO 486 Ca 0.09 0.05 -0.24 0.00 -2.02 0.00 0.00 63.50 61.38 1uwu n PRO 486 Cb 0.33 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.32 1uwu n PRO 486 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uwu s LEU 487 N -2.70 3.66 0.45 2.45 1.43 -0.41 -5.06 118.68 118.49 1uwu s LEU 487 Ca 0.21 0.40 -0.25 0.00 -1.03 0.00 0.00 54.13 53.46 1uwu s LEU 487 Cb 0.17 -3.28 -0.08 0.00 0.03 0.00 0.00 46.19 43.04 1uwu s LEU 487 CO 0.42 -0.67 1.34 -0.60 0.23 0.00 0.00 176.35 177.08 1uwu s ARG 488 N -4.58 3.72 0.00 1.70 3.52 -1.26 -5.02 118.95 117.03 1uwu s ARG 488 Ca 0.48 2.23 0.09 0.00 -0.13 0.00 0.00 55.73 58.40 1uwu s ARG 488 Cb -0.10 -2.61 0.08 0.00 -1.56 0.00 0.00 34.95 30.75 1uwu s ARG 488 CO 0.39 -0.72 0.80 0.72 -0.81 0.00 0.00 175.30 175.68