#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 3.56 -0.07 3.17 2.02 -0.62 -4.99 117.35 120.41 1uwu s TYR 2 Ca 0.00 -2.76 -0.11 0.00 -0.37 0.00 0.00 57.07 53.83 1uwu s TYR 2 Cb 0.00 -2.59 -0.05 0.00 -0.40 0.00 0.00 41.96 38.92 1uwu s TYR 2 CO 0.00 -0.93 0.27 -1.12 -1.57 0.00 0.00 175.55 172.20 1uwu s SER 3 N 0.98 6.57 0.26 2.29 0.01 -1.26 -1.44 113.70 121.11 1uwu s SER 3 Ca 0.05 0.69 0.05 0.00 1.31 0.00 0.00 55.95 58.04 1uwu s SER 3 Cb -0.19 -2.16 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 1uwu s SER 3 CO -0.07 0.35 0.38 -0.36 0.41 0.00 0.00 173.24 173.95 1uwu s PHE 4 N -0.94 3.41 0.61 2.43 0.40 -0.69 -5.01 117.98 118.20 1uwu s PHE 4 Ca 0.19 -0.02 -0.19 0.00 -0.60 0.00 0.00 56.93 56.31 1uwu s PHE 4 Cb -0.14 -1.64 -0.03 0.00 0.51 0.00 0.00 43.02 41.72 1uwu s PHE 4 CO 0.08 0.37 1.18 -2.30 0.70 0.00 0.00 175.22 175.25 1uwu n PRO 5 N -1.46 1.13 0.27 0.24 -0.02 -1.26 -4.87 135.00 129.03 1uwu n PRO 5 Ca -0.08 0.43 0.17 0.00 -2.02 0.00 0.00 63.50 62.01 1uwu n PRO 5 Cb 0.57 -2.40 0.94 0.00 -0.02 0.00 0.00 33.50 32.58 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 0.66 0.00 0.50 2.55 2.35 -1.97 -1.70 115.58 117.97 1uwu h ASN 6 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1uwu h ASN 6 Cb 1.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.71 1uwu h ASN 6 CO 0.53 0.00 -0.77 -1.54 -1.65 0.00 0.00 177.43 174.00 1uwu n SER 7 N -3.62 0.62 -4.75 5.81 3.41 -1.26 -4.93 113.62 108.91 1uwu n SER 7 Ca -0.01 -0.23 -0.41 0.00 -0.26 0.00 0.00 58.87 57.95 1uwu n SER 7 Cb 0.19 0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 64.63 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 -3.11 2.97 -0.05 7.33 2.19 -0.64 -4.97 117.98 121.69 1uwu s PHE 8 Ca 0.07 0.97 0.06 0.00 0.33 0.00 0.00 56.93 58.35 1uwu s PHE 8 Cb 0.15 -3.87 -0.02 0.00 -1.31 0.00 0.00 43.02 37.97 1uwu s PHE 8 CO 0.76 -2.88 -0.22 1.03 1.83 0.00 0.00 175.22 175.74 1uwu s ARG 9 N -0.36 2.44 -0.12 10.12 0.52 -1.00 -4.95 118.95 125.61 1uwu s ARG 9 Ca 0.60 -0.86 -0.07 0.00 -0.52 0.00 0.00 55.73 54.88 1uwu s ARG 9 Cb -0.43 -2.19 -0.04 0.00 0.52 0.00 0.00 34.95 32.80 1uwu s ARG 9 CO 0.44 0.48 0.15 -0.06 0.02 0.00 0.00 175.30 176.33 1uwu s PHE 10 N -0.40 3.59 0.00 -0.53 0.08 -1.26 -1.69 117.98 117.76 1uwu s PHE 10 Ca 0.04 0.53 0.00 0.00 0.12 0.00 0.00 56.93 57.62 1uwu s PHE 10 Cb -0.12 -1.96 0.00 0.00 -0.57 0.00 0.00 43.02 40.37 1uwu s PHE 10 CO 0.02 0.71 0.00 0.41 -0.10 0.00 0.00 175.22 176.25 1uwu n GLY 11 N 2.07 3.19 3.30 4.36 0.00 0.14 -0.73 105.19 117.51 1uwu n GLY 11 Ca -0.20 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.17 -0.17 0.13 1.61 -2.14 -1.09 -1.50 118.94 115.59 1uwu s TRP 12 Ca 0.00 -0.12 0.10 0.00 2.66 0.00 0.00 56.10 58.74 1uwu s TRP 12 Cb 0.00 0.22 -0.04 0.00 -3.10 0.00 0.00 33.47 30.55 1uwu s TRP 12 CO 0.00 -0.67 -0.21 -1.12 -2.66 0.00 0.00 176.95 172.29 1uwu s SER 13 N -2.70 3.66 0.20 -2.66 0.01 -0.77 -1.75 113.70 109.70 1uwu s SER 13 Ca 0.02 -0.65 -0.17 0.00 1.31 0.00 0.00 55.95 56.46 1uwu s SER 13 Cb 0.02 -0.41 0.02 0.00 0.21 0.00 0.00 66.02 65.86 1uwu s SER 13 CO -0.11 0.17 0.53 0.00 0.41 0.00 0.00 173.24 174.24 1uwu s GLN 14 N -2.17 1.41 0.17 12.44 -2.07 -0.58 -4.26 119.66 124.60 1uwu s GLN 14 Ca 0.17 -0.91 0.11 0.00 -1.82 0.00 0.00 55.36 52.90 1uwu s GLN 14 Cb -0.10 0.52 -0.04 0.00 -1.09 0.00 0.00 33.01 32.29 1uwu s GLN 14 CO 0.09 -0.60 -0.24 0.00 -1.32 0.00 0.00 175.29 173.22 1uwu s ALA 15 N -3.89 2.38 0.07 2.60 0.00 -1.26 -4.09 121.76 117.57 1uwu s ALA 15 Ca 0.11 -1.55 -0.32 0.00 0.00 0.00 0.00 51.96 50.20 1uwu s ALA 15 Cb -0.01 -0.32 -0.19 0.00 0.00 0.00 0.00 23.12 22.61 1uwu s ALA 15 CO -0.01 0.43 1.62 0.78 0.00 0.00 0.00 175.76 178.57 1uwu h GLY 16 N 3.43 -0.85 1.39 0.00 0.00 -1.92 -1.99 103.07 103.13 1uwu h GLY 16 Ca -0.47 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1uwu h GLY 16 CO 0.46 -0.31 0.40 -2.75 0.00 0.00 0.00 176.54 174.33 1uwu h PHE 17 N -0.83 0.78 0.01 5.60 3.57 -1.93 0.28 116.94 124.41 1uwu h PHE 17 Ca -0.08 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.23 1uwu h PHE 17 Cb 0.63 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1uwu h PHE 17 CO -0.03 0.50 -0.97 1.96 -2.23 0.00 0.00 178.31 177.54 1uwu h GLN 18 N 0.84 0.04 0.00 1.11 4.20 -1.80 -3.41 115.11 116.08 1uwu h GLN 18 Ca 0.22 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.81 1uwu h GLN 18 Cb -0.08 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1uwu h GLN 18 CO -0.05 0.97 -1.39 0.43 -0.67 0.00 0.00 178.83 178.12 1uwu n SER 19 N -3.44 3.38 0.05 1.46 7.64 -0.76 -1.79 113.62 120.16 1uwu n SER 19 Ca -0.01 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.74 1uwu n SER 19 Cb 0.90 0.96 -0.09 0.00 -1.01 0.00 0.00 64.21 64.97 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 -0.10 -7.29 1.43 5.08 -1.12 0.12 114.58 112.70 1uwu h GLU 20 Ca -0.10 0.01 -0.51 0.00 -1.00 0.00 0.00 59.36 57.76 1uwu h GLU 20 Cb 0.92 0.02 0.09 0.00 0.50 0.00 0.00 28.75 30.28 1uwu h GLU 20 CO 0.01 0.21 0.36 -1.64 -1.00 0.00 0.00 179.01 176.94 1uwu s MET 21 N -4.91 2.92 0.00 2.33 -1.94 -1.26 -1.12 119.30 115.31 1uwu s MET 21 Ca -0.15 1.08 0.00 0.00 -1.71 0.00 0.00 55.69 54.92 1uwu s MET 21 Cb 0.03 -1.98 0.00 0.00 2.01 0.00 0.00 34.83 34.89 1uwu s MET 21 CO 0.64 -1.12 0.00 0.41 -0.01 0.00 0.00 175.02 174.94 1uwu n GLY 22 N -1.50 1.29 3.69 -0.03 0.00 -1.20 -0.93 105.19 106.50 1uwu n GLY 22 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.21 5.23 0.17 2.61 -4.23 -1.26 -4.73 115.64 113.21 1uwu s THR 23 Ca 0.00 0.67 -0.32 0.00 -1.18 0.00 0.00 61.69 60.86 1uwu s THR 23 Cb 0.00 -3.71 -0.16 0.00 1.34 0.00 0.00 72.50 69.97 1uwu s THR 23 CO 0.00 0.29 0.94 -2.65 -0.54 0.00 0.00 174.62 172.66 1uwu n PRO 24 N 4.22 0.69 0.00 3.99 -0.02 -1.26 -1.53 135.00 141.09 1uwu n PRO 24 Ca -0.09 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 1uwu n PRO 24 Cb 0.51 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 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 1.80 0.29 0.19 -1.23 0.00 -1.26 -4.95 105.19 100.03 1uwu n GLY 25 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 1.19 -4.73 1.61 3.41 -0.58 -4.99 113.62 109.52 1uwu n SER 26 Ca 0.00 -0.96 -0.42 0.00 -0.26 0.00 0.00 58.87 57.23 1uwu n SER 26 Cb 0.00 0.51 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 1uwu n SER 26 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1uwu n GLU 27 N -0.90 2.77 -3.82 4.33 1.02 -1.26 -4.69 120.64 118.09 1uwu n GLU 27 Ca 0.08 1.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.91 1uwu n GLU 27 Cb 0.37 -2.82 -0.14 0.00 -0.02 0.00 0.00 31.44 28.83 1uwu n GLU 27 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1uwu s ASP 28 N 0.94 4.05 0.00 1.62 2.15 -1.26 -4.96 116.67 119.20 1uwu s ASP 28 Ca 0.71 -2.46 0.30 0.00 0.43 0.00 0.00 52.55 51.54 1uwu s ASP 28 Cb -0.50 -1.23 1.56 0.00 -0.30 0.00 0.00 42.92 42.45 1uwu s ASP 28 CO 0.38 -0.30 2.03 -0.81 -0.17 0.00 0.00 175.17 176.30 1uwu n PRO 29 N 3.80 1.26 -1.24 4.34 -0.04 -1.26 -4.48 135.00 137.38 1uwu n PRO 29 Ca 0.05 -0.37 -0.31 0.00 -0.04 0.00 0.00 63.50 62.83 1uwu n PRO 29 Cb 0.36 -1.49 0.09 0.00 -0.04 0.00 0.00 33.50 32.43 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 -0.54 6.92 -4.43 3.54 5.03 -1.26 -4.61 115.26 119.90 1uwu n ASN 30 Ca 0.22 -3.65 -0.23 0.00 0.87 0.00 0.00 54.58 51.79 1uwu n ASN 30 Cb 0.20 -0.96 -0.10 0.00 -1.02 0.00 0.00 39.78 37.90 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 -4.22 2.27 0.17 3.41 -4.23 -1.26 -1.67 115.64 110.12 1uwu s THR 31 Ca 0.59 -2.35 -0.14 0.00 -1.18 0.00 0.00 61.69 58.61 1uwu s THR 31 Cb 0.46 -2.22 0.07 0.00 1.34 0.00 0.00 72.50 72.15 1uwu s THR 31 CO 0.01 -0.45 1.77 -2.24 -0.54 0.00 0.00 174.62 173.17 1uwu h ASP 32 N 2.37 0.27 -0.65 3.99 2.03 -1.18 -2.41 116.42 120.84 1uwu h ASP 32 Ca -0.40 0.04 0.03 0.00 -0.73 0.00 0.00 57.03 55.97 1uwu h ASP 32 Cb 1.25 -0.01 -0.04 0.00 -0.83 0.00 0.00 39.33 39.70 1uwu h ASP 32 CO 0.60 0.19 0.39 -0.50 -1.03 0.00 0.00 179.24 178.90 1uwu h TRP 33 N 0.41 0.73 0.15 4.15 4.06 -1.92 0.13 115.95 123.67 1uwu h TRP 33 Ca 0.21 0.02 0.01 0.00 2.06 0.00 0.00 58.89 61.19 1uwu h TRP 33 Cb 0.16 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.06 1uwu h TRP 33 CO -0.12 0.41 -0.17 -0.92 -3.56 0.00 0.00 178.44 174.08 1uwu h TYR 34 N 0.76 -0.43 -0.71 0.49 5.03 -1.86 -1.60 116.97 118.66 1uwu h TYR 34 Ca 0.27 0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.61 1uwu h TYR 34 Cb 0.05 0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.46 1uwu h TYR 34 CO -0.05 -0.25 0.44 -0.22 -1.32 0.00 0.00 178.16 176.76 1uwu h LYS 35 N -0.35 0.84 -0.42 1.82 3.64 -1.21 -2.50 116.57 118.39 1uwu h LYS 35 Ca 0.01 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1uwu h LYS 35 Cb 0.34 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 1uwu h LYS 35 CO -0.05 0.56 0.20 2.35 -2.27 0.00 0.00 179.45 180.23 1uwu h TRP 36 N 0.87 0.36 0.00 1.91 2.91 -0.44 -2.02 115.95 119.54 1uwu h TRP 36 Ca 0.28 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.32 1uwu h TRP 36 Cb 0.02 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 28.57 1uwu h TRP 36 CO -0.04 0.18 0.00 1.33 -1.03 0.00 0.00 178.44 178.88 1uwu n VAL 37 N -4.93 0.60 1.13 2.65 0.24 -0.63 -2.59 118.33 114.80 1uwu n VAL 37 Ca 0.02 -0.26 0.12 0.00 -2.04 0.00 0.00 64.34 62.19 1uwu n VAL 37 Cb 0.11 -0.61 0.26 0.00 -1.47 0.00 0.00 33.84 32.13 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 -2.25 0.00 -1.93 6.34 8.25 -0.96 -4.73 115.22 119.94 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 0.42 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.37 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 -2.67 6.61 0.24 0.41 2.15 -0.79 -4.91 116.67 117.72 1uwu s ASP 39 Ca 0.19 2.39 -0.05 0.00 0.43 0.00 0.00 52.55 55.51 1uwu s ASP 39 Cb 0.18 -2.54 0.40 0.00 -0.30 0.00 0.00 42.92 40.66 1uwu s ASP 39 CO 0.60 -0.93 1.78 -0.65 -0.17 0.00 0.00 175.17 175.80 1uwu h PRO 40 N 9.31 0.61 -0.35 4.34 0.11 -1.91 -1.24 132.00 142.86 1uwu h PRO 40 Ca -0.42 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 1uwu h PRO 40 Cb 1.20 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1uwu h PRO 40 CO 0.94 0.41 -0.23 0.93 -0.21 0.00 0.00 178.00 179.84 1uwu h GLU 41 N 0.63 0.77 -0.71 1.05 5.08 -1.97 -1.46 114.58 117.98 1uwu h GLU 41 Ca 0.39 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1uwu h GLU 41 Cb 0.45 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 1uwu h GLU 41 CO -0.30 0.99 0.45 -0.91 -1.00 0.00 0.00 179.01 178.24 1uwu h ASN 42 N 0.56 0.84 -0.29 1.42 2.35 -1.77 -0.87 115.58 117.80 1uwu h ASN 42 Ca 0.07 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.73 1uwu h ASN 42 Cb 0.78 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1uwu h ASN 42 CO 0.06 0.63 -0.05 0.24 -1.65 0.00 0.00 177.43 176.66 1uwu h MET 43 N 0.98 0.55 -0.14 0.81 2.86 -1.03 -1.11 114.93 117.86 1uwu h MET 43 Ca 0.26 -0.20 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 1uwu h MET 43 Cb -0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1uwu h MET 43 CO -0.05 0.74 -0.24 0.00 1.06 0.00 0.00 176.91 178.42 1uwu h ALA 44 N 0.80 1.34 0.00 6.32 0.00 -0.82 -1.86 119.26 125.03 1uwu h ALA 44 Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1uwu h ALA 44 Cb 0.52 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1uwu h ALA 44 CO 0.03 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1uwu n ALA 45 N -2.48 2.14 -1.17 0.00 0.00 -0.37 -4.91 120.51 113.72 1uwu n ALA 45 Ca -0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.33 1uwu n ALA 45 Cb 0.35 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 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 1.05 0.82 0.19 0.00 0.00 -0.70 -4.91 105.19 101.63 1uwu n GLY 46 Ca 0.05 -0.48 -0.04 0.00 0.00 0.00 0.00 46.02 45.56 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 0.28 -9.17 0.99 3.38 -1.46 -3.43 115.31 105.90 1uwu h LEU 47 Ca -0.12 -0.13 -0.63 0.00 0.09 0.00 0.00 57.88 57.08 1uwu h LEU 47 Cb 0.50 -0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.02 1uwu h LEU 47 CO 0.18 0.73 -0.78 0.68 0.09 0.00 0.00 178.44 179.34 1uwu s VAL 48 N -4.00 2.57 0.21 1.22 -7.23 -1.18 -4.13 120.40 107.86 1uwu s VAL 48 Ca -0.04 -2.13 0.18 0.00 -1.81 0.00 0.00 61.98 58.18 1uwu s VAL 48 Cb 0.13 -2.29 0.13 0.00 0.56 0.00 0.00 36.38 34.91 1uwu s VAL 48 CO 0.79 -0.24 1.76 0.77 -0.31 0.00 0.00 175.10 177.86 1uwu h SER 49 N 2.72 0.00 0.00 4.85 4.64 -1.13 -3.43 113.55 121.20 1uwu h SER 49 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1uwu h SER 49 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1uwu h SER 49 CO 0.54 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.48 1uwu n GLY 50 N 0.10 2.00 3.79 -0.77 0.00 -1.26 -5.04 105.19 104.01 1uwu n GLY 50 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.46 6.02 -0.02 1.61 1.01 -1.26 -5.05 116.67 117.53 1uwu s ASP 51 Ca 0.00 1.95 0.06 0.00 0.71 0.00 0.00 52.55 55.27 1uwu s ASP 51 Cb 0.00 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1uwu s ASP 51 CO 0.00 -1.01 -0.20 -0.76 0.21 0.00 0.00 175.17 173.41 1uwu s LEU 52 N -3.87 2.03 0.53 1.23 1.43 -1.26 -4.93 118.68 113.84 1uwu s LEU 52 Ca 0.67 -0.37 0.30 0.00 -1.03 0.00 0.00 54.13 53.70 1uwu s LEU 52 Cb -0.18 -1.05 1.44 0.00 0.03 0.00 0.00 46.19 46.43 1uwu s LEU 52 CO 0.27 0.24 2.04 1.55 0.23 0.00 0.00 176.35 180.68 1uwu h PRO 53 N 5.68 0.00 0.00 1.29 0.13 -1.96 -1.56 132.00 135.57 1uwu h PRO 53 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1uwu h PRO 53 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1uwu h PRO 53 CO 0.48 0.10 0.00 -0.85 -0.23 0.00 0.00 178.00 177.50 1uwu n GLU 54 N -3.41 0.01 -1.02 0.86 0.00 -1.26 -1.70 120.64 114.12 1uwu n GLU 54 Ca -0.01 0.36 -0.07 0.00 0.00 0.00 0.00 57.16 57.44 1uwu n GLU 54 Cb 0.27 -1.52 0.29 0.00 0.00 0.00 0.00 31.44 30.49 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 -1.53 4.76 -2.26 -1.84 5.03 -0.59 -3.24 115.26 115.59 1uwu n ASN 55 Ca 0.02 -3.20 0.00 0.00 0.87 0.00 0.00 54.58 52.27 1uwu n ASN 55 Cb 0.10 -0.75 0.00 0.00 -1.02 0.00 0.00 39.78 38.11 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 -0.17 -1.21 0.14 7.41 0.00 -0.69 -4.88 105.19 105.79 1uwu n GLY 56 Ca 0.41 -1.64 0.13 0.00 0.00 0.00 0.00 46.02 44.92 1uwu n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uwu h PRO 57 N 0.00 0.00 -1.77 1.61 0.13 -1.69 -3.38 132.00 126.91 1uwu h PRO 57 Ca 0.00 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.08 1uwu h PRO 57 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 1uwu h PRO 57 CO 0.00 0.00 -0.09 0.41 -0.23 0.00 0.00 178.00 178.09 1uwu n GLY 58 N 0.51 0.70 0.30 1.56 0.00 -0.11 -4.89 105.19 103.26 1uwu n GLY 58 Ca 0.03 -0.53 0.08 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.34 0.27 -0.45 1.61 3.20 -0.38 -0.20 116.97 120.68 1uwu h TYR 59 Ca -0.08 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.88 1uwu h TYR 59 Cb 1.05 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 39.16 1uwu h TYR 59 CO 0.06 0.16 0.05 2.35 -1.64 0.00 0.00 178.16 179.15 1uwu h TRP 60 N 0.28 0.07 0.03 -3.82 2.91 -1.33 -1.44 115.95 112.66 1uwu h TRP 60 Ca 0.11 0.03 -0.30 0.00 1.13 0.00 0.00 58.89 59.87 1uwu h TRP 60 Cb 0.10 0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 28.75 1uwu h TRP 60 CO -0.00 -0.04 -1.65 0.78 -1.03 0.00 0.00 178.44 176.49 1uwu h GLY 61 N 0.17 0.08 -2.32 2.65 0.00 -1.76 -3.40 103.07 98.49 1uwu h GLY 61 Ca 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1uwu h GLY 61 CO -0.33 0.18 0.00 0.70 0.00 0.00 0.00 176.54 177.09 1uwu n ASN 62 N -3.19 3.96 -0.29 0.19 5.03 -0.10 -4.67 115.26 116.18 1uwu n ASN 62 Ca -0.17 -2.26 0.22 0.00 0.87 0.00 0.00 54.58 53.24 1uwu n ASN 62 Cb 1.04 -0.46 0.52 0.00 -1.02 0.00 0.00 39.78 39.86 1uwu n ASN 62 CO 0.00 0.00 0.00 0.10 -1.83 0.00 0.00 177.26 175.53 1uwu h TYR 63 N 3.35 0.59 -0.83 3.10 -0.00 -1.47 -1.07 116.97 120.63 1uwu h TYR 63 Ca 0.00 0.02 0.03 0.00 -0.00 0.00 0.00 58.73 58.78 1uwu h TYR 63 Cb 1.13 -0.17 -0.05 0.00 -0.00 0.00 0.00 36.73 37.64 1uwu h TYR 63 CO 0.52 0.09 0.54 0.87 -0.00 0.00 0.00 178.16 180.18 1uwu h LYS 64 N 0.39 1.03 -0.44 0.10 1.57 -1.88 -0.31 116.57 117.03 1uwu h LYS 64 Ca 0.55 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.25 1uwu h LYS 64 Cb 1.41 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1uwu h LYS 64 CO -0.24 0.68 0.21 1.15 -0.57 0.00 0.00 179.45 180.69 1uwu h THR 65 N 1.06 1.18 -0.36 -0.16 2.02 -1.58 0.25 112.91 115.32 1uwu h THR 65 Ca 0.33 -0.51 0.04 0.00 0.77 0.00 0.00 66.41 67.04 1uwu h THR 65 Cb -0.02 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1uwu h THR 65 CO -0.11 0.20 0.15 -0.26 0.37 0.00 0.00 175.52 175.87 1uwu h PHE 66 N 0.57 0.27 -0.32 3.16 -1.00 -1.22 -2.00 116.94 116.40 1uwu h PHE 66 Ca 0.15 0.02 -0.11 0.00 2.81 0.00 0.00 57.97 60.83 1uwu h PHE 66 Cb 0.11 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 1uwu h PHE 66 CO -0.01 0.13 -0.27 0.45 -1.61 0.00 0.00 178.31 177.00 1uwu h HIS 67 N 0.32 0.75 -0.06 -0.55 3.86 -0.86 -1.21 115.15 117.39 1uwu h HIS 67 Ca 0.16 -0.18 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1uwu h HIS 67 Cb 0.11 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1uwu h HIS 67 CO -0.12 0.86 -0.04 -0.44 0.86 0.00 0.00 177.93 179.05 1uwu h ASP 68 N 0.57 -0.12 -0.55 2.45 3.32 -0.69 -0.51 116.42 120.88 1uwu h ASP 68 Ca 0.07 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1uwu h ASP 68 Cb 0.76 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.35 1uwu h ASP 68 CO 0.06 -0.05 0.31 0.78 -1.72 0.00 0.00 179.24 178.61 1uwu h ASN 69 N -0.04 0.68 -0.73 6.45 2.35 -1.19 -0.55 115.58 122.56 1uwu h ASN 69 Ca 0.04 -0.09 0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1uwu h ASN 69 Cb 0.09 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 1uwu h ASN 69 CO -0.09 0.57 0.46 0.00 -1.65 0.00 0.00 177.43 176.73 1uwu h ALA 70 N 1.14 0.94 -0.26 -0.83 0.00 -1.01 -0.44 119.26 118.81 1uwu h ALA 70 Ca 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1uwu h ALA 70 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1uwu h ALA 70 CO -0.03 0.27 0.11 0.37 0.00 0.00 0.00 179.25 179.96 1uwu h GLN 71 N 0.92 0.38 0.00 0.00 4.15 -0.85 -1.54 115.11 118.17 1uwu h GLN 71 Ca 0.29 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.63 1uwu h GLN 71 Cb -0.02 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.61 1uwu h GLN 71 CO -0.10 0.40 -0.07 0.87 -1.93 0.00 0.00 178.83 178.01 1uwu h LYS 72 N 0.27 0.00 -0.00 1.69 1.57 -0.82 -1.33 116.57 117.95 1uwu h LYS 72 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1uwu h LYS 72 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1uwu h LYS 72 CO -0.01 0.07 -0.00 -0.12 -0.57 0.00 0.00 179.45 178.82 1uwu n MET 73 N -4.26 0.44 -0.86 3.15 1.56 -0.20 -4.90 117.12 112.04 1uwu n MET 73 Ca -0.03 -0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.40 1uwu n MET 73 Cb 0.15 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 34.02 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 1.28 0.51 3.78 -5.12 0.00 -0.50 -4.06 105.19 101.09 1uwu n GLY 74 Ca 0.14 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 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 4.03 0.00 0.99 1.43 -0.62 -4.46 118.68 120.06 1uwu s LEU 75 Ca 0.00 2.05 0.00 0.00 -1.03 0.00 0.00 54.13 55.15 1uwu s LEU 75 Cb 0.00 -4.30 0.00 0.00 0.03 0.00 0.00 46.19 41.92 1uwu s LEU 75 CO 0.00 -0.65 0.43 0.29 0.23 0.00 0.00 176.35 176.65 1uwu n LYS 76 N -0.40 0.17 -3.81 1.70 4.01 0.09 -4.71 118.16 115.21 1uwu n LYS 76 Ca 0.07 -0.51 -0.12 0.00 -0.51 0.00 0.00 58.31 57.23 1uwu n LYS 76 Cb 0.50 -0.76 -0.10 0.00 -0.51 0.00 0.00 35.03 34.16 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 -0.17 0.05 -0.02 -0.18 2.07 -1.19 -0.62 121.20 121.13 1uwu s ILE 77 Ca 0.00 -0.44 -0.05 0.00 -1.41 0.00 0.00 60.65 58.75 1uwu s ILE 77 Cb 0.00 -0.47 0.01 0.00 0.13 0.00 0.00 42.46 42.13 1uwu s ILE 77 CO 0.00 -0.24 0.12 0.00 -1.91 0.00 0.00 174.94 172.90 1uwu s ALA 78 N -0.98 -0.28 -0.09 1.50 0.00 -0.16 -2.69 121.76 119.07 1uwu s ALA 78 Ca -0.11 0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.95 1uwu s ALA 78 Cb -0.05 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.03 1uwu s ALA 78 CO 0.02 -0.12 -0.09 0.50 0.00 0.00 0.00 175.76 176.07 1uwu s ARG 79 N -0.60 1.53 0.21 0.00 3.00 -0.72 -0.97 118.95 121.39 1uwu s ARG 79 Ca -0.07 -0.30 -0.00 0.00 -1.00 0.00 0.00 55.73 54.36 1uwu s ARG 79 Cb -0.04 -1.44 -0.04 0.00 0.00 0.00 0.00 34.95 33.42 1uwu s ARG 79 CO 0.01 -0.13 0.11 -0.51 0.00 0.00 0.00 175.30 174.77 1uwu s LEU 80 N 1.22 1.38 0.14 -0.88 1.43 -1.08 -1.52 118.68 119.38 1uwu s LEU 80 Ca -0.04 -1.36 0.08 0.00 -1.03 0.00 0.00 54.13 51.78 1uwu s LEU 80 Cb -0.14 0.26 -0.04 0.00 0.03 0.00 0.00 46.19 46.30 1uwu s LEU 80 CO -0.03 -0.79 -0.17 0.54 0.23 0.00 0.00 176.35 176.13 1uwu s ASN 81 N -3.19 2.47 0.25 2.29 4.22 -1.26 -0.80 114.94 118.93 1uwu s ASN 81 Ca 0.36 -0.82 -0.27 0.00 -2.14 0.00 0.00 52.86 49.99 1uwu s ASN 81 Cb 0.07 -0.13 -0.09 0.00 1.28 0.00 0.00 41.25 42.38 1uwu s ASN 81 CO 0.11 -0.05 0.89 0.68 -2.04 0.00 0.00 177.10 176.69 1uwu s VAL 82 N -1.95 4.21 -0.41 3.54 -7.23 -1.17 -4.27 120.40 113.12 1uwu s VAL 82 Ca 0.12 1.86 -0.23 0.00 -1.81 0.00 0.00 61.98 61.93 1uwu s VAL 82 Cb -0.06 -4.15 0.02 0.00 0.56 0.00 0.00 36.38 32.75 1uwu s VAL 82 CO 0.05 0.36 0.79 -1.61 -0.31 0.00 0.00 175.10 174.38 1uwu s GLU 83 N -1.54 3.59 0.25 4.82 0.41 -1.26 -4.51 118.70 120.46 1uwu s GLU 83 Ca 0.43 0.11 -0.10 0.00 -0.41 0.00 0.00 54.97 55.00 1uwu s GLU 83 Cb -0.22 -3.87 0.37 0.00 -1.78 0.00 0.00 34.13 28.62 1uwu s GLU 83 CO 0.27 -0.98 1.59 2.35 -0.49 0.00 0.00 175.26 177.99 1uwu h TRP 84 N 8.73 -0.47 -0.53 1.61 2.91 -1.87 0.97 115.95 127.31 1uwu h TRP 84 Ca -0.25 0.08 0.14 0.00 1.13 0.00 0.00 58.89 59.99 1uwu h TRP 84 Cb 1.09 0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 30.06 1uwu h TRP 84 CO 0.80 -0.37 0.37 0.66 -1.03 0.00 0.00 178.44 178.87 1uwu h SER 85 N -0.00 0.05 0.15 2.65 4.64 -1.87 -0.51 113.55 118.66 1uwu h SER 85 Ca 0.41 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.50 1uwu h SER 85 Cb 0.62 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1uwu h SER 85 CO -0.88 0.03 -0.90 0.03 -0.87 0.00 0.00 176.83 174.23 1uwu h ARG 86 N 0.05 0.55 0.22 4.77 3.08 -1.17 -2.85 114.38 119.04 1uwu h ARG 86 Ca 0.25 -0.54 -0.29 0.00 0.07 0.00 0.00 59.98 59.47 1uwu h ARG 86 Cb 0.93 0.14 0.03 0.00 0.08 0.00 0.00 29.97 31.15 1uwu h ARG 86 CO -0.02 1.17 -1.28 0.82 -1.07 0.00 0.00 179.97 179.59 1uwu h ILE 87 N 0.34 1.35 -2.58 2.04 1.08 -1.29 -3.40 117.51 115.04 1uwu h ILE 87 Ca -0.08 -2.65 -0.60 0.00 -0.39 0.00 0.00 64.86 61.14 1uwu h ILE 87 Cb 1.53 3.09 -0.41 0.00 -3.07 0.00 0.00 36.82 37.96 1uwu h ILE 87 CO 0.17 0.78 -0.70 0.49 -0.69 0.00 0.00 178.15 178.20 1uwu n PHE 88 N -3.84 2.37 0.26 1.37 3.72 -0.27 0.05 117.46 121.11 1uwu n PHE 88 Ca -0.16 -4.04 0.15 0.00 -0.05 0.00 0.00 57.45 53.36 1uwu n PHE 88 Cb 1.02 -0.44 0.49 0.00 -0.94 0.00 0.00 39.48 39.61 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 4.89 0.00 -6.36 -1.08 0.13 -1.71 -3.42 132.00 124.45 1uwu h PRO 89 Ca 0.17 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.65 1uwu h PRO 89 Cb 0.76 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.76 1uwu h PRO 89 CO 0.68 0.00 -0.68 -0.80 -0.23 0.00 0.00 178.00 176.97 1uwu s ASN 90 N -5.86 4.88 0.44 1.44 0.02 -1.26 -4.79 114.94 109.80 1uwu s ASN 90 Ca 0.03 -0.19 -0.25 0.00 -1.02 0.00 0.00 52.86 51.43 1uwu s ASN 90 Cb 0.07 -1.13 -0.09 0.00 0.02 0.00 0.00 41.25 40.12 1uwu s ASN 90 CO 0.59 0.20 1.31 -0.81 0.02 0.00 0.00 177.10 178.41 1uwu n PRO 91 N 0.80 1.97 -3.61 -0.60 -0.04 -1.26 -5.00 135.00 127.25 1uwu n PRO 91 Ca -0.12 0.70 -0.33 0.00 -0.04 0.00 0.00 63.50 63.71 1uwu n PRO 91 Cb 0.52 -2.45 -0.05 0.00 -0.04 0.00 0.00 33.50 31.48 1uwu n PRO 91 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1uwu s LEU 92 N -2.01 4.28 0.31 1.53 1.02 -1.26 -5.05 118.68 117.51 1uwu s LEU 92 Ca 0.62 0.70 -0.30 0.00 0.02 0.00 0.00 54.13 55.17 1uwu s LEU 92 Cb -0.49 -3.23 -0.12 0.00 0.02 0.00 0.00 46.19 42.38 1uwu s LEU 92 CO 0.57 0.08 1.55 -0.81 0.02 0.00 0.00 176.35 177.77 1uwu n PRO 93 N 0.37 2.64 -1.88 1.29 -0.04 -1.26 -4.93 135.00 131.19 1uwu n PRO 93 Ca -0.04 0.94 -0.41 0.00 -0.04 0.00 0.00 63.50 63.94 1uwu n PRO 93 Cb 0.52 -2.69 -0.02 0.00 -0.04 0.00 0.00 33.50 31.27 1uwu n PRO 93 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1uwu s ARG 94 N -0.89 4.18 0.00 0.54 3.03 -1.26 -5.20 118.95 119.35 1uwu s ARG 94 Ca 0.62 2.46 0.00 0.00 2.03 0.00 0.00 55.73 60.84 1uwu s ARG 94 Cb -0.50 -3.05 0.00 0.00 -1.03 0.00 0.00 34.95 30.37 1uwu s ARG 94 CO 0.52 -0.52 0.00 -0.35 -1.13 0.00 0.00 175.30 173.82 1uwu n PRO 95 N 1.95 0.00 0.00 3.89 -0.04 -1.26 -5.25 135.00 134.29 1uwu n PRO 95 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1uwu n PRO 95 Cb 0.39 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.85 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 -3.57 0.54 7.35 -1.26 -5.15 117.46 115.37 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 5.78 0.59 -2.13 2.15 -1.26 -4.97 116.67 116.82 1uwu s ASP 99 Ca 0.00 -1.17 0.34 0.00 0.43 0.00 0.00 52.55 52.16 1uwu s ASP 99 Cb 0.00 -2.04 1.85 0.00 -0.30 0.00 0.00 42.92 42.43 1uwu s ASP 99 CO 0.00 -0.46 2.20 -0.08 -0.17 0.00 0.00 175.17 176.66 1uwu h GLU 100 N 8.48 0.00 0.00 4.34 4.57 -2.01 -2.31 114.58 127.65 1uwu h GLU 100 Ca -0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.93 1uwu h GLU 100 Cb 1.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 1uwu h GLU 100 CO 0.72 0.04 0.00 0.66 -1.18 0.00 0.00 179.01 179.25 1uwu h SER 101 N 0.00 0.00 -3.02 1.04 4.64 -2.01 -3.44 113.55 110.75 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 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1uwu h SER 101 CO 0.01 0.00 0.71 -0.75 -0.87 0.00 0.00 176.83 175.92 1uwu s LYS 102 N -3.19 4.34 0.08 4.77 2.47 -0.87 -4.96 119.74 122.38 1uwu s LYS 102 Ca 0.08 1.99 -0.20 0.00 -1.56 0.00 0.00 55.97 56.28 1uwu s LYS 102 Cb 0.10 -3.33 -0.10 0.00 -1.46 0.00 0.00 37.83 33.04 1uwu s LYS 102 CO 0.59 -0.42 1.53 0.37 0.16 0.00 0.00 175.35 177.58 1uwu h GLN 103 N 6.99 0.34 -5.94 4.03 4.15 -1.89 -3.45 115.11 119.35 1uwu h GLN 103 Ca -0.41 -0.10 -0.62 0.00 0.77 0.00 0.00 58.65 58.29 1uwu h GLN 103 Cb 1.20 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.80 1uwu h GLN 103 CO 0.86 0.51 -0.29 -0.51 -1.93 0.00 0.00 178.83 177.47 1uwu s ASP 104 N -5.80 6.66 -0.37 -0.69 1.11 -1.26 -5.00 116.67 111.33 1uwu s ASP 104 Ca -0.14 0.79 0.03 0.00 0.18 0.00 0.00 52.55 53.41 1uwu s ASP 104 Cb 0.07 -2.18 0.10 0.00 1.07 0.00 0.00 42.92 41.98 1uwu s ASP 104 CO 0.73 0.31 0.10 -0.69 1.18 0.00 0.00 175.17 176.79 1uwu s VAL 105 N -1.14 2.48 -0.11 -1.27 1.01 -1.26 -4.96 120.40 115.13 1uwu s VAL 105 Ca 0.24 -2.39 0.22 0.00 0.00 0.00 0.00 61.98 60.05 1uwu s VAL 105 Cb -0.15 -2.80 -0.20 0.00 0.00 0.00 0.00 36.38 33.23 1uwu s VAL 105 CO 0.12 -0.63 0.69 0.35 0.00 0.00 0.00 175.10 175.63 1uwu n THR 106 N 4.20 0.30 -3.74 3.92 -2.24 -1.26 -4.92 114.28 110.55 1uwu n THR 106 Ca 0.03 -0.53 -0.13 0.00 -2.27 0.00 0.00 64.05 61.15 1uwu n THR 106 Cb 0.41 -0.16 -0.10 0.00 -2.10 0.00 0.00 70.33 68.38 1uwu n THR 106 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1uwu s GLU 107 N -3.42 0.47 -0.17 -0.78 2.12 -1.26 -4.88 118.70 110.78 1uwu s GLU 107 Ca -0.05 0.51 -0.01 0.00 0.36 0.00 0.00 54.97 55.78 1uwu s GLU 107 Cb 0.12 0.23 0.04 0.00 0.26 0.00 0.00 34.13 34.78 1uwu s GLU 107 CO 0.86 -0.06 -0.03 0.08 -0.54 0.00 0.00 175.26 175.57 1uwu s VAL 108 N 0.13 0.97 -0.19 3.70 1.01 -1.26 -5.11 120.40 119.65 1uwu s VAL 108 Ca -0.01 -0.59 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 1uwu s VAL 108 Cb -0.03 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 1uwu s VAL 108 CO 0.01 0.07 1.30 -0.70 0.00 0.00 0.00 175.10 175.77 1uwu s GLU 109 N 1.69 4.15 -0.08 2.72 2.12 -1.26 -4.90 118.70 123.13 1uwu s GLU 109 Ca 0.00 1.60 0.02 0.00 0.36 0.00 0.00 54.97 56.95 1uwu s GLU 109 Cb -0.16 -3.80 0.02 0.00 0.26 0.00 0.00 34.13 30.45 1uwu s GLU 109 CO -0.07 -0.81 -0.12 0.42 -0.54 0.00 0.00 175.26 174.14 1uwu s ILE 110 N 3.75 1.18 0.34 -3.70 1.01 -1.26 -5.06 121.20 117.46 1uwu s ILE 110 Ca 0.56 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.81 1uwu s ILE 110 Cb -0.21 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1uwu s ILE 110 CO 0.17 0.37 0.26 0.54 0.00 0.00 0.00 174.94 176.29 1uwu s ASN 111 N 0.96 1.83 0.20 3.58 2.20 -1.26 -5.04 114.94 117.41 1uwu s ASN 111 Ca -0.09 -1.76 -0.11 0.00 -0.94 0.00 0.00 52.86 49.97 1uwu s ASN 111 Cb -0.15 0.56 0.27 0.00 -2.00 0.00 0.00 41.25 39.93 1uwu s ASN 111 CO 0.00 -1.05 1.71 -0.33 -2.94 0.00 0.00 177.10 174.49 1uwu h GLU 112 N 2.09 0.26 -0.33 3.55 4.39 -1.99 -1.09 114.58 121.46 1uwu h GLU 112 Ca -0.26 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1uwu h GLU 112 Cb 1.24 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.81 1uwu h GLU 112 CO 0.39 0.17 0.21 -0.91 -1.16 0.00 0.00 179.01 177.71 1uwu h ASN 113 N 0.27 0.39 -0.92 1.42 2.35 -1.99 -1.08 115.58 116.02 1uwu h ASN 113 Ca 0.30 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1uwu h ASN 113 Cb 0.42 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.65 1uwu h ASN 113 CO -0.37 0.30 0.58 -0.08 -1.65 0.00 0.00 177.43 176.21 1uwu h GLU 114 N 0.44 1.24 -0.46 0.81 4.81 -1.72 -1.10 114.58 118.60 1uwu h GLU 114 Ca 0.12 -0.09 -0.11 0.00 -0.13 0.00 0.00 59.36 59.15 1uwu h GLU 114 Cb -0.02 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 1uwu h GLU 114 CO -0.02 0.84 -0.15 -0.07 -0.73 0.00 0.00 179.01 178.88 1uwu h LEU 115 N 1.26 0.86 -1.27 1.64 3.38 -0.96 -1.55 115.31 118.68 1uwu h LEU 115 Ca 0.33 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1uwu h LEU 115 Cb -0.10 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1uwu h LEU 115 CO -0.07 1.01 -0.16 0.11 0.09 0.00 0.00 178.44 179.42 1uwu h LYS 116 N 0.77 0.29 -0.16 1.13 1.57 -0.75 0.03 116.57 119.44 1uwu h LYS 116 Ca 0.12 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1uwu h LYS 116 Cb 0.67 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1uwu h LYS 116 CO 0.05 0.46 -0.30 0.00 -0.57 0.00 0.00 179.45 179.08 1uwu h ARG 117 N 0.28 0.49 -0.94 3.15 2.47 -0.82 -3.01 114.38 115.99 1uwu h ARG 117 Ca 0.05 -0.31 0.03 0.00 -1.26 0.00 0.00 59.98 58.49 1uwu h ARG 117 Cb 0.45 0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 28.76 1uwu h ARG 117 CO 0.03 0.92 0.62 -0.07 0.56 0.00 0.00 179.97 182.02 1uwu h LEU 118 N 0.12 1.03 -1.49 3.04 3.38 -1.18 -1.59 115.31 118.63 1uwu h LEU 118 Ca 0.01 -0.01 0.39 0.00 0.09 0.00 0.00 57.88 58.35 1uwu h LEU 118 Cb 0.89 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.29 1uwu h LEU 118 CO 0.07 0.72 0.83 -0.78 0.09 0.00 0.00 178.44 179.37 1uwu h ASP 119 N 1.20 0.26 1.54 -0.43 3.58 -0.84 0.13 116.42 121.86 1uwu h ASP 119 Ca 0.37 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.92 1uwu h ASP 119 Cb -0.02 0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.10 1uwu h ASP 119 CO -0.11 -0.08 0.00 -0.08 -2.88 0.00 0.00 179.24 176.10 1uwu h GLU 120 N 0.16 0.00 0.00 0.28 4.57 -1.32 -3.01 114.58 115.27 1uwu h GLU 120 Ca 0.74 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.92 1uwu h GLU 120 Cb 2.31 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.90 1uwu h GLU 120 CO -0.32 0.00 -1.03 0.66 -1.18 0.00 0.00 179.01 177.14 1uwu n TYR 121 N -2.48 0.22 -2.28 0.92 4.01 0.42 -4.99 117.16 112.98 1uwu n TYR 121 Ca 0.05 0.06 -0.38 0.00 -0.16 0.00 0.00 57.90 57.47 1uwu n TYR 121 Cb 0.44 -0.39 -0.02 0.00 -0.31 0.00 0.00 39.34 39.06 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 -3.18 3.18 -0.32 -0.72 0.00 -1.07 -4.80 121.76 114.85 1uwu s ALA 122 Ca 0.04 0.99 -0.29 0.00 0.00 0.00 0.00 51.96 52.71 1uwu s ALA 122 Cb 0.15 -3.39 -0.00 0.00 0.00 0.00 0.00 23.12 19.88 1uwu s ALA 122 CO 0.81 -0.54 1.38 1.21 0.00 0.00 0.00 175.76 178.61 1uwu s ASN 123 N -1.07 6.53 0.24 0.00 3.84 0.11 -4.91 114.94 119.67 1uwu s ASN 123 Ca 0.56 1.15 0.03 0.00 0.21 0.00 0.00 52.86 54.82 1uwu s ASN 123 Cb -0.32 -2.54 0.26 0.00 -0.55 0.00 0.00 41.25 38.11 1uwu s ASN 123 CO 0.40 -1.21 1.58 0.11 -2.79 0.00 0.00 177.10 175.19 1uwu h LYS 124 N 9.92 0.30 -0.31 0.43 1.79 -1.93 -2.28 116.57 124.49 1uwu h LYS 124 Ca -0.28 -0.19 -0.03 0.00 -2.18 0.00 0.00 60.65 57.98 1uwu h LYS 124 Cb 1.11 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.77 1uwu h LYS 124 CO 1.04 0.77 0.09 -0.44 -1.08 0.00 0.00 179.45 179.84 1uwu h ASP 125 N 0.23 0.46 0.22 0.86 3.32 -1.97 -0.17 116.42 119.38 1uwu h ASP 125 Ca 0.00 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.82 1uwu h ASP 125 Cb 1.04 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1uwu h ASP 125 CO 0.09 0.56 -0.10 0.00 -1.72 0.00 0.00 179.24 178.07 1uwu h ALA 126 N 0.92 -0.29 -0.57 3.45 0.00 -1.85 -0.68 119.26 120.25 1uwu h ALA 126 Ca 0.10 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1uwu h ALA 126 Cb 0.27 0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1uwu h ALA 126 CO -0.00 -0.65 0.25 -0.07 0.00 0.00 0.00 179.25 178.78 1uwu h LEU 127 N -0.31 0.32 -0.63 0.00 3.38 -1.37 -1.25 115.31 115.44 1uwu h LEU 127 Ca -0.03 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1uwu h LEU 127 Cb 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1uwu h LEU 127 CO 0.05 0.21 0.22 -1.13 0.09 0.00 0.00 178.44 177.87 1uwu h ASN 128 N 0.47 0.89 0.19 -0.43 -0.73 -0.92 -1.04 115.58 114.02 1uwu h ASN 128 Ca 0.27 -0.19 -0.01 0.00 1.87 0.00 0.00 56.30 58.24 1uwu h ASN 128 Cb 0.26 -0.23 0.00 0.00 0.27 0.00 0.00 38.32 38.61 1uwu h ASN 128 CO -0.23 0.85 -0.09 -0.74 -0.37 0.00 0.00 177.43 176.84 1uwu h HIS 129 N 0.89 -0.24 -0.77 0.67 2.76 -0.82 -0.23 115.15 117.40 1uwu h HIS 129 Ca 0.20 -0.01 0.13 0.00 -2.20 0.00 0.00 60.37 58.50 1uwu h HIS 129 Cb 0.26 0.08 -0.09 0.00 1.55 0.00 0.00 27.41 29.21 1uwu h HIS 129 CO 0.02 -0.09 0.36 1.88 -1.30 0.00 0.00 177.93 178.80 1uwu h TYR 130 N -0.34 0.63 -0.82 5.26 0.05 -1.20 0.05 116.97 120.60 1uwu h TYR 130 Ca -0.03 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.85 1uwu h TYR 130 Cb 0.26 -0.17 -0.06 0.00 1.01 0.00 0.00 36.73 37.77 1uwu h TYR 130 CO -0.04 0.15 0.50 -0.09 -1.05 0.00 0.00 178.16 177.63 1uwu h ARG 131 N 0.55 0.88 -0.67 4.88 2.43 -0.79 0.41 114.38 122.07 1uwu h ARG 131 Ca 0.41 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 1uwu h ARG 131 Cb 0.56 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 1uwu h ARG 131 CO -0.35 0.58 0.25 0.93 -1.51 0.00 0.00 179.97 179.87 1uwu h GLU 132 N 0.90 1.02 -0.07 0.20 5.08 0.59 -0.77 114.58 121.54 1uwu h GLU 132 Ca 0.37 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1uwu h GLU 132 Cb 0.20 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1uwu h GLU 132 CO -0.18 0.86 0.02 0.82 -1.00 0.00 0.00 179.01 179.53 1uwu h ILE 133 N 0.96 1.17 -0.06 3.13 2.04 -0.39 -2.37 117.51 121.99 1uwu h ILE 133 Ca 0.22 -0.52 -0.11 0.00 1.00 0.00 0.00 64.86 65.46 1uwu h ILE 133 Cb 0.24 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1uwu h ILE 133 CO -0.01 0.14 -0.45 -0.26 0.00 0.00 0.00 178.15 177.57 1uwu h PHE 134 N -0.09 0.16 -0.41 1.37 0.04 -0.86 -1.04 116.94 116.11 1uwu h PHE 134 Ca 0.02 -0.05 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 1uwu h PHE 134 Cb 0.21 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 1uwu h PHE 134 CO -0.00 0.56 -0.05 0.87 -0.60 0.00 0.00 178.31 179.09 1uwu h LYS 135 N 0.11 0.76 -0.78 1.51 1.57 -1.08 -0.90 116.57 117.76 1uwu h LYS 135 Ca 0.01 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 1uwu h LYS 135 Cb 0.84 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.06 1uwu h LYS 135 CO 0.06 0.87 0.29 0.22 -0.57 0.00 0.00 179.45 180.32 1uwu h ASP 136 N 0.59 1.10 0.04 0.86 3.58 -1.10 -0.93 116.42 120.57 1uwu h ASP 136 Ca 0.11 -0.18 0.01 0.00 0.42 0.00 0.00 57.03 57.39 1uwu h ASP 136 Cb 0.55 -0.29 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 1uwu h ASP 136 CO 0.03 0.99 -0.11 0.25 -2.88 0.00 0.00 179.24 177.52 1uwu h LEU 137 N 1.15 -0.32 -1.55 2.28 5.85 -1.01 -2.72 115.31 118.99 1uwu h LEU 137 Ca 0.26 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 1uwu h LEU 137 Cb 0.25 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1uwu h LEU 137 CO -0.02 -0.17 0.13 0.11 -0.34 0.00 0.00 178.44 178.15 1uwu h LYS 138 N -0.22 0.42 0.00 1.25 1.79 -0.88 -2.19 116.57 116.74 1uwu h LYS 138 Ca 0.03 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1uwu h LYS 138 Cb 0.25 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1uwu h LYS 138 CO -0.08 0.35 0.00 -1.13 -1.08 0.00 0.00 179.45 177.51 1uwu n SER 139 N -4.42 0.65 -0.56 0.86 3.41 -0.38 -1.74 113.62 111.44 1uwu n SER 139 Ca 0.01 0.68 0.09 0.00 -0.26 0.00 0.00 58.87 59.40 1uwu n SER 139 Cb 0.13 -0.81 0.32 0.00 -0.26 0.00 0.00 64.21 63.59 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 -2.24 1.72 -1.11 4.33 5.12 -0.83 -4.91 116.66 118.75 1uwu n ARG 140 Ca 0.01 -1.10 -0.04 0.00 -1.93 0.00 0.00 57.85 54.80 1uwu n ARG 140 Cb 0.19 -1.35 -0.02 0.00 -1.16 0.00 0.00 32.46 30.12 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 1.09 0.66 3.65 -0.13 0.00 -0.71 -4.92 105.19 104.83 1uwu n GLY 141 Ca 0.15 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.84 4.10 0.37 0.99 1.43 -1.22 -4.75 118.68 118.76 1uwu s LEU 142 Ca 0.00 1.02 -0.28 0.00 -1.03 0.00 0.00 54.13 53.85 1uwu s LEU 142 Cb 0.00 -3.15 -0.10 0.00 0.03 0.00 0.00 46.19 42.97 1uwu s LEU 142 CO 0.00 -0.47 1.40 -0.47 0.23 0.00 0.00 176.35 177.04 1uwu s TYR 143 N 2.62 2.75 -0.22 0.29 5.04 0.21 -4.47 117.35 123.57 1uwu s TYR 143 Ca 0.34 1.29 0.02 0.00 -2.44 0.00 0.00 57.07 56.28 1uwu s TYR 143 Cb -0.16 -3.86 0.05 0.00 0.35 0.00 0.00 41.96 38.35 1uwu s TYR 143 CO 0.09 -2.50 -0.12 0.12 -1.34 0.00 0.00 175.55 171.79 1uwu s PHE 144 N -1.15 2.82 -0.36 4.97 5.36 -1.26 -0.99 117.98 127.36 1uwu s PHE 144 Ca 0.53 -1.90 -0.14 0.00 -0.96 0.00 0.00 56.93 54.46 1uwu s PHE 144 Cb -0.43 -1.81 -0.01 0.00 -0.34 0.00 0.00 43.02 40.44 1uwu s PHE 144 CO 0.57 -0.81 0.26 0.42 -1.46 0.00 0.00 175.22 174.20 1uwu s ILE 145 N 1.26 5.28 -0.27 3.12 1.01 -0.15 -1.05 121.20 130.40 1uwu s ILE 145 Ca -0.03 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 1uwu s ILE 145 Cb -0.17 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1uwu s ILE 145 CO -0.08 -0.11 0.39 -0.22 0.00 0.00 0.00 174.94 174.93 1uwu s LEU 146 N 1.72 4.05 -0.04 2.97 2.96 -0.31 -2.63 118.68 127.39 1uwu s LEU 146 Ca 0.06 0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 54.16 1uwu s LEU 146 Cb -0.18 -2.46 -0.05 0.00 0.50 0.00 0.00 46.19 44.00 1uwu s LEU 146 CO 0.10 -0.20 0.31 0.21 -1.32 0.00 0.00 176.35 175.45 1uwu s ASN 147 N 1.63 6.65 0.21 3.68 2.47 0.02 -0.88 114.94 128.71 1uwu s ASN 147 Ca 0.16 0.77 0.17 0.00 0.42 0.00 0.00 52.86 54.38 1uwu s ASN 147 Cb -0.16 -2.18 0.01 0.00 -1.45 0.00 0.00 41.25 37.47 1uwu s ASN 147 CO 0.10 0.35 1.20 0.24 -3.72 0.00 0.00 177.10 175.26 1uwu h MET 148 N 4.75 0.00 -2.46 0.43 2.86 -1.10 -3.11 114.93 116.30 1uwu h MET 148 Ca -0.53 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.04 1uwu h MET 148 Cb 1.22 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.63 1uwu h MET 148 CO 0.60 0.33 -0.25 -0.47 1.06 0.00 0.00 176.91 178.19 1uwu s TYR 149 N -3.01 -0.78 -0.31 -0.22 5.04 -1.12 -4.62 117.35 112.32 1uwu s TYR 149 Ca 0.01 1.56 0.18 0.00 -2.44 0.00 0.00 57.07 56.39 1uwu s TYR 149 Cb 0.08 0.38 0.47 0.00 0.35 0.00 0.00 41.96 43.23 1uwu s TYR 149 CO 0.77 -0.43 0.99 1.58 -1.34 0.00 0.00 175.55 177.12 1uwu n HIS 150 N 4.60 1.05 0.00 4.97 -0.00 -1.26 -0.41 115.22 124.17 1uwu n HIS 150 Ca -0.19 -2.66 0.00 0.00 0.46 0.00 0.00 57.72 55.33 1uwu n HIS 150 Cb 0.54 -0.29 0.00 0.00 -0.12 0.00 0.00 29.99 30.12 1uwu n HIS 150 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 1uwu n TRP 151 N -0.17 0.00 -1.93 1.57 8.01 -1.26 -4.88 117.44 118.77 1uwu n TRP 151 Ca 0.08 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.86 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 4.22 0.11 -0.99 0.02 -1.26 -4.95 135.00 132.15 1uwu s PRO 152 Ca 0.00 2.40 0.05 0.00 0.02 0.00 0.00 61.00 63.47 1uwu s PRO 152 Cb 0.00 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 1uwu s PRO 152 CO 0.00 -0.47 0.00 -0.51 -0.33 0.00 0.00 177.00 175.70 1uwu s LEU 153 N -0.74 3.43 0.31 -5.54 1.43 -1.26 -4.79 118.68 111.52 1uwu s LEU 153 Ca 0.59 -0.23 -0.29 0.00 -1.03 0.00 0.00 54.13 53.17 1uwu s LEU 153 Cb -0.44 -2.15 -0.13 0.00 0.03 0.00 0.00 46.19 43.51 1uwu s LEU 153 CO 0.48 0.15 1.32 -2.65 0.23 0.00 0.00 176.35 175.88 1uwu n PRO 154 N 0.38 2.08 0.16 1.29 -0.02 -1.26 -0.87 135.00 136.77 1uwu n PRO 154 Ca -0.11 0.73 0.15 0.00 -2.02 0.00 0.00 63.50 62.26 1uwu n PRO 154 Cb 0.53 -2.33 0.73 0.00 -0.02 0.00 0.00 33.50 32.40 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 3.06 0.00 -0.18 2.45 3.38 -1.53 0.33 115.31 122.83 1uwu h LEU 155 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 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 0.67 0.00 0.00 -2.67 0.09 0.00 0.00 178.44 176.53 1uwu n TRP 156 N -4.22 0.37 -0.02 1.13 4.27 -1.26 -2.47 117.44 115.24 1uwu n TRP 156 Ca 0.03 0.13 0.07 0.00 -3.89 0.00 0.00 57.50 53.84 1uwu n TRP 156 Cb 0.33 -0.71 -0.16 0.00 -1.36 0.00 0.00 31.31 29.41 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 -1.82 0.03 -3.37 5.67 4.77 0.05 -4.82 117.00 117.50 1uwu n LEU 157 Ca 0.04 0.01 -0.06 0.00 -0.03 0.00 0.00 56.01 55.97 1uwu n LEU 157 Cb 0.27 0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.38 1uwu n LEU 157 CO 0.21 0.08 0.01 -2.28 -1.33 0.00 0.00 177.39 174.09 1uwu s HIS 158 N -3.34 -1.01 -0.51 -1.77 5.04 -0.85 -1.08 115.29 111.77 1uwu s HIS 158 Ca -0.08 1.18 -0.16 0.00 -1.54 0.00 0.00 55.06 54.47 1uwu s HIS 158 Cb 0.13 0.21 0.11 0.00 0.04 0.00 0.00 32.58 33.06 1uwu s HIS 158 CO 0.89 -0.71 0.45 0.34 -2.34 0.00 0.00 174.74 173.37 1uwu s ASP 159 N 2.64 6.15 0.32 9.88 -1.08 -0.45 -4.27 116.67 129.86 1uwu s ASP 159 Ca 0.12 -1.61 0.16 0.00 -0.52 0.00 0.00 52.55 50.69 1uwu s ASP 159 Cb -0.15 -2.19 0.44 0.00 -1.46 0.00 0.00 42.92 39.56 1uwu s ASP 159 CO -0.17 -0.77 1.62 1.55 0.52 0.00 0.00 175.17 177.92 1uwu h PRO 160 N 8.82 0.00 -0.19 4.34 0.13 -1.86 -3.07 132.00 140.16 1uwu h PRO 160 Ca -0.29 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.75 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 0.97 0.48 -0.22 0.82 -0.23 0.00 0.00 178.00 179.82 1uwu h ILE 161 N 0.00 1.33 -0.38 -3.56 1.08 -1.93 0.41 117.51 114.47 1uwu h ILE 161 Ca -0.00 -1.40 0.08 0.00 -0.39 0.00 0.00 64.86 63.15 1uwu h ILE 161 Cb 1.10 1.80 -0.08 0.00 -3.07 0.00 0.00 36.82 36.57 1uwu h ILE 161 CO 0.06 0.43 -0.15 0.03 -0.69 0.00 0.00 178.15 177.82 1uwu h ARG 162 N 0.16 -0.08 -0.35 2.37 3.08 -1.87 -1.39 114.38 116.30 1uwu h ARG 162 Ca 0.03 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1uwu h ARG 162 Cb 0.77 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 1uwu h ARG 162 CO 0.05 -0.05 0.15 0.28 -1.07 0.00 0.00 179.97 179.33 1uwu h VAL 163 N -0.08 1.18 -0.92 2.04 2.07 -1.49 -1.44 116.25 117.61 1uwu h VAL 163 Ca 0.19 -0.56 0.21 0.00 0.82 0.00 0.00 66.70 67.36 1uwu h VAL 163 Cb 0.37 0.90 -0.12 0.00 -1.52 0.00 0.00 31.29 30.92 1uwu h VAL 163 CO -0.44 0.20 0.46 -0.09 0.02 0.00 0.00 177.57 177.73 1uwu h ARG 164 N 0.42 0.50 0.00 1.57 2.43 -0.57 0.16 114.38 118.89 1uwu h ARG 164 Ca 0.12 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1uwu h ARG 164 Cb 0.18 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1uwu h ARG 164 CO -0.01 0.33 0.00 0.54 -1.51 0.00 0.00 179.97 179.32 1uwu n ARG 165 N -4.95 0.52 -0.49 0.20 1.74 -0.55 -4.84 116.66 108.28 1uwu n ARG 165 Ca 0.22 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.34 1uwu n ARG 165 Cb 0.62 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 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 0.49 0.73 3.41 -0.13 0.00 0.58 -5.04 105.19 105.23 1uwu n GLY 166 Ca 0.14 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.26 5.91 -0.15 1.61 2.15 -0.59 -4.96 116.67 118.38 1uwu s ASP 167 Ca 0.00 -0.95 0.17 0.00 0.43 0.00 0.00 52.55 52.20 1uwu s ASP 167 Cb 0.00 -2.09 0.76 0.00 -0.30 0.00 0.00 42.92 41.29 1uwu s ASP 167 CO 0.00 -0.42 1.68 0.49 -0.17 0.00 0.00 175.17 176.75 1uwu n PHE 168 N 5.07 1.68 1.00 -5.34 3.72 -1.26 -3.55 117.46 118.77 1uwu n PHE 168 Ca -0.11 -0.65 0.13 0.00 -0.05 0.00 0.00 57.45 56.77 1uwu n PHE 168 Cb 0.46 -0.32 0.41 0.00 -0.94 0.00 0.00 39.48 39.09 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 1.00 0.00 -2.73 4.37 -2.24 -1.26 -4.92 114.28 108.51 1uwu n THR 169 Ca 0.27 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1uwu n THR 169 Cb 0.99 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 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 1.50 2.47 3.66 3.38 0.00 -1.26 -5.04 105.19 109.90 1uwu n GLY 170 Ca 0.06 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 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 -0.05 4.15 -0.12 1.61 0.02 -1.26 -4.89 135.00 134.46 1uwu s PRO 171 Ca 0.00 2.28 0.15 0.00 0.02 0.00 0.00 61.00 63.45 1uwu s PRO 171 Cb 0.00 -4.04 0.39 0.00 0.02 0.00 0.00 34.50 30.87 1uwu s PRO 171 CO 0.00 -0.90 1.29 -1.13 -0.33 0.00 0.00 177.00 175.93 1uwu n SER 172 N 7.33 3.20 0.00 2.53 3.41 -1.14 -1.34 113.62 127.60 1uwu n SER 172 Ca 0.18 -2.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.03 1uwu n SER 172 Cb 0.42 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1uwu n SER 172 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwu n GLY 173 N -0.53 3.37 0.00 5.00 0.00 -0.24 -1.82 105.19 110.97 1uwu n GLY 173 Ca 0.16 -0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.10 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 14.00 0.00 1.42 1.61 7.02 -1.26 -1.75 117.44 138.47 1uwu n TRP 174 Ca 0.00 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.62 1uwu n TRP 174 Cb 0.00 -0.11 0.68 0.00 -2.42 0.00 0.00 31.31 29.46 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 -1.11 0.22 -4.29 -0.99 4.77 -0.76 -4.26 117.00 110.58 1uwu n LEU 175 Ca 0.09 0.15 -0.32 0.00 -0.03 0.00 0.00 56.01 55.90 1uwu n LEU 175 Cb 0.07 -0.23 -0.16 0.00 -2.33 0.00 0.00 43.42 40.77 1uwu n LEU 175 CO 0.08 0.04 -0.54 -0.55 -1.33 0.00 0.00 177.39 175.10 1uwu s SER 176 N -2.53 3.29 0.47 -1.43 0.15 -0.72 -4.97 113.70 107.96 1uwu s SER 176 Ca 0.29 -0.47 0.32 0.00 0.70 0.00 0.00 55.95 56.79 1uwu s SER 176 Cb 0.20 -1.05 1.46 0.00 -1.71 0.00 0.00 66.02 64.92 1uwu s SER 176 CO 0.47 0.23 1.95 0.71 1.20 0.00 0.00 173.24 177.80 1uwu h THR 177 N 5.16 0.00 -0.85 6.45 1.35 -1.86 -2.26 112.91 120.90 1uwu h THR 177 Ca -0.30 -0.26 0.06 0.00 -0.55 0.00 0.00 66.41 65.36 1uwu h THR 177 Cb 1.19 1.12 -0.05 0.00 -1.73 0.00 0.00 68.15 68.68 1uwu h THR 177 CO 0.48 0.00 0.55 -0.09 -0.25 0.00 0.00 175.52 176.22 1uwu h ARG 178 N 0.00 0.92 -0.64 4.72 9.65 -1.91 -0.74 114.38 126.38 1uwu h ARG 178 Ca 0.00 -0.06 -0.08 0.00 -1.10 0.00 0.00 59.98 58.75 1uwu h ARG 178 Cb 0.30 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 1uwu h ARG 178 CO 0.00 0.61 0.09 1.15 2.80 0.00 0.00 179.97 184.62 1uwu h THR 179 N 0.95 1.26 -0.48 0.20 2.02 -1.64 -1.04 112.91 114.18 1uwu h THR 179 Ca 0.36 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1uwu h THR 179 Cb 0.20 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 1uwu h THR 179 CO -0.13 0.39 0.26 0.58 0.37 0.00 0.00 175.52 176.98 1uwu h VAL 180 N 0.98 1.17 0.18 3.16 2.07 -1.42 0.51 116.25 122.90 1uwu h VAL 180 Ca 0.19 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1uwu h VAL 180 Cb 0.45 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1uwu h VAL 180 CO 0.01 0.19 -0.08 0.22 0.02 0.00 0.00 177.57 177.93 1uwu h TYR 181 N 0.63 -0.22 -0.01 1.57 3.20 -1.00 -2.49 116.97 118.65 1uwu h TYR 181 Ca 0.17 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 1uwu h TYR 181 Cb 0.07 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1uwu h TYR 181 CO -0.02 -0.04 -0.35 0.93 -1.64 0.00 0.00 178.16 177.05 1uwu h GLU 182 N -0.36 0.02 -0.50 1.82 4.39 -1.05 -2.87 114.58 116.02 1uwu h GLU 182 Ca -0.02 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 1uwu h GLU 182 Cb 0.28 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 1uwu h GLU 182 CO 0.04 0.37 0.02 0.35 -1.16 0.00 0.00 179.01 178.63 1uwu h PHE 183 N 0.02 0.95 -0.56 4.33 3.57 -0.77 0.86 116.94 125.33 1uwu h PHE 183 Ca -0.00 -0.16 0.02 0.00 3.53 0.00 0.00 57.97 61.36 1uwu h PHE 183 Cb 0.63 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 1uwu h PHE 183 CO 0.00 0.88 0.35 0.00 -2.23 0.00 0.00 178.31 177.31 1uwu h ALA 184 N 0.94 0.72 -0.44 2.41 0.00 -1.27 -0.06 119.26 121.57 1uwu h ALA 184 Ca 0.15 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1uwu h ALA 184 Cb 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1uwu h ALA 184 CO 0.02 0.08 -0.16 0.00 0.00 0.00 0.00 179.25 179.19 1uwu h ARG 185 N 0.69 0.88 -0.53 0.00 3.08 -1.28 -2.14 114.38 115.08 1uwu h ARG 185 Ca 0.22 -0.36 0.01 0.00 0.07 0.00 0.00 59.98 59.92 1uwu h ARG 185 Cb -0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 1uwu h ARG 185 CO -0.09 1.01 0.34 0.35 -1.07 0.00 0.00 179.97 180.51 1uwu h PHE 186 N 0.71 0.63 -0.24 3.04 3.57 -0.53 0.12 116.94 124.23 1uwu h PHE 186 Ca 0.10 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1uwu h PHE 186 Cb 0.71 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.23 1uwu h PHE 186 CO 0.05 0.38 0.09 0.77 -2.23 0.00 0.00 178.31 177.37 1uwu h SER 187 N 0.68 0.33 -0.95 0.41 0.02 -0.88 -0.81 113.55 112.35 1uwu h SER 187 Ca 0.20 -0.17 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1uwu h SER 187 Cb -0.04 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 1uwu h SER 187 CO -0.07 0.42 0.61 0.00 -1.14 0.00 0.00 176.83 176.65 1uwu h ALA 188 N 0.93 1.27 -0.45 3.77 0.00 -1.25 -2.10 119.26 121.43 1uwu h ALA 188 Ca 0.08 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1uwu h ALA 188 Cb 0.19 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1uwu h ALA 188 CO -0.01 0.46 0.16 -0.92 0.00 0.00 0.00 179.25 178.94 1uwu h TYR 189 N 1.16 0.70 -0.22 0.00 3.20 -0.31 -0.61 116.97 120.89 1uwu h TYR 189 Ca 0.39 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 62.16 1uwu h TYR 189 Cb 0.06 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1uwu h TYR 189 CO -0.01 0.61 -0.01 0.82 -1.64 0.00 0.00 178.16 177.94 1uwu h ILE 190 N 0.58 1.26 -0.78 1.81 1.08 -0.96 -0.86 117.51 119.64 1uwu h ILE 190 Ca 0.15 -0.91 0.06 0.00 -0.39 0.00 0.00 64.86 63.77 1uwu h ILE 190 Cb 0.23 1.42 -0.06 0.00 -3.07 0.00 0.00 36.82 35.34 1uwu h ILE 190 CO -0.01 0.28 0.47 0.00 -0.69 0.00 0.00 178.15 178.20 1uwu h ALA 191 N 0.79 1.07 -0.77 1.87 0.00 -1.32 0.19 119.26 121.10 1uwu h ALA 191 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1uwu h ALA 191 Cb 0.42 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1uwu h ALA 191 CO 0.01 0.19 0.49 2.35 0.00 0.00 0.00 179.25 182.29 1uwu h TRP 192 N 0.86 0.93 0.01 0.00 7.01 -0.72 -0.00 115.95 124.03 1uwu h TRP 192 Ca 0.35 0.02 -0.20 0.00 2.11 0.00 0.00 58.89 61.17 1uwu h TRP 192 Cb 0.18 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.91 1uwu h TRP 192 CO -0.05 0.55 -0.93 0.87 -2.79 0.00 0.00 178.44 176.09 1uwu h LYS 193 N 0.97 0.05 -0.00 2.65 1.79 -0.42 -3.39 116.57 118.22 1uwu h LYS 193 Ca 0.30 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1uwu h LYS 193 Cb -0.02 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1uwu h LYS 193 CO -0.10 0.94 -0.00 1.19 -1.08 0.00 0.00 179.45 180.39 1uwu n PHE 194 N -3.50 0.00 -0.27 -1.35 3.72 0.62 -4.75 117.46 111.93 1uwu n PHE 194 Ca -0.01 0.00 0.29 0.00 -0.05 0.00 0.00 57.45 57.68 1uwu n PHE 194 Cb 0.86 0.00 0.67 0.00 -0.94 0.00 0.00 39.48 40.08 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 0.61 0.12 0.32 4.37 3.58 -1.19 0.23 116.42 124.47 1uwu h ASP 195 Ca 0.00 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.44 1uwu h ASP 195 Cb 0.13 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.18 1uwu h ASP 195 CO 0.00 0.03 -0.13 -2.24 -2.88 0.00 0.00 179.24 174.02 1uwu h ASP 196 N 0.11 0.00 0.12 2.28 2.03 -1.85 -3.14 116.42 115.97 1uwu h ASP 196 Ca 0.52 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.60 1uwu h ASP 196 Cb 1.83 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 40.29 1uwu h ASP 196 CO -0.08 0.13 -2.10 0.18 -1.03 0.00 0.00 179.24 176.34 1uwu n LEU 197 N -3.75 0.15 -4.81 0.15 4.77 0.78 -5.00 117.00 109.30 1uwu n LEU 197 Ca -0.02 0.07 -0.36 0.00 -0.03 0.00 0.00 56.01 55.66 1uwu n LEU 197 Cb 0.23 0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 41.53 1uwu n LEU 197 CO 0.31 0.28 0.46 -0.69 -1.33 0.00 0.00 177.39 176.42 1uwu s VAL 198 N -2.89 4.50 -0.25 4.08 1.01 -1.03 -4.78 120.40 121.04 1uwu s VAL 198 Ca -0.08 1.39 -0.12 0.00 0.00 0.00 0.00 61.98 63.17 1uwu s VAL 198 Cb 0.09 -3.89 -0.11 0.00 0.00 0.00 0.00 36.38 32.47 1uwu s VAL 198 CO 0.85 0.21 -0.32 0.47 0.00 0.00 0.00 175.10 176.31 1uwu n ASP 199 N 0.73 1.78 -4.14 3.32 8.00 -0.21 -4.96 116.55 121.07 1uwu n ASP 199 Ca -0.02 0.28 -0.10 0.00 0.71 0.00 0.00 54.79 55.66 1uwu n ASP 199 Cb 0.51 -0.71 -0.10 0.00 -0.02 0.00 0.00 41.12 40.79 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 -2.46 0.74 0.08 -1.24 2.02 -0.92 -4.45 118.70 112.48 1uwu s GLU 200 Ca -0.35 -1.24 0.08 0.00 0.02 0.00 0.00 54.97 53.48 1uwu s GLU 200 Cb 0.13 -0.12 -0.04 0.00 0.10 0.00 0.00 34.13 34.20 1uwu s GLU 200 CO 0.44 -0.03 -0.17 0.71 0.02 0.00 0.00 175.26 176.23 1uwu s TYR 201 N -3.41 2.56 -0.02 1.61 2.02 -0.09 -1.16 117.35 118.87 1uwu s TYR 201 Ca 0.08 -0.25 0.08 0.00 -0.37 0.00 0.00 57.07 56.61 1uwu s TYR 201 Cb 0.04 -1.41 -0.02 0.00 -0.40 0.00 0.00 41.96 40.17 1uwu s TYR 201 CO -0.05 0.32 -0.25 0.45 -1.57 0.00 0.00 175.55 174.45 1uwu s SER 202 N -1.80 3.10 0.10 2.29 0.15 -0.06 -0.29 113.70 117.19 1uwu s SER 202 Ca 0.16 -0.46 -0.13 0.00 0.70 0.00 0.00 55.95 56.23 1uwu s SER 202 Cb -0.11 -0.36 -0.16 0.00 -1.71 0.00 0.00 66.02 63.68 1uwu s SER 202 CO 0.08 0.32 1.30 0.71 1.20 0.00 0.00 173.24 176.84 1uwu h THR 203 N 4.47 1.28 -2.57 6.45 1.35 -1.62 -1.12 112.91 121.15 1uwu h THR 203 Ca -0.43 -2.00 -0.09 0.00 -0.55 0.00 0.00 66.41 63.33 1uwu h THR 203 Cb 1.12 2.02 -0.20 0.00 -1.73 0.00 0.00 68.15 69.36 1uwu h THR 203 CO 0.47 0.63 -0.08 -0.32 -0.25 0.00 0.00 175.52 175.97 1uwu s MET 204 N -3.71 0.80 -0.27 4.72 1.75 -1.26 -2.80 119.30 118.53 1uwu s MET 204 Ca -0.10 0.13 -0.08 0.00 -1.25 0.00 0.00 55.69 54.39 1uwu s MET 204 Cb 0.08 0.37 -0.02 0.00 2.84 0.00 0.00 34.83 38.11 1uwu s MET 204 CO 0.91 -0.22 0.09 1.21 -0.65 0.00 0.00 175.02 176.36 1uwu s ASN 205 N -1.00 5.20 -1.07 1.11 2.47 0.45 -1.63 114.94 120.47 1uwu s ASN 205 Ca -0.10 -0.37 -0.18 0.00 0.42 0.00 0.00 52.86 52.62 1uwu s ASN 205 Cb -0.03 -1.93 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 1uwu s ASN 205 CO 0.06 -0.10 0.75 -0.62 -3.72 0.00 0.00 177.10 173.47 1uwu n GLU 206 N 4.92 -1.13 0.14 0.43 1.02 0.23 -4.73 120.64 121.52 1uwu n GLU 206 Ca -0.15 0.54 0.08 0.00 -0.02 0.00 0.00 57.16 57.61 1uwu n GLU 206 Cb 0.50 -3.79 0.57 0.00 -0.02 0.00 0.00 31.44 28.71 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 -1.55 0.18 -0.18 3.49 0.13 -1.89 -2.00 132.00 130.18 1uwu h PRO 207 Ca -0.61 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.49 1uwu h PRO 207 Cb 1.34 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1uwu h PRO 207 CO 0.45 0.12 -0.00 -2.95 -0.23 0.00 0.00 178.00 175.39 1uwu h ASN 208 N 0.19 0.23 -0.12 1.44 -1.07 -1.93 -1.81 115.58 112.51 1uwu h ASN 208 Ca 0.08 -0.03 -0.21 0.00 0.07 0.00 0.00 56.30 56.21 1uwu h ASN 208 Cb 0.10 -0.06 0.01 0.00 -2.07 0.00 0.00 38.32 36.30 1uwu h ASN 208 CO -0.01 0.29 -0.75 0.58 0.07 0.00 0.00 177.43 177.60 1uwu h VAL 209 N 0.26 1.30 0.00 6.14 2.07 -1.73 0.46 116.25 124.75 1uwu h VAL 209 Ca 0.06 -1.98 0.02 0.00 0.82 0.00 0.00 66.70 65.62 1uwu h VAL 209 Cb 0.18 2.10 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 1uwu h VAL 209 CO 0.00 0.62 -0.10 0.58 0.02 0.00 0.00 177.57 178.69 1uwu h VAL 210 N 0.41 0.74 -0.16 2.57 2.07 -1.30 0.96 116.25 121.54 1uwu h VAL 210 Ca -0.06 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.29 1uwu h VAL 210 Cb 1.39 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1uwu h VAL 210 CO 0.15 0.00 -0.60 1.23 0.02 0.00 0.00 177.57 178.37 1uwu h GLY 211 N -0.18 0.60 0.46 2.17 0.00 -1.39 -1.61 103.07 103.13 1uwu h GLY 211 Ca 0.04 -0.74 -0.00 0.00 0.00 0.00 0.00 47.33 46.63 1uwu h GLY 211 CO -0.10 0.66 -0.01 -1.33 0.00 0.00 0.00 176.54 175.76 1uwu h GLY 212 N 1.07 -0.03 1.46 4.60 0.00 -0.69 -2.94 103.07 106.53 1uwu h GLY 212 Ca -0.00 0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.22 1uwu h GLY 212 CO 0.11 -0.01 -0.93 1.41 0.00 0.00 0.00 176.54 177.13 1uwu h LEU 213 N -0.57 0.00 -1.11 3.11 3.38 -0.92 -1.23 115.31 117.97 1uwu h LEU 213 Ca -0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1uwu h LEU 213 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1uwu h LEU 213 CO 0.00 0.47 -0.13 1.23 0.09 0.00 0.00 178.44 180.10 1uwu h GLY 214 N 3.66 0.51 0.00 0.83 0.00 -1.37 -3.35 103.07 103.34 1uwu h GLY 214 Ca -0.07 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1uwu h GLY 214 CO 0.05 0.33 0.00 -1.72 0.00 0.00 0.00 176.54 175.19 1uwu n TYR 215 N -4.20 0.00 0.09 5.60 4.01 -1.11 -1.74 117.16 119.80 1uwu n TYR 215 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1uwu n TYR 215 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 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 -0.20 0.61 -1.47 -0.72 0.31 -0.72 -0.53 118.33 115.60 1uwu n VAL 216 Ca 0.00 0.20 -0.40 0.00 -0.01 0.00 0.00 64.34 64.13 1uwu n VAL 216 Cb 0.07 -1.04 -0.02 0.00 -0.91 0.00 0.00 33.84 31.94 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 2.56 4.20 0.22 2.92 0.00 -0.55 -4.70 105.19 109.86 1uwu n GLY 217 Ca 0.00 -1.50 0.15 0.00 0.00 0.00 0.00 46.02 44.67 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 3.53 0.00 0.00 1.61 -1.51 -1.87 -1.61 116.25 116.40 1uwu h VAL 218 Ca 0.70 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 65.78 1uwu h VAL 218 Cb 0.45 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1uwu h VAL 218 CO 1.83 0.00 0.00 0.11 -1.23 0.00 0.00 177.57 178.28 1uwu h LYS 219 N 0.00 0.00 0.00 5.19 1.57 -1.90 -2.77 116.57 118.66 1uwu h LYS 219 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1uwu h LYS 219 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1uwu h LYS 219 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.75 1uwu n SER 220 N -2.58 0.38 -2.73 0.86 3.41 -0.61 -4.92 113.62 107.44 1uwu n SER 220 Ca 0.01 0.60 -0.17 0.00 -0.26 0.00 0.00 58.87 59.06 1uwu n SER 220 Cb 0.23 -0.68 0.06 0.00 -0.26 0.00 0.00 64.21 63.55 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 -0.14 -0.13 3.78 5.00 0.00 -1.05 -4.69 105.19 107.96 1uwu n GLY 221 Ca 0.02 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.23 3.34 0.45 1.61 0.40 -1.26 -4.63 117.98 114.66 1uwu s PHE 222 Ca 0.37 0.30 -0.23 0.00 -0.60 0.00 0.00 56.93 56.78 1uwu s PHE 222 Cb -0.16 -1.82 -0.08 0.00 0.51 0.00 0.00 43.02 41.47 1uwu s PHE 222 CO 0.52 0.58 1.11 -1.25 0.70 0.00 0.00 175.22 176.88 1uwu s PRO 223 N -1.22 3.87 -0.04 0.24 0.04 -1.26 -1.32 135.00 135.30 1uwu s PRO 223 Ca 0.17 1.63 0.15 0.00 0.04 0.00 0.00 61.00 62.98 1uwu s PRO 223 Cb -0.12 -2.39 0.50 0.00 0.04 0.00 0.00 34.50 32.53 1uwu s PRO 223 CO 0.07 -0.42 1.39 -0.35 0.04 0.00 0.00 177.00 177.73 1uwu n PRO 224 N -0.45 2.63 -3.30 0.56 -0.04 -1.25 -4.43 135.00 128.71 1uwu n PRO 224 Ca 0.07 -1.99 -0.22 0.00 -0.04 0.00 0.00 63.50 61.31 1uwu n PRO 224 Cb 0.49 -1.57 0.06 0.00 -0.04 0.00 0.00 33.50 32.44 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 1.11 -0.48 3.40 0.55 0.00 -0.44 -3.53 105.19 105.81 1uwu n GLY 225 Ca 0.18 0.16 -0.37 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.24 3.13 -0.43 1.61 5.04 -1.07 -4.86 117.35 117.54 1uwu s TYR 226 Ca 0.44 -0.68 -0.28 0.00 -2.44 0.00 0.00 57.07 54.11 1uwu s TYR 226 Cb -0.20 -2.28 0.02 0.00 0.35 0.00 0.00 41.96 39.86 1uwu s TYR 226 CO 0.55 -0.47 1.06 -1.17 -1.34 0.00 0.00 175.55 174.18 1uwu s LEU 227 N 1.57 3.80 -0.30 6.97 2.96 -1.26 -4.24 118.68 128.19 1uwu s LEU 227 Ca 0.04 0.56 -0.08 0.00 -0.22 0.00 0.00 54.13 54.43 1uwu s LEU 227 Cb -0.16 -3.46 0.17 0.00 0.50 0.00 0.00 46.19 43.24 1uwu s LEU 227 CO 0.04 -1.09 0.80 -0.55 -1.32 0.00 0.00 176.35 174.23 1uwu s SER 228 N 2.18 -0.96 0.17 3.68 0.15 0.31 -5.02 113.70 114.20 1uwu s SER 228 Ca 0.44 0.81 -0.14 0.00 0.70 0.00 0.00 55.95 57.76 1uwu s SER 228 Cb -0.09 1.89 0.11 0.00 -1.71 0.00 0.00 66.02 66.22 1uwu s SER 228 CO 0.26 -0.18 1.78 -0.26 1.20 0.00 0.00 173.24 176.04 1uwu h PHE 229 N 7.91 0.43 -0.02 3.44 0.04 -1.93 -0.49 116.94 126.32 1uwu h PHE 229 Ca -0.18 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.61 1uwu h PHE 229 Cb 1.15 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 39.17 1uwu h PHE 229 CO 0.12 0.21 0.01 1.49 -0.60 0.00 0.00 178.31 179.54 1uwu h GLU 230 N 0.46 0.03 0.00 1.51 4.81 -1.95 -1.50 114.58 117.94 1uwu h GLU 230 Ca 0.21 -0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 1uwu h GLU 230 Cb 0.12 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1uwu h GLU 230 CO -0.15 0.05 -0.42 -0.07 -0.73 0.00 0.00 179.01 177.69 1uwu h LEU 231 N -0.00 0.00 -0.52 1.64 3.38 -1.91 -1.73 115.31 116.17 1uwu h LEU 231 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1uwu h LEU 231 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1uwu h LEU 231 CO -0.00 0.42 0.26 -1.28 0.09 0.00 0.00 178.44 177.94 1uwu h SER 232 N 0.00 0.66 -0.32 -0.43 0.87 -0.65 -0.25 113.55 113.44 1uwu h SER 232 Ca -0.00 -0.11 0.04 0.00 -1.23 0.00 0.00 61.79 60.48 1uwu h SER 232 Cb 0.75 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.50 1uwu h SER 232 CO 0.06 0.59 0.09 0.03 -0.53 0.00 0.00 176.83 177.06 1uwu h ARG 233 N 0.69 0.21 -0.37 2.24 3.08 -0.98 -0.96 114.38 118.30 1uwu h ARG 233 Ca 0.18 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.23 1uwu h ARG 233 Cb 0.09 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1uwu h ARG 233 CO -0.03 0.14 0.23 -0.09 -1.07 0.00 0.00 179.97 179.15 1uwu h ARG 234 N 0.22 0.46 -0.61 0.04 2.43 -1.14 -0.31 114.38 115.46 1uwu h ARG 234 Ca 0.14 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.31 1uwu h ARG 234 Cb 0.13 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 1uwu h ARG 234 CO -0.17 0.30 0.38 0.00 -1.51 0.00 0.00 179.97 178.97 1uwu h ALA 235 N 1.15 0.79 -0.54 2.80 0.00 -0.88 -1.12 119.26 121.47 1uwu h ALA 235 Ca 0.14 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1uwu h ALA 235 Cb -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1uwu h ALA 235 CO -0.04 0.12 -0.06 0.52 0.00 0.00 0.00 179.25 179.78 1uwu h MET 236 N 0.74 0.99 -0.36 0.00 2.86 -0.76 -0.83 114.93 117.58 1uwu h MET 236 Ca 0.24 -0.35 0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1uwu h MET 236 Cb 0.01 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1uwu h MET 236 CO -0.10 1.03 0.17 -0.92 1.06 0.00 0.00 176.91 178.15 1uwu h TYR 237 N 0.87 0.31 -0.40 -0.22 3.20 -0.71 -1.52 116.97 118.51 1uwu h TYR 237 Ca 0.14 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 1uwu h TYR 237 Cb 0.62 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1uwu h TYR 237 CO 0.04 0.16 0.17 -0.91 -1.64 0.00 0.00 178.16 175.98 1uwu h ASN 238 N 0.35 0.54 -0.14 -2.11 2.35 -0.98 -2.64 115.58 112.96 1uwu h ASN 238 Ca 0.15 -0.16 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 1uwu h ASN 238 Cb 0.08 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1uwu h ASN 238 CO -0.12 0.55 -0.08 -0.29 -1.65 0.00 0.00 177.43 175.85 1uwu h ILE 239 N 0.50 1.21 0.16 2.81 2.10 -1.02 0.24 117.51 123.51 1uwu h ILE 239 Ca 0.13 -0.89 -0.01 0.00 1.08 0.00 0.00 64.86 65.18 1uwu h ILE 239 Cb 0.17 1.09 0.00 0.00 -1.09 0.00 0.00 36.82 36.99 1uwu h ILE 239 CO -0.01 0.29 -0.08 0.40 -1.08 0.00 0.00 178.15 177.67 1uwu h ILE 240 N 0.43 0.87 -0.68 2.19 2.04 -1.15 0.86 117.51 122.08 1uwu h ILE 240 Ca 0.09 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.85 1uwu h ILE 240 Cb 0.41 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 1uwu h ILE 240 CO 0.02 0.03 0.45 1.56 0.00 0.00 0.00 178.15 180.21 1uwu h GLN 241 N -0.27 0.83 -0.66 2.37 4.20 -1.08 -1.35 115.11 119.15 1uwu h GLN 241 Ca -0.02 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.56 1uwu h GLN 241 Cb 0.21 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 1uwu h GLN 241 CO 0.04 0.55 0.11 0.00 -0.67 0.00 0.00 178.83 178.85 1uwu h ALA 242 N 1.59 0.94 0.08 3.87 0.00 -0.13 -0.58 119.26 125.02 1uwu h ALA 242 Ca 0.26 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uwu h ALA 242 Cb 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1uwu h ALA 242 CO -0.07 0.66 -0.04 1.25 0.00 0.00 0.00 179.25 181.06 1uwu h HIS 243 N 1.02 -0.10 -0.69 0.00 -0.00 0.25 0.42 115.15 116.05 1uwu h HIS 243 Ca 0.20 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.57 1uwu h HIS 243 Cb 0.43 0.03 -0.03 0.00 -0.00 0.00 0.00 27.41 27.84 1uwu h HIS 243 CO 0.03 -0.04 0.45 0.00 -0.00 0.00 0.00 177.93 178.37 1uwu h ALA 244 N 0.80 0.88 -0.31 5.26 0.00 -1.09 -0.04 119.26 124.76 1uwu h ALA 244 Ca -0.01 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1uwu h ALA 244 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1uwu h ALA 244 CO 0.02 0.32 -0.43 -0.09 0.00 0.00 0.00 179.25 179.07 1uwu h ARG 245 N 0.94 0.79 -0.87 0.00 9.65 -1.00 -1.91 114.38 121.97 1uwu h ARG 245 Ca 0.25 -0.43 -0.01 0.00 -1.10 0.00 0.00 59.98 58.69 1uwu h ARG 245 Cb -0.09 0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.47 1uwu h ARG 245 CO -0.05 1.06 0.52 0.00 2.80 0.00 0.00 179.97 184.30 1uwu h ALA 246 N 0.87 1.27 -0.25 2.80 0.00 -0.58 -0.51 119.26 122.86 1uwu h ALA 246 Ca 0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1uwu h ALA 246 Cb 0.99 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1uwu h ALA 246 CO 0.10 0.62 0.14 -0.92 0.00 0.00 0.00 179.25 179.18 1uwu h TYR 247 N 1.21 0.34 -0.74 0.00 5.03 -0.71 0.57 116.97 122.66 1uwu h TYR 247 Ca 0.31 -0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.56 1uwu h TYR 247 Cb -0.04 -0.11 -0.03 0.00 1.55 0.00 0.00 36.73 38.10 1uwu h TYR 247 CO 0.01 0.29 0.25 -0.44 -1.32 0.00 0.00 178.16 176.95 1uwu h ASP 248 N 0.29 1.07 -0.23 -2.11 3.32 -1.15 -0.91 116.42 116.68 1uwu h ASP 248 Ca 0.09 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 1uwu h ASP 248 Cb 0.06 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1uwu h ASP 248 CO -0.01 0.98 0.08 1.23 -1.72 0.00 0.00 179.24 179.79 1uwu h GLY 249 N 1.09 0.38 1.00 2.75 0.00 -0.90 -1.02 103.07 106.38 1uwu h GLY 249 Ca 0.24 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1uwu h GLY 249 CO -0.01 0.21 0.26 -2.22 0.00 0.00 0.00 176.54 174.78 1uwu h ILE 250 N 0.21 1.11 0.00 2.60 2.04 -0.71 -2.92 117.51 119.84 1uwu h ILE 250 Ca 0.08 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1uwu h ILE 250 Cb 0.22 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1uwu h ILE 250 CO -0.00 0.11 -0.00 0.11 0.00 0.00 0.00 178.15 178.36 1uwu h LYS 251 N 0.54 0.00 0.00 2.37 1.79 -0.93 -0.20 116.57 120.14 1uwu h LYS 251 Ca 0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.62 1uwu h LYS 251 Cb -0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1uwu h LYS 251 CO -0.03 0.00 0.00 0.66 -1.08 0.00 0.00 179.45 179.00 1uwu h SER 252 N 0.00 0.00 0.00 0.86 4.64 -0.98 -3.28 113.55 114.79 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 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1uwu h SER 252 CO 0.00 0.00 0.00 0.55 -0.87 0.00 0.00 176.83 176.51 1uwu n VAL 253 N -2.44 0.00 -3.74 0.95 3.14 -0.48 -5.08 118.33 110.69 1uwu n VAL 253 Ca 0.01 -0.30 -0.14 0.00 -2.96 0.00 0.00 64.34 60.95 1uwu n VAL 253 Cb 0.20 1.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.90 1uwu n VAL 253 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1uwu s SER 254 N -0.60 -0.23 0.00 6.55 0.15 -0.21 -4.84 113.70 114.52 1uwu s SER 254 Ca 0.00 0.11 0.24 0.00 0.70 0.00 0.00 55.95 57.01 1uwu s SER 254 Cb 0.00 0.34 0.28 0.00 -1.71 0.00 0.00 66.02 64.93 1uwu s SER 254 CO 0.00 -0.48 1.29 0.29 1.20 0.00 0.00 173.24 175.53 1uwu n LYS 255 N 1.16 1.68 -1.92 5.44 4.76 -1.26 -4.28 118.16 123.74 1uwu n LYS 255 Ca -0.21 -1.32 -0.32 0.00 -2.87 0.00 0.00 58.31 53.59 1uwu n LYS 255 Cb 0.56 -1.47 0.02 0.00 -1.84 0.00 0.00 35.03 32.30 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 -2.23 3.21 0.37 1.97 1.02 -1.26 -4.98 119.74 117.84 1uwu s LYS 256 Ca 0.25 1.14 -0.28 0.00 0.02 0.00 0.00 55.97 57.11 1uwu s LYS 256 Cb 0.19 -2.02 -0.10 0.00 -0.52 0.00 0.00 37.83 35.38 1uwu s LYS 256 CO 0.43 -0.89 1.42 -2.14 -0.92 0.00 0.00 175.35 173.25 1uwu s PRO 257 N -4.32 4.12 -0.13 -1.68 0.02 -1.26 -4.85 135.00 126.91 1uwu s PRO 257 Ca 0.62 2.44 0.00 0.00 0.02 0.00 0.00 61.00 64.08 1uwu s PRO 257 Cb -0.15 -2.95 0.02 0.00 0.02 0.00 0.00 34.50 31.44 1uwu s PRO 257 CO 0.41 -0.47 -0.11 0.08 -0.33 0.00 0.00 177.00 176.58 1uwu s VAL 258 N -1.14 1.32 0.00 3.83 1.01 -1.26 -0.91 120.40 123.25 1uwu s VAL 258 Ca 0.53 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.02 1uwu s VAL 258 Cb -0.44 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1uwu s VAL 258 CO 0.59 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.72 1uwu n GLY 259 N 4.75 6.20 3.26 4.51 0.00 0.60 -1.11 105.19 123.39 1uwu n GLY 259 Ca -0.16 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 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 0.75 0.05 -0.13 -0.61 2.07 -1.17 -1.67 121.20 120.49 1uwu s ILE 260 Ca 0.00 -0.42 -0.01 0.00 -1.41 0.00 0.00 60.65 58.81 1uwu s ILE 260 Cb 0.00 -0.63 -0.02 0.00 0.13 0.00 0.00 42.46 41.94 1uwu s ILE 260 CO 0.00 -0.23 -0.10 -0.63 -1.91 0.00 0.00 174.94 172.07 1uwu s ILE 261 N -1.22 3.32 0.07 2.00 1.01 -0.65 -0.06 121.20 125.67 1uwu s ILE 261 Ca -0.13 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.00 1uwu s ILE 261 Cb -0.05 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1uwu s ILE 261 CO 0.04 0.52 -0.14 -0.47 0.00 0.00 0.00 174.94 174.90 1uwu s TYR 262 N 0.26 1.16 -0.26 3.97 5.04 -0.78 0.78 117.35 127.52 1uwu s TYR 262 Ca -0.07 -0.46 -0.24 0.00 -2.44 0.00 0.00 57.07 53.85 1uwu s TYR 262 Cb -0.15 -0.65 -0.00 0.00 0.35 0.00 0.00 41.96 41.50 1uwu s TYR 262 CO 0.05 0.04 0.82 0.00 -1.34 0.00 0.00 175.55 175.12 1uwu s ALA 263 N -1.28 3.62 0.06 3.97 0.00 -1.26 -2.37 121.76 124.50 1uwu s ALA 263 Ca -0.03 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 51.80 1uwu s ALA 263 Cb -0.10 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 1uwu s ALA 263 CO 0.02 -1.00 -0.20 -0.80 0.00 0.00 0.00 175.76 173.78 1uwu s ASN 264 N 1.42 3.71 0.11 0.00 0.01 -0.75 -4.99 114.94 114.44 1uwu s ASN 264 Ca 0.34 -0.50 0.08 0.00 -0.71 0.00 0.00 52.86 52.08 1uwu s ASN 264 Cb -0.15 -0.53 -0.04 0.00 0.41 0.00 0.00 41.25 40.94 1uwu s ASN 264 CO 0.09 0.23 -0.21 -0.55 -1.51 0.00 0.00 177.10 175.15 1uwu s SER 265 N -1.61 2.58 -0.37 -1.22 0.15 -1.26 -4.26 113.70 107.70 1uwu s SER 265 Ca 0.15 -0.70 -0.22 0.00 0.70 0.00 0.00 55.95 55.88 1uwu s SER 265 Cb -0.10 -0.14 0.01 0.00 -1.71 0.00 0.00 66.02 64.07 1uwu s SER 265 CO 0.06 0.06 0.70 -0.55 1.20 0.00 0.00 173.24 174.71 1uwu s SER 266 N -1.97 6.46 -0.20 5.45 0.15 -1.20 -4.88 113.70 117.52 1uwu s SER 266 Ca 0.07 0.17 -0.27 0.00 0.70 0.00 0.00 55.95 56.62 1uwu s SER 266 Cb -0.10 -2.36 -0.00 0.00 -1.71 0.00 0.00 66.02 61.85 1uwu s SER 266 CO 0.04 -0.68 0.91 -0.36 1.20 0.00 0.00 173.24 174.35 1uwu s PHE 267 N 2.91 3.38 -0.01 3.44 0.08 -1.26 -0.87 117.98 125.64 1uwu s PHE 267 Ca 0.27 1.32 0.07 0.00 0.12 0.00 0.00 56.93 58.71 1uwu s PHE 267 Cb -0.14 -3.12 -0.02 0.00 -0.57 0.00 0.00 43.02 39.18 1uwu s PHE 267 CO 0.17 -0.35 -0.22 -0.65 -0.10 0.00 0.00 175.22 174.06 1uwu s GLN 268 N 2.63 1.74 0.11 0.44 -1.52 -0.04 -4.95 119.66 118.07 1uwu s GLN 268 Ca 0.40 -0.80 -0.30 0.00 -1.95 0.00 0.00 55.36 52.71 1uwu s GLN 268 Cb -0.16 -1.70 -0.06 0.00 -0.22 0.00 0.00 33.01 30.87 1uwu s GLN 268 CO 0.10 0.46 1.01 -1.25 -0.25 0.00 0.00 175.29 175.37 1uwu s PRO 269 N -0.58 4.63 0.11 2.91 0.04 -1.26 -1.10 135.00 139.75 1uwu s PRO 269 Ca 0.08 1.53 -0.21 0.00 0.04 0.00 0.00 61.00 62.45 1uwu s PRO 269 Cb -0.08 -3.36 -0.09 0.00 0.04 0.00 0.00 34.50 31.00 1uwu s PRO 269 CO -0.01 0.11 1.76 1.25 0.04 0.00 0.00 177.00 180.15 1uwu h LEU 270 N 5.75 0.13 -9.28 -3.56 5.85 -1.61 -3.46 115.31 109.14 1uwu h LEU 270 Ca -0.43 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 57.80 1uwu h LEU 270 Cb 1.21 -0.03 -0.14 0.00 0.37 0.00 0.00 40.66 42.08 1uwu h LEU 270 CO 0.73 0.10 -0.59 0.42 -0.34 0.00 0.00 178.44 178.75 1uwu s THR 271 N -6.18 1.12 -1.10 1.05 -4.23 -1.26 -5.03 115.64 100.01 1uwu s THR 271 Ca -0.13 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.49 1uwu s THR 271 Cb 0.08 -2.72 0.12 0.00 1.34 0.00 0.00 72.50 71.31 1uwu s THR 271 CO 0.68 0.00 1.34 -0.90 -0.54 0.00 0.00 174.62 175.20 1uwu n ASP 272 N -0.79 0.00 -0.50 3.99 5.68 -1.26 -1.47 116.55 122.21 1uwu n ASP 272 Ca -0.03 0.41 0.05 0.00 -0.50 0.00 0.00 54.79 54.71 1uwu n ASP 272 Cb 0.66 -0.45 0.13 0.00 -1.14 0.00 0.00 41.12 40.33 1uwu n ASP 272 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1uwu n LYS 273 N -1.45 1.62 -0.17 0.11 4.01 -1.26 -4.25 118.16 116.77 1uwu n LYS 273 Ca 0.03 -0.97 0.08 0.00 -0.51 0.00 0.00 58.31 56.94 1uwu n LYS 273 Cb 0.12 -1.22 0.15 0.00 -0.51 0.00 0.00 35.03 33.58 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 0.28 2.77 0.09 4.39 8.00 -0.54 -4.70 116.55 126.84 1uwu n ASP 274 Ca 0.09 -2.80 -0.02 0.00 0.71 0.00 0.00 54.79 52.78 1uwu n ASP 274 Cb 0.23 -0.37 0.24 0.00 -0.02 0.00 0.00 41.12 41.19 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 0.68 0.27 -0.61 -1.24 2.86 -1.78 -2.18 114.93 112.93 1uwu h MET 275 Ca 0.00 -0.12 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1uwu h MET 275 Cb 1.02 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.64 1uwu h MET 275 CO 0.06 0.61 0.26 0.93 1.06 0.00 0.00 176.91 179.82 1uwu h GLU 276 N 0.23 0.90 -0.86 1.72 5.08 -1.94 -2.70 114.58 117.01 1uwu h GLU 276 Ca 0.03 -0.15 0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1uwu h GLU 276 Cb 0.76 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.81 1uwu h GLU 276 CO 0.06 0.75 0.56 0.00 -1.00 0.00 0.00 179.01 179.38 1uwu h ALA 277 N 1.10 1.59 -0.28 3.43 0.00 -1.74 -1.46 119.26 121.90 1uwu h ALA 277 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1uwu h ALA 277 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1uwu h ALA 277 CO -0.02 0.27 0.13 0.28 0.00 0.00 0.00 179.25 179.91 1uwu h VAL 278 N 0.93 1.16 -0.58 0.00 2.07 -1.15 -1.14 116.25 117.54 1uwu h VAL 278 Ca 0.38 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1uwu h VAL 278 Cb 0.27 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1uwu h VAL 278 CO -0.14 0.16 0.17 -0.33 0.02 0.00 0.00 177.57 177.45 1uwu h GLU 279 N 0.32 0.90 -0.72 1.57 5.08 -1.11 0.33 114.58 120.94 1uwu h GLU 279 Ca 0.10 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1uwu h GLU 279 Cb 0.14 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 1uwu h GLU 279 CO -0.01 0.82 0.47 0.52 -1.00 0.00 0.00 179.01 179.81 1uwu h MET 280 N 0.82 0.93 -0.59 2.33 2.86 -1.20 -0.47 114.93 119.61 1uwu h MET 280 Ca 0.18 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 1uwu h MET 280 Cb 0.30 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1uwu h MET 280 CO -0.00 0.62 0.32 0.00 1.06 0.00 0.00 176.91 178.90 1uwu h ALA 281 N 1.27 0.76 -0.65 6.32 0.00 -0.78 -1.10 119.26 125.08 1uwu h ALA 281 Ca 0.27 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1uwu h ALA 281 Cb -0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1uwu h ALA 281 CO -0.07 0.28 0.05 0.93 0.00 0.00 0.00 179.25 180.45 1uwu h GLU 282 N 0.80 1.11 0.09 0.00 5.08 -0.57 -0.70 114.58 120.38 1uwu h GLU 282 Ca 0.21 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1uwu h GLU 282 Cb 0.05 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1uwu h GLU 282 CO -0.03 1.04 -0.10 -0.91 -1.00 0.00 0.00 179.01 178.01 1uwu h ASN 283 N 1.02 -0.27 0.37 1.42 2.35 -1.00 -0.34 115.58 119.12 1uwu h ASN 283 Ca 0.19 0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.90 1uwu h ASN 283 Cb 0.51 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 1uwu h ASN 283 CO 0.02 -0.16 -0.32 0.44 -1.65 0.00 0.00 177.43 175.77 1uwu h ASP 284 N -0.22 0.00 -0.00 5.81 3.32 -0.99 -1.83 116.42 122.51 1uwu h ASP 284 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1uwu h ASP 284 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1uwu h ASP 284 CO -0.04 0.32 -0.36 0.59 -1.72 0.00 0.00 179.24 178.03 1uwu n ASN 285 N -4.06 0.62 0.14 6.45 3.02 -0.29 -4.84 115.26 116.31 1uwu n ASN 285 Ca -0.02 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1uwu n ASN 285 Cb 0.37 0.86 0.00 0.00 -0.61 0.00 0.00 39.78 40.40 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 -0.96 0.00 -0.21 3.52 0.63 -0.25 -4.92 116.66 114.46 1uwu n ARG 286 Ca 0.02 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.87 1uwu n ARG 286 Cb 0.16 0.00 0.04 0.00 0.45 0.00 0.00 32.46 33.11 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 1.15 -0.85 -0.14 -0.00 -1.24 -2.44 115.95 112.43 1uwu h TRP 287 Ca 0.00 -0.19 0.08 0.00 -0.00 0.00 0.00 58.89 58.78 1uwu h TRP 287 Cb 0.00 -0.30 -0.06 0.00 -0.00 0.00 0.00 29.16 28.80 1uwu h TRP 287 CO 0.00 1.01 0.56 0.11 -0.00 0.00 0.00 178.44 180.11 1uwu h TRP 288 N 0.98 0.93 -0.01 0.49 5.08 -1.58 0.38 115.95 122.22 1uwu h TRP 288 Ca 0.18 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 60.16 1uwu h TRP 288 Cb 0.54 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 26.39 1uwu h TRP 288 CO 0.04 0.47 -0.05 0.35 -1.28 0.00 0.00 178.44 177.97 1uwu h PHE 289 N 0.90 0.06 -0.03 0.12 3.04 -1.74 -2.93 116.94 116.36 1uwu h PHE 289 Ca 0.38 -0.03 -0.16 0.00 3.98 0.00 0.00 57.97 62.14 1uwu h PHE 289 Cb 0.30 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.79 1uwu h PHE 289 CO -0.00 0.71 -0.70 0.74 -2.02 0.00 0.00 178.31 177.04 1uwu h PHE 290 N -0.60 0.21 -0.12 0.41 0.04 -1.12 -2.28 116.94 113.49 1uwu h PHE 290 Ca -0.00 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1uwu h PHE 290 Cb 0.71 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.82 1uwu h PHE 290 CO 0.16 0.80 -0.00 -0.44 -0.60 0.00 0.00 178.31 178.22 1uwu h ASP 291 N 0.11 0.15 0.07 2.17 3.32 -0.34 -0.37 116.42 121.53 1uwu h ASP 291 Ca -0.02 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1uwu h ASP 291 Cb 1.24 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1uwu h ASP 291 CO 0.10 0.19 -0.04 0.00 -1.72 0.00 0.00 179.24 177.78 1uwu h ALA 292 N 1.83 -0.10 0.00 3.45 0.00 -1.19 -0.87 119.26 122.38 1uwu h ALA 292 Ca 0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1uwu h ALA 292 Cb 0.13 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1uwu h ALA 292 CO 0.00 -0.38 -0.46 0.44 0.00 0.00 0.00 179.25 178.85 1uwu n ILE 293 N -4.97 0.38 -0.13 0.00 -5.35 -1.07 -1.57 119.36 106.65 1uwu n ILE 293 Ca -0.08 -0.25 -0.25 0.00 -0.27 0.00 0.00 62.75 61.89 1uwu n ILE 293 Cb 0.21 -0.22 -0.10 0.00 -1.74 0.00 0.00 39.64 37.79 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 -2.09 1.48 0.88 7.28 5.41 -0.16 -1.38 119.36 130.78 1uwu n ILE 294 Ca 0.04 -0.44 0.09 0.00 1.00 0.00 0.00 62.75 63.44 1uwu n ILE 294 Cb 0.43 -1.72 -0.04 0.00 -0.71 0.00 0.00 39.64 37.60 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 -3.90 1.18 -0.97 0.38 1.74 -0.39 -0.07 116.66 114.63 1uwu n ARG 295 Ca -0.51 -0.56 0.00 0.00 -0.77 0.00 0.00 57.85 56.01 1uwu n ARG 295 Cb 0.91 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.96 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 1.36 0.42 3.67 -0.13 0.00 -0.61 -4.69 105.19 105.21 1uwu n GLY 296 Ca 0.06 0.00 -0.43 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 -0.56 4.33 0.23 1.61 2.02 -0.83 -0.93 118.70 124.57 1uwu s GLU 297 Ca 0.00 1.40 -0.13 0.00 0.02 0.00 0.00 54.97 56.26 1uwu s GLU 297 Cb 0.00 -3.60 -0.00 0.00 0.10 0.00 0.00 34.13 30.63 1uwu s GLU 297 CO 0.00 -0.50 0.46 -1.50 0.02 0.00 0.00 175.26 173.74 1uwu s ILE 298 N 2.69 0.01 -0.06 -1.63 2.07 -0.48 -2.68 121.20 121.12 1uwu s ILE 298 Ca 0.47 -1.34 0.06 0.00 -1.41 0.00 0.00 60.65 58.43 1uwu s ILE 298 Cb -0.17 -2.09 -0.01 0.00 0.13 0.00 0.00 42.46 40.32 1uwu s ILE 298 CO 0.12 -0.05 -0.24 -0.89 -1.91 0.00 0.00 174.94 171.96 1uwu s THR 299 N -4.00 2.00 -0.61 4.00 2.01 -1.26 -0.95 115.64 116.84 1uwu s THR 299 Ca 0.20 -1.03 -0.04 0.00 0.31 0.00 0.00 61.69 61.13 1uwu s THR 299 Cb -0.00 -1.70 0.16 0.00 0.01 0.00 0.00 72.50 70.97 1uwu s THR 299 CO 0.07 0.56 0.44 -0.75 -0.69 0.00 0.00 174.62 174.24 1uwu s LYS 304 N -0.09 2.59 0.49 4.92 2.47 -1.26 -5.10 119.74 123.77 1uwu s LYS 304 Ca -0.05 -2.41 0.02 0.00 -1.56 0.00 0.00 55.97 51.97 1uwu s LYS 304 Cb -0.14 -3.79 -0.02 0.00 -1.46 0.00 0.00 37.83 32.41 1uwu s LYS 304 CO 0.04 -1.17 0.00 0.96 0.16 0.00 0.00 175.35 175.34 1uwu s ILE 305 N 0.17 1.31 -0.18 5.43 -0.00 -0.12 -5.14 121.20 122.66 1uwu s ILE 305 Ca 0.15 -2.00 -0.03 0.00 -0.00 0.00 0.00 60.65 58.78 1uwu s ILE 305 Cb -0.20 -2.31 -0.01 0.00 -0.00 0.00 0.00 42.46 39.94 1uwu s ILE 305 CO -0.04 0.00 -0.06 -0.69 -0.00 0.00 0.00 174.94 174.15 1uwu s VAL 306 N -2.85 3.42 -0.27 8.37 1.01 -1.26 -1.38 120.40 127.43 1uwu s VAL 306 Ca 0.11 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 1uwu s VAL 306 Cb 0.03 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.88 1uwu s VAL 306 CO 0.06 0.46 0.10 -0.13 0.00 0.00 0.00 175.10 175.58 1uwu s ARG 307 N 0.94 3.51 0.50 2.72 0.52 -0.11 -4.97 118.95 122.07 1uwu s ARG 307 Ca -0.01 -0.58 0.27 0.00 -0.52 0.00 0.00 55.73 54.89 1uwu s ARG 307 Cb -0.15 -3.40 1.31 0.00 0.52 0.00 0.00 34.95 33.23 1uwu s ARG 307 CO 0.01 -0.28 2.00 -0.44 0.02 0.00 0.00 175.30 176.61 1uwu h ASP 308 N 8.27 0.00 1.01 0.23 3.32 -1.96 -1.76 116.42 125.54 1uwu h ASP 308 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1uwu h ASP 308 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1uwu h ASP 308 CO 0.59 0.15 0.00 -0.90 -1.72 0.00 0.00 179.24 177.36 1uwu n ASP 309 N -3.55 0.27 -0.09 6.45 5.75 -1.26 -3.53 116.55 120.59 1uwu n ASP 309 Ca -0.01 0.54 -0.09 0.00 -0.01 0.00 0.00 54.79 55.21 1uwu n ASP 309 Cb 0.29 -0.61 -0.16 0.00 -1.03 0.00 0.00 41.12 39.62 1uwu n ASP 309 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1uwu n LEU 310 N -1.77 0.04 -4.76 -2.12 4.77 -0.71 -4.86 117.00 107.60 1uwu n LEU 310 Ca 0.06 0.02 -0.41 0.00 -0.03 0.00 0.00 56.01 55.64 1uwu n LEU 310 Cb 0.32 0.47 -0.01 0.00 -2.33 0.00 0.00 43.42 41.88 1uwu n LEU 310 CO 0.25 0.48 1.17 1.17 -1.33 0.00 0.00 177.39 179.13 1uwu n LYS 311 N -2.75 2.66 -1.64 3.23 4.81 -0.91 -3.24 118.16 120.32 1uwu n LYS 311 Ca -0.31 0.94 -0.16 0.00 -0.87 0.00 0.00 58.31 57.90 1uwu n LYS 311 Cb 1.14 -2.68 -0.06 0.00 0.02 0.00 0.00 35.03 33.45 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 1.19 1.21 2.45 3.14 0.00 0.90 -4.89 105.19 109.21 1uwu n GLY 312 Ca 0.04 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.54 3.66 -3.60 1.61 3.00 -0.48 -4.84 116.66 113.47 1uwu n ARG 313 Ca -0.17 -2.90 -0.02 0.00 -0.01 0.00 0.00 57.85 54.75 1uwu n ARG 313 Cb 0.55 -2.44 -0.06 0.00 0.00 0.00 0.00 32.46 30.52 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 -1.95 -0.63 -0.17 0.55 2.96 -1.26 -4.86 118.68 113.32 1uwu s LEU 314 Ca 0.57 0.97 0.18 0.00 -0.22 0.00 0.00 54.13 55.64 1uwu s LEU 314 Cb 0.26 1.87 -0.26 0.00 0.50 0.00 0.00 46.19 48.56 1uwu s LEU 314 CO -0.14 -0.15 0.12 0.47 -1.32 0.00 0.00 176.35 175.34 1uwu n ASP 315 N 4.14 0.08 -3.68 3.68 8.00 -0.27 -5.04 116.55 123.46 1uwu n ASP 315 Ca -0.17 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.23 1uwu n ASP 315 Cb 0.56 1.13 -0.04 0.00 -0.02 0.00 0.00 41.12 42.75 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 -2.62 -0.16 -0.15 1.24 1.48 -1.25 -4.43 118.94 113.05 1uwu s TRP 316 Ca -0.10 -0.17 0.02 0.00 -1.06 0.00 0.00 56.10 54.80 1uwu s TRP 316 Cb 0.07 0.32 0.01 0.00 -1.16 0.00 0.00 33.47 32.71 1uwu s TRP 316 CO 0.83 -0.80 -0.21 0.42 -4.06 0.00 0.00 176.95 173.12 1uwu s ILE 317 N -3.84 2.12 -0.27 0.66 1.01 -0.72 -3.05 121.20 117.12 1uwu s ILE 317 Ca 0.06 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.59 1uwu s ILE 317 Cb 0.01 -1.85 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 1uwu s ILE 317 CO -0.08 0.55 0.47 -0.83 0.00 0.00 0.00 174.94 175.05 1uwu s GLY 318 N 0.87 1.85 -0.40 6.18 0.00 0.91 -2.45 107.32 114.28 1uwu s GLY 318 Ca -0.05 -0.70 -0.14 0.00 0.00 0.00 0.00 44.72 43.83 1uwu s GLY 318 CO -0.03 1.17 0.27 0.14 0.00 0.00 0.00 173.10 174.65 1uwu s VAL 319 N 2.25 5.02 -0.11 1.40 1.01 -0.34 -1.86 120.40 127.77 1uwu s VAL 319 Ca 0.19 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.29 1uwu s VAL 319 Cb -0.16 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1uwu s VAL 319 CO 0.10 -0.29 0.31 0.20 0.00 0.00 0.00 175.10 175.41 1uwu s ASN 320 N 1.66 6.55 -0.15 3.32 -0.87 -1.00 -1.11 114.94 123.34 1uwu s ASN 320 Ca 0.04 0.65 -0.09 0.00 -1.57 0.00 0.00 52.86 51.89 1uwu s ASN 320 Cb -0.19 -2.19 0.05 0.00 -0.02 0.00 0.00 41.25 38.90 1uwu s ASN 320 CO 0.09 0.21 0.36 -0.47 -2.57 0.00 0.00 177.10 174.71 1uwu s TYR 321 N -0.20 -0.51 0.00 2.20 5.04 -0.47 -1.82 117.35 121.60 1uwu s TYR 321 Ca 0.19 1.12 0.00 0.00 -2.44 0.00 0.00 57.07 55.93 1uwu s TYR 321 Cb -0.14 0.19 0.00 0.00 0.35 0.00 0.00 41.96 42.36 1uwu s TYR 321 CO 0.07 -0.30 0.00 0.66 -1.34 0.00 0.00 175.55 174.64 1uwu n TYR 322 N 4.10 0.00 -3.85 4.97 4.01 -1.26 -4.14 117.16 120.98 1uwu n TYR 322 Ca -0.23 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.47 1uwu n TYR 322 Cb 0.55 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.60 1uwu n TYR 322 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1uwu s THR 323 N -1.87 0.00 0.64 -0.72 -1.32 -1.26 -4.72 115.64 106.40 1uwu s THR 323 Ca 0.00 -0.70 0.01 0.00 -1.21 0.00 0.00 61.69 59.79 1uwu s THR 323 Cb 0.00 -2.81 0.09 0.00 -1.51 0.00 0.00 72.50 68.27 1uwu s THR 323 CO 0.00 0.00 0.89 0.00 -2.21 0.00 0.00 174.62 173.30 1uwu s ARG 324 N -2.31 2.07 -0.07 7.08 1.70 -1.26 -3.24 118.95 122.92 1uwu s ARG 324 Ca 0.19 -1.02 0.00 0.00 -0.47 0.00 0.00 55.73 54.44 1uwu s ARG 324 Cb -0.03 -2.41 0.02 0.00 -0.57 0.00 0.00 34.95 31.96 1uwu s ARG 324 CO 0.07 -1.11 -0.04 0.99 -1.08 0.00 0.00 175.30 174.12 1uwu s THR 325 N -2.96 0.62 -0.14 4.99 2.01 -0.05 -3.90 115.64 116.21 1uwu s THR 325 Ca 0.62 -0.10 -0.18 0.00 0.31 0.00 0.00 61.69 62.34 1uwu s THR 325 Cb -0.07 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.72 1uwu s THR 325 CO 0.42 0.27 0.47 -0.69 -0.69 0.00 0.00 174.62 174.40 1uwu s VAL 326 N 1.39 5.18 0.16 3.82 1.01 -1.26 -0.86 120.40 129.85 1uwu s VAL 326 Ca -0.03 0.92 0.09 0.00 0.00 0.00 0.00 61.98 62.96 1uwu s VAL 326 Cb -0.13 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1uwu s VAL 326 CO -0.03 0.30 -0.19 0.68 0.00 0.00 0.00 175.10 175.86 1uwu s VAL 327 N 0.80 1.86 0.08 2.92 -7.23 -0.26 -0.58 120.40 117.98 1uwu s VAL 327 Ca 0.25 -1.90 0.05 0.00 -1.81 0.00 0.00 61.98 58.58 1uwu s VAL 327 Cb -0.15 -1.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 1uwu s VAL 327 CO 0.10 -0.28 -0.15 -1.59 -0.31 0.00 0.00 175.10 172.88 1uwu s LYS 328 N -2.71 0.85 0.33 4.82 -2.85 0.15 -1.58 119.74 118.75 1uwu s LYS 328 Ca 0.15 -0.99 -0.29 0.00 -1.00 0.00 0.00 55.97 53.84 1uwu s LYS 328 Cb -0.06 -0.87 -0.10 0.00 -2.06 0.00 0.00 37.83 34.74 1uwu s LYS 328 CO 0.07 0.19 1.30 0.50 0.10 0.00 0.00 175.35 177.51 1uwu s ARG 329 N -1.84 4.37 0.16 1.78 6.06 -1.26 -1.63 118.95 126.60 1uwu s ARG 329 Ca -0.01 2.20 0.07 0.00 -2.50 0.00 0.00 55.73 55.49 1uwu s ARG 329 Cb -0.10 -3.08 -0.04 0.00 0.06 0.00 0.00 34.95 31.79 1uwu s ARG 329 CO 0.02 -0.17 -0.15 0.99 -2.50 0.00 0.00 175.30 173.49 1uwu s THR 330 N -1.10 1.61 0.12 4.11 2.01 0.21 -4.86 115.64 117.74 1uwu s THR 330 Ca 0.49 -1.96 -0.24 0.00 0.31 0.00 0.00 61.69 60.29 1uwu s THR 330 Cb -0.39 -1.82 -0.06 0.00 0.01 0.00 0.00 72.50 70.24 1uwu s THR 330 CO 0.52 -0.46 1.41 -0.33 -0.69 0.00 0.00 174.62 175.07 1uwu h GLU 331 N 3.08 -0.01 0.00 4.92 5.08 -2.00 -2.30 114.58 123.35 1uwu h GLU 331 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1uwu h GLU 331 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1uwu h GLU 331 CO 0.55 -0.01 0.00 1.17 -1.00 0.00 0.00 179.01 179.72 1uwu n LYS 332 N -4.73 0.11 0.00 2.33 0.00 -1.26 -4.99 118.16 109.62 1uwu n LYS 332 Ca 0.01 0.10 0.00 0.00 0.00 0.00 0.00 58.31 58.43 1uwu n LYS 332 Cb 0.20 -1.64 0.00 0.00 0.00 0.00 0.00 35.03 33.60 1uwu n LYS 332 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1uwu n GLY 333 N 1.35 -0.86 3.27 3.14 0.00 -0.86 -5.15 105.19 106.07 1uwu n GLY 333 Ca 0.06 0.40 -0.11 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.08 0.04 1.61 1.13 -1.26 0.67 117.35 119.45 1uwu s TYR 334 Ca 0.00 -0.18 0.02 0.00 -1.41 0.00 0.00 57.07 55.50 1uwu s TYR 334 Cb 0.00 0.12 -0.02 0.00 -1.10 0.00 0.00 41.96 40.95 1uwu s TYR 334 CO 0.00 -0.58 -0.07 0.14 -2.51 0.00 0.00 175.55 172.53 1uwu s VAL 335 N -3.30 0.48 0.33 -3.49 -7.23 -0.64 -4.87 120.40 101.67 1uwu s VAL 335 Ca 0.00 -1.11 -0.19 0.00 -1.81 0.00 0.00 61.98 58.87 1uwu s VAL 335 Cb 0.02 -0.62 -0.09 0.00 0.56 0.00 0.00 36.38 36.24 1uwu s VAL 335 CO -0.08 -0.44 0.81 -0.44 -0.31 0.00 0.00 175.10 174.64 1uwu s SER 336 N -1.66 6.94 -0.15 4.85 0.01 -1.26 -0.67 113.70 121.76 1uwu s SER 336 Ca -0.10 1.47 -0.05 0.00 1.31 0.00 0.00 55.95 58.59 1uwu s SER 336 Cb -0.09 -2.45 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 1uwu s SER 336 CO -0.00 -0.17 0.02 -0.76 0.41 0.00 0.00 173.24 172.73 1uwu s LEU 337 N -2.70 3.58 0.78 2.44 1.43 0.25 -4.94 118.68 119.52 1uwu s LEU 337 Ca 0.53 0.03 -0.12 0.00 -1.03 0.00 0.00 54.13 53.54 1uwu s LEU 337 Cb -0.12 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.29 1uwu s LEU 337 CO 0.18 0.22 1.14 -0.83 0.23 0.00 0.00 176.35 177.29 1uwu s GLY 338 N 0.06 1.92 0.00 -3.19 0.00 -1.26 -3.83 107.32 101.02 1uwu s GLY 338 Ca 0.03 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.30 1uwu s GLY 338 CO 0.02 0.93 0.00 0.61 0.00 0.00 0.00 173.10 174.65 1uwu n GLY 339 N -0.33 0.78 3.22 0.20 0.00 0.24 -4.96 105.19 104.34 1uwu n GLY 339 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.87 1.15 0.00 1.61 2.02 -1.25 -0.78 117.35 117.23 1uwu s TYR 340 Ca 0.00 -1.12 0.00 0.00 -0.37 0.00 0.00 57.07 55.58 1uwu s TYR 340 Cb 0.00 -0.65 0.00 0.00 -0.40 0.00 0.00 41.96 40.91 1uwu s TYR 340 CO 0.00 -0.34 0.00 0.41 -1.57 0.00 0.00 175.55 174.05 1uwu n GLY 341 N -0.23 3.61 0.02 0.71 0.00 -1.25 -1.74 105.19 106.30 1uwu n GLY 341 Ca -0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 -1.86 1.61 1.44 -1.25 -0.67 115.22 128.48 1uwu n HIS 342 Ca 0.00 0.00 -0.34 0.00 -2.01 0.00 0.00 57.72 55.37 1uwu n HIS 342 Cb 0.00 -0.33 0.04 0.00 0.12 0.00 0.00 29.99 29.83 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 1.35 5.82 3.87 -1.39 0.00 -0.71 -4.63 105.19 109.50 1uwu n GLY 343 Ca 0.12 -2.51 -0.23 0.00 0.00 0.00 0.00 46.02 43.40 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 -4.16 4.06 0.31 0.00 2.02 -1.26 -4.55 118.70 115.11 1uwu s GLU 345 Ca 0.43 1.48 -0.29 0.00 0.02 0.00 0.00 54.97 56.61 1uwu s GLU 345 Cb -0.02 -2.42 -0.10 0.00 0.10 0.00 0.00 34.13 31.69 1uwu s GLU 345 CO 0.25 -0.22 1.28 1.03 0.02 0.00 0.00 175.26 177.62 1uwu s ARG 346 N -2.69 4.40 -1.13 1.61 0.52 -1.26 -3.91 118.95 116.49 1uwu s ARG 346 Ca 0.60 2.14 -0.13 0.00 -0.52 0.00 0.00 55.73 57.82 1uwu s ARG 346 Cb -0.21 -3.11 -0.03 0.00 0.52 0.00 0.00 34.95 32.13 1uwu s ARG 346 CO 0.26 -0.14 0.83 0.09 0.02 0.00 0.00 175.30 176.36 1uwu n ASN 347 N 1.13 -5.31 0.00 0.23 4.13 -0.47 -4.90 115.26 110.08 1uwu n ASN 347 Ca 0.01 -0.88 0.00 0.00 1.68 0.00 0.00 54.58 55.39 1uwu n ASN 347 Cb 0.42 -4.13 0.00 0.00 -1.54 0.00 0.00 39.78 34.53 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 -2.92 2.02 -3.97 6.41 2.88 -1.25 -4.44 113.62 112.34 1uwu n SER 348 Ca -0.11 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.31 1uwu n SER 348 Cb 0.61 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.95 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 0.39 0.26 1.01 2.46 0.11 -1.26 -0.80 120.40 122.58 1uwu s VAL 349 Ca 0.00 -0.60 -0.15 0.00 -2.93 0.00 0.00 61.98 58.29 1uwu s VAL 349 Cb 0.00 -0.32 0.20 0.00 -1.53 0.00 0.00 36.38 34.74 1uwu s VAL 349 CO 0.00 -0.22 1.18 -0.94 -3.33 0.00 0.00 175.10 171.79 1uwu s SER 350 N -0.87 2.61 0.65 3.54 1.04 0.38 -4.76 113.70 116.29 1uwu s SER 350 Ca -0.07 0.67 0.37 0.00 0.48 0.00 0.00 55.95 57.40 1uwu s SER 350 Cb -0.06 -0.99 2.07 0.00 0.10 0.00 0.00 66.02 67.14 1uwu s SER 350 CO -0.00 -3.08 2.21 -0.07 0.98 0.00 0.00 173.24 173.28 1uwu h LEU 351 N -1.87 0.00 -1.27 2.42 3.38 -1.30 -0.85 115.31 115.81 1uwu h LEU 351 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1uwu h LEU 351 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1uwu h LEU 351 CO 0.47 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.00 1uwu n ALA 352 N -2.09 2.51 -0.91 1.53 0.00 -1.26 -4.93 120.51 115.36 1uwu n ALA 352 Ca -0.02 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1uwu n ALA 352 Cb 0.19 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 1.18 0.60 3.83 0.00 0.00 -0.32 -5.04 105.19 105.44 1uwu n GLY 353 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 4.47 0.47 0.99 1.43 -1.26 -4.76 118.68 120.01 1uwu s LEU 354 Ca 0.00 1.11 -0.24 0.00 -1.03 0.00 0.00 54.13 53.97 1uwu s LEU 354 Cb 0.00 -2.86 -0.07 0.00 0.03 0.00 0.00 46.19 43.29 1uwu s LEU 354 CO 0.00 0.26 1.32 -2.16 0.23 0.00 0.00 176.35 176.00 1uwu s PRO 355 N -1.29 3.61 0.20 1.29 0.04 -1.26 -0.47 135.00 137.12 1uwu s PRO 355 Ca 0.29 2.17 0.08 0.00 0.04 0.00 0.00 61.00 63.58 1uwu s PRO 355 Cb -0.17 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 1uwu s PRO 355 CO 0.17 -0.79 0.01 0.95 0.04 0.00 0.00 177.00 177.37 1uwu s THR 356 N -1.31 3.66 0.92 1.26 -4.23 0.02 -1.77 115.64 114.19 1uwu s THR 356 Ca 0.63 -1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 59.46 1uwu s THR 356 Cb -0.38 -2.88 0.20 0.00 1.34 0.00 0.00 72.50 70.78 1uwu s THR 356 CO 0.48 -0.20 1.26 -0.94 -0.54 0.00 0.00 174.62 174.68 1uwu s SER 357 N -3.19 3.23 0.64 3.99 1.04 -0.69 -3.84 113.70 114.89 1uwu s SER 357 Ca 0.29 -0.02 0.33 0.00 0.48 0.00 0.00 55.95 57.03 1uwu s SER 357 Cb -0.08 -0.03 1.85 0.00 0.10 0.00 0.00 66.02 67.85 1uwu s SER 357 CO 0.19 -2.63 2.09 0.44 0.98 0.00 0.00 173.24 174.31 1uwu h ASP 358 N -1.43 0.00 0.03 7.02 5.19 -1.60 -0.30 116.42 125.33 1uwu h ASP 358 Ca -0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.00 1uwu h ASP 358 Cb 1.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.74 1uwu h ASP 358 CO 0.34 0.00 -0.28 0.33 -3.12 0.00 0.00 179.24 176.51 1uwu n PHE 359 N -3.26 0.00 -1.70 4.55 -0.00 -1.26 -4.67 117.46 111.12 1uwu n PHE 359 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 1uwu n PHE 359 Cb 0.30 -0.03 0.00 0.00 -0.00 0.00 0.00 39.48 39.75 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 1.36 0.39 3.68 7.13 0.00 -0.25 -4.78 105.19 112.73 1uwu n GLY 360 Ca 0.12 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.00 3.31 0.26 1.61 0.51 -1.26 -2.04 118.94 119.33 1uwu s TRP 361 Ca 0.00 0.18 -0.29 0.00 -2.12 0.00 0.00 56.10 53.86 1uwu s TRP 361 Cb 0.00 -2.05 -0.09 0.00 -0.81 0.00 0.00 33.47 30.52 1uwu s TRP 361 CO 0.00 0.28 1.23 -2.00 -0.51 0.00 0.00 176.95 175.94 1uwu s GLU 362 N 0.08 4.47 -0.22 4.98 2.12 0.15 -1.71 118.70 128.58 1uwu s GLU 362 Ca 0.06 2.00 -0.29 0.00 0.36 0.00 0.00 54.97 57.10 1uwu s GLU 362 Cb -0.12 -3.16 -0.02 0.00 0.26 0.00 0.00 34.13 31.09 1uwu s GLU 362 CO 0.00 -0.06 1.58 0.12 -0.54 0.00 0.00 175.26 176.36 1uwu s PHE 363 N -0.70 2.18 -0.45 5.30 5.36 -0.73 -4.63 117.98 124.30 1uwu s PHE 363 Ca 0.50 0.58 0.07 0.00 -0.96 0.00 0.00 56.93 57.12 1uwu s PHE 363 Cb -0.35 -3.96 0.28 0.00 -0.34 0.00 0.00 43.02 38.64 1uwu s PHE 363 CO 0.43 -2.80 0.87 0.34 -1.46 0.00 0.00 175.22 172.60 1uwu n PHE 364 N 8.29 -2.34 0.26 10.12 7.35 -1.26 -4.83 117.46 135.05 1uwu n PHE 364 Ca 0.18 -2.38 0.10 0.00 -0.76 0.00 0.00 57.45 54.59 1uwu n PHE 364 Cb 0.45 1.05 0.68 0.00 0.35 0.00 0.00 39.48 42.02 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 3.62 0.00 -0.50 -7.13 0.13 -1.92 -2.43 132.00 123.77 1uwu h PRO 365 Ca -0.07 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 65.14 1uwu h PRO 365 Cb 1.02 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1uwu h PRO 365 CO 0.32 0.09 0.34 1.49 -0.23 0.00 0.00 178.00 180.01 1uwu h GLU 366 N 0.00 0.30 -0.61 0.86 4.22 -1.95 -1.33 114.58 116.06 1uwu h GLU 366 Ca -0.00 -0.02 0.18 0.00 0.08 0.00 0.00 59.36 59.60 1uwu h GLU 366 Cb 0.19 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1uwu h GLU 366 CO 0.01 0.20 0.48 0.78 -2.18 0.00 0.00 179.01 178.30 1uwu h GLY 367 N 0.30 0.00 1.35 1.92 0.00 -1.83 -1.66 103.07 103.15 1uwu h GLY 367 Ca 0.23 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.34 1uwu h GLY 367 CO -0.05 0.00 -0.80 -2.00 0.00 0.00 0.00 176.54 173.69 1uwu h LEU 368 N 0.00 0.76 -0.46 3.11 5.85 -1.44 -0.84 115.31 122.29 1uwu h LEU 368 Ca 0.29 -0.52 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 1uwu h LEU 368 Cb 1.26 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1uwu h LEU 368 CO -0.00 1.30 0.18 0.22 -0.34 0.00 0.00 178.44 179.80 1uwu h TYR 369 N 0.42 0.71 -0.02 1.25 3.20 -1.44 -1.61 116.97 119.47 1uwu h TYR 369 Ca -0.06 -0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.79 1uwu h TYR 369 Cb 1.42 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 39.43 1uwu h TYR 369 CO 0.07 0.61 -0.25 0.22 -1.64 0.00 0.00 178.16 177.17 1uwu h ASP 370 N 0.61 -0.74 -0.33 -2.11 3.58 -1.16 -2.13 116.42 114.13 1uwu h ASP 370 Ca 0.15 0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.68 1uwu h ASP 370 Cb 0.20 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 41.55 1uwu h ASP 370 CO -0.01 -0.32 0.08 0.58 -2.88 0.00 0.00 179.24 176.69 1uwu h VAL 371 N -0.38 1.22 -0.46 2.25 2.07 -1.04 -1.10 116.25 118.81 1uwu h VAL 371 Ca 0.07 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1uwu h VAL 371 Cb 0.47 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1uwu h VAL 371 CO -0.24 0.25 0.16 -0.07 0.02 0.00 0.00 177.57 177.69 1uwu h LEU 372 N 0.38 0.66 -0.42 2.57 3.38 -1.25 -2.29 115.31 118.34 1uwu h LEU 372 Ca 0.10 -0.19 -0.18 0.00 0.09 0.00 0.00 57.88 57.70 1uwu h LEU 372 Cb 0.30 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1uwu h LEU 372 CO 0.00 0.67 -0.65 0.71 0.09 0.00 0.00 178.44 179.26 1uwu h THR 373 N 0.61 1.34 -0.53 0.22 1.35 -1.31 -1.58 112.91 113.00 1uwu h THR 373 Ca 0.15 -1.95 -0.01 0.00 -0.55 0.00 0.00 66.41 64.05 1uwu h THR 373 Cb 0.24 1.93 -0.03 0.00 -1.73 0.00 0.00 68.15 68.56 1uwu h THR 373 CO -0.01 0.60 0.29 0.11 -0.25 0.00 0.00 175.52 176.27 1uwu h LYS 374 N 0.39 0.74 -0.40 4.72 1.79 -1.15 -0.45 116.57 122.21 1uwu h LYS 374 Ca -0.02 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 1uwu h LYS 374 Cb 1.22 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.71 1uwu h LYS 374 CO 0.12 0.57 0.16 1.88 -1.08 0.00 0.00 179.45 181.10 1uwu h TYR 375 N 0.71 0.60 -0.08 -1.35 0.05 -1.30 -2.30 116.97 113.31 1uwu h TYR 375 Ca 0.19 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.92 1uwu h TYR 375 Cb 0.04 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 37.60 1uwu h TYR 375 CO -0.02 0.53 0.05 2.35 -1.05 0.00 0.00 178.16 180.03 1uwu h TRP 376 N 0.50 0.11 0.00 4.88 2.91 -1.09 -1.33 115.95 121.93 1uwu h TRP 376 Ca 0.13 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.13 1uwu h TRP 376 Cb 0.18 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 28.79 1uwu h TRP 376 CO -0.00 0.08 -0.11 -0.91 -1.03 0.00 0.00 178.44 176.46 1uwu h ASN 377 N 0.11 0.00 0.14 2.65 2.35 -1.01 -0.44 115.58 119.38 1uwu h ASN 377 Ca 0.03 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.50 1uwu h ASN 377 Cb -0.00 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.37 1uwu h ASN 377 CO -0.01 0.11 -1.41 -0.09 -1.65 0.00 0.00 177.43 174.38 1uwu h ARG 378 N 0.00 0.30 0.00 0.81 2.43 -0.86 -3.43 114.38 113.64 1uwu h ARG 378 Ca -0.00 -0.52 -0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1uwu h ARG 378 Cb 0.22 0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1uwu h ARG 378 CO 0.01 1.25 -1.11 0.66 -1.51 0.00 0.00 179.97 179.28 1uwu n TYR 379 N -3.86 0.00 -3.22 2.20 4.01 -0.55 -5.02 117.16 110.71 1uwu n TYR 379 Ca -0.23 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.29 1uwu n TYR 379 Cb 0.94 -0.06 0.01 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 -1.64 -1.83 -3.78 -0.72 8.25 -0.18 -4.99 115.22 110.34 1uwu n HIS 380 Ca -0.01 0.47 -0.37 0.00 -0.26 0.00 0.00 57.72 57.55 1uwu n HIS 380 Cb 0.12 -3.40 -0.06 0.00 1.12 0.00 0.00 29.99 27.77 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 -6.51 4.41 0.78 2.41 1.43 -1.26 -5.08 118.68 114.85 1uwu s LEU 381 Ca 0.35 0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 53.93 1uwu s LEU 381 Cb -0.18 -2.26 0.06 0.00 0.03 0.00 0.00 46.19 43.85 1uwu s LEU 381 CO 0.44 0.37 1.13 -0.72 0.23 0.00 0.00 176.35 177.80 1uwu s TYR 382 N -1.07 2.26 0.08 0.29 1.13 -1.26 -4.76 117.35 114.01 1uwu s TYR 382 Ca 0.18 1.62 0.03 0.00 -1.41 0.00 0.00 57.07 57.50 1uwu s TYR 382 Cb -0.13 -3.22 -0.03 0.00 -1.10 0.00 0.00 41.96 37.47 1uwu s TYR 382 CO 0.08 -2.17 -0.09 -1.64 -2.51 0.00 0.00 175.55 169.22 1uwu s MET 383 N -4.50 0.74 0.04 -3.49 -1.94 -0.20 -1.75 119.30 108.21 1uwu s MET 383 Ca 0.66 -1.05 0.09 0.00 -1.71 0.00 0.00 55.69 53.68 1uwu s MET 383 Cb -0.21 -0.42 -0.03 0.00 2.01 0.00 0.00 34.83 36.18 1uwu s MET 383 CO 0.52 0.06 -0.25 0.71 -0.01 0.00 0.00 175.02 176.04 1uwu s TYR 384 N -2.23 2.35 -0.60 -0.03 2.02 -1.02 -0.63 117.35 117.21 1uwu s TYR 384 Ca 0.01 -0.39 -0.27 0.00 -0.37 0.00 0.00 57.07 56.05 1uwu s TYR 384 Cb -0.04 -1.40 0.03 0.00 -0.40 0.00 0.00 41.96 40.15 1uwu s TYR 384 CO -0.01 0.14 1.13 0.08 -1.57 0.00 0.00 175.55 175.33 1uwu s VAL 385 N -0.82 4.08 -0.50 0.71 1.01 -0.44 -1.20 120.40 123.24 1uwu s VAL 385 Ca 0.12 0.64 0.23 0.00 0.00 0.00 0.00 61.98 62.97 1uwu s VAL 385 Cb -0.10 -4.71 0.02 0.00 0.00 0.00 0.00 36.38 31.60 1uwu s VAL 385 CO 0.02 -1.36 1.21 0.71 0.00 0.00 0.00 175.10 175.68 1uwu h THR 386 N 6.10 0.00 -2.69 3.92 1.35 -1.36 0.16 112.91 120.40 1uwu h THR 386 Ca -0.26 -0.67 -0.11 0.00 -0.55 0.00 0.00 66.41 64.82 1uwu h THR 386 Cb 1.06 1.20 -0.23 0.00 -1.73 0.00 0.00 68.15 68.45 1uwu h THR 386 CO 1.18 0.00 -0.20 -1.61 -0.25 0.00 0.00 175.52 174.64 1uwu s GLU 387 N -3.24 0.54 -0.29 4.72 2.02 -1.20 -4.50 118.70 116.75 1uwu s GLU 387 Ca 0.04 0.53 -0.16 0.00 0.02 0.00 0.00 54.97 55.40 1uwu s GLU 387 Cb 0.12 0.26 0.16 0.00 0.10 0.00 0.00 34.13 34.77 1uwu s GLU 387 CO 0.75 -0.08 1.02 1.21 0.02 0.00 0.00 175.26 178.18 1uwu s ASN 388 N 0.05 -0.47 0.00 -0.19 3.84 -1.22 -1.37 114.94 115.57 1uwu s ASN 388 Ca -0.02 0.71 0.00 0.00 0.21 0.00 0.00 52.86 53.76 1uwu s ASN 388 Cb -0.03 1.35 0.00 0.00 -0.55 0.00 0.00 41.25 42.02 1uwu s ASN 388 CO 0.01 -0.11 0.00 0.61 -2.79 0.00 0.00 177.10 174.83 1uwu n GLY 389 N 4.14 0.61 3.25 1.21 0.00 -1.26 -1.05 105.19 112.09 1uwu n GLY 389 Ca -0.14 -0.76 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.08 0.01 -0.40 -0.61 2.07 -1.26 -4.91 121.20 114.02 1uwu s ILE 390 Ca 0.00 -0.11 -0.29 0.00 -1.41 0.00 0.00 60.65 58.84 1uwu s ILE 390 Cb 0.00 -0.54 0.02 0.00 0.13 0.00 0.00 42.46 42.08 1uwu s ILE 390 CO 0.00 -0.06 1.10 0.00 -1.91 0.00 0.00 174.94 174.07 1uwu s ALA 391 N -0.18 3.32 -0.43 1.50 0.00 -1.26 -4.24 121.76 120.47 1uwu s ALA 391 Ca -0.03 -0.28 0.03 0.00 0.00 0.00 0.00 51.96 51.67 1uwu s ALA 391 Cb -0.03 -3.78 0.19 0.00 0.00 0.00 0.00 23.12 19.50 1uwu s ALA 391 CO 0.01 -1.88 0.82 0.34 0.00 0.00 0.00 175.76 175.05 1uwu s ASP 392 N 2.07 -1.11 0.25 0.00 2.15 -0.11 -1.40 116.67 118.52 1uwu s ASP 392 Ca 0.46 -1.01 -0.04 0.00 0.43 0.00 0.00 52.55 52.39 1uwu s ASP 392 Cb -0.10 1.43 0.28 0.00 -0.30 0.00 0.00 42.92 44.24 1uwu s ASP 392 CO 0.24 -0.07 1.78 -0.78 -0.17 0.00 0.00 175.17 176.16 1uwu h ASP 393 N 5.43 0.90 1.28 -0.34 3.58 -1.92 -2.86 116.42 122.49 1uwu h ASP 393 Ca 0.03 -0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.30 1uwu h ASP 393 Cb 1.16 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.97 1uwu h ASP 393 CO 0.00 0.88 -0.02 0.00 -2.88 0.00 0.00 179.24 177.22 1uwu h ALA 394 N 1.24 1.00 -0.63 -0.78 0.00 -1.95 -3.47 119.26 114.66 1uwu h ALA 394 Ca 0.19 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1uwu h ALA 394 Cb 0.34 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1uwu h ALA 394 CO 0.00 0.03 -0.17 -3.47 0.00 0.00 0.00 179.25 175.64 1uwu n ASP 395 N -3.11 -3.67 -0.07 0.00 2.03 -1.08 -4.97 116.55 105.67 1uwu n ASP 395 Ca 0.01 0.14 -0.12 0.00 0.52 0.00 0.00 54.79 55.34 1uwu n ASP 395 Cb 0.38 -2.22 -0.05 0.00 -0.72 0.00 0.00 41.12 38.50 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 0.51 0.00 -0.67 0.05 -1.91 -3.37 116.97 111.58 1uwu h TYR 396 Ca -0.18 -0.13 -0.36 0.00 0.05 0.00 0.00 58.73 58.12 1uwu h TYR 396 Cb 0.72 -0.12 -0.07 0.00 1.01 0.00 0.00 36.73 38.28 1uwu h TYR 396 CO 0.23 0.72 -2.27 1.04 -1.05 0.00 0.00 178.16 176.83 1uwu n GLN 397 N -4.54 0.68 -0.26 4.88 6.02 -1.26 -4.61 117.38 118.28 1uwu n GLN 397 Ca -0.05 0.04 0.07 0.00 -0.01 0.00 0.00 57.00 57.06 1uwu n GLN 397 Cb 0.32 -1.57 0.21 0.00 1.02 0.00 0.00 30.24 30.23 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 0.30 -0.71 -1.09 2.43 -1.93 0.13 114.38 113.51 1uwu h ARG 398 Ca -0.50 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 58.75 1uwu h ARG 398 Cb 2.21 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 31.62 1uwu h ARG 398 CO 0.04 0.20 0.34 -1.35 -1.51 0.00 0.00 179.97 177.69 1uwu h PRO 399 N 0.31 0.56 -0.33 0.20 0.11 -1.82 0.30 132.00 131.33 1uwu h PRO 399 Ca 0.45 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.44 1uwu h PRO 399 Cb 0.79 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 1uwu h PRO 399 CO -0.52 0.37 -0.13 1.88 -0.21 0.00 0.00 178.00 179.40 1uwu h TYR 400 N 0.57 0.77 -0.15 0.65 0.05 -1.51 -2.29 116.97 115.06 1uwu h TYR 400 Ca 0.35 -0.18 -0.00 0.00 0.05 0.00 0.00 58.73 58.95 1uwu h TYR 400 Cb 0.40 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.95 1uwu h TYR 400 CO -0.12 0.87 0.09 -0.92 -1.05 0.00 0.00 178.16 177.03 1uwu h TYR 401 N 0.45 0.19 0.75 4.88 5.03 -0.32 -0.87 116.97 127.08 1uwu h TYR 401 Ca 0.08 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.36 1uwu h TYR 401 Cb 0.64 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.86 1uwu h TYR 401 CO 0.06 0.15 -0.43 1.25 -1.32 0.00 0.00 178.16 177.87 1uwu h LEU 402 N 0.17 -1.06 -0.66 2.82 5.85 -0.46 -1.92 115.31 120.06 1uwu h LEU 402 Ca 0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1uwu h LEU 402 Cb 0.02 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 1uwu h LEU 402 CO -0.01 -0.68 0.25 0.58 -0.34 0.00 0.00 178.44 178.24 1uwu h VAL 403 N -1.09 1.24 -0.61 1.05 2.07 -1.38 -1.80 116.25 115.74 1uwu h VAL 403 Ca -0.10 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 1uwu h VAL 403 Cb 0.87 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1uwu h VAL 403 CO 0.12 0.31 0.37 0.28 0.02 0.00 0.00 177.57 178.67 1uwu h SER 404 N 0.95 0.72 0.19 0.57 0.02 -1.15 -0.33 113.55 114.53 1uwu h SER 404 Ca 0.22 -0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.93 1uwu h SER 404 Cb 0.24 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1uwu h SER 404 CO -0.01 0.56 -0.73 0.45 -1.14 0.00 0.00 176.83 175.96 1uwu h HIS 405 N 0.82 0.63 -0.59 3.45 -0.00 -1.14 -2.04 115.15 116.28 1uwu h HIS 405 Ca 0.22 -0.28 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 1uwu h HIS 405 Cb -0.03 -0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 27.25 1uwu h HIS 405 CO -0.02 1.04 0.31 0.28 -0.00 0.00 0.00 177.93 179.54 1uwu h VAL 406 N 0.32 1.20 -0.83 2.45 2.07 -1.13 -1.73 116.25 118.60 1uwu h VAL 406 Ca -0.03 -0.52 0.08 0.00 0.82 0.00 0.00 66.70 67.05 1uwu h VAL 406 Cb 1.31 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 1uwu h VAL 406 CO 0.13 0.22 0.49 0.22 0.02 0.00 0.00 177.57 178.65 1uwu h TYR 407 N 0.80 0.90 -0.19 1.57 3.20 -0.83 -1.79 116.97 120.64 1uwu h TYR 407 Ca 0.21 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 1uwu h TYR 407 Cb 0.06 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 1uwu h TYR 407 CO -0.01 0.41 -0.17 1.96 -1.64 0.00 0.00 178.16 178.72 1uwu h GLN 408 N 0.86 0.32 -0.19 1.82 1.08 -0.61 0.19 115.11 118.58 1uwu h GLN 408 Ca 0.38 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.49 1uwu h GLN 408 Cb 0.27 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1uwu h GLN 408 CO -0.21 0.49 0.09 0.28 -0.95 0.00 0.00 178.83 178.54 1uwu h VAL 409 N 0.30 1.13 -0.61 -0.54 2.07 -0.64 -0.08 116.25 117.88 1uwu h VAL 409 Ca 0.06 -0.37 0.09 0.00 0.82 0.00 0.00 66.70 67.29 1uwu h VAL 409 Cb 0.48 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.20 1uwu h VAL 409 CO 0.03 0.12 0.25 -0.74 0.02 0.00 0.00 177.57 177.26 1uwu h HIS 410 N 0.19 0.45 -0.51 1.57 -0.00 -0.77 -0.90 115.15 115.18 1uwu h HIS 410 Ca 0.07 0.03 0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1uwu h HIS 410 Cb 0.11 -0.11 -0.05 0.00 -0.00 0.00 0.00 27.41 27.36 1uwu h HIS 410 CO -0.03 0.14 0.22 -0.09 -0.00 0.00 0.00 177.93 178.18 1uwu h ARG 411 N 0.46 0.42 -0.46 5.26 2.43 -0.76 -0.27 114.38 121.46 1uwu h ARG 411 Ca 0.30 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1uwu h ARG 411 Cb 0.34 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1uwu h ARG 411 CO -0.28 0.27 0.27 0.00 -1.51 0.00 0.00 179.97 178.73 1uwu h ALA 412 N 1.31 0.58 -0.45 2.80 0.00 -0.17 -1.71 119.26 121.62 1uwu h ALA 412 Ca 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1uwu h ALA 412 Cb 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1uwu h ALA 412 CO -0.20 0.08 0.26 0.82 0.00 0.00 0.00 179.25 180.20 1uwu h ILE 413 N 0.60 1.15 -0.78 0.00 2.04 -0.93 -2.00 117.51 117.61 1uwu h ILE 413 Ca 0.16 -0.38 0.15 0.00 1.00 0.00 0.00 64.86 65.79 1uwu h ILE 413 Cb 0.01 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 36.63 1uwu h ILE 413 CO -0.03 0.16 0.52 -1.13 0.00 0.00 0.00 178.15 177.67 1uwu h ASN 414 N 0.59 0.43 0.54 1.72 -0.73 -0.75 0.15 115.58 117.53 1uwu h ASN 414 Ca 0.16 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.35 1uwu h ASN 414 Cb 0.03 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.56 1uwu h ASN 414 CO -0.03 0.22 0.00 -1.20 -0.37 0.00 0.00 177.43 176.05 1uwu n SER 415 N -4.49 0.00 0.00 1.15 7.64 -0.67 -4.90 113.62 112.35 1uwu n SER 415 Ca 0.15 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1uwu n SER 415 Cb 0.52 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 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 1.00 1.00 3.74 0.23 0.00 0.52 -5.09 105.19 106.59 1uwu n GLY 416 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 3.56 -0.84 4.61 0.00 -0.94 -4.95 121.76 121.18 1uwu s ALA 417 Ca 0.00 1.20 -0.21 0.00 0.00 0.00 0.00 51.96 52.95 1uwu s ALA 417 Cb 0.00 -3.51 0.10 0.00 0.00 0.00 0.00 23.12 19.71 1uwu s ALA 417 CO 0.00 -0.61 1.11 0.34 0.00 0.00 0.00 175.76 176.59 1uwu s ASP 418 N 0.25 6.44 -0.13 0.00 -1.08 -1.26 -4.18 116.67 116.70 1uwu s ASP 418 Ca 0.57 -1.57 0.02 0.00 -0.52 0.00 0.00 52.55 51.05 1uwu s ASP 418 Cb -0.39 -2.43 0.00 0.00 -1.46 0.00 0.00 42.92 38.65 1uwu s ASP 418 CO 0.41 -1.26 -0.21 -0.69 0.52 0.00 0.00 175.17 173.94 1uwu s VAL 419 N 3.50 2.26 -0.81 1.11 1.01 -1.26 -1.03 120.40 125.17 1uwu s VAL 419 Ca 0.30 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.45 1uwu s VAL 419 Cb -0.09 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.38 1uwu s VAL 419 CO -0.02 0.54 0.58 0.54 0.00 0.00 0.00 175.10 176.75 1uwu n ARG 420 N 3.84 2.34 -3.62 2.72 1.74 0.20 -4.96 116.66 118.93 1uwu n ARG 420 Ca -0.19 -0.52 -0.02 0.00 -0.77 0.00 0.00 57.85 56.35 1uwu n ARG 420 Cb 0.52 -1.05 -0.01 0.00 -1.02 0.00 0.00 32.46 30.90 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 -1.37 -0.36 -0.09 -0.13 0.00 -1.26 -2.37 107.32 101.74 1uwu s GLY 421 Ca 0.07 0.99 -0.01 0.00 0.00 0.00 0.00 44.72 45.77 1uwu s GLY 421 CO 0.25 0.27 -0.04 -0.47 0.00 0.00 0.00 173.10 173.11 1uwu s TYR 422 N -2.55 1.10 -0.27 1.90 5.04 -0.68 -1.33 117.35 120.56 1uwu s TYR 422 Ca 0.12 -0.47 0.01 0.00 -2.44 0.00 0.00 57.07 54.29 1uwu s TYR 422 Cb 0.02 -1.03 0.05 0.00 0.35 0.00 0.00 41.96 41.35 1uwu s TYR 422 CO -0.04 -0.42 -0.08 -0.51 -1.34 0.00 0.00 175.55 173.16 1uwu s LEU 423 N 1.83 3.48 0.32 6.97 1.02 0.56 -0.69 118.68 132.18 1uwu s LEU 423 Ca 0.05 -1.26 -0.28 0.00 0.02 0.00 0.00 54.13 52.66 1uwu s LEU 423 Cb -0.12 -1.61 -0.09 0.00 0.02 0.00 0.00 46.19 44.39 1uwu s LEU 423 CO -0.07 -0.19 1.14 -2.28 0.02 0.00 0.00 176.35 174.97 1uwu s HIS 424 N 1.18 3.36 -0.45 0.29 2.46 -0.56 -3.42 115.29 118.15 1uwu s HIS 424 Ca -0.06 1.62 -0.16 0.00 0.47 0.00 0.00 55.06 56.93 1uwu s HIS 424 Cb -0.19 -3.35 0.05 0.00 -0.13 0.00 0.00 32.58 28.95 1uwu s HIS 424 CO -0.04 -0.91 0.39 -0.46 -2.47 0.00 0.00 174.74 171.24 1uwu s TRP 425 N -1.26 3.22 0.31 3.88 -0.11 -0.22 -1.84 118.94 122.91 1uwu s TRP 425 Ca 0.49 -0.71 0.02 0.00 1.22 0.00 0.00 56.10 57.13 1uwu s TRP 425 Cb -0.32 -2.96 -0.02 0.00 -1.50 0.00 0.00 33.47 28.67 1uwu s TRP 425 CO 0.41 -0.73 0.32 0.45 -4.62 0.00 0.00 176.95 172.78 1uwu s SER 426 N 2.18 1.13 0.12 5.86 0.15 -0.87 -4.09 113.70 118.17 1uwu s SER 426 Ca 0.06 -1.58 -0.22 0.00 0.70 0.00 0.00 55.95 54.91 1uwu s SER 426 Cb -0.21 0.56 -0.06 0.00 -1.71 0.00 0.00 66.02 64.60 1uwu s SER 426 CO 0.09 -1.10 1.70 0.25 1.20 0.00 0.00 173.24 175.38 1uwu h LEU 427 N 2.21 -0.24 -8.69 3.45 5.85 -1.75 -1.28 115.31 114.87 1uwu h LEU 427 Ca -0.28 0.05 -0.34 0.00 0.84 0.00 0.00 57.88 58.16 1uwu h LEU 427 Cb 1.24 0.13 -0.15 0.00 0.37 0.00 0.00 40.66 42.25 1uwu h LEU 427 CO 0.40 -0.10 -0.71 0.00 -0.34 0.00 0.00 178.44 177.69 1uwu s ALA 428 N -6.18 1.52 0.64 1.25 0.00 -1.26 -0.29 121.76 117.44 1uwu s ALA 428 Ca -0.14 -1.53 -0.17 0.00 0.00 0.00 0.00 51.96 50.12 1uwu s ALA 428 Cb 0.09 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.24 1uwu s ALA 428 CO 0.68 -0.10 0.68 -0.25 0.00 0.00 0.00 175.76 176.77 1uwu n ASP 429 N -0.23 -0.47 -2.65 0.00 8.00 -0.88 -4.15 116.55 116.17 1uwu n ASP 429 Ca -0.10 0.70 -0.10 0.00 0.71 0.00 0.00 54.79 56.01 1uwu n ASP 429 Cb 0.61 -1.26 0.01 0.00 -0.02 0.00 0.00 41.12 40.45 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 -0.29 -1.73 -4.58 -2.24 0.23 -1.26 -4.77 115.26 100.62 1uwu n ASN 430 Ca 0.12 -2.52 -0.42 0.00 -0.53 0.00 0.00 54.58 51.23 1uwu n ASN 430 Cb 0.48 2.97 -0.02 0.00 -2.08 0.00 0.00 39.78 41.13 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 -3.04 2.31 -1.41 -2.53 5.04 -0.74 -4.66 117.35 112.32 1uwu s TYR 431 Ca 0.19 0.54 -0.10 0.00 -2.44 0.00 0.00 57.07 55.25 1uwu s TYR 431 Cb -0.03 -4.36 0.07 0.00 0.35 0.00 0.00 41.96 37.98 1uwu s TYR 431 CO 0.14 -1.97 2.29 -1.91 -1.34 0.00 0.00 175.55 172.76 1uwu n GLU 432 N 8.49 3.56 0.00 4.97 4.07 0.27 -4.65 120.64 137.35 1uwu n GLU 432 Ca 0.14 -2.96 0.00 0.00 -0.06 0.00 0.00 57.16 54.28 1uwu n GLU 432 Cb 0.49 -2.96 0.00 0.00 -0.06 0.00 0.00 31.44 28.90 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 4.14 0.00 0.29 4.31 7.02 -1.26 -1.06 117.44 130.88 1uwu n TRP 433 Ca 0.55 0.00 0.17 0.00 -1.02 0.00 0.00 57.50 57.21 1uwu n TRP 433 Cb 0.32 0.00 0.85 0.00 -2.42 0.00 0.00 31.31 30.06 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 -0.36 1.09 0.00 6.99 0.00 -1.84 -2.47 119.26 122.67 1uwu h ALA 434 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1uwu h ALA 434 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1uwu h ALA 434 CO 0.00 0.06 -0.05 0.77 0.00 0.00 0.00 179.25 180.03 1uwu h SER 435 N 0.00 0.00 0.00 0.00 0.02 -1.43 0.69 113.55 112.83 1uwu h SER 435 Ca -0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1uwu h SER 435 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1uwu h SER 435 CO 0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 1uwu n GLY 436 N 1.19 -0.63 0.03 -3.77 0.00 -0.93 -4.10 105.19 96.98 1uwu n GLY 436 Ca 0.04 -1.15 0.13 0.00 0.00 0.00 0.00 46.02 45.05 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 0.00 0.23 1.61 3.72 -1.26 -0.57 117.46 121.20 1uwu n PHE 437 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 1uwu n PHE 437 Cb 0.00 -0.32 0.54 0.00 -0.94 0.00 0.00 39.48 38.76 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 0.17 0.00 -3.60 4.37 4.64 -1.90 -3.39 113.55 113.83 1uwu h SER 438 Ca 0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 1uwu h SER 438 Cb 0.47 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.42 1uwu h SER 438 CO 0.00 0.20 0.24 -0.04 -0.87 0.00 0.00 176.83 176.36 1uwu s MET 439 N -3.81 3.40 -0.37 4.77 -1.94 -1.26 -4.92 119.30 115.18 1uwu s MET 439 Ca -0.00 -0.17 -0.05 0.00 -1.71 0.00 0.00 55.69 53.75 1uwu s MET 439 Cb 0.11 -3.92 0.07 0.00 2.01 0.00 0.00 34.83 33.09 1uwu s MET 439 CO 0.62 -1.02 0.14 1.03 -0.01 0.00 0.00 175.02 175.78 1uwu s ARG 440 N 3.04 2.45 0.00 2.03 0.52 -1.26 -4.65 118.95 121.07 1uwu s ARG 440 Ca 0.26 -1.40 0.24 0.00 -0.52 0.00 0.00 55.73 54.31 1uwu s ARG 440 Cb -0.13 -3.51 0.24 0.00 0.52 0.00 0.00 34.95 32.07 1uwu s ARG 440 CO 0.20 -0.82 1.27 1.19 0.02 0.00 0.00 175.30 177.17 1uwu n PHE 441 N 4.75 0.00 -2.32 -0.53 3.01 -1.26 -0.93 117.46 120.19 1uwu n PHE 441 Ca -0.10 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 57.97 1uwu n PHE 441 Cb 0.43 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.87 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 -2.14 2.93 0.47 1.37 0.00 -1.26 -2.06 107.32 106.64 1uwu s GLY 442 Ca 0.26 0.99 0.19 0.00 0.00 0.00 0.00 44.72 46.16 1uwu s GLY 442 CO 0.38 1.55 2.03 1.41 0.00 0.00 0.00 173.10 178.46 1uwu h LEU 443 N 3.05 0.00 -8.83 0.66 3.38 -0.86 -3.42 115.31 109.29 1uwu h LEU 443 Ca -0.48 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 56.83 1uwu h LEU 443 Cb 1.23 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.75 1uwu h LEU 443 CO 0.64 0.16 -0.70 -0.76 0.09 0.00 0.00 178.44 177.87 1uwu s LEU 444 N -8.22 3.07 0.09 1.67 1.43 0.61 -2.46 118.68 114.87 1uwu s LEU 444 Ca -0.04 -0.16 -0.28 0.00 -1.03 0.00 0.00 54.13 52.62 1uwu s LEU 444 Cb 0.15 -1.71 -0.06 0.00 0.03 0.00 0.00 46.19 44.60 1uwu s LEU 444 CO 0.66 0.21 0.87 -0.75 0.23 0.00 0.00 176.35 177.57 1uwu s LYS 445 N 0.10 4.62 -0.20 1.70 2.20 0.52 -2.07 119.74 126.61 1uwu s LYS 445 Ca -0.03 1.28 -0.07 0.00 -0.36 0.00 0.00 55.97 56.79 1uwu s LYS 445 Cb -0.14 -3.36 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 1uwu s LYS 445 CO 0.03 0.28 0.06 0.08 -0.36 0.00 0.00 175.35 175.45 1uwu s VAL 446 N -0.16 4.67 -0.46 4.02 1.01 -1.26 -0.85 120.40 127.37 1uwu s VAL 446 Ca 0.42 -0.07 -0.23 0.00 0.00 0.00 0.00 61.98 62.10 1uwu s VAL 446 Cb -0.22 -3.12 0.03 0.00 0.00 0.00 0.00 36.38 33.06 1uwu s VAL 446 CO 0.27 0.43 0.79 -0.62 0.00 0.00 0.00 175.10 175.97 1uwu s ASP 447 N 0.68 6.40 0.37 3.32 -1.08 -0.56 -4.94 116.67 120.86 1uwu s ASP 447 Ca 0.03 -0.14 0.28 0.00 -0.52 0.00 0.00 52.55 52.19 1uwu s ASP 447 Cb -0.13 -2.39 1.10 0.00 -1.46 0.00 0.00 42.92 40.04 1uwu s ASP 447 CO 0.02 -0.93 1.82 1.88 0.52 0.00 0.00 175.17 178.47 1uwu h TYR 448 N 9.00 0.00 -0.16 -5.34 0.05 -1.92 0.34 116.97 118.93 1uwu h TYR 448 Ca -0.25 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.36 1uwu h TYR 448 Cb 1.08 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.82 1uwu h TYR 448 CO 0.80 0.00 -0.63 -0.91 -1.05 0.00 0.00 178.16 176.38 1uwu h ASN 449 N 0.00 0.65 0.00 3.88 2.35 -1.93 -3.37 115.58 117.17 1uwu h ASN 449 Ca 0.00 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 1uwu h ASN 449 Cb 0.47 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1uwu h ASN 449 CO 0.00 1.12 0.00 0.35 -1.65 0.00 0.00 177.43 177.25 1uwu n THR 450 N -3.93 0.00 -1.18 2.81 -2.24 -1.10 -5.00 114.28 103.65 1uwu n THR 450 Ca -0.04 -0.50 -0.06 0.00 -2.27 0.00 0.00 64.05 61.18 1uwu n THR 450 Cb 0.65 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.86 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 -0.79 -1.47 -2.26 -0.78 4.76 0.12 -4.98 118.16 112.75 1uwu n LYS 451 Ca 0.00 0.66 -0.39 0.00 -2.87 0.00 0.00 58.31 55.71 1uwu n LYS 451 Cb 0.00 -4.88 -0.02 0.00 -1.84 0.00 0.00 35.03 28.29 1uwu n LYS 451 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1uwu s ARG 452 N -2.29 4.14 -0.11 1.97 3.52 -1.21 -4.81 118.95 120.15 1uwu s ARG 452 Ca 0.00 1.92 -0.03 0.00 -0.13 0.00 0.00 55.73 57.49 1uwu s ARG 452 Cb 0.00 -2.78 -0.03 0.00 -1.56 0.00 0.00 34.95 30.58 1uwu s ARG 452 CO 0.00 -0.27 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.69 1uwu s LEU 453 N -2.31 3.44 0.10 -0.88 1.43 -1.26 -1.49 118.68 117.71 1uwu s LEU 453 Ca 0.55 0.03 0.09 0.00 -1.03 0.00 0.00 54.13 53.77 1uwu s LEU 453 Cb -0.33 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 1uwu s LEU 453 CO 0.42 0.29 -0.24 -0.31 0.23 0.00 0.00 176.35 176.74 1uwu s TYR 454 N -0.37 2.02 -0.44 0.29 1.51 -0.03 -4.94 117.35 115.39 1uwu s TYR 454 Ca 0.07 -0.40 -0.24 0.00 -1.01 0.00 0.00 57.07 55.49 1uwu s TYR 454 Cb -0.12 -1.13 0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1uwu s TYR 454 CO 0.02 0.23 0.83 -1.58 -1.11 0.00 0.00 175.55 173.94 1uwu s TRP 455 N -1.04 2.99 0.62 2.71 0.52 -1.26 -0.35 118.94 123.13 1uwu s TRP 455 Ca 0.10 0.29 -0.17 0.00 0.02 0.00 0.00 56.10 56.34 1uwu s TRP 455 Cb -0.10 -3.72 -0.02 0.00 -1.15 0.00 0.00 33.47 28.48 1uwu s TRP 455 CO 0.04 -0.99 1.13 1.03 0.02 0.00 0.00 176.95 178.18 1uwu s ARG 456 N 3.41 2.96 0.45 4.98 0.52 -1.03 -4.93 118.95 125.30 1uwu s ARG 456 Ca 0.32 1.52 0.22 0.00 -0.52 0.00 0.00 55.73 57.27 1uwu s ARG 456 Cb -0.12 -1.96 1.21 0.00 0.52 0.00 0.00 34.95 34.60 1uwu s ARG 456 CO 0.23 -1.15 1.85 -1.35 0.02 0.00 0.00 175.30 174.90 1uwu h PRO 457 N 0.46 0.28 -0.47 3.54 0.11 -1.93 0.04 132.00 134.03 1uwu h PRO 457 Ca -0.48 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.70 1uwu h PRO 457 Cb 1.26 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1uwu h PRO 457 CO 0.55 0.18 0.32 0.66 -0.21 0.00 0.00 178.00 179.50 1uwu h SER 458 N 0.28 0.23 -0.76 -2.05 4.64 -1.90 -0.94 113.55 113.05 1uwu h SER 458 Ca 0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.76 1uwu h SER 458 Cb 1.38 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 63.39 1uwu h SER 458 CO -0.14 0.14 0.33 0.00 -0.87 0.00 0.00 176.83 176.29 1uwu h ALA 459 N 1.76 1.12 -0.59 5.18 0.00 -1.13 0.25 119.26 125.85 1uwu h ALA 459 Ca 0.21 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1uwu h ALA 459 Cb 0.51 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1uwu h ALA 459 CO -0.04 0.64 0.05 -0.07 0.00 0.00 0.00 179.25 179.82 1uwu h LEU 460 N 1.11 0.94 -0.29 0.00 3.38 -1.24 -0.47 115.31 118.75 1uwu h LEU 460 Ca 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1uwu h LEU 460 Cb 0.18 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1uwu h LEU 460 CO -0.03 0.97 0.11 0.58 0.09 0.00 0.00 178.44 180.17 1uwu h VAL 461 N 0.91 1.18 -0.32 1.22 2.07 -0.98 -2.05 116.25 118.28 1uwu h VAL 461 Ca 0.18 -0.55 -0.07 0.00 0.82 0.00 0.00 66.70 67.08 1uwu h VAL 461 Cb 0.47 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1uwu h VAL 461 CO 0.02 0.19 -0.08 0.22 0.02 0.00 0.00 177.57 177.93 1uwu h TYR 462 N 0.31 0.57 -0.69 1.57 3.20 -0.30 -1.47 116.97 120.16 1uwu h TYR 462 Ca 0.10 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1uwu h TYR 462 Cb 0.19 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.27 1uwu h TYR 462 CO -0.01 0.61 0.28 -0.09 -1.64 0.00 0.00 178.16 177.31 1uwu h ARG 463 N 0.50 1.01 -0.24 1.82 2.43 -0.87 0.44 114.38 119.47 1uwu h ARG 463 Ca 0.10 -0.17 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1uwu h ARG 463 Cb 0.45 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 1uwu h ARG 463 CO 0.02 0.82 0.01 0.93 -1.51 0.00 0.00 179.97 180.25 1uwu h GLU 464 N 0.99 0.09 0.11 0.20 4.39 -0.56 -0.61 114.58 119.20 1uwu h GLU 464 Ca 0.23 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 1uwu h GLU 464 Cb 0.19 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1uwu h GLU 464 CO -0.02 0.06 -0.05 0.82 -1.16 0.00 0.00 179.01 178.66 1uwu h ILE 465 N 0.09 0.95 -0.17 3.13 2.04 -0.82 -2.72 117.51 120.01 1uwu h ILE 465 Ca 0.11 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 1uwu h ILE 465 Cb 0.13 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1uwu h ILE 465 CO -0.18 0.05 -0.05 0.00 0.00 0.00 0.00 178.15 177.97 1uwu h ALA 466 N 0.63 0.23 -0.19 1.87 0.00 -0.80 0.18 119.26 121.18 1uwu h ALA 466 Ca -0.02 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1uwu h ALA 466 Cb 0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1uwu h ALA 466 CO 0.03 0.01 -0.19 1.79 0.00 0.00 0.00 179.25 180.89 1uwu h THR 467 N 0.03 1.22 -0.00 0.00 1.35 -1.20 -2.72 112.91 111.60 1uwu h THR 467 Ca 0.04 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 1uwu h THR 467 Cb 0.50 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 1uwu h THR 467 CO 0.02 0.32 -0.42 0.59 -0.25 0.00 0.00 175.52 175.78 1uwu n ASN 468 N -4.20 0.48 -3.39 5.36 3.02 -1.03 -4.95 115.26 110.55 1uwu n ASN 468 Ca -0.00 -0.22 -0.25 0.00 -0.03 0.00 0.00 54.58 54.08 1uwu n ASN 468 Cb 0.33 0.15 0.03 0.00 -0.61 0.00 0.00 39.78 39.68 1uwu n ASN 468 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uwu n GLY 469 N 1.48 -0.51 3.54 7.41 0.00 0.55 -4.93 105.19 112.73 1uwu n GLY 469 Ca 0.06 0.15 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 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 -3.15 -1.85 -0.37 4.61 0.00 -0.68 -1.71 121.76 118.61 1uwu s ALA 470 Ca 0.45 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 1uwu s ALA 470 Cb -0.22 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1uwu s ALA 470 CO 0.56 -0.47 1.38 0.42 0.00 0.00 0.00 175.76 177.64 1uwu s ILE 471 N -1.93 3.98 0.73 0.00 1.01 -0.52 -4.11 121.20 120.35 1uwu s ILE 471 Ca -0.01 1.04 -0.11 0.00 0.00 0.00 0.00 60.65 61.57 1uwu s ILE 471 Cb -0.01 -4.18 0.03 0.00 0.01 0.00 0.00 42.46 38.31 1uwu s ILE 471 CO -0.01 -0.65 1.07 0.42 0.00 0.00 0.00 174.94 175.77 1uwu s THR 472 N 5.06 3.72 0.27 2.92 -4.23 -1.26 -1.58 115.64 120.53 1uwu s THR 472 Ca 0.60 0.56 0.01 0.00 -1.18 0.00 0.00 61.69 61.67 1uwu s THR 472 Cb -0.15 -3.34 0.26 0.00 1.34 0.00 0.00 72.50 70.62 1uwu s THR 472 CO 0.29 -0.73 1.80 0.44 -0.54 0.00 0.00 174.62 175.88 1uwu h ASP 473 N -0.81 0.73 0.65 3.99 3.32 -1.95 -2.46 116.42 119.90 1uwu h ASP 473 Ca -0.45 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 1uwu h ASP 473 Cb 1.23 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1uwu h ASP 473 CO 0.58 0.34 -0.08 1.05 -1.72 0.00 0.00 179.24 179.42 1uwu h GLU 474 N 0.80 0.00 -0.25 3.56 9.09 -2.02 -2.99 114.58 122.77 1uwu h GLU 474 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.90 1uwu h GLU 474 Cb 0.61 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.71 1uwu h GLU 474 CO -0.32 0.08 0.00 0.44 0.05 0.00 0.00 179.01 179.26 1uwu n ILE 475 N -3.31 1.26 0.27 -1.06 -5.35 -0.95 -4.70 119.36 105.53 1uwu n ILE 475 Ca -0.01 -1.21 0.15 0.00 -0.27 0.00 0.00 62.75 61.42 1uwu n ILE 475 Cb 0.27 0.34 0.74 0.00 -1.74 0.00 0.00 39.64 39.26 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 1.51 0.00 0.00 6.28 4.81 -1.35 -1.76 114.58 124.08 1uwu h GLU 476 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1uwu h GLU 476 Cb 0.82 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.20 1uwu h GLU 476 CO 0.04 0.08 -0.06 1.12 -0.73 0.00 0.00 179.01 179.46 1uwu h HIS 477 N 0.00 0.00 0.00 0.92 2.07 -1.84 -2.21 115.15 114.09 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 0.42 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.40 1uwu h HIS 477 CO 0.00 0.06 0.00 1.28 -3.07 0.00 0.00 177.93 176.20 1uwu n LEU 478 N -3.27 0.00 -3.64 6.12 4.77 -0.66 -3.90 117.00 116.41 1uwu n LEU 478 Ca -0.01 0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.84 1uwu n LEU 478 Cb 0.25 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1uwu n LEU 478 CO 0.27 -0.09 2.81 -3.20 -1.33 0.00 0.00 177.39 175.85 1uwu n ASN 479 N -1.28 5.00 -3.85 -1.43 4.05 -0.83 -3.85 115.26 113.07 1uwu n ASN 479 Ca 0.10 -2.80 -0.07 0.00 0.45 0.00 0.00 54.58 52.26 1uwu n ASN 479 Cb 0.16 -1.63 -0.02 0.00 1.23 0.00 0.00 39.78 39.52 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 2.86 -0.26 0.09 1.20 1.04 -1.25 -4.94 113.70 112.43 1uwu s SER 480 Ca 0.52 -0.59 -0.30 0.00 0.48 0.00 0.00 55.95 56.05 1uwu s SER 480 Cb 0.15 0.72 -0.05 0.00 0.10 0.00 0.00 66.02 66.93 1uwu s SER 480 CO -0.08 -1.33 1.05 -0.69 0.98 0.00 0.00 173.24 173.18 1uwu s VAL 481 N -3.89 4.34 0.12 5.02 1.01 -1.26 -4.76 120.40 120.99 1uwu s VAL 481 Ca 0.11 1.82 -0.35 0.00 0.00 0.00 0.00 61.98 63.56 1uwu s VAL 481 Cb -0.06 -4.17 -0.16 0.00 0.00 0.00 0.00 36.38 32.00 1uwu s VAL 481 CO 0.07 0.22 1.35 -2.65 0.00 0.00 0.00 175.10 174.08 1uwu n PRO 482 N 3.24 1.36 -1.68 2.72 -0.02 -1.26 -4.85 135.00 134.51 1uwu n PRO 482 Ca 0.05 0.49 -0.45 0.00 -2.02 0.00 0.00 63.50 61.56 1uwu n PRO 482 Cb 0.48 -2.13 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 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 2.49 2.40 0.09 0.52 -0.02 -1.26 -4.83 135.00 134.41 1uwu n PRO 483 Ca 0.17 0.87 -0.00 0.00 -2.02 0.00 0.00 63.50 62.52 1uwu n PRO 483 Cb 0.22 -2.72 -0.03 0.00 -0.02 0.00 0.00 33.50 30.95 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 4.63 0.97 -0.70 -1.45 -1.51 -1.93 -3.38 116.25 112.87 1uwu h VAL 484 Ca -0.47 -2.45 0.12 0.00 -1.23 0.00 0.00 66.70 62.67 1uwu h VAL 484 Cb 1.25 2.43 -0.08 0.00 -2.13 0.00 0.00 31.29 32.76 1uwu h VAL 484 CO 0.93 0.55 0.30 0.50 -1.23 0.00 0.00 177.57 178.62 1uwu h LYS 485 N 0.00 0.47 0.00 5.19 3.11 -1.98 -0.97 116.57 122.39 1uwu h LYS 485 Ca -0.05 -0.03 0.00 0.00 -2.81 0.00 0.00 60.65 57.76 1uwu h LYS 485 Cb 1.53 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 32.66 1uwu h LYS 485 CO 0.08 0.31 0.00 -2.30 -2.81 0.00 0.00 179.45 174.72 1uwu n PRO 486 N -4.96 0.01 -2.85 1.90 -0.02 -1.26 -4.88 135.00 122.94 1uwu n PRO 486 Ca 0.12 0.04 -0.25 0.00 -2.02 0.00 0.00 63.50 61.40 1uwu n PRO 486 Cb 0.34 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.33 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 -2.98 3.60 0.34 2.45 1.43 -0.37 -5.05 118.68 118.09 1uwu s LEU 487 Ca 0.13 0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 53.44 1uwu s LEU 487 Cb 0.17 -3.38 -0.11 0.00 0.03 0.00 0.00 46.19 42.91 1uwu s LEU 487 CO 0.48 -0.71 1.49 -0.60 0.23 0.00 0.00 176.35 177.24 1uwu s ARG 488 N -4.65 4.15 0.00 1.70 3.52 -1.26 -5.01 118.95 117.40 1uwu s ARG 488 Ca 0.48 2.51 0.13 0.00 -0.13 0.00 0.00 55.73 58.72 1uwu s ARG 488 Cb -0.10 -3.01 0.10 0.00 -1.56 0.00 0.00 34.95 30.38 1uwu s ARG 488 CO 0.40 -0.51 0.91 1.58 -0.81 0.00 0.00 175.30 176.87