#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uwq s TYR 2 N 0.00 2.02 -0.05 1.12 2.02 -0.18 -4.98 117.35 117.30 1uwq s TYR 2 Ca 0.00 -1.76 -0.09 0.00 -0.37 0.00 0.00 57.07 54.85 1uwq s TYR 2 Cb 0.00 -1.73 -0.05 0.00 -0.40 0.00 0.00 41.96 39.79 1uwq s TYR 2 CO 0.00 -0.82 0.26 -1.12 -1.57 0.00 0.00 175.55 172.30 1uwq s SER 3 N 1.51 6.55 0.13 2.29 0.01 -1.26 -0.85 113.70 122.08 1uwq s SER 3 Ca 0.05 0.65 0.03 0.00 1.31 0.00 0.00 55.95 57.99 1uwq s SER 3 Cb -0.18 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 1uwq s SER 3 CO -0.16 0.34 0.20 -0.36 0.41 0.00 0.00 173.24 173.67 1uwq s PHE 4 N -1.12 3.34 0.56 2.43 0.40 -0.13 -4.99 117.98 118.48 1uwq s PHE 4 Ca 0.21 0.09 -0.18 0.00 -0.60 0.00 0.00 56.93 56.45 1uwq s PHE 4 Cb -0.14 -1.62 -0.10 0.00 0.51 0.00 0.00 43.02 41.67 1uwq s PHE 4 CO 0.10 0.53 0.33 -2.30 0.70 0.00 0.00 175.22 174.58 1uwq n PRO 5 N -0.23 0.35 0.28 0.24 -0.02 -1.26 -4.86 135.00 129.49 1uwq n PRO 5 Ca -0.07 0.14 0.14 0.00 -2.02 0.00 0.00 63.50 61.69 1uwq n PRO 5 Cb 0.53 -1.50 0.86 0.00 -0.02 0.00 0.00 33.50 33.37 1uwq n PRO 5 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1uwq h ASN 6 N 0.12 0.00 0.49 2.55 2.35 -1.97 -2.25 115.58 116.86 1uwq h ASN 6 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1uwq h ASN 6 Cb 1.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.78 1uwq h ASN 6 CO 0.45 0.00 -0.45 -1.54 -1.65 0.00 0.00 177.43 174.24 1uwq n SER 7 N -3.96 0.54 -4.76 5.81 3.41 -1.26 -4.92 113.62 108.48 1uwq n SER 7 Ca -0.02 -0.30 -0.41 0.00 -0.26 0.00 0.00 58.87 57.88 1uwq n SER 7 Cb 0.12 0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.24 1uwq n SER 7 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1uwq s PHE 8 N -2.93 3.37 -0.05 7.33 2.19 -0.85 -4.95 117.98 122.08 1uwq s PHE 8 Ca 0.13 1.54 0.06 0.00 0.33 0.00 0.00 56.93 58.99 1uwq s PHE 8 Cb 0.18 -3.45 -0.01 0.00 -1.31 0.00 0.00 43.02 38.43 1uwq s PHE 8 CO 0.67 -1.14 -0.23 1.03 1.83 0.00 0.00 175.22 177.38 1uwq s ARG 9 N -1.33 2.35 -0.16 10.12 0.52 -0.94 -4.97 118.95 124.54 1uwq s ARG 9 Ca 0.48 -0.83 -0.07 0.00 -0.52 0.00 0.00 55.73 54.78 1uwq s ARG 9 Cb -0.35 -2.01 -0.04 0.00 0.52 0.00 0.00 34.95 33.07 1uwq s ARG 9 CO 0.44 0.35 0.09 -0.06 0.02 0.00 0.00 175.30 176.15 1uwq s PHE 10 N -0.13 3.38 0.00 -0.53 0.08 -1.26 -0.65 117.98 118.87 1uwq s PHE 10 Ca -0.03 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1uwq s PHE 10 Cb -0.13 -2.02 0.00 0.00 -0.57 0.00 0.00 43.02 40.30 1uwq s PHE 10 CO 0.03 0.39 0.00 0.41 -0.10 0.00 0.00 175.22 175.96 1uwq n GLY 11 N 2.91 3.31 3.40 4.36 0.00 0.33 -0.42 105.19 119.08 1uwq n GLY 11 Ca -0.18 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 1uwq n GLY 11 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1uwq s TRP 12 N 0.05 -0.08 0.20 1.61 -2.14 -1.01 -1.10 118.94 116.48 1uwq s TRP 12 Ca 0.00 -0.26 0.09 0.00 2.66 0.00 0.00 56.10 58.59 1uwq s TRP 12 Cb 0.00 0.26 -0.05 0.00 -3.10 0.00 0.00 33.47 30.59 1uwq s TRP 12 CO 0.00 -0.79 -0.17 -1.12 -2.66 0.00 0.00 176.95 172.21 1uwq s SER 13 N -2.86 2.86 -0.02 -2.66 0.01 -0.84 -1.39 113.70 108.80 1uwq s SER 13 Ca 0.08 -0.96 -0.29 0.00 1.31 0.00 0.00 55.95 56.09 1uwq s SER 13 Cb 0.01 -0.18 0.08 0.00 0.21 0.00 0.00 66.02 66.14 1uwq s SER 13 CO -0.06 -0.06 0.72 -1.58 0.41 0.00 0.00 173.24 172.66 1uwq s GLN 14 N -3.26 1.02 0.10 12.44 0.74 -0.87 -4.22 119.66 125.60 1uwq s GLN 14 Ca 0.21 0.07 0.09 0.00 0.05 0.00 0.00 55.36 55.79 1uwq s GLN 14 Cb -0.04 0.48 -0.04 0.00 1.10 0.00 0.00 33.01 34.51 1uwq s GLN 14 CO 0.09 -0.35 -0.22 0.00 -0.55 0.00 0.00 175.29 174.25 1uwq s ALA 15 N -1.77 2.53 0.08 1.58 0.00 -1.26 -4.09 121.76 118.83 1uwq s ALA 15 Ca -0.06 -1.36 -0.29 0.00 0.00 0.00 0.00 51.96 50.25 1uwq s ALA 15 Cb -0.00 -0.56 -0.17 0.00 0.00 0.00 0.00 23.12 22.38 1uwq s ALA 15 CO 0.03 0.57 1.66 0.78 0.00 0.00 0.00 175.76 178.80 1uwq h GLY 16 N 4.01 -0.58 1.18 0.00 0.00 -1.91 -2.16 103.07 103.61 1uwq h GLY 16 Ca -0.50 0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.08 1uwq h GLY 16 CO 0.44 -0.21 0.50 -2.75 0.00 0.00 0.00 176.54 174.51 1uwq h PHE 17 N -0.56 0.91 0.00 5.60 3.57 -1.95 0.26 116.94 124.76 1uwq h PHE 17 Ca -0.06 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.30 1uwq h PHE 17 Cb 0.43 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1uwq h PHE 17 CO -0.05 0.54 -0.80 1.96 -2.23 0.00 0.00 178.31 177.74 1uwq h GLN 18 N 0.95 0.00 0.00 1.11 4.20 -1.78 -3.40 115.11 116.20 1uwq h GLN 18 Ca 0.29 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.00 1uwq h GLN 18 Cb -0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1uwq h GLN 18 CO -0.08 0.80 -1.02 0.43 -0.67 0.00 0.00 178.83 178.29 1uwq n SER 19 N -3.44 4.92 0.05 1.46 7.64 -0.83 -1.50 113.62 121.93 1uwq n SER 19 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 1uwq n SER 19 Cb 0.81 0.82 -0.09 0.00 -1.01 0.00 0.00 64.21 64.75 1uwq n SER 19 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1uwq h GLU 20 N 0.00 -0.12 -7.19 1.43 5.08 -1.13 0.65 114.58 113.30 1uwq h GLU 20 Ca -0.00 0.01 -0.50 0.00 -1.00 0.00 0.00 59.36 57.87 1uwq h GLU 20 Cb 0.40 0.03 0.07 0.00 0.50 0.00 0.00 28.75 29.75 1uwq h GLU 20 CO 0.00 0.18 0.38 -1.64 -1.00 0.00 0.00 179.01 176.92 1uwq s MET 21 N -5.00 3.18 0.00 2.33 -1.94 -1.26 -0.98 119.30 115.63 1uwq s MET 21 Ca -0.15 1.28 0.00 0.00 -1.71 0.00 0.00 55.69 55.11 1uwq s MET 21 Cb 0.03 -2.01 0.00 0.00 2.01 0.00 0.00 34.83 34.86 1uwq s MET 21 CO 0.64 -0.93 0.00 0.41 -0.01 0.00 0.00 175.02 175.13 1uwq n GLY 22 N -0.78 1.16 3.93 -0.03 0.00 -1.22 -0.97 105.19 107.27 1uwq n GLY 22 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1uwq n GLY 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uwq s THR 23 N 0.00 5.33 0.13 2.61 -4.23 -1.26 -4.73 115.64 113.49 1uwq s THR 23 Ca 0.00 -0.45 -0.35 0.00 -1.18 0.00 0.00 61.69 59.71 1uwq s THR 23 Cb 0.00 -3.68 -0.14 0.00 1.34 0.00 0.00 72.50 70.02 1uwq s THR 23 CO 0.00 0.02 1.53 -2.65 -0.54 0.00 0.00 174.62 172.99 1uwq n PRO 24 N -0.10 1.90 -0.32 3.99 -0.02 -1.26 -1.90 135.00 137.28 1uwq n PRO 24 Ca -0.05 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1uwq n PRO 24 Cb 0.52 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1uwq n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uwq n GLY 25 N 3.24 0.73 0.17 -1.23 0.00 -1.26 -4.92 105.19 101.92 1uwq n GLY 25 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1uwq n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uwq n SER 26 N 0.00 1.15 -4.72 1.61 3.41 -0.80 -4.99 113.62 109.28 1uwq n SER 26 Ca 0.00 -0.94 -0.43 0.00 -0.26 0.00 0.00 58.87 57.24 1uwq n SER 26 Cb 0.00 0.56 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 1uwq n SER 26 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1uwq n GLU 27 N -0.99 2.46 -3.71 4.33 2.13 -1.26 -4.66 120.64 118.93 1uwq n GLU 27 Ca 0.07 0.87 -0.30 0.00 0.66 0.00 0.00 57.16 58.47 1uwq n GLU 27 Cb 0.37 -2.60 -0.13 0.00 0.27 0.00 0.00 31.44 29.35 1uwq n GLU 27 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1uwq s ASP 28 N 0.32 3.68 0.00 4.31 2.15 -1.26 -4.98 116.67 120.89 1uwq s ASP 28 Ca 0.64 -2.55 0.20 0.00 0.43 0.00 0.00 52.55 51.27 1uwq s ASP 28 Cb -0.55 -1.02 1.07 0.00 -0.30 0.00 0.00 42.92 42.13 1uwq s ASP 28 CO 0.51 -0.28 1.71 -0.81 -0.17 0.00 0.00 175.17 176.13 1uwq n PRO 29 N 3.65 1.18 -1.21 4.34 -0.04 -1.26 -4.46 135.00 137.19 1uwq n PRO 29 Ca 0.08 -0.27 -0.23 0.00 -0.04 0.00 0.00 63.50 63.04 1uwq n PRO 29 Cb 0.35 -1.33 0.17 0.00 -0.04 0.00 0.00 33.50 32.65 1uwq n PRO 29 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1uwq n ASN 30 N -0.53 4.03 -4.55 3.54 5.03 -1.26 -4.62 115.26 116.90 1uwq n ASN 30 Ca 0.15 -3.65 -0.24 0.00 0.87 0.00 0.00 54.58 51.72 1uwq n ASN 30 Cb 0.13 -0.83 -0.09 0.00 -1.02 0.00 0.00 39.78 37.97 1uwq n ASN 30 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1uwq s THR 31 N -3.46 2.83 0.24 3.41 -4.23 -1.26 -0.60 115.64 112.57 1uwq s THR 31 Ca 0.57 -2.20 -0.05 0.00 -1.18 0.00 0.00 61.69 58.83 1uwq s THR 31 Cb 0.48 -2.54 0.22 0.00 1.34 0.00 0.00 72.50 72.00 1uwq s THR 31 CO 0.09 -0.37 1.84 -2.24 -0.54 0.00 0.00 174.62 173.40 1uwq h ASP 32 N 2.09 0.80 -0.56 3.99 3.04 -1.35 -2.36 116.42 122.07 1uwq h ASP 32 Ca -0.42 0.03 -0.06 0.00 -3.24 0.00 0.00 57.03 53.33 1uwq h ASP 32 Cb 1.26 -0.14 -0.02 0.00 -1.04 0.00 0.00 39.33 39.38 1uwq h ASP 32 CO 0.61 0.50 0.10 -0.50 -2.04 0.00 0.00 179.24 177.91 1uwq h TRP 33 N 0.93 0.98 -0.22 4.15 4.06 -1.93 0.24 115.95 124.16 1uwq h TRP 33 Ca 0.39 -0.13 0.01 0.00 2.06 0.00 0.00 58.89 61.21 1uwq h TRP 33 Cb 0.24 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1uwq h TRP 33 CO -0.04 0.86 0.14 -0.92 -3.56 0.00 0.00 178.44 174.92 1uwq h TYR 34 N 0.82 0.26 -0.47 0.49 5.03 -1.85 -1.09 116.97 120.16 1uwq h TYR 34 Ca 0.17 0.01 -0.08 0.00 2.58 0.00 0.00 58.73 61.41 1uwq h TYR 34 Cb 0.40 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.58 1uwq h TYR 34 CO 0.03 0.16 -0.01 -0.22 -1.32 0.00 0.00 178.16 176.79 1uwq h LYS 35 N 0.28 0.84 -0.71 1.82 3.64 -1.11 -2.44 116.57 118.90 1uwq h LYS 35 Ca 0.08 -0.28 0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1uwq h LYS 35 Cb -0.02 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 31.66 1uwq h LYS 35 CO -0.03 0.90 0.34 2.35 -2.27 0.00 0.00 179.45 180.73 1uwq h TRP 36 N 0.70 0.60 0.00 1.91 2.91 -0.18 -1.69 115.95 120.20 1uwq h TRP 36 Ca 0.13 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.18 1uwq h TRP 36 Cb 0.53 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 1uwq h TRP 36 CO 0.04 0.20 -0.29 -0.39 -1.03 0.00 0.00 178.44 176.97 1uwq h VAL 37 N 0.56 0.00 -0.00 2.65 -1.51 -1.01 -2.99 116.25 113.96 1uwq h VAL 37 Ca 0.35 -0.68 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 1uwq h VAL 37 Cb 0.40 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1uwq h VAL 37 CO -0.29 0.00 -0.36 1.41 -1.23 0.00 0.00 177.57 177.10 1uwq n HIS 38 N -2.49 0.00 -1.90 5.19 8.25 -0.93 -4.72 115.22 118.63 1uwq n HIS 38 Ca 0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.08 1uwq n HIS 38 Cb 0.47 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 1uwq n HIS 38 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1uwq s ASP 39 N -2.94 6.59 0.25 0.41 2.15 -0.67 -4.90 116.67 117.56 1uwq s ASP 39 Ca 0.13 2.42 -0.04 0.00 0.43 0.00 0.00 52.55 55.50 1uwq s ASP 39 Cb 0.18 -2.54 0.47 0.00 -0.30 0.00 0.00 42.92 40.73 1uwq s ASP 39 CO 0.64 -0.95 1.71 -0.65 -0.17 0.00 0.00 175.17 175.76 1uwq h PRO 40 N 9.44 0.37 -0.38 4.34 0.11 -1.92 -1.15 132.00 142.83 1uwq h PRO 40 Ca -0.43 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.54 1uwq h PRO 40 Cb 1.20 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1uwq h PRO 40 CO 0.94 0.25 -0.21 0.93 -0.21 0.00 0.00 178.00 179.70 1uwq h GLU 41 N 0.39 0.81 -0.83 1.05 5.08 -1.98 -1.19 114.58 117.91 1uwq h GLU 41 Ca 0.42 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1uwq h GLU 41 Cb 0.67 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 1uwq h GLU 41 CO -0.44 1.00 0.51 -0.91 -1.00 0.00 0.00 179.01 178.17 1uwq h ASN 42 N 0.61 1.00 -0.42 1.42 2.35 -1.77 -0.91 115.58 117.85 1uwq h ASN 42 Ca 0.08 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 1uwq h ASN 42 Cb 0.77 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.87 1uwq h ASN 42 CO 0.06 0.76 0.19 0.24 -1.65 0.00 0.00 177.43 177.04 1uwq h MET 43 N 1.14 0.61 -0.09 0.81 2.86 -1.11 -0.48 114.93 118.67 1uwq h MET 43 Ca 0.30 -0.10 -0.10 0.00 -2.06 0.00 0.00 59.70 57.75 1uwq h MET 43 Cb -0.06 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.48 1uwq h MET 43 CO -0.06 0.54 -0.40 0.00 1.06 0.00 0.00 176.91 178.05 1uwq h ALA 44 N 1.04 1.17 0.00 6.32 0.00 -0.89 -1.89 119.26 125.02 1uwq h ALA 44 Ca 0.14 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1uwq h ALA 44 Cb 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1uwq h ALA 44 CO -0.02 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1uwq n ALA 45 N -2.47 2.07 -1.25 0.00 0.00 -0.38 -4.90 120.51 113.58 1uwq n ALA 45 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 1uwq n ALA 45 Cb 0.46 -1.42 -0.04 0.00 0.00 0.00 0.00 19.45 18.46 1uwq n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwq n GLY 46 N 0.88 1.04 0.19 0.00 0.00 -0.71 -4.91 105.19 101.68 1uwq n GLY 46 Ca 0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 46.02 45.53 1uwq n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1uwq h LEU 47 N 0.00 0.16 -8.92 0.99 3.38 -1.35 -3.44 115.31 106.13 1uwq h LEU 47 Ca -0.18 -0.06 -0.51 0.00 0.09 0.00 0.00 57.88 57.21 1uwq h LEU 47 Cb 0.61 -0.04 -0.16 0.00 0.09 0.00 0.00 40.66 41.16 1uwq h LEU 47 CO 0.26 0.56 -0.76 0.68 0.09 0.00 0.00 178.44 179.27 1uwq s VAL 48 N -4.12 1.92 -0.15 1.22 -7.23 -1.18 -4.11 120.40 106.74 1uwq s VAL 48 Ca -0.04 -2.11 0.24 0.00 -1.81 0.00 0.00 61.98 58.26 1uwq s VAL 48 Cb 0.14 -2.00 0.28 0.00 0.56 0.00 0.00 36.38 35.36 1uwq s VAL 48 CO 0.76 -0.43 1.72 0.77 -0.31 0.00 0.00 175.10 177.61 1uwq h SER 49 N 2.83 0.00 0.00 4.85 4.64 -1.46 -3.42 113.55 120.99 1uwq h SER 49 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1uwq h SER 49 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1uwq h SER 49 CO 0.56 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 177.27 1uwq n GLY 50 N 0.68 2.25 3.78 -0.77 0.00 -1.26 -5.03 105.19 104.84 1uwq n GLY 50 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 1uwq n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uwq s ASP 51 N -1.54 5.87 -0.06 1.61 1.01 -1.26 -5.05 116.67 117.25 1uwq s ASP 51 Ca 0.00 2.04 0.04 0.00 0.71 0.00 0.00 52.55 55.35 1uwq s ASP 51 Cb 0.00 -2.57 -0.00 0.00 1.01 0.00 0.00 42.92 41.36 1uwq s ASP 51 CO 0.00 -1.11 -0.20 -0.76 0.21 0.00 0.00 175.17 173.31 1uwq s LEU 52 N -3.87 1.96 0.59 1.23 1.43 -1.26 -4.91 118.68 113.85 1uwq s LEU 52 Ca 0.69 -0.44 0.31 0.00 -1.03 0.00 0.00 54.13 53.66 1uwq s LEU 52 Cb -0.20 -1.17 1.83 0.00 0.03 0.00 0.00 46.19 46.67 1uwq s LEU 52 CO 0.27 0.16 2.24 1.55 0.23 0.00 0.00 176.35 180.81 1uwq h PRO 53 N 6.41 0.00 0.00 1.29 0.13 -1.96 -2.10 132.00 135.77 1uwq h PRO 53 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1uwq h PRO 53 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1uwq h PRO 53 CO 0.47 0.02 0.00 -0.85 -0.23 0.00 0.00 178.00 177.41 1uwq n GLU 54 N -3.76 0.06 -0.96 0.86 0.00 -1.26 -1.58 120.64 114.00 1uwq n GLU 54 Ca -0.03 0.25 -0.03 0.00 0.00 0.00 0.00 57.16 57.35 1uwq n GLU 54 Cb 0.10 -1.50 0.32 0.00 0.00 0.00 0.00 31.44 30.36 1uwq n GLU 54 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1uwq n ASN 55 N -1.43 4.84 -2.36 -1.84 3.02 -0.79 -3.42 115.26 113.28 1uwq n ASN 55 Ca 0.04 -3.19 0.00 0.00 -0.03 0.00 0.00 54.58 51.40 1uwq n ASN 55 Cb 0.13 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 38.58 1uwq n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uwq n GLY 56 N -0.10 -0.93 0.01 7.41 0.00 -0.61 -4.88 105.19 106.08 1uwq n GLY 56 Ca 0.38 -1.66 0.11 0.00 0.00 0.00 0.00 46.02 44.84 1uwq n GLY 56 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uwq n PRO 57 N -0.62 0.02 -2.83 1.61 -0.04 -1.10 -4.23 135.00 127.81 1uwq n PRO 57 Ca 0.00 0.12 -0.09 0.00 -0.04 0.00 0.00 63.50 63.50 1uwq n PRO 57 Cb 0.00 -1.52 0.03 0.00 -0.04 0.00 0.00 33.50 31.97 1uwq n PRO 57 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uwq n GLY 58 N 0.84 0.32 0.24 0.55 0.00 -0.14 -4.90 105.19 102.08 1uwq n GLY 58 Ca 0.05 -0.30 0.04 0.00 0.00 0.00 0.00 46.02 45.81 1uwq n GLY 58 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1uwq h TYR 59 N -0.97 0.15 -0.48 1.61 3.20 -0.34 0.30 116.97 120.44 1uwq h TYR 59 Ca -0.22 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.73 1uwq h TYR 59 Cb 1.14 -0.04 -0.09 0.00 1.54 0.00 0.00 36.73 39.28 1uwq h TYR 59 CO 0.19 0.28 -0.06 2.35 -1.64 0.00 0.00 178.16 179.27 1uwq h TRP 60 N 0.14 -0.15 0.01 -3.82 2.91 -1.26 -1.03 115.95 112.74 1uwq h TRP 60 Ca 0.03 0.04 -0.29 0.00 1.13 0.00 0.00 58.89 59.80 1uwq h TRP 60 Cb 0.33 0.14 -0.05 0.00 -0.51 0.00 0.00 29.16 29.07 1uwq h TRP 60 CO 0.00 -0.16 -1.69 0.78 -1.03 0.00 0.00 178.44 176.35 1uwq h GLY 61 N 0.05 0.03 -2.38 2.65 0.00 -1.75 -3.40 103.07 98.26 1uwq h GLY 61 Ca 0.24 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1uwq h GLY 61 CO -0.45 0.06 0.00 0.70 0.00 0.00 0.00 176.54 176.85 1uwq n ASN 62 N -3.10 4.24 -0.25 0.19 3.02 0.08 -4.70 115.26 114.74 1uwq n ASN 62 Ca -0.17 -2.51 0.23 0.00 -0.03 0.00 0.00 54.58 52.11 1uwq n ASN 62 Cb 1.05 -0.50 0.57 0.00 -0.61 0.00 0.00 39.78 40.29 1uwq n ASN 62 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 1uwq h TYR 63 N 3.14 0.41 -0.81 3.10 -0.00 -1.40 -0.69 116.97 120.72 1uwq h TYR 63 Ca 0.00 0.01 -0.03 0.00 -0.00 0.00 0.00 58.73 58.71 1uwq h TYR 63 Cb 1.33 -0.12 -0.04 0.00 -0.00 0.00 0.00 36.73 37.90 1uwq h TYR 63 CO 0.61 0.08 0.37 0.87 -0.00 0.00 0.00 178.16 180.10 1uwq h LYS 64 N 0.28 1.19 -0.59 0.10 1.57 -1.87 -0.41 116.57 116.84 1uwq h LYS 64 Ca 0.49 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 59.03 1uwq h LYS 64 Cb 1.43 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 1uwq h LYS 64 CO -0.15 0.93 0.16 1.15 -0.57 0.00 0.00 179.45 180.96 1uwq h THR 65 N 1.16 1.25 -0.03 -0.16 2.02 -1.51 -0.70 112.91 114.94 1uwq h THR 65 Ca 0.28 -0.87 0.01 0.00 0.77 0.00 0.00 66.41 66.59 1uwq h THR 65 Cb 0.15 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1uwq h THR 65 CO -0.03 0.33 -0.01 -0.26 0.37 0.00 0.00 175.52 175.91 1uwq h PHE 66 N 0.84 -0.03 -0.38 3.16 -1.00 -1.25 -2.15 116.94 116.14 1uwq h PHE 66 Ca 0.19 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.89 1uwq h PHE 66 Cb 0.33 0.02 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 1uwq h PHE 66 CO 0.02 -0.02 -0.09 0.45 -1.61 0.00 0.00 178.31 177.06 1uwq h HIS 67 N -0.01 0.71 -0.29 -0.55 3.86 -0.94 -0.74 115.15 117.19 1uwq h HIS 67 Ca 0.02 -0.11 0.03 0.00 -1.16 0.00 0.00 60.37 59.14 1uwq h HIS 67 Cb 0.04 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 1uwq h HIS 67 CO -0.11 0.72 0.10 -0.44 0.86 0.00 0.00 177.93 179.07 1uwq h ASP 68 N 0.60 0.11 -0.35 2.45 3.32 -0.93 0.01 116.42 121.64 1uwq h ASP 68 Ca 0.11 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 1uwq h ASP 68 Cb 0.52 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1uwq h ASP 68 CO 0.03 0.10 0.01 0.78 -1.72 0.00 0.00 179.24 178.44 1uwq h ASN 69 N 0.23 0.59 -0.77 6.45 2.35 -1.05 -1.03 115.58 122.34 1uwq h ASN 69 Ca 0.13 -0.30 0.05 0.00 -0.55 0.00 0.00 56.30 55.63 1uwq h ASN 69 Cb 0.09 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.25 1uwq h ASN 69 CO -0.13 0.74 0.47 0.00 -1.65 0.00 0.00 177.43 176.87 1uwq h ALA 70 N 0.87 1.04 -0.21 -0.83 0.00 -1.01 -0.38 119.26 118.74 1uwq h ALA 70 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1uwq h ALA 70 Cb 0.44 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1uwq h ALA 70 CO 0.02 0.22 0.04 0.37 0.00 0.00 0.00 179.25 179.90 1uwq h GLN 71 N 0.89 0.34 -0.62 0.00 4.15 -0.84 -1.56 115.11 117.47 1uwq h GLN 71 Ca 0.33 -0.09 0.13 0.00 0.77 0.00 0.00 58.65 59.79 1uwq h GLN 71 Cb 0.12 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 27.73 1uwq h GLN 71 CO -0.15 0.47 0.42 0.87 -1.93 0.00 0.00 178.83 178.51 1uwq h LYS 72 N 0.14 0.29 -0.00 1.69 1.57 -0.97 0.30 116.57 119.59 1uwq h LYS 72 Ca 0.06 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1uwq h LYS 72 Cb 0.30 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1uwq h LYS 72 CO 0.00 0.19 -0.05 -0.12 -0.57 0.00 0.00 179.45 178.91 1uwq n MET 73 N -4.45 0.68 -1.06 3.15 1.56 -0.17 -4.90 117.12 111.93 1uwq n MET 73 Ca 0.11 -0.14 -0.02 0.00 -0.27 0.00 0.00 57.70 57.38 1uwq n MET 73 Cb 0.47 -1.50 -0.01 0.00 2.15 0.00 0.00 33.22 34.34 1uwq n MET 73 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1uwq n GLY 74 N 1.23 0.55 3.77 -5.12 0.00 0.09 -4.20 105.19 101.52 1uwq n GLY 74 Ca 0.16 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 1uwq n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwq s LEU 75 N -0.46 3.89 0.00 0.99 1.43 -0.63 -4.49 118.68 119.41 1uwq s LEU 75 Ca 0.00 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1uwq s LEU 75 Cb 0.00 -4.40 0.00 0.00 0.03 0.00 0.00 46.19 41.82 1uwq s LEU 75 CO 0.00 -1.07 0.19 0.29 0.23 0.00 0.00 176.35 175.99 1uwq n LYS 76 N -0.88 -0.31 -3.85 1.70 4.01 0.43 -4.73 118.16 114.55 1uwq n LYS 76 Ca 0.09 -0.19 -0.12 0.00 -0.51 0.00 0.00 58.31 57.58 1uwq n LYS 76 Cb 0.49 -0.68 -0.11 0.00 -0.51 0.00 0.00 35.03 34.22 1uwq n LYS 76 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1uwq s ILE 77 N -0.01 0.05 0.01 -0.18 2.07 -1.19 -1.07 121.20 120.88 1uwq s ILE 77 Ca 0.00 -0.40 0.01 0.00 -1.41 0.00 0.00 60.65 58.85 1uwq s ILE 77 Cb 0.00 -0.36 -0.01 0.00 0.13 0.00 0.00 42.46 42.22 1uwq s ILE 77 CO 0.00 -0.22 -0.03 0.00 -1.91 0.00 0.00 174.94 172.78 1uwq s ALA 78 N -0.76 0.23 -0.09 1.50 0.00 -0.09 -2.40 121.76 120.16 1uwq s ALA 78 Ca -0.08 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 51.58 1uwq s ALA 78 Cb -0.05 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.10 1uwq s ALA 78 CO 0.01 -0.01 -0.14 0.50 0.00 0.00 0.00 175.76 176.12 1uwq s ARG 79 N -0.61 2.04 0.09 0.00 3.00 -0.48 -0.98 118.95 122.01 1uwq s ARG 79 Ca -0.05 -0.51 -0.02 0.00 -1.00 0.00 0.00 55.73 54.16 1uwq s ARG 79 Cb -0.04 -1.72 -0.04 0.00 0.00 0.00 0.00 34.95 33.15 1uwq s ARG 79 CO -0.00 -0.03 0.04 -0.51 0.00 0.00 0.00 175.30 174.80 1uwq s LEU 80 N 0.87 2.03 0.27 -0.88 1.43 -1.03 -2.06 118.68 119.31 1uwq s LEU 80 Ca -0.10 -1.07 0.12 0.00 -1.03 0.00 0.00 54.13 52.05 1uwq s LEU 80 Cb -0.15 0.33 -0.05 0.00 0.03 0.00 0.00 46.19 46.35 1uwq s LEU 80 CO 0.01 -0.68 -0.20 0.54 0.23 0.00 0.00 176.35 176.24 1uwq s ASN 81 N -2.98 3.58 0.04 2.29 4.22 -1.26 -0.81 114.94 120.02 1uwq s ASN 81 Ca 0.15 -1.00 -0.16 0.00 -2.14 0.00 0.00 52.86 49.71 1uwq s ASN 81 Cb 0.07 -0.30 -0.06 0.00 1.28 0.00 0.00 41.25 42.24 1uwq s ASN 81 CO -0.04 0.05 0.48 0.68 -2.04 0.00 0.00 177.10 176.23 1uwq s VAL 82 N -2.39 4.91 -0.43 3.54 -7.23 -1.18 -4.48 120.40 113.15 1uwq s VAL 82 Ca 0.29 0.98 -0.25 0.00 -1.81 0.00 0.00 61.98 61.19 1uwq s VAL 82 Cb -0.05 -3.79 0.02 0.00 0.56 0.00 0.00 36.38 33.12 1uwq s VAL 82 CO 0.14 0.54 0.89 -1.61 -0.31 0.00 0.00 175.10 174.76 1uwq s GLU 83 N -1.16 3.61 0.18 4.82 0.41 -1.26 -4.59 118.70 120.71 1uwq s GLU 83 Ca 0.27 0.24 -0.14 0.00 -0.41 0.00 0.00 54.97 54.92 1uwq s GLU 83 Cb -0.18 -3.89 0.17 0.00 -1.78 0.00 0.00 34.13 28.46 1uwq s GLU 83 CO 0.16 -1.10 1.21 1.87 -0.49 0.00 0.00 175.26 176.91 1uwq n TRP 84 N 6.93 0.00 -0.21 1.61 -0.00 -1.26 -0.85 117.44 123.65 1uwq n TRP 84 Ca 0.05 0.96 0.17 0.00 -0.00 0.00 0.00 57.50 58.69 1uwq n TRP 84 Cb 0.48 -0.78 0.50 0.00 -0.00 0.00 0.00 31.31 31.52 1uwq n TRP 84 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 177.69 178.35 1uwq h SER 85 N 0.00 0.41 0.73 5.87 4.64 -1.87 0.27 113.55 123.60 1uwq h SER 85 Ca 0.26 0.03 -0.17 0.00 -0.47 0.00 0.00 61.79 61.45 1uwq h SER 85 Cb 0.46 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1uwq h SER 85 CO -0.77 0.19 -0.78 0.03 -0.87 0.00 0.00 176.83 174.63 1uwq h ARG 86 N 0.43 0.04 0.12 4.77 3.08 -1.38 -2.58 114.38 118.85 1uwq h ARG 86 Ca 0.43 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 60.25 1uwq h ARG 86 Cb 1.01 0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.08 1uwq h ARG 86 CO -0.15 0.80 -0.88 0.82 -1.07 0.00 0.00 179.97 179.49 1uwq h ILE 87 N 0.02 1.41 -2.39 2.04 1.08 -1.14 -3.41 117.51 115.12 1uwq h ILE 87 Ca -0.01 -2.47 -0.60 0.00 -0.39 0.00 0.00 64.86 61.38 1uwq h ILE 87 Cb 1.38 3.08 -0.41 0.00 -3.07 0.00 0.00 36.82 37.80 1uwq h ILE 87 CO 0.11 0.69 -0.68 0.49 -0.69 0.00 0.00 178.15 178.06 1uwq n PHE 88 N -4.14 2.74 0.38 1.37 3.72 -0.03 -0.67 117.46 120.83 1uwq n PHE 88 Ca -0.17 -4.06 0.13 0.00 -0.05 0.00 0.00 57.45 53.30 1uwq n PHE 88 Cb 0.80 -0.50 0.53 0.00 -0.94 0.00 0.00 39.48 39.37 1uwq n PHE 88 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1uwq h PRO 89 N 4.53 0.00 -6.42 -1.08 0.13 -1.70 -3.43 132.00 124.04 1uwq h PRO 89 Ca 0.17 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.68 1uwq h PRO 89 Cb 0.73 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 31.70 1uwq h PRO 89 CO 0.73 0.00 -0.76 -0.80 -0.23 0.00 0.00 178.00 176.94 1uwq s ASN 90 N -4.56 3.79 0.59 1.44 0.01 -1.26 -4.83 114.94 110.12 1uwq s ASN 90 Ca 0.04 -0.82 -0.19 0.00 -0.71 0.00 0.00 52.86 51.18 1uwq s ASN 90 Cb 0.09 -0.44 -0.04 0.00 0.41 0.00 0.00 41.25 41.27 1uwq s ASN 90 CO 0.43 0.08 1.22 -2.84 -1.51 0.00 0.00 177.10 174.48 1uwq s PRO 91 N -3.05 2.97 0.33 -0.60 0.02 -1.26 -5.03 135.00 128.38 1uwq s PRO 91 Ca 0.25 1.87 -0.01 0.00 0.02 0.00 0.00 61.00 63.14 1uwq s PRO 91 Cb -0.07 -1.96 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 1uwq s PRO 91 CO 0.14 -1.22 0.55 -0.51 -0.33 0.00 0.00 177.00 175.63 1uwq s LEU 92 N -4.02 4.02 0.25 -5.54 1.43 -1.26 -5.06 118.68 108.50 1uwq s LEU 92 Ca 0.77 0.51 -0.31 0.00 -1.03 0.00 0.00 54.13 54.08 1uwq s LEU 92 Cb -0.32 -3.36 -0.13 0.00 0.03 0.00 0.00 46.19 42.41 1uwq s LEU 92 CO 0.34 -0.27 1.36 -2.65 0.23 0.00 0.00 176.35 175.37 1uwq n PRO 93 N -1.56 1.96 -1.63 1.29 -0.02 -1.26 -4.88 135.00 128.90 1uwq n PRO 93 Ca -0.04 0.70 -0.49 0.00 -2.02 0.00 0.00 63.50 61.65 1uwq n PRO 93 Cb 0.55 -2.32 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 1uwq n PRO 93 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1uwq n ARG 94 N 1.77 1.61 -2.20 -0.52 0.00 -1.26 -4.88 116.66 111.18 1uwq n ARG 94 Ca 0.11 0.58 -0.26 0.00 -0.00 0.00 0.00 57.85 58.28 1uwq n ARG 94 Cb 0.32 -2.26 0.08 0.00 -0.00 0.00 0.00 32.46 30.60 1uwq n ARG 94 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1uwq s PRO 95 N 0.53 2.00 0.14 2.89 0.05 -1.26 -5.06 135.00 134.29 1uwq s PRO 95 Ca 0.80 -0.34 -0.25 0.00 0.05 0.00 0.00 61.00 61.27 1uwq s PRO 95 Cb -0.82 -2.15 -0.07 0.00 0.05 0.00 0.00 34.50 31.51 1uwq s PRO 95 CO 0.44 -1.38 0.76 1.14 0.05 0.00 0.00 177.00 178.01 1uwq s GLN 96 N -5.31 4.53 -1.18 4.56 0.00 -1.26 -4.35 119.66 116.65 1uwq s GLN 96 Ca 0.62 1.11 -0.03 0.00 -0.00 0.00 0.00 55.36 57.07 1uwq s GLN 96 Cb -0.10 -3.27 -0.02 0.00 0.00 0.00 0.00 33.01 29.62 1uwq s GLN 96 CO 0.46 0.53 0.91 -1.71 0.00 0.00 0.00 175.29 175.48 1uwq n ASN 97 N 1.78 -3.19 -3.69 12.60 2.85 -1.26 -5.01 115.26 119.35 1uwq n ASN 97 Ca -0.06 -0.70 -0.20 0.00 -0.11 0.00 0.00 54.58 53.51 1uwq n ASN 97 Cb 0.49 -4.85 -0.18 0.00 1.24 0.00 0.00 39.78 36.48 1uwq n ASN 97 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1uwq s PHE 98 N -3.43 0.13 -0.40 1.20 5.36 -1.26 -5.08 117.98 114.48 1uwq s PHE 98 Ca 0.14 0.20 -0.05 0.00 -0.96 0.00 0.00 56.93 56.27 1uwq s PHE 98 Cb -0.02 -0.50 0.10 0.00 -0.34 0.00 0.00 43.02 42.26 1uwq s PHE 98 CO 0.76 -0.20 0.20 0.34 -1.46 0.00 0.00 175.22 174.86 1uwq s ASP 99 N 2.06 5.33 0.08 6.13 -1.08 -1.26 -4.98 116.67 122.94 1uwq s ASP 99 Ca 0.04 -1.83 0.13 0.00 -0.52 0.00 0.00 52.55 50.37 1uwq s ASP 99 Cb -0.12 -1.86 0.59 0.00 -1.46 0.00 0.00 42.92 40.07 1uwq s ASP 99 CO -0.03 -0.52 1.42 -0.62 0.52 0.00 0.00 175.17 175.93 1uwq n GLU 100 N 4.69 0.05 0.09 4.34 4.71 -1.26 -2.32 120.64 130.94 1uwq n GLU 100 Ca -0.06 0.38 0.12 0.00 -0.01 0.00 0.00 57.16 57.59 1uwq n GLU 100 Cb 0.42 -1.61 0.14 0.00 -1.01 0.00 0.00 31.44 29.37 1uwq n GLU 100 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1uwq h SER 101 N 0.00 0.00 -3.18 1.62 4.64 -2.01 -3.44 113.55 111.18 1uwq h SER 101 Ca 0.00 -0.12 -0.53 0.00 -0.47 0.00 0.00 61.79 60.67 1uwq h SER 101 Cb 0.19 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.30 1uwq h SER 101 CO 0.00 0.06 0.67 -0.54 -0.87 0.00 0.00 176.83 176.15 1uwq s LYS 102 N -3.22 4.37 0.08 4.77 3.01 -0.98 -4.96 119.74 122.80 1uwq s LYS 102 Ca 0.05 2.02 -0.19 0.00 -1.01 0.00 0.00 55.97 56.83 1uwq s LYS 102 Cb 0.11 -3.24 -0.09 0.00 -1.01 0.00 0.00 37.83 33.60 1uwq s LYS 102 CO 0.73 -0.34 1.53 0.37 0.51 0.00 0.00 175.35 178.15 1uwq h GLN 103 N 6.25 0.37 -5.96 1.68 4.15 -1.90 -3.45 115.11 116.25 1uwq h GLN 103 Ca -0.43 -0.11 -0.62 0.00 0.77 0.00 0.00 58.65 58.26 1uwq h GLN 103 Cb 1.21 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.81 1uwq h GLN 103 CO 0.82 0.54 -0.24 -0.51 -1.93 0.00 0.00 178.83 177.50 1uwq s ASP 104 N -5.84 6.74 -0.46 -0.69 1.11 -1.26 -5.00 116.67 111.28 1uwq s ASP 104 Ca -0.14 0.89 -0.02 0.00 0.18 0.00 0.00 52.55 53.46 1uwq s ASP 104 Cb 0.07 -2.22 0.12 0.00 1.07 0.00 0.00 42.92 41.96 1uwq s ASP 104 CO 0.73 0.33 0.25 -0.69 1.18 0.00 0.00 175.17 176.98 1uwq s VAL 105 N -1.09 3.26 -0.15 -1.27 1.01 -1.26 -4.94 120.40 115.95 1uwq s VAL 105 Ca 0.23 -2.39 0.18 0.00 0.00 0.00 0.00 61.98 60.00 1uwq s VAL 105 Cb -0.16 -3.22 -0.09 0.00 0.00 0.00 0.00 36.38 32.91 1uwq s VAL 105 CO 0.12 -0.74 0.90 0.71 0.00 0.00 0.00 175.10 176.09 1uwq h THR 106 N 6.05 0.37 -2.91 3.92 1.35 -1.96 -3.47 112.91 116.26 1uwq h THR 106 Ca -0.09 -1.72 -0.13 0.00 -0.55 0.00 0.00 66.41 63.92 1uwq h THR 106 Cb 1.01 1.90 -0.23 0.00 -1.73 0.00 0.00 68.15 69.09 1uwq h THR 106 CO 0.69 0.21 -0.29 -0.70 -0.25 0.00 0.00 175.52 175.17 1uwq s GLU 107 N -3.04 0.49 -0.19 4.72 2.12 -1.26 -4.87 118.70 116.66 1uwq s GLU 107 Ca -0.02 0.30 -0.02 0.00 0.36 0.00 0.00 54.97 55.58 1uwq s GLU 107 Cb 0.09 0.23 0.06 0.00 0.26 0.00 0.00 34.13 34.77 1uwq s GLU 107 CO 0.80 -0.09 0.02 0.08 -0.54 0.00 0.00 175.26 175.54 1uwq s VAL 108 N -0.25 0.63 -0.09 3.70 1.01 -1.26 -5.11 120.40 119.02 1uwq s VAL 108 Ca -0.04 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 1uwq s VAL 108 Cb -0.03 -1.10 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 1uwq s VAL 108 CO 0.02 -0.18 1.11 -0.70 0.00 0.00 0.00 175.10 175.34 1uwq s GLU 109 N 1.81 4.38 -0.05 2.72 2.12 -1.26 -4.91 118.70 123.50 1uwq s GLU 109 Ca -0.01 1.53 0.00 0.00 0.36 0.00 0.00 54.97 56.85 1uwq s GLU 109 Cb -0.17 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.68 1uwq s GLU 109 CO -0.08 -0.40 -0.03 0.42 -0.54 0.00 0.00 175.26 174.62 1uwq s ILE 110 N 2.21 0.51 0.40 -3.70 1.01 -1.26 -5.07 121.20 115.30 1uwq s ILE 110 Ca 0.52 -0.07 0.03 0.00 0.00 0.00 0.00 60.65 61.14 1uwq s ILE 110 Cb -0.21 -0.57 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 1uwq s ILE 110 CO 0.19 0.24 0.10 0.54 0.00 0.00 0.00 174.94 176.00 1uwq s ASN 111 N 1.21 2.89 0.31 3.58 2.20 -1.26 -5.03 114.94 118.83 1uwq s ASN 111 Ca -0.07 -1.60 0.02 0.00 -0.94 0.00 0.00 52.86 50.27 1uwq s ASN 111 Cb -0.14 0.37 0.57 0.00 -2.00 0.00 0.00 41.25 40.05 1uwq s ASN 111 CO -0.02 -0.84 1.91 -0.08 -2.94 0.00 0.00 177.10 175.13 1uwq h GLU 112 N 1.80 0.95 -0.29 3.55 4.81 -1.99 -0.81 114.58 122.60 1uwq h GLU 112 Ca -0.38 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 58.76 1uwq h GLU 112 Cb 1.27 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1uwq h GLU 112 CO 0.62 0.63 0.03 -0.91 -0.73 0.00 0.00 179.01 178.65 1uwq h ASN 113 N 0.98 0.48 -0.75 1.04 2.35 -1.99 -1.37 115.58 116.31 1uwq h ASN 113 Ca 0.38 -0.28 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1uwq h ASN 113 Cb 0.23 -0.13 -0.06 0.00 0.05 0.00 0.00 38.32 38.42 1uwq h ASN 113 CO -0.14 0.64 0.44 -0.08 -1.65 0.00 0.00 177.43 176.64 1uwq h GLU 114 N 0.29 0.79 -0.69 0.81 4.22 -1.83 -1.82 114.58 116.36 1uwq h GLU 114 Ca 0.08 -0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.44 1uwq h GLU 114 Cb 0.38 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1uwq h GLU 114 CO 0.01 0.52 0.30 -0.07 -2.18 0.00 0.00 179.01 177.59 1uwq h LEU 115 N 0.82 0.93 -1.12 1.64 3.38 -0.88 -1.30 115.31 118.78 1uwq h LEU 115 Ca 0.33 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1uwq h LEU 115 Cb 0.17 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1uwq h LEU 115 CO -0.17 0.83 0.02 0.11 0.09 0.00 0.00 178.44 179.32 1uwq h LYS 116 N 0.97 0.64 -0.10 1.13 1.57 -0.90 -0.89 116.57 118.98 1uwq h LYS 116 Ca 0.23 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1uwq h LYS 116 Cb 0.17 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1uwq h LYS 116 CO -0.02 0.64 0.02 0.00 -0.57 0.00 0.00 179.45 179.52 1uwq h ARG 117 N 0.61 0.17 -0.81 3.15 2.47 -0.95 -2.98 114.38 116.04 1uwq h ARG 117 Ca 0.13 -0.04 0.10 0.00 -1.26 0.00 0.00 59.98 58.91 1uwq h ARG 117 Cb 0.35 -0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 28.57 1uwq h ARG 117 CO 0.01 0.36 0.45 -0.07 0.56 0.00 0.00 179.97 181.28 1uwq h LEU 118 N -0.05 0.63 -2.05 3.04 3.38 -1.05 -1.34 115.31 117.87 1uwq h LEU 118 Ca 0.03 0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1uwq h LEU 118 Cb 0.27 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1uwq h LEU 118 CO 0.00 0.35 0.29 -0.78 0.09 0.00 0.00 178.44 178.39 1uwq h ASP 119 N 0.74 0.00 0.28 -0.43 3.58 -1.01 -0.49 116.42 119.09 1uwq h ASP 119 Ca 0.40 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.79 1uwq h ASP 119 Cb 0.40 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 1uwq h ASP 119 CO -0.26 0.00 -0.28 -0.33 -2.88 0.00 0.00 179.24 175.48 1uwq h GLU 120 N 0.00 0.01 0.00 0.28 5.08 -1.18 -3.14 114.58 115.63 1uwq h GLU 120 Ca 0.17 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1uwq h GLU 120 Cb 0.75 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1uwq h GLU 120 CO -0.00 0.30 -0.84 0.66 -1.00 0.00 0.00 179.01 178.13 1uwq n TYR 121 N -4.20 0.25 -2.52 4.33 4.01 -0.21 -4.96 117.16 113.87 1uwq n TYR 121 Ca -0.02 0.07 -0.39 0.00 -0.16 0.00 0.00 57.90 57.41 1uwq n TYR 121 Cb 0.34 -0.41 -0.04 0.00 -0.31 0.00 0.00 39.34 38.91 1uwq n TYR 121 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1uwq s ALA 122 N -3.14 3.27 -0.26 -0.72 0.00 -1.12 -4.82 121.76 114.97 1uwq s ALA 122 Ca 0.06 0.80 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 1uwq s ALA 122 Cb 0.15 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 1uwq s ALA 122 CO 0.77 -0.16 1.40 1.21 0.00 0.00 0.00 175.76 178.98 1uwq s ASN 123 N -1.17 6.61 0.18 0.00 3.84 0.15 -4.90 114.94 119.64 1uwq s ASN 123 Ca 0.50 1.40 0.01 0.00 0.21 0.00 0.00 52.86 54.98 1uwq s ASN 123 Cb -0.28 -2.54 0.04 0.00 -0.55 0.00 0.00 41.25 37.93 1uwq s ASN 123 CO 0.35 -1.10 1.41 0.11 -2.79 0.00 0.00 177.10 175.09 1uwq h LYS 124 N 9.61 0.26 -0.40 0.43 1.79 -1.93 -1.70 116.57 124.63 1uwq h LYS 124 Ca -0.29 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 57.92 1uwq h LYS 124 Cb 1.12 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.81 1uwq h LYS 124 CO 1.02 0.94 0.21 -0.44 -1.08 0.00 0.00 179.45 180.09 1uwq h ASP 125 N 0.16 0.51 -0.57 0.86 3.32 -1.96 0.29 116.42 119.03 1uwq h ASP 125 Ca -0.04 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1uwq h ASP 125 Cb 1.40 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 1uwq h ASP 125 CO 0.13 0.47 0.17 0.00 -1.72 0.00 0.00 179.24 178.29 1uwq h ALA 126 N 1.06 0.75 -0.19 3.45 0.00 -1.82 -0.13 119.26 122.38 1uwq h ALA 126 Ca 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1uwq h ALA 126 Cb 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1uwq h ALA 126 CO -0.02 0.42 0.10 -0.07 0.00 0.00 0.00 179.25 179.68 1uwq h LEU 127 N 0.81 0.24 -0.73 0.00 3.38 -1.05 -1.45 115.31 116.52 1uwq h LEU 127 Ca 0.18 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1uwq h LEU 127 Cb 0.29 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1uwq h LEU 127 CO -0.00 0.28 0.22 0.78 0.09 0.00 0.00 178.44 179.81 1uwq h ASN 128 N 0.19 1.06 -0.15 -0.43 -0.26 -0.82 -1.92 115.58 113.26 1uwq h ASN 128 Ca 0.07 -0.21 -0.00 0.00 -0.56 0.00 0.00 56.30 55.59 1uwq h ASN 128 Cb 0.10 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.07 1uwq h ASN 128 CO -0.01 0.99 0.09 -0.74 -1.06 0.00 0.00 177.43 176.70 1uwq h HIS 129 N 1.08 0.20 -1.00 1.19 2.76 -0.80 -0.85 115.15 117.74 1uwq h HIS 129 Ca 0.23 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.44 1uwq h HIS 129 Cb 0.31 -0.07 -0.06 0.00 1.55 0.00 0.00 27.41 29.15 1uwq h HIS 129 CO 0.03 0.18 0.65 1.88 -1.30 0.00 0.00 177.93 179.37 1uwq h TYR 130 N 0.17 1.22 -0.32 5.26 0.05 -1.20 0.11 116.97 122.26 1uwq h TYR 130 Ca 0.05 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.90 1uwq h TYR 130 Cb 0.04 -0.41 -0.04 0.00 1.01 0.00 0.00 36.73 37.33 1uwq h TYR 130 CO -0.05 0.69 0.10 -0.09 -1.05 0.00 0.00 178.16 177.77 1uwq h ARG 131 N 1.25 0.23 -0.42 4.88 2.43 -1.07 0.57 114.38 122.25 1uwq h ARG 131 Ca 0.40 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.56 1uwq h ARG 131 Cb 0.03 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1uwq h ARG 131 CO -0.13 0.15 0.25 0.93 -1.51 0.00 0.00 179.97 179.66 1uwq h GLU 132 N 0.24 0.58 0.10 0.20 5.08 -0.11 0.15 114.58 120.82 1uwq h GLU 132 Ca 0.15 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1uwq h GLU 132 Cb 0.12 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1uwq h GLU 132 CO -0.16 0.44 -0.17 0.82 -1.00 0.00 0.00 179.01 178.94 1uwq h ILE 133 N 0.56 0.61 -0.22 3.13 2.04 -0.82 -1.95 117.51 120.85 1uwq h ILE 133 Ca 0.15 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.94 1uwq h ILE 133 Cb 0.01 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 1uwq h ILE 133 CO -0.03 0.00 -0.16 -0.26 0.00 0.00 0.00 178.15 177.70 1uwq h PHE 134 N -0.33 0.41 -0.27 1.37 0.04 -0.67 -0.77 116.94 116.71 1uwq h PHE 134 Ca 0.02 -0.06 -0.06 0.00 2.80 0.00 0.00 57.97 60.67 1uwq h PHE 134 Cb 0.35 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 1uwq h PHE 134 CO -0.17 0.53 -0.07 0.87 -0.60 0.00 0.00 178.31 178.86 1uwq h LYS 135 N 0.35 0.53 -0.81 1.51 1.57 -0.89 -1.26 116.57 117.57 1uwq h LYS 135 Ca 0.06 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1uwq h LYS 135 Cb 0.49 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 1uwq h LYS 135 CO 0.03 0.74 0.44 0.22 -0.57 0.00 0.00 179.45 180.31 1uwq h ASP 136 N 0.28 1.01 0.33 0.86 3.58 -0.94 -1.39 116.42 120.15 1uwq h ASP 136 Ca 0.07 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.42 1uwq h ASP 136 Cb 0.55 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.34 1uwq h ASP 136 CO 0.03 0.81 -0.16 0.25 -2.88 0.00 0.00 179.24 177.30 1uwq h LEU 137 N 1.13 -0.37 -1.86 2.28 5.85 -0.92 -2.60 115.31 118.81 1uwq h LEU 137 Ca 0.29 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 1uwq h LEU 137 Cb 0.03 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1uwq h LEU 137 CO -0.05 -0.22 0.00 0.11 -0.34 0.00 0.00 178.44 177.95 1uwq h LYS 138 N -0.49 0.08 0.00 1.25 1.79 -1.09 -2.18 116.57 115.93 1uwq h LYS 138 Ca -0.04 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1uwq h LYS 138 Cb 0.37 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 1uwq h LYS 138 CO 0.07 0.09 0.00 0.66 -1.08 0.00 0.00 179.45 179.20 1uwq h SER 139 N 0.08 0.00 -0.26 0.86 4.64 -0.86 -1.99 113.55 116.02 1uwq h SER 139 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1uwq h SER 139 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1uwq h SER 139 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1uwq n ARG 140 N -2.40 1.80 -1.56 4.77 5.12 -0.82 -4.92 116.66 118.64 1uwq n ARG 140 Ca 0.02 -1.22 -0.06 0.00 -1.93 0.00 0.00 57.85 54.66 1uwq n ARG 140 Cb 0.25 -1.35 -0.02 0.00 -1.16 0.00 0.00 32.46 30.19 1uwq n ARG 140 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1uwq n GLY 141 N 1.12 0.54 3.67 -0.13 0.00 -0.75 -4.94 105.19 104.70 1uwq n GLY 141 Ca 0.14 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 1uwq n GLY 141 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwq s LEU 142 N -1.49 4.16 0.28 0.99 1.43 -1.21 -4.77 118.68 118.07 1uwq s LEU 142 Ca 0.00 0.93 -0.29 0.00 -1.03 0.00 0.00 54.13 53.73 1uwq s LEU 142 Cb 0.00 -2.97 -0.10 0.00 0.03 0.00 0.00 46.19 43.15 1uwq s LEU 142 CO 0.00 -0.29 1.32 -0.47 0.23 0.00 0.00 176.35 177.14 1uwq s TYR 143 N 1.89 3.12 -0.24 0.29 6.14 -0.23 -4.38 117.35 123.94 1uwq s TYR 143 Ca 0.31 1.31 0.00 0.00 0.64 0.00 0.00 57.07 59.34 1uwq s TYR 143 Cb -0.16 -3.67 0.03 0.00 0.42 0.00 0.00 41.96 38.59 1uwq s TYR 143 CO 0.11 -1.94 -0.11 0.12 0.64 0.00 0.00 175.55 174.37 1uwq s PHE 144 N -0.63 3.06 -0.33 4.97 5.36 -1.26 -0.91 117.98 128.24 1uwq s PHE 144 Ca 0.52 -1.81 -0.13 0.00 -0.96 0.00 0.00 56.93 54.55 1uwq s PHE 144 Cb -0.39 -1.99 -0.02 0.00 -0.34 0.00 0.00 43.02 40.28 1uwq s PHE 144 CO 0.47 -0.80 0.26 0.42 -1.46 0.00 0.00 175.22 174.12 1uwq s ILE 145 N 1.25 5.26 -0.26 3.12 1.01 -0.15 -0.96 121.20 130.46 1uwq s ILE 145 Ca -0.01 -0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 1uwq s ILE 145 Cb -0.17 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.54 1uwq s ILE 145 CO -0.07 0.01 0.25 -0.22 0.00 0.00 0.00 174.94 174.91 1uwq s LEU 146 N 1.80 4.05 -0.09 2.97 2.96 -0.28 -2.45 118.68 127.63 1uwq s LEU 146 Ca 0.08 0.14 -0.06 0.00 -0.22 0.00 0.00 54.13 54.06 1uwq s LEU 146 Cb -0.17 -2.24 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 1uwq s LEU 146 CO 0.11 -0.07 0.16 0.21 -1.32 0.00 0.00 176.35 175.44 1uwq s ASN 147 N 1.54 6.40 0.04 3.68 2.47 0.01 -1.32 114.94 127.75 1uwq s ASN 147 Ca 0.10 0.46 0.13 0.00 0.42 0.00 0.00 52.86 53.97 1uwq s ASN 147 Cb -0.15 -2.06 -0.18 0.00 -1.45 0.00 0.00 41.25 37.40 1uwq s ASN 147 CO 0.09 0.37 0.87 0.24 -3.72 0.00 0.00 177.10 174.96 1uwq h MET 148 N 4.71 0.00 -2.92 0.43 2.86 -0.90 -3.11 114.93 116.00 1uwq h MET 148 Ca -0.54 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 56.90 1uwq h MET 148 Cb 1.22 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 32.57 1uwq h MET 148 CO 0.61 0.54 -0.51 -0.47 1.06 0.00 0.00 176.91 178.14 1uwq s TYR 149 N -2.72 -0.39 -0.33 -0.22 5.04 -0.87 -4.58 117.35 113.29 1uwq s TYR 149 Ca -0.03 0.91 0.15 0.00 -2.44 0.00 0.00 57.07 55.67 1uwq s TYR 149 Cb 0.08 -0.00 0.46 0.00 0.35 0.00 0.00 41.96 42.85 1uwq s TYR 149 CO 0.82 -0.31 1.04 1.58 -1.34 0.00 0.00 175.55 177.34 1uwq n HIS 150 N 4.93 1.79 0.00 4.97 -0.00 -1.26 -0.78 115.22 124.87 1uwq n HIS 150 Ca -0.13 -2.65 0.00 0.00 0.46 0.00 0.00 57.72 55.39 1uwq n HIS 150 Cb 0.51 -0.28 0.00 0.00 -0.12 0.00 0.00 29.99 30.10 1uwq n HIS 150 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 1uwq n TRP 151 N -0.33 0.00 -1.88 1.57 7.02 -1.26 -4.87 117.44 117.69 1uwq n TRP 151 Ca 0.18 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.24 1uwq n TRP 151 Cb 0.80 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.66 1uwq n TRP 151 CO 0.00 0.00 0.00 -2.14 -2.02 0.00 0.00 177.69 173.53 1uwq s PRO 152 N 0.00 4.19 0.05 -0.99 0.02 -1.26 -4.96 135.00 132.05 1uwq s PRO 152 Ca 0.00 2.43 0.02 0.00 0.02 0.00 0.00 61.00 63.47 1uwq s PRO 152 Cb 0.00 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.35 1uwq s PRO 152 CO 0.00 -0.65 0.08 -0.51 -0.33 0.00 0.00 177.00 175.59 1uwq s LEU 153 N 1.14 3.84 0.35 -5.54 1.43 -1.26 -4.76 118.68 113.87 1uwq s LEU 153 Ca 0.71 0.05 -0.27 0.00 -1.03 0.00 0.00 54.13 53.59 1uwq s LEU 153 Cb -0.45 -2.41 -0.12 0.00 0.03 0.00 0.00 46.19 43.23 1uwq s LEU 153 CO 0.32 0.21 1.20 -2.65 0.23 0.00 0.00 176.35 175.66 1uwq n PRO 154 N 0.73 1.88 0.11 1.29 -0.02 -1.26 -1.22 135.00 136.51 1uwq n PRO 154 Ca -0.10 0.66 0.17 0.00 -2.02 0.00 0.00 63.50 62.21 1uwq n PRO 154 Cb 0.52 -2.21 0.72 0.00 -0.02 0.00 0.00 33.50 32.51 1uwq n PRO 154 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1uwq h LEU 155 N 2.29 0.00 -0.39 2.45 3.38 -1.07 -0.36 115.31 121.61 1uwq h LEU 155 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1uwq h LEU 155 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1uwq h LEU 155 CO 0.61 0.00 0.00 -2.67 0.09 0.00 0.00 178.44 176.47 1uwq n TRP 156 N -4.21 0.48 0.00 1.13 4.27 -1.26 -2.01 117.44 115.84 1uwq n TRP 156 Ca 0.05 0.19 0.10 0.00 -3.89 0.00 0.00 57.50 53.94 1uwq n TRP 156 Cb 0.44 -0.80 -0.15 0.00 -1.36 0.00 0.00 31.31 29.44 1uwq n TRP 156 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1uwq n LEU 157 N -1.93 0.01 -3.39 5.67 4.77 -0.17 -4.79 117.00 117.16 1uwq n LEU 157 Ca 0.03 -0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 55.98 1uwq n LEU 157 Cb 0.21 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1uwq n LEU 157 CO 0.18 0.00 0.12 -2.28 -1.33 0.00 0.00 177.39 174.08 1uwq s HIS 158 N -3.35 -1.25 -0.53 -1.77 5.04 -0.85 -0.66 115.29 111.92 1uwq s HIS 158 Ca -0.07 1.64 -0.16 0.00 -1.54 0.00 0.00 55.06 54.94 1uwq s HIS 158 Cb 0.13 0.47 0.12 0.00 0.04 0.00 0.00 32.58 33.33 1uwq s HIS 158 CO 0.81 -0.73 0.48 0.34 -2.34 0.00 0.00 174.74 173.31 1uwq s ASP 159 N 2.76 6.17 0.38 9.88 -1.08 -0.46 -4.32 116.67 130.01 1uwq s ASP 159 Ca 0.09 -1.75 0.20 0.00 -0.52 0.00 0.00 52.55 50.58 1uwq s ASP 159 Cb -0.14 -2.20 0.69 0.00 -1.46 0.00 0.00 42.92 39.81 1uwq s ASP 159 CO -0.18 -0.83 1.73 1.55 0.52 0.00 0.00 175.17 177.96 1uwq h PRO 160 N 8.86 0.00 -0.26 4.34 0.13 -1.87 -2.95 132.00 140.25 1uwq h PRO 160 Ca -0.30 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.68 1uwq h PRO 160 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1uwq h PRO 160 CO 1.02 0.34 -0.45 0.82 -0.23 0.00 0.00 178.00 179.50 1uwq h ILE 161 N 0.00 1.30 -0.39 -3.56 1.08 -1.92 0.43 117.51 114.45 1uwq h ILE 161 Ca -0.00 -1.65 0.03 0.00 -0.39 0.00 0.00 64.86 62.85 1uwq h ILE 161 Cb 0.90 1.69 -0.03 0.00 -3.07 0.00 0.00 36.82 36.31 1uwq h ILE 161 CO 0.04 0.53 0.18 -0.09 -0.69 0.00 0.00 178.15 178.12 1uwq h ARG 162 N 0.52 0.36 -0.26 2.37 2.43 -1.87 -1.20 114.38 116.73 1uwq h ARG 162 Ca 0.02 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 1uwq h ARG 162 Cb 1.05 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.52 1uwq h ARG 162 CO 0.10 0.24 -0.20 0.28 -1.51 0.00 0.00 179.97 178.88 1uwq h VAL 163 N 0.37 1.31 -0.89 0.20 2.07 -1.41 -1.63 116.25 116.26 1uwq h VAL 163 Ca 0.17 -1.35 0.22 0.00 0.82 0.00 0.00 66.70 66.56 1uwq h VAL 163 Cb 0.09 1.62 -0.13 0.00 -1.52 0.00 0.00 31.29 31.36 1uwq h VAL 163 CO -0.13 0.42 0.38 -0.09 0.02 0.00 0.00 177.57 178.17 1uwq h ARG 164 N 0.31 0.37 0.00 1.57 1.12 -0.73 0.14 114.38 117.16 1uwq h ARG 164 Ca 0.05 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.89 1uwq h ARG 164 Cb 0.75 -0.08 0.00 0.00 -0.01 0.00 0.00 29.97 30.62 1uwq h ARG 164 CO 0.05 0.25 0.00 0.54 -3.11 0.00 0.00 179.97 177.70 1uwq n ARG 165 N -5.06 0.36 -0.57 0.20 1.74 -0.47 -4.85 116.66 108.02 1uwq n ARG 165 Ca 0.22 0.07 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 1uwq n ARG 165 Cb 0.66 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.60 1uwq n ARG 165 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwq n GLY 166 N 0.53 0.67 3.47 -0.13 0.00 0.50 -5.03 105.19 105.21 1uwq n GLY 166 Ca 0.11 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1uwq n GLY 166 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uwq s ASP 167 N -2.34 6.12 -0.31 1.61 -1.08 -0.66 -4.97 116.67 115.04 1uwq s ASP 167 Ca 0.00 -0.79 0.10 0.00 -0.52 0.00 0.00 52.55 51.34 1uwq s ASP 167 Cb 0.00 -2.17 0.70 0.00 -1.46 0.00 0.00 42.92 39.99 1uwq s ASP 167 CO 0.00 -0.44 1.74 0.49 0.52 0.00 0.00 175.17 177.48 1uwq n PHE 168 N 5.23 2.20 0.75 -5.34 3.72 -1.26 -3.77 117.46 118.99 1uwq n PHE 168 Ca -0.10 -1.22 0.12 0.00 -0.05 0.00 0.00 57.45 56.19 1uwq n PHE 168 Cb 0.47 -0.64 0.12 0.00 -0.94 0.00 0.00 39.48 38.50 1uwq n PHE 168 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1uwq n THR 169 N -0.31 0.14 -2.78 4.37 -2.24 -1.26 -4.94 114.28 107.25 1uwq n THR 169 Ca 0.39 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 1uwq n THR 169 Cb 1.32 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1uwq n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uwq n GLY 170 N 1.42 2.90 3.67 3.38 0.00 -1.26 -5.03 105.19 110.26 1uwq n GLY 170 Ca 0.04 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1uwq n GLY 170 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1uwq s PRO 171 N 0.09 4.17 -0.07 1.61 0.02 -1.26 -4.89 135.00 134.67 1uwq s PRO 171 Ca 0.00 2.36 0.13 0.00 0.02 0.00 0.00 61.00 63.50 1uwq s PRO 171 Cb 0.00 -3.95 0.38 0.00 0.02 0.00 0.00 34.50 30.95 1uwq s PRO 171 CO 0.00 -0.86 1.31 -1.13 -0.33 0.00 0.00 177.00 175.99 1uwq n SER 172 N 6.91 3.25 0.00 2.53 3.41 -1.17 -1.35 113.62 127.21 1uwq n SER 172 Ca 0.18 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 1uwq n SER 172 Cb 0.42 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 1uwq n SER 172 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwq n GLY 173 N 0.11 2.75 0.00 5.00 0.00 0.17 -2.28 105.19 110.95 1uwq n GLY 173 Ca 0.15 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.86 1uwq n GLY 173 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1uwq n TRP 174 N 13.64 0.00 0.88 1.61 7.02 -1.26 -1.65 117.44 137.68 1uwq n TRP 174 Ca 0.00 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.59 1uwq n TRP 174 Cb 0.00 -0.27 0.52 0.00 -2.42 0.00 0.00 31.31 29.13 1uwq n TRP 174 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1uwq n LEU 175 N -1.27 0.00 -4.20 -0.99 4.77 -0.96 -4.25 117.00 110.09 1uwq n LEU 175 Ca 0.04 0.43 -0.32 0.00 -0.03 0.00 0.00 56.01 56.14 1uwq n LEU 175 Cb 0.07 -0.43 -0.17 0.00 -2.33 0.00 0.00 43.42 40.55 1uwq n LEU 175 CO 0.06 -0.10 -0.55 -0.55 -1.33 0.00 0.00 177.39 174.93 1uwq s SER 176 N -2.87 3.02 0.50 -1.43 0.15 -0.66 -4.96 113.70 107.46 1uwq s SER 176 Ca 0.14 -0.55 0.33 0.00 0.70 0.00 0.00 55.95 56.57 1uwq s SER 176 Cb 0.15 -1.38 1.79 0.00 -1.71 0.00 0.00 66.02 64.87 1uwq s SER 176 CO 0.39 0.14 2.01 0.71 1.20 0.00 0.00 173.24 177.69 1uwq h THR 177 N 5.74 0.00 -0.96 6.45 1.35 -1.86 -0.75 112.91 122.88 1uwq h THR 177 Ca -0.22 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 1uwq h THR 177 Cb 1.23 0.73 -0.05 0.00 -1.73 0.00 0.00 68.15 68.33 1uwq h THR 177 CO 0.48 0.00 0.61 -0.09 -0.25 0.00 0.00 175.52 176.27 1uwq h ARG 178 N 0.00 1.28 -0.61 4.72 9.65 -1.91 -0.21 114.38 127.30 1uwq h ARG 178 Ca 0.00 -0.10 -0.05 0.00 -1.10 0.00 0.00 59.98 58.73 1uwq h ARG 178 Cb 0.05 -0.28 -0.03 0.00 -1.39 0.00 0.00 29.97 28.32 1uwq h ARG 178 CO 0.00 0.87 0.17 1.15 2.80 0.00 0.00 179.97 184.97 1uwq h THR 179 N 1.31 1.24 -0.24 0.20 2.02 -1.37 -0.18 112.91 115.89 1uwq h THR 179 Ca 0.35 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1uwq h THR 179 Cb -0.10 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1uwq h THR 179 CO -0.07 0.32 0.10 0.58 0.37 0.00 0.00 175.52 176.82 1uwq h VAL 180 N 0.90 1.16 -0.30 3.16 2.07 -1.35 0.24 116.25 122.12 1uwq h VAL 180 Ca 0.20 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1uwq h VAL 180 Cb 0.28 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1uwq h VAL 180 CO -0.01 0.16 0.16 0.22 0.02 0.00 0.00 177.57 178.12 1uwq h TYR 181 N 0.24 0.43 -0.43 1.57 5.03 -0.78 -2.25 116.97 120.78 1uwq h TYR 181 Ca 0.08 -0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.26 1uwq h TYR 181 Cb 0.16 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 38.29 1uwq h TYR 181 CO -0.01 0.36 -0.19 0.93 -1.32 0.00 0.00 178.16 177.93 1uwq h GLU 182 N 0.37 0.83 -0.51 1.82 4.39 -0.90 -2.66 114.58 117.91 1uwq h GLU 182 Ca 0.11 -0.32 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 1uwq h GLU 182 Cb 0.09 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1uwq h GLU 182 CO -0.02 0.95 0.32 0.35 -1.16 0.00 0.00 179.01 179.46 1uwq h PHE 183 N 0.73 0.66 -0.30 4.33 3.57 -0.77 0.19 116.94 125.35 1uwq h PHE 183 Ca 0.11 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.68 1uwq h PHE 183 Cb 0.71 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 39.15 1uwq h PHE 183 CO 0.04 0.45 -0.23 0.00 -2.23 0.00 0.00 178.31 176.34 1uwq h ALA 184 N 1.16 -0.06 -0.61 2.41 0.00 -1.27 -0.17 119.26 120.73 1uwq h ALA 184 Ca 0.18 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1uwq h ALA 184 Cb -0.03 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1uwq h ALA 184 CO -0.04 -0.63 0.30 0.00 0.00 0.00 0.00 179.25 178.88 1uwq h ARG 185 N -0.20 0.87 -0.20 0.00 3.08 -1.12 -1.83 114.38 114.98 1uwq h ARG 185 Ca 0.16 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1uwq h ARG 185 Cb 0.45 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1uwq h ARG 185 CO -0.42 0.70 0.12 0.35 -1.07 0.00 0.00 179.97 179.65 1uwq h PHE 186 N 0.83 0.26 -0.40 3.04 3.57 -0.16 -1.00 116.94 123.08 1uwq h PHE 186 Ca 0.21 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 1uwq h PHE 186 Cb 0.11 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1uwq h PHE 186 CO -0.00 0.20 0.19 0.77 -2.23 0.00 0.00 178.31 177.23 1uwq h SER 187 N 0.25 0.53 -0.87 0.41 0.02 -0.86 -0.01 113.55 113.01 1uwq h SER 187 Ca 0.07 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1uwq h SER 187 Cb 0.01 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.37 1uwq h SER 187 CO -0.01 0.52 0.54 0.00 -1.14 0.00 0.00 176.83 176.73 1uwq h ALA 188 N 1.03 1.11 -0.51 3.77 0.00 -1.29 -1.83 119.26 121.54 1uwq h ALA 188 Ca 0.14 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1uwq h ALA 188 Cb 0.13 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1uwq h ALA 188 CO -0.02 0.56 -0.01 -0.92 0.00 0.00 0.00 179.25 178.86 1uwq h TYR 189 N 1.19 1.01 -0.31 0.00 3.20 -0.60 -0.78 116.97 120.68 1uwq h TYR 189 Ca 0.31 -0.18 -0.09 0.00 3.14 0.00 0.00 58.73 61.92 1uwq h TYR 189 Cb -0.07 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 37.93 1uwq h TYR 189 CO -0.00 0.94 -0.15 0.82 -1.64 0.00 0.00 178.16 178.12 1uwq h ILE 190 N 0.79 1.29 -0.88 1.81 1.08 -0.80 -1.74 117.51 119.05 1uwq h ILE 190 Ca 0.14 -1.26 0.06 0.00 -0.39 0.00 0.00 64.86 63.42 1uwq h ILE 190 Cb 0.54 1.45 -0.06 0.00 -3.07 0.00 0.00 36.82 35.68 1uwq h ILE 190 CO 0.03 0.40 0.58 0.00 -0.69 0.00 0.00 178.15 178.47 1uwq h ALA 191 N 0.76 1.53 -0.63 1.87 0.00 -1.24 -0.12 119.26 121.43 1uwq h ALA 191 Ca 0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1uwq h ALA 191 Cb 0.68 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1uwq h ALA 191 CO 0.05 0.33 0.09 2.35 0.00 0.00 0.00 179.25 182.07 1uwq h TRP 192 N 1.00 1.11 0.08 0.00 7.01 -0.79 -1.73 115.95 122.63 1uwq h TRP 192 Ca 0.38 -0.15 -0.25 0.00 2.11 0.00 0.00 58.89 60.98 1uwq h TRP 192 Cb 0.20 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 1uwq h TRP 192 CO -0.00 0.94 -1.17 0.87 -2.79 0.00 0.00 178.44 176.29 1uwq h LYS 193 N 0.98 0.16 -0.03 2.65 1.79 -0.67 -3.40 116.57 118.05 1uwq h LYS 193 Ca 0.19 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1uwq h LYS 193 Cb 0.44 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 1uwq h LYS 193 CO 0.01 1.12 0.00 1.19 -1.08 0.00 0.00 179.45 180.69 1uwq n PHE 194 N -3.45 0.03 0.24 -1.35 3.72 -0.12 -4.75 117.46 111.79 1uwq n PHE 194 Ca -0.06 -0.07 0.17 0.00 -0.05 0.00 0.00 57.45 57.45 1uwq n PHE 194 Cb 0.99 -0.01 0.89 0.00 -0.94 0.00 0.00 39.48 40.41 1uwq n PHE 194 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 1uwq h ASP 195 N 1.12 0.00 0.78 4.37 3.58 -1.52 0.54 116.42 125.29 1uwq h ASP 195 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 1uwq h ASP 195 Cb 0.29 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 1uwq h ASP 195 CO 0.00 0.00 -0.02 -2.24 -2.88 0.00 0.00 179.24 174.10 1uwq h ASP 196 N 0.00 0.00 0.00 2.28 2.03 -1.86 -3.14 116.42 115.73 1uwq h ASP 196 Ca 0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.36 1uwq h ASP 196 Cb 0.39 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.89 1uwq h ASP 196 CO -0.00 0.02 -1.41 0.18 -1.03 0.00 0.00 179.24 177.00 1uwq n LEU 197 N -3.14 0.26 -4.83 0.15 4.77 0.19 -5.00 117.00 109.40 1uwq n LEU 197 Ca -0.00 -0.17 -0.38 0.00 -0.03 0.00 0.00 56.01 55.43 1uwq n LEU 197 Cb 0.26 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.29 1uwq n LEU 197 CO 0.26 0.06 0.20 -0.69 -1.33 0.00 0.00 177.39 175.90 1uwq s VAL 198 N -2.93 4.86 -0.25 4.08 1.01 -1.03 -4.76 120.40 121.38 1uwq s VAL 198 Ca -0.02 0.99 -0.12 0.00 0.00 0.00 0.00 61.98 62.83 1uwq s VAL 198 Cb 0.11 -3.80 -0.15 0.00 0.00 0.00 0.00 36.38 32.54 1uwq s VAL 198 CO 0.68 0.49 -0.17 0.47 0.00 0.00 0.00 175.10 176.56 1uwq n ASP 199 N 1.52 1.95 -4.11 3.32 8.00 -0.14 -4.95 116.55 122.15 1uwq n ASP 199 Ca -0.10 0.27 -0.08 0.00 0.71 0.00 0.00 54.79 55.58 1uwq n ASP 199 Cb 0.51 -0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 40.73 1uwq n ASP 199 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1uwq s GLU 200 N -2.48 0.76 0.08 -1.24 2.02 -0.90 -4.47 118.70 112.46 1uwq s GLU 200 Ca -0.35 -1.31 0.10 0.00 0.02 0.00 0.00 54.97 53.43 1uwq s GLU 200 Cb 0.12 0.23 -0.03 0.00 0.10 0.00 0.00 34.13 34.54 1uwq s GLU 200 CO 0.55 -0.18 -0.26 0.71 0.02 0.00 0.00 175.26 176.10 1uwq s TYR 201 N -3.97 2.27 -0.02 1.61 2.02 0.13 -1.13 117.35 118.26 1uwq s TYR 201 Ca 0.14 -0.40 0.07 0.00 -0.37 0.00 0.00 57.07 56.52 1uwq s TYR 201 Cb 0.08 -1.31 -0.02 0.00 -0.40 0.00 0.00 41.96 40.31 1uwq s TYR 201 CO -0.05 0.20 -0.24 0.45 -1.57 0.00 0.00 175.55 174.34 1uwq s SER 202 N -1.55 2.82 -0.07 2.29 0.15 -0.43 0.23 113.70 117.14 1uwq s SER 202 Ca 0.12 -0.44 -0.25 0.00 0.70 0.00 0.00 55.95 56.08 1uwq s SER 202 Cb -0.10 -0.38 -0.21 0.00 -1.71 0.00 0.00 66.02 63.62 1uwq s SER 202 CO 0.03 0.28 1.01 0.71 1.20 0.00 0.00 173.24 176.48 1uwq h THR 203 N 4.62 1.37 -4.07 6.45 1.35 -1.60 -1.39 112.91 119.64 1uwq h THR 203 Ca -0.40 -1.51 -0.13 0.00 -0.55 0.00 0.00 66.41 63.82 1uwq h THR 203 Cb 1.13 2.34 -0.17 0.00 -1.73 0.00 0.00 68.15 69.73 1uwq h THR 203 CO 0.47 0.37 -0.63 -0.04 -0.25 0.00 0.00 175.52 175.44 1uwq s MET 204 N -3.40 0.55 -0.17 4.72 -1.94 -1.26 -2.05 119.30 115.75 1uwq s MET 204 Ca -0.16 -0.98 -0.02 0.00 -1.71 0.00 0.00 55.69 52.82 1uwq s MET 204 Cb -0.00 0.20 -0.01 0.00 2.01 0.00 0.00 34.83 37.03 1uwq s MET 204 CO 0.62 -0.11 -0.08 1.21 -0.01 0.00 0.00 175.02 176.65 1uwq s ASN 205 N -2.44 4.25 -1.23 3.03 2.47 0.04 -1.20 114.94 119.86 1uwq s ASN 205 Ca -0.01 -0.33 -0.23 0.00 0.42 0.00 0.00 52.86 52.72 1uwq s ASN 205 Cb 0.02 -1.69 0.01 0.00 -1.45 0.00 0.00 41.25 38.14 1uwq s ASN 205 CO -0.07 0.08 0.66 -0.62 -3.72 0.00 0.00 177.10 173.43 1uwq n GLU 206 N 4.10 -1.07 0.12 0.43 1.02 0.11 -4.75 120.64 120.61 1uwq n GLU 206 Ca -0.18 0.28 0.03 0.00 -0.02 0.00 0.00 57.16 57.27 1uwq n GLU 206 Cb 0.52 -3.51 0.42 0.00 -0.02 0.00 0.00 31.44 28.85 1uwq n GLU 206 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1uwq h PRO 207 N -2.18 0.24 -0.16 3.49 0.13 -1.89 -2.16 132.00 129.48 1uwq h PRO 207 Ca -0.68 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 64.41 1uwq h PRO 207 Cb 1.38 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.47 1uwq h PRO 207 CO 0.53 0.33 0.10 -2.95 -0.23 0.00 0.00 178.00 175.79 1uwq h ASN 208 N 0.23 0.17 -0.01 1.44 -1.07 -1.93 -2.03 115.58 112.37 1uwq h ASN 208 Ca 0.05 -0.00 -0.26 0.00 0.07 0.00 0.00 56.30 56.15 1uwq h ASN 208 Cb 0.30 -0.04 0.02 0.00 -2.07 0.00 0.00 38.32 36.53 1uwq h ASN 208 CO 0.01 0.12 -1.01 0.58 0.07 0.00 0.00 177.43 177.21 1uwq h VAL 209 N 0.20 1.28 -0.07 6.14 2.07 -1.76 0.12 116.25 124.22 1uwq h VAL 209 Ca 0.06 -2.21 0.04 0.00 0.82 0.00 0.00 66.70 65.41 1uwq h VAL 209 Cb 0.00 2.32 -0.05 0.00 -1.52 0.00 0.00 31.29 32.04 1uwq h VAL 209 CO -0.01 0.69 -0.24 0.58 0.02 0.00 0.00 177.57 178.61 1uwq h VAL 210 N 0.42 0.44 -0.16 2.57 2.07 -1.20 -0.72 116.25 119.67 1uwq h VAL 210 Ca -0.12 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.22 1uwq h VAL 210 Cb 1.66 0.44 0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1uwq h VAL 210 CO 0.20 0.00 -0.60 1.23 0.02 0.00 0.00 177.57 178.42 1uwq h GLY 211 N -0.33 0.75 0.84 2.17 0.00 -1.46 -2.21 103.07 102.83 1uwq h GLY 211 Ca 0.08 -1.01 -0.03 0.00 0.00 0.00 0.00 47.33 46.37 1uwq h GLY 211 CO -0.26 0.90 -0.31 -1.33 0.00 0.00 0.00 176.54 175.54 1uwq h GLY 212 N 0.37 -0.92 1.44 4.60 0.00 -0.66 -2.89 103.07 105.00 1uwq h GLY 212 Ca -0.03 0.34 -0.16 0.00 0.00 0.00 0.00 47.33 47.48 1uwq h GLY 212 CO 0.13 -0.33 -0.56 1.41 0.00 0.00 0.00 176.54 177.19 1uwq h LEU 213 N -1.05 0.66 -1.24 3.11 3.38 -1.29 -0.78 115.31 118.10 1uwq h LEU 213 Ca -0.09 -0.35 0.08 0.00 0.09 0.00 0.00 57.88 57.61 1uwq h LEU 213 Cb 0.71 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1uwq h LEU 213 CO 0.15 1.08 0.55 1.23 0.09 0.00 0.00 178.44 181.54 1uwq h GLY 214 N 1.02 1.20 0.00 0.83 0.00 -1.47 -3.31 103.07 101.35 1uwq h GLY 214 Ca 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1uwq h GLY 214 CO 0.11 0.24 0.00 -1.72 0.00 0.00 0.00 176.54 175.17 1uwq n TYR 215 N -4.50 0.00 0.08 5.60 4.01 -1.09 -2.18 117.16 119.08 1uwq n TYR 215 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 1uwq n TYR 215 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 1uwq n TYR 215 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1uwq n VAL 216 N -0.17 0.56 -1.14 -0.72 0.31 -0.47 -0.24 118.33 116.46 1uwq n VAL 216 Ca 0.00 0.19 -0.34 0.00 -0.01 0.00 0.00 64.34 64.18 1uwq n VAL 216 Cb 0.09 -1.01 -0.02 0.00 -0.91 0.00 0.00 33.84 31.99 1uwq n VAL 216 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uwq n GLY 217 N 2.61 3.60 0.25 2.92 0.00 -0.42 -4.71 105.19 109.43 1uwq n GLY 217 Ca 0.00 -1.24 0.16 0.00 0.00 0.00 0.00 46.02 44.94 1uwq n GLY 217 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1uwq h VAL 218 N 3.55 0.00 0.00 1.61 -1.51 -1.87 -1.97 116.25 116.07 1uwq h VAL 218 Ca 0.62 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 65.62 1uwq h VAL 218 Cb 0.35 1.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.93 1uwq h VAL 218 CO 1.71 0.00 0.00 0.11 -1.23 0.00 0.00 177.57 178.16 1uwq h LYS 219 N 0.00 0.00 0.00 5.19 1.57 -1.89 -2.56 116.57 118.88 1uwq h LYS 219 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1uwq h LYS 219 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1uwq h LYS 219 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.75 1uwq n SER 220 N -2.47 0.39 -3.07 0.86 3.41 -0.74 -4.91 113.62 107.10 1uwq n SER 220 Ca 0.01 0.58 -0.19 0.00 -0.26 0.00 0.00 58.87 59.01 1uwq n SER 220 Cb 0.19 -0.67 0.07 0.00 -0.26 0.00 0.00 64.21 63.54 1uwq n SER 220 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwq n GLY 221 N 0.28 -0.28 3.87 5.00 0.00 -0.96 -4.66 105.19 108.43 1uwq n GLY 221 Ca 0.03 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 1uwq n GLY 221 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1uwq s PHE 222 N -3.27 3.63 0.53 1.61 0.40 -1.26 -4.60 117.98 115.02 1uwq s PHE 222 Ca 0.37 0.64 -0.19 0.00 -0.60 0.00 0.00 56.93 57.15 1uwq s PHE 222 Cb -0.16 -2.02 -0.06 0.00 0.51 0.00 0.00 43.02 41.28 1uwq s PHE 222 CO 0.61 0.71 1.11 -1.25 0.70 0.00 0.00 175.22 177.09 1uwq s PRO 223 N -1.10 3.44 0.00 0.24 0.04 -1.26 -0.82 135.00 135.53 1uwq s PRO 223 Ca 0.18 1.54 0.12 0.00 0.04 0.00 0.00 61.00 62.87 1uwq s PRO 223 Cb -0.13 -2.03 0.39 0.00 0.04 0.00 0.00 34.50 32.78 1uwq s PRO 223 CO 0.07 -0.76 1.30 -0.35 0.04 0.00 0.00 177.00 177.30 1uwq n PRO 224 N -1.28 1.64 -3.72 0.56 -0.04 -1.26 -4.45 135.00 126.46 1uwq n PRO 224 Ca 0.11 -0.98 -0.25 0.00 -0.04 0.00 0.00 63.50 62.34 1uwq n PRO 224 Cb 0.51 -1.26 0.05 0.00 -0.04 0.00 0.00 33.50 32.77 1uwq n PRO 224 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1uwq n GLY 225 N 0.98 -0.46 3.31 0.55 0.00 -0.00 -3.43 105.19 106.13 1uwq n GLY 225 Ca 0.11 0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 1uwq n GLY 225 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1uwq s TYR 226 N -3.38 3.14 -0.38 1.61 5.04 -1.01 -4.84 117.35 117.53 1uwq s TYR 226 Ca 0.44 -1.14 -0.29 0.00 -2.44 0.00 0.00 57.07 53.64 1uwq s TYR 226 Cb -0.21 -2.22 0.01 0.00 0.35 0.00 0.00 41.96 39.90 1uwq s TYR 226 CO 0.78 -0.62 1.25 -1.17 -1.34 0.00 0.00 175.55 174.45 1uwq s LEU 227 N 1.45 3.75 -0.30 6.97 2.96 -1.26 -4.19 118.68 128.06 1uwq s LEU 227 Ca 0.02 0.88 -0.08 0.00 -0.22 0.00 0.00 54.13 54.73 1uwq s LEU 227 Cb -0.17 -3.54 0.18 0.00 0.50 0.00 0.00 46.19 43.15 1uwq s LEU 227 CO 0.01 -1.18 0.85 -0.55 -1.32 0.00 0.00 176.35 174.15 1uwq s SER 228 N 2.80 -0.87 0.16 3.68 0.15 0.67 -5.02 113.70 115.27 1uwq s SER 228 Ca 0.53 0.60 -0.16 0.00 0.70 0.00 0.00 55.95 57.63 1uwq s SER 228 Cb -0.12 1.75 0.10 0.00 -1.71 0.00 0.00 66.02 66.04 1uwq s SER 228 CO 0.27 -0.16 1.71 -0.26 1.20 0.00 0.00 173.24 175.99 1uwq h PHE 229 N 7.97 0.04 -0.30 3.44 0.04 -1.93 -1.28 116.94 124.93 1uwq h PHE 229 Ca -0.18 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.66 1uwq h PHE 229 Cb 1.16 0.04 -0.04 0.00 2.20 0.00 0.00 35.95 39.31 1uwq h PHE 229 CO 0.09 -0.04 0.04 1.49 -0.60 0.00 0.00 178.31 179.29 1uwq h GLU 230 N 0.14 0.14 0.00 1.51 4.81 -1.95 -1.63 114.58 117.59 1uwq h GLU 230 Ca 0.19 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.31 1uwq h GLU 230 Cb 0.25 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1uwq h GLU 230 CO -0.29 0.09 -0.50 -0.07 -0.73 0.00 0.00 179.01 177.51 1uwq h LEU 231 N 0.14 0.00 -0.59 1.64 3.38 -1.91 -1.84 115.31 116.14 1uwq h LEU 231 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1uwq h LEU 231 Cb 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1uwq h LEU 231 CO -0.20 0.50 0.30 -1.28 0.09 0.00 0.00 178.44 177.85 1uwq h SER 232 N 0.00 0.75 -0.29 -0.43 0.87 -0.83 0.89 113.55 114.51 1uwq h SER 232 Ca -0.01 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 1uwq h SER 232 Cb 0.95 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 1uwq h SER 232 CO 0.07 0.66 0.19 0.03 -0.53 0.00 0.00 176.83 177.24 1uwq h ARG 233 N 0.80 0.39 -0.20 2.24 3.08 -0.99 -1.74 114.38 117.97 1uwq h ARG 233 Ca 0.20 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.24 1uwq h ARG 233 Cb 0.09 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1uwq h ARG 233 CO -0.03 0.28 0.10 -0.09 -1.07 0.00 0.00 179.97 179.16 1uwq h ARG 234 N 0.38 0.20 -0.58 0.04 2.43 -1.08 0.12 114.38 115.89 1uwq h ARG 234 Ca 0.11 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.35 1uwq h ARG 234 Cb -0.02 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.42 1uwq h ARG 234 CO -0.02 0.13 0.22 0.00 -1.51 0.00 0.00 179.97 178.79 1uwq h ALA 235 N 1.10 0.74 -0.45 2.80 0.00 -0.71 -1.40 119.26 121.34 1uwq h ALA 235 Ca 0.08 0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1uwq h ALA 235 Cb 0.02 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1uwq h ALA 235 CO -0.06 -0.19 -0.21 0.52 0.00 0.00 0.00 179.25 179.32 1uwq h MET 236 N 0.41 0.94 -0.20 0.00 2.86 -0.95 -0.16 114.93 117.83 1uwq h MET 236 Ca 0.29 -0.41 0.04 0.00 -2.06 0.00 0.00 59.70 57.56 1uwq h MET 236 Cb 0.33 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1uwq h MET 236 CO -0.28 1.07 -0.06 -0.92 1.06 0.00 0.00 176.91 177.78 1uwq h TYR 237 N 0.78 -0.14 -0.76 -0.22 3.20 -0.46 -1.31 116.97 118.07 1uwq h TYR 237 Ca 0.10 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 1uwq h TYR 237 Cb 0.79 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 1uwq h TYR 237 CO 0.05 -0.11 0.38 -0.91 -1.64 0.00 0.00 178.16 175.94 1uwq h ASN 238 N -0.02 0.98 -0.64 -2.11 2.35 -1.08 -2.35 115.58 112.71 1uwq h ASN 238 Ca 0.10 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1uwq h ASN 238 Cb 0.17 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 1uwq h ASN 238 CO -0.22 0.83 0.22 -0.29 -1.65 0.00 0.00 177.43 176.32 1uwq h ILE 239 N 1.06 1.24 0.12 2.81 2.10 -0.79 0.16 117.51 124.22 1uwq h ILE 239 Ca 0.26 -0.83 -0.01 0.00 1.08 0.00 0.00 64.86 65.37 1uwq h ILE 239 Cb 0.09 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 36.32 1uwq h ILE 239 CO -0.04 0.32 -0.06 0.40 -1.08 0.00 0.00 178.15 177.70 1uwq h ILE 240 N 0.98 0.95 0.00 2.19 2.04 -1.01 0.35 117.51 123.01 1uwq h ILE 240 Ca 0.22 -0.23 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 1uwq h ILE 240 Cb 0.26 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1uwq h ILE 240 CO -0.01 0.06 -0.35 0.06 0.00 0.00 0.00 178.15 177.91 1uwq h GLN 241 N -0.26 0.00 -0.83 2.37 3.07 -1.28 -1.64 115.11 116.55 1uwq h GLN 241 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.68 1uwq h GLN 241 Cb 0.21 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.73 1uwq h GLN 241 CO 0.03 0.35 0.36 0.00 0.09 0.00 0.00 178.83 179.65 1uwq h ALA 242 N 1.65 1.07 -0.03 0.06 0.00 -0.40 -0.26 119.26 121.35 1uwq h ALA 242 Ca -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1uwq h ALA 242 Cb 0.62 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1uwq h ALA 242 CO 0.05 0.67 0.02 1.25 0.00 0.00 0.00 179.25 181.23 1uwq h HIS 243 N 1.19 0.05 -0.62 0.00 -0.00 -0.11 0.00 115.15 115.67 1uwq h HIS 243 Ca 0.28 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.67 1uwq h HIS 243 Cb 0.18 -0.01 -0.04 0.00 -0.00 0.00 0.00 27.41 27.53 1uwq h HIS 243 CO 0.02 0.15 0.39 0.00 -0.00 0.00 0.00 177.93 178.49 1uwq h ALA 244 N 0.89 0.80 -0.44 5.26 0.00 -0.98 -0.02 119.26 124.76 1uwq h ALA 244 Ca 0.01 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1uwq h ALA 244 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1uwq h ALA 244 CO -0.00 0.14 -0.05 0.00 0.00 0.00 0.00 179.25 179.34 1uwq h ARG 245 N 0.77 0.75 -0.21 0.00 -0.00 -1.01 -2.02 114.38 112.66 1uwq h ARG 245 Ca 0.24 -0.22 -0.12 0.00 -0.50 0.00 0.00 59.98 59.38 1uwq h ARG 245 Cb -0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 29.97 29.87 1uwq h ARG 245 CO -0.09 0.80 -0.39 0.00 0.00 0.00 0.00 179.97 180.29 1uwq h ALA 246 N 1.25 0.95 0.46 0.04 0.00 -0.40 -0.51 119.26 121.04 1uwq h ALA 246 Ca 0.13 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1uwq h ALA 246 Cb 0.50 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1uwq h ALA 246 CO 0.03 0.62 -0.22 -0.92 0.00 0.00 0.00 179.25 178.76 1uwq h TYR 247 N 0.39 -0.57 -0.67 0.00 5.03 -0.66 -0.50 116.97 120.00 1uwq h TYR 247 Ca 0.04 -0.01 0.11 0.00 2.58 0.00 0.00 58.73 61.44 1uwq h TYR 247 Cb 0.85 0.19 -0.08 0.00 1.55 0.00 0.00 36.73 39.24 1uwq h TYR 247 CO 0.03 -0.30 0.26 -0.44 -1.32 0.00 0.00 178.16 176.39 1uwq h ASP 248 N -0.72 0.25 -0.26 -2.11 3.32 -1.36 -0.05 116.42 115.49 1uwq h ASP 248 Ca -0.06 0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.13 1uwq h ASP 248 Cb 0.52 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 1uwq h ASP 248 CO 0.10 0.13 -0.05 1.23 -1.72 0.00 0.00 179.24 178.94 1uwq h GLY 249 N 0.43 0.21 0.97 2.75 0.00 -0.88 -0.78 103.07 105.78 1uwq h GLY 249 Ca 0.35 0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.67 1uwq h GLY 249 CO -0.34 -0.09 -0.05 -2.22 0.00 0.00 0.00 176.54 173.85 1uwq h ILE 250 N 0.02 1.27 0.00 2.60 2.04 -0.53 -2.71 117.51 120.20 1uwq h ILE 250 Ca 0.13 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1uwq h ILE 250 Cb 0.19 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1uwq h ILE 250 CO -0.25 0.37 -0.06 0.11 0.00 0.00 0.00 178.15 178.32 1uwq h LYS 251 N 0.59 0.00 0.00 2.37 1.79 -0.71 0.15 116.57 120.76 1uwq h LYS 251 Ca 0.11 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 1uwq h LYS 251 Cb 0.55 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 1uwq h LYS 251 CO 0.03 0.06 0.00 0.66 -1.08 0.00 0.00 179.45 179.12 1uwq h SER 252 N 0.00 0.00 0.00 0.86 4.64 -0.80 -3.27 113.55 114.98 1uwq h SER 252 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uwq h SER 252 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1uwq h SER 252 CO 0.01 0.00 0.00 0.52 -0.87 0.00 0.00 176.83 176.49 1uwq n VAL 253 N -2.88 0.00 -3.81 0.95 0.31 -0.42 -5.06 118.33 107.41 1uwq n VAL 253 Ca 0.02 -0.44 -0.12 0.00 -0.01 0.00 0.00 64.34 63.78 1uwq n VAL 253 Cb 0.32 1.03 -0.09 0.00 -0.91 0.00 0.00 33.84 34.19 1uwq n VAL 253 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1uwq s SER 254 N -0.67 -0.09 0.00 4.52 0.15 0.40 -4.87 113.70 113.15 1uwq s SER 254 Ca 0.00 -0.07 0.24 0.00 0.70 0.00 0.00 55.95 56.82 1uwq s SER 254 Cb 0.00 0.27 0.32 0.00 -1.71 0.00 0.00 66.02 64.89 1uwq s SER 254 CO 0.00 -0.43 1.28 0.29 1.20 0.00 0.00 173.24 175.58 1uwq n LYS 255 N 1.28 0.58 -1.40 5.44 4.76 -1.26 -4.26 118.16 123.30 1uwq n LYS 255 Ca -0.22 -0.41 -0.31 0.00 -2.87 0.00 0.00 58.31 54.50 1uwq n LYS 255 Cb 0.56 -1.49 0.07 0.00 -1.84 0.00 0.00 35.03 32.33 1uwq n LYS 255 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1uwq s LYS 256 N -2.71 2.52 0.33 1.97 1.02 -1.26 -4.98 119.74 116.63 1uwq s LYS 256 Ca 0.17 1.05 -0.29 0.00 0.02 0.00 0.00 55.97 56.92 1uwq s LYS 256 Cb 0.18 -1.94 -0.10 0.00 -0.52 0.00 0.00 37.83 35.45 1uwq s LYS 256 CO 0.64 -1.42 1.26 -2.14 -0.92 0.00 0.00 175.35 172.77 1uwq s PRO 257 N -4.97 4.39 -0.17 -1.68 0.02 -1.26 -4.88 135.00 126.44 1uwq s PRO 257 Ca 0.60 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.73 1uwq s PRO 257 Cb -0.16 -3.06 0.03 0.00 0.02 0.00 0.00 34.50 31.33 1uwq s PRO 257 CO 0.56 -0.12 -0.13 0.08 -0.33 0.00 0.00 177.00 177.06 1uwq s VAL 258 N -1.16 1.64 0.00 3.83 1.01 -1.26 -0.69 120.40 123.77 1uwq s VAL 258 Ca 0.49 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1uwq s VAL 258 Cb -0.38 -1.62 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1uwq s VAL 258 CO 0.50 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.53 1uwq n GLY 259 N 4.72 7.47 3.19 4.51 0.00 0.13 -1.47 105.19 123.74 1uwq n GLY 259 Ca -0.16 -1.95 -0.11 0.00 0.00 0.00 0.00 46.02 43.80 1uwq n GLY 259 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uwq s ILE 260 N 0.77 0.09 -0.09 -0.61 2.07 -1.14 -1.61 121.20 120.68 1uwq s ILE 260 Ca 0.00 -0.73 0.04 0.00 -1.41 0.00 0.00 60.65 58.55 1uwq s ILE 260 Cb 0.00 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.82 1uwq s ILE 260 CO 0.00 -0.40 -0.21 -0.63 -1.91 0.00 0.00 174.94 171.79 1uwq s ILE 261 N -2.07 2.39 0.06 2.00 1.01 -0.34 -0.16 121.20 124.09 1uwq s ILE 261 Ca -0.09 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.68 1uwq s ILE 261 Cb -0.03 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 1uwq s ILE 261 CO -0.01 0.56 -0.10 -0.47 0.00 0.00 0.00 174.94 174.91 1uwq s TYR 262 N 0.08 0.93 -0.35 3.97 5.04 -0.81 0.09 117.35 126.30 1uwq s TYR 262 Ca -0.09 -0.52 -0.21 0.00 -2.44 0.00 0.00 57.07 53.80 1uwq s TYR 262 Cb -0.15 -0.53 0.00 0.00 0.35 0.00 0.00 41.96 41.63 1uwq s TYR 262 CO 0.06 -0.02 0.67 0.00 -1.34 0.00 0.00 175.55 174.91 1uwq s ALA 263 N -1.59 3.46 0.08 3.97 0.00 -1.26 -2.20 121.76 124.22 1uwq s ALA 263 Ca -0.04 -0.78 0.06 0.00 0.00 0.00 0.00 51.96 51.20 1uwq s ALA 263 Cb -0.08 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.79 1uwq s ALA 263 CO 0.01 -1.34 -0.06 -0.80 0.00 0.00 0.00 175.76 173.57 1uwq s ASN 264 N 1.78 4.63 0.03 0.00 0.01 -0.47 -4.99 114.94 115.93 1uwq s ASN 264 Ca 0.26 -0.28 0.03 0.00 -0.71 0.00 0.00 52.86 52.17 1uwq s ASN 264 Cb -0.14 -0.99 -0.02 0.00 0.41 0.00 0.00 41.25 40.51 1uwq s ASN 264 CO 0.15 0.20 -0.10 -0.55 -1.51 0.00 0.00 177.10 175.29 1uwq s SER 265 N -2.07 1.12 -0.32 -1.22 0.15 -1.26 -4.26 113.70 105.83 1uwq s SER 265 Ca 0.22 -0.44 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 1uwq s SER 265 Cb -0.11 -0.03 -0.00 0.00 -1.71 0.00 0.00 66.02 64.16 1uwq s SER 265 CO 0.14 -0.07 0.65 -0.55 1.20 0.00 0.00 173.24 174.61 1uwq s SER 266 N -1.18 6.49 -0.14 5.45 0.15 -1.16 -4.86 113.70 118.45 1uwq s SER 266 Ca -0.04 0.37 -0.24 0.00 0.70 0.00 0.00 55.95 56.75 1uwq s SER 266 Cb -0.08 -2.34 -0.02 0.00 -1.71 0.00 0.00 66.02 61.87 1uwq s SER 266 CO 0.01 -0.53 0.75 -0.36 1.20 0.00 0.00 173.24 174.30 1uwq s PHE 267 N 2.69 3.46 -0.00 3.44 0.08 -1.26 -0.33 117.98 126.06 1uwq s PHE 267 Ca 0.26 1.18 0.06 0.00 0.12 0.00 0.00 56.93 58.55 1uwq s PHE 267 Cb -0.15 -2.90 -0.02 0.00 -0.57 0.00 0.00 43.02 39.39 1uwq s PHE 267 CO 0.13 -0.12 -0.18 -0.65 -0.10 0.00 0.00 175.22 174.29 1uwq s GLN 268 N 1.67 1.43 0.04 0.44 -1.52 0.16 -4.95 119.66 116.93 1uwq s GLN 268 Ca 0.36 -0.70 -0.30 0.00 -1.95 0.00 0.00 55.36 52.77 1uwq s GLN 268 Cb -0.17 -1.41 -0.04 0.00 -0.22 0.00 0.00 33.01 31.18 1uwq s GLN 268 CO 0.14 0.38 0.98 -1.25 -0.25 0.00 0.00 175.29 175.29 1uwq s PRO 269 N -0.58 4.60 0.11 2.91 0.04 -1.26 -1.23 135.00 139.59 1uwq s PRO 269 Ca 0.07 1.45 -0.26 0.00 0.04 0.00 0.00 61.00 62.29 1uwq s PRO 269 Cb -0.07 -3.43 -0.08 0.00 0.04 0.00 0.00 34.50 30.96 1uwq s PRO 269 CO -0.00 0.03 1.64 1.25 0.04 0.00 0.00 177.00 179.96 1uwq h LEU 270 N 6.39 -0.69 -9.41 -3.56 5.85 -1.60 -3.45 115.31 108.84 1uwq h LEU 270 Ca -0.42 0.08 -0.54 0.00 0.84 0.00 0.00 57.88 57.85 1uwq h LEU 270 Cb 1.22 0.27 -0.13 0.00 0.37 0.00 0.00 40.66 42.38 1uwq h LEU 270 CO 0.74 -0.32 -0.61 0.42 -0.34 0.00 0.00 178.44 178.33 1uwq s THR 271 N -6.07 1.58 -1.49 1.05 -4.23 -1.26 -5.02 115.64 100.20 1uwq s THR 271 Ca -0.15 -2.01 0.07 0.00 -1.18 0.00 0.00 61.69 58.42 1uwq s THR 271 Cb 0.08 -2.85 0.13 0.00 1.34 0.00 0.00 72.50 71.20 1uwq s THR 271 CO 0.65 -0.03 1.07 -0.90 -0.54 0.00 0.00 174.62 174.88 1uwq n ASP 272 N -0.80 0.00 -1.26 3.99 5.75 -1.26 -2.11 116.55 120.86 1uwq n ASP 272 Ca -0.04 0.14 0.07 0.00 -0.01 0.00 0.00 54.79 54.96 1uwq n ASP 272 Cb 0.66 -0.26 0.27 0.00 -1.03 0.00 0.00 41.12 40.77 1uwq n ASP 272 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1uwq n LYS 273 N -1.26 3.03 -0.10 0.11 4.01 -1.26 -4.38 118.16 118.31 1uwq n LYS 273 Ca 0.04 -2.17 0.07 0.00 -0.51 0.00 0.00 58.31 55.74 1uwq n LYS 273 Cb 0.05 -1.72 0.10 0.00 -0.51 0.00 0.00 35.03 32.95 1uwq n LYS 273 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1uwq n ASP 274 N 0.84 2.00 -0.11 4.39 8.00 -0.90 -4.73 116.55 126.04 1uwq n ASP 274 Ca 0.20 -2.77 0.00 0.00 0.71 0.00 0.00 54.79 52.93 1uwq n ASP 274 Cb 0.69 -0.33 0.28 0.00 -0.02 0.00 0.00 41.12 41.74 1uwq n ASP 274 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 1uwq h MET 275 N 0.00 0.76 -0.41 -1.24 2.86 -1.79 -1.91 114.93 113.21 1uwq h MET 275 Ca 0.00 -0.09 -0.11 0.00 -2.06 0.00 0.00 59.70 57.44 1uwq h MET 275 Cb 0.97 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1uwq h MET 275 CO 0.00 0.59 -0.20 1.49 1.06 0.00 0.00 176.91 179.86 1uwq h GLU 276 N 0.76 0.79 -0.98 1.72 4.81 -1.95 -2.74 114.58 117.00 1uwq h GLU 276 Ca 0.19 -0.31 0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1uwq h GLU 276 Cb 0.08 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.35 1uwq h GLU 276 CO -0.03 0.92 0.63 0.00 -0.73 0.00 0.00 179.01 179.81 1uwq h ALA 277 N 1.08 1.36 -0.24 2.92 0.00 -1.70 -0.78 119.26 121.91 1uwq h ALA 277 Ca 0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1uwq h ALA 277 Cb 0.70 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1uwq h ALA 277 CO 0.05 0.41 0.12 0.28 0.00 0.00 0.00 179.25 180.11 1uwq h VAL 278 N 1.13 1.13 -0.40 0.00 2.07 -1.20 -1.25 116.25 117.74 1uwq h VAL 278 Ca 0.43 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.63 1uwq h VAL 278 Cb 0.18 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1uwq h VAL 278 CO -0.18 0.13 0.14 -0.33 0.02 0.00 0.00 177.57 177.35 1uwq h GLU 279 N 0.26 0.30 -0.51 1.57 5.08 -1.08 0.13 114.58 120.32 1uwq h GLU 279 Ca 0.08 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1uwq h GLU 279 Cb 0.09 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1uwq h GLU 279 CO -0.01 0.20 0.30 0.52 -1.00 0.00 0.00 179.01 179.01 1uwq h MET 280 N 0.31 0.69 -0.59 2.33 2.86 -0.97 -0.28 114.93 119.28 1uwq h MET 280 Ca 0.18 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1uwq h MET 280 Cb 0.16 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1uwq h MET 280 CO -0.18 0.51 0.36 0.00 1.06 0.00 0.00 176.91 178.66 1uwq h ALA 281 N 1.14 0.75 -0.94 6.32 0.00 -0.79 0.76 119.26 126.50 1uwq h ALA 281 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1uwq h ALA 281 Cb 0.00 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.51 1uwq h ALA 281 CO -0.03 0.22 0.58 0.93 0.00 0.00 0.00 179.25 180.94 1uwq h GLU 282 N 0.80 1.28 0.21 0.00 5.08 -0.46 -0.79 114.58 120.69 1uwq h GLU 282 Ca 0.21 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1uwq h GLU 282 Cb -0.03 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 28.95 1uwq h GLU 282 CO -0.04 0.89 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.84 1uwq h ASN 283 N 1.30 -0.25 0.97 1.42 2.35 -0.67 -0.96 115.58 119.73 1uwq h ASN 283 Ca 0.34 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 56.08 1uwq h ASN 283 Cb -0.07 0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 1uwq h ASN 283 CO -0.06 -0.18 -0.08 0.44 -1.65 0.00 0.00 177.43 175.90 1uwq h ASP 284 N -0.29 0.00 0.00 5.81 5.19 -0.63 -2.27 116.42 124.23 1uwq h ASP 284 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1uwq h ASP 284 Cb 0.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1uwq h ASP 284 CO 0.04 0.08 -0.62 0.59 -3.12 0.00 0.00 179.24 176.22 1uwq n ASN 285 N -3.22 1.82 0.14 6.45 3.02 -0.32 -4.89 115.26 118.26 1uwq n ASN 285 Ca 0.00 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 1uwq n ASN 285 Cb 0.34 1.08 0.00 0.00 -0.61 0.00 0.00 39.78 40.60 1uwq n ASN 285 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1uwq n ARG 286 N -1.33 0.00 -0.12 3.52 0.63 -0.69 -4.90 116.66 113.76 1uwq n ARG 286 Ca 0.00 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.85 1uwq n ARG 286 Cb 0.08 -0.06 0.07 0.00 0.45 0.00 0.00 32.46 33.00 1uwq n ARG 286 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1uwq h TRP 287 N 0.00 0.98 -0.77 -0.14 -0.00 -1.25 -2.49 115.95 112.27 1uwq h TRP 287 Ca 0.00 -0.21 0.11 0.00 -0.00 0.00 0.00 58.89 58.78 1uwq h TRP 287 Cb 0.00 -0.24 -0.08 0.00 -0.00 0.00 0.00 29.16 28.85 1uwq h TRP 287 CO 0.00 0.97 0.40 0.11 -0.00 0.00 0.00 178.44 179.93 1uwq h TRP 288 N 0.76 0.72 0.05 0.49 5.08 -1.65 0.37 115.95 121.77 1uwq h TRP 288 Ca 0.11 0.03 -0.00 0.00 1.08 0.00 0.00 58.89 60.11 1uwq h TRP 288 Cb 0.71 -0.21 0.00 0.00 -3.00 0.00 0.00 29.16 26.66 1uwq h TRP 288 CO 0.04 0.25 -0.02 0.35 -1.28 0.00 0.00 178.44 177.78 1uwq h PHE 289 N 0.66 -0.06 -0.00 0.12 3.04 -1.77 -2.86 116.94 116.06 1uwq h PHE 289 Ca 0.39 -0.00 -0.18 0.00 3.98 0.00 0.00 57.97 62.16 1uwq h PHE 289 Cb 0.43 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.94 1uwq h PHE 289 CO -0.09 0.27 -0.81 0.74 -2.02 0.00 0.00 178.31 176.40 1uwq h PHE 290 N -0.40 0.16 -0.07 0.41 -1.00 -1.16 -2.64 116.94 112.25 1uwq h PHE 290 Ca -0.01 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1uwq h PHE 290 Cb 0.36 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.89 1uwq h PHE 290 CO 0.04 0.87 0.04 -0.44 -1.61 0.00 0.00 178.31 177.20 1uwq h ASP 291 N 0.06 0.08 -0.10 2.17 3.32 -0.34 -0.57 116.42 121.03 1uwq h ASP 291 Ca -0.02 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 1uwq h ASP 291 Cb 1.41 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.94 1uwq h ASP 291 CO 0.12 0.06 -0.13 0.00 -1.72 0.00 0.00 179.24 177.56 1uwq h ALA 292 N 1.96 0.15 -0.00 3.45 0.00 -1.21 -0.99 119.26 122.61 1uwq h ALA 292 Ca 0.02 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1uwq h ALA 292 Cb -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1uwq h ALA 292 CO -0.00 0.02 -0.37 0.44 0.00 0.00 0.00 179.25 179.33 1uwq n ILE 293 N -4.62 0.00 -0.09 0.00 -5.35 -1.10 -1.72 119.36 106.48 1uwq n ILE 293 Ca -0.07 -0.07 -0.15 0.00 -0.27 0.00 0.00 62.75 62.19 1uwq n ILE 293 Cb 0.35 0.34 -0.07 0.00 -1.74 0.00 0.00 39.64 38.52 1uwq n ILE 293 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1uwq n ILE 294 N -1.03 0.96 0.51 7.28 5.41 -0.24 -1.39 119.36 130.86 1uwq n ILE 294 Ca 0.09 -0.31 0.06 0.00 1.00 0.00 0.00 62.75 63.59 1uwq n ILE 294 Cb 0.34 -1.37 0.03 0.00 -0.71 0.00 0.00 39.64 37.94 1uwq n ILE 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1uwq n ARG 295 N -3.33 1.15 -0.96 0.38 1.74 -0.55 -0.20 116.66 114.88 1uwq n ARG 295 Ca -0.32 -1.02 0.00 0.00 -0.77 0.00 0.00 57.85 55.74 1uwq n ARG 295 Cb 0.78 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 31.03 1uwq n ARG 295 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1uwq n GLY 296 N 0.78 0.35 3.66 -0.13 0.00 -0.68 -4.74 105.19 104.43 1uwq n GLY 296 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1uwq n GLY 296 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uwq s GLU 297 N -0.73 4.26 0.08 1.61 2.02 -0.49 -0.82 118.70 124.63 1uwq s GLU 297 Ca 0.00 1.24 -0.10 0.00 0.02 0.00 0.00 54.97 56.13 1uwq s GLU 297 Cb 0.00 -3.63 0.00 0.00 0.10 0.00 0.00 34.13 30.60 1uwq s GLU 297 CO 0.00 -0.56 0.21 -1.50 0.02 0.00 0.00 175.26 173.44 1uwq s ILE 298 N 2.95 0.13 -0.20 -1.63 2.07 -0.56 -2.60 121.20 121.36 1uwq s ILE 298 Ca 0.42 -1.07 -0.06 0.00 -1.41 0.00 0.00 60.65 58.53 1uwq s ILE 298 Cb -0.15 -1.25 -0.03 0.00 0.13 0.00 0.00 42.46 41.15 1uwq s ILE 298 CO 0.08 -0.59 0.04 -0.89 -1.91 0.00 0.00 174.94 171.66 1uwq s THR 299 N -3.64 4.37 -0.03 4.00 2.01 -1.26 -0.53 115.64 120.55 1uwq s THR 299 Ca 0.03 -0.17 0.05 0.00 0.31 0.00 0.00 61.69 61.90 1uwq s THR 299 Cb 0.04 -2.98 -0.07 0.00 0.01 0.00 0.00 72.50 69.50 1uwq s THR 299 CO -0.10 0.43 0.06 -1.14 -0.69 0.00 0.00 174.62 173.18 1uwq n ARG 300 N 4.00 2.00 -1.23 4.92 0.63 -1.26 -5.02 116.66 120.70 1uwq n ARG 300 Ca -0.17 -0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.74 1uwq n ARG 300 Cb 0.52 -1.12 0.00 0.00 0.45 0.00 0.00 32.46 32.31 1uwq n ARG 300 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1uwq n GLU 303 N -1.98 -1.55 -3.47 -0.14 0.28 -1.26 -5.07 120.64 107.45 1uwq n GLU 303 Ca -0.05 1.16 -0.40 0.00 -0.16 0.00 0.00 57.16 57.71 1uwq n GLU 303 Cb 0.45 -1.67 -0.10 0.00 1.43 0.00 0.00 31.44 31.55 1uwq n GLU 303 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1uwq s LYS 304 N -3.41 3.57 0.30 3.44 1.02 -1.26 -5.00 119.74 118.40 1uwq s LYS 304 Ca 0.00 -0.50 0.04 0.00 0.02 0.00 0.00 55.97 55.53 1uwq s LYS 304 Cb 0.00 -3.79 -0.06 0.00 -0.52 0.00 0.00 37.83 33.46 1uwq s LYS 304 CO 0.00 -0.46 0.03 0.96 -0.92 0.00 0.00 175.35 174.96 1uwq s ILE 305 N 1.87 1.19 -0.19 2.17 -4.36 0.30 -4.99 121.20 117.20 1uwq s ILE 305 Ca 0.09 -2.02 -0.01 0.00 -0.26 0.00 0.00 60.65 58.45 1uwq s ILE 305 Cb -0.17 -2.65 0.00 0.00 1.25 0.00 0.00 42.46 40.89 1uwq s ILE 305 CO 0.11 -0.10 -0.12 -0.69 0.24 0.00 0.00 174.94 174.37 1uwq s VAL 306 N -3.31 2.77 -0.27 8.37 1.01 -1.26 -1.50 120.40 126.21 1uwq s VAL 306 Ca 0.34 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 1uwq s VAL 306 Cb 0.07 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 1uwq s VAL 306 CO 0.14 0.49 0.14 -0.13 0.00 0.00 0.00 175.10 175.73 1uwq s ARG 307 N 1.19 3.78 0.49 2.72 0.52 -0.00 -4.96 118.95 122.68 1uwq s ARG 307 Ca 0.02 -0.42 0.24 0.00 -0.52 0.00 0.00 55.73 55.05 1uwq s ARG 307 Cb -0.14 -3.52 1.26 0.00 0.52 0.00 0.00 34.95 33.07 1uwq s ARG 307 CO -0.05 -0.21 2.00 -0.44 0.02 0.00 0.00 175.30 176.63 1uwq h ASP 308 N 8.32 0.00 1.40 0.23 3.32 -1.95 -2.05 116.42 125.68 1uwq h ASP 308 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1uwq h ASP 308 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1uwq h ASP 308 CO 0.57 0.17 0.00 -2.24 -1.72 0.00 0.00 179.24 176.02 1uwq h ASP 309 N 0.00 0.00 0.13 6.45 2.03 -1.93 -3.27 116.42 119.83 1uwq h ASP 309 Ca -0.00 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.94 1uwq h ASP 309 Cb 0.43 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.88 1uwq h ASP 309 CO 0.02 0.00 -2.14 0.18 -1.03 0.00 0.00 179.24 176.27 1uwq n LEU 310 N -2.56 2.11 -4.66 0.15 4.77 -0.83 -4.85 117.00 111.12 1uwq n LEU 310 Ca 0.04 0.11 -0.45 0.00 -0.03 0.00 0.00 56.01 55.69 1uwq n LEU 310 Cb 0.40 -0.63 -0.02 0.00 -2.33 0.00 0.00 43.42 40.83 1uwq n LEU 310 CO 0.29 0.76 0.92 1.17 -1.33 0.00 0.00 177.39 179.19 1uwq n LYS 311 N -3.25 1.92 -1.20 3.23 4.81 -0.85 -3.02 118.16 119.80 1uwq n LYS 311 Ca -0.34 0.68 -0.07 0.00 -0.87 0.00 0.00 58.31 57.71 1uwq n LYS 311 Cb 1.05 -2.28 -0.03 0.00 0.02 0.00 0.00 35.03 33.79 1uwq n LYS 311 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1uwq n GLY 312 N 1.73 0.88 2.54 3.14 0.00 0.72 -4.89 105.19 109.30 1uwq n GLY 312 Ca 0.10 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1uwq n GLY 312 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uwq n ARG 313 N -2.37 3.18 -3.63 1.61 3.00 -0.48 -4.84 116.66 113.12 1uwq n ARG 313 Ca -0.07 -2.88 -0.05 0.00 -0.01 0.00 0.00 57.85 54.85 1uwq n ARG 313 Cb 0.28 -2.30 -0.06 0.00 0.00 0.00 0.00 32.46 30.37 1uwq n ARG 313 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1uwq s LEU 314 N -2.48 -0.86 -0.10 0.55 2.96 -1.26 -4.87 118.68 112.63 1uwq s LEU 314 Ca 0.56 1.33 0.15 0.00 -0.22 0.00 0.00 54.13 55.95 1uwq s LEU 314 Cb 0.33 2.20 -0.22 0.00 0.50 0.00 0.00 46.19 48.99 1uwq s LEU 314 CO -0.20 -0.21 0.18 0.47 -1.32 0.00 0.00 176.35 175.27 1uwq n ASP 315 N 4.35 1.07 -3.46 3.68 8.00 -0.54 -5.04 116.55 124.61 1uwq n ASP 315 Ca -0.18 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.18 1uwq n ASP 315 Cb 0.57 1.24 -0.03 0.00 -0.02 0.00 0.00 41.12 42.88 1uwq n ASP 315 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1uwq s TRP 316 N -2.70 -0.57 -0.15 1.24 1.48 -1.26 -4.43 118.94 112.55 1uwq s TRP 316 Ca -0.07 0.58 0.00 0.00 -1.06 0.00 0.00 56.10 55.55 1uwq s TRP 316 Cb 0.07 0.50 -0.00 0.00 -1.16 0.00 0.00 33.47 32.88 1uwq s TRP 316 CO 0.68 -0.76 -0.15 0.42 -4.06 0.00 0.00 176.95 173.07 1uwq s ILE 317 N -2.90 2.66 -0.33 0.66 1.01 -0.76 -2.88 121.20 118.65 1uwq s ILE 317 Ca -0.03 -0.78 -0.18 0.00 0.00 0.00 0.00 60.65 59.67 1uwq s ILE 317 Cb -0.01 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 1uwq s ILE 317 CO -0.05 0.52 0.50 -0.83 0.00 0.00 0.00 174.94 175.07 1uwq s GLY 318 N 0.79 1.83 -0.33 6.18 0.00 0.77 -2.01 107.32 114.54 1uwq s GLY 318 Ca -0.06 -0.95 -0.17 0.00 0.00 0.00 0.00 44.72 43.54 1uwq s GLY 318 CO 0.00 1.24 0.46 0.14 0.00 0.00 0.00 173.10 174.94 1uwq s VAL 319 N 2.35 5.07 -0.25 1.40 1.01 0.42 -1.92 120.40 128.48 1uwq s VAL 319 Ca 0.19 0.32 -0.10 0.00 0.00 0.00 0.00 61.98 62.38 1uwq s VAL 319 Cb -0.16 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 1uwq s VAL 319 CO 0.12 -0.13 0.16 0.20 0.00 0.00 0.00 175.10 175.45 1uwq s ASN 320 N 1.73 5.99 -0.03 3.32 -0.87 -0.94 -0.77 114.94 123.38 1uwq s ASN 320 Ca 0.17 0.05 -0.00 0.00 -1.57 0.00 0.00 52.86 51.50 1uwq s ASN 320 Cb -0.16 -2.09 0.03 0.00 -0.02 0.00 0.00 41.25 39.01 1uwq s ASN 320 CO 0.12 0.02 0.02 -0.47 -2.57 0.00 0.00 177.10 174.23 1uwq s TYR 321 N 1.31 0.16 0.00 2.20 5.04 -0.06 -1.36 117.35 124.64 1uwq s TYR 321 Ca 0.07 0.08 0.00 0.00 -2.44 0.00 0.00 57.07 54.78 1uwq s TYR 321 Cb -0.14 -0.35 0.00 0.00 0.35 0.00 0.00 41.96 41.82 1uwq s TYR 321 CO 0.06 -0.12 0.00 0.66 -1.34 0.00 0.00 175.55 174.81 1uwq n TYR 322 N 4.31 0.00 -3.78 4.97 4.01 -1.26 -4.13 117.16 121.27 1uwq n TYR 322 Ca -0.24 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.47 1uwq n TYR 322 Cb 0.50 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.55 1uwq n TYR 322 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1uwq n THR 323 N -2.36 0.00 -2.92 -0.72 5.66 -1.26 -4.72 114.28 107.97 1uwq n THR 323 Ca 0.00 -0.44 -0.19 0.00 -3.05 0.00 0.00 64.05 60.37 1uwq n THR 323 Cb 0.46 0.59 0.04 0.00 -1.55 0.00 0.00 70.33 69.87 1uwq n THR 323 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uwq s ARG 324 N -2.04 2.53 -0.05 1.09 1.70 -1.26 -3.00 118.95 117.92 1uwq s ARG 324 Ca 0.17 -1.26 0.02 0.00 -0.47 0.00 0.00 55.73 54.19 1uwq s ARG 324 Cb -0.02 -2.64 0.02 0.00 -0.57 0.00 0.00 34.95 31.73 1uwq s ARG 324 CO 0.04 -0.61 -0.09 0.99 -1.08 0.00 0.00 175.30 174.55 1uwq s THR 325 N -2.58 0.84 -0.17 4.99 2.01 0.56 -3.77 115.64 117.51 1uwq s THR 325 Ca 0.58 -0.32 -0.12 0.00 0.31 0.00 0.00 61.69 62.14 1uwq s THR 325 Cb -0.08 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 1uwq s THR 325 CO 0.37 0.29 0.23 -0.69 -0.69 0.00 0.00 174.62 174.12 1uwq s VAL 326 N 0.70 5.35 0.20 3.82 1.01 -1.26 -0.67 120.40 129.55 1uwq s VAL 326 Ca -0.12 0.41 0.11 0.00 0.00 0.00 0.00 61.98 62.39 1uwq s VAL 326 Cb -0.14 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1uwq s VAL 326 CO 0.02 0.41 -0.23 0.68 0.00 0.00 0.00 175.10 175.98 1uwq s VAL 327 N 0.40 2.33 0.08 2.92 -7.23 -0.36 -0.77 120.40 117.78 1uwq s VAL 327 Ca 0.13 -2.06 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 1uwq s VAL 327 Cb -0.12 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 1uwq s VAL 327 CO 0.02 -0.15 -0.09 -1.59 -0.31 0.00 0.00 175.10 172.97 1uwq s LYS 328 N -2.75 0.76 0.32 4.82 -2.85 -0.53 -1.53 119.74 117.99 1uwq s LYS 328 Ca 0.21 -1.06 -0.29 0.00 -1.00 0.00 0.00 55.97 53.83 1uwq s LYS 328 Cb -0.08 -0.45 -0.10 0.00 -2.06 0.00 0.00 37.83 35.15 1uwq s LYS 328 CO 0.10 0.07 1.25 1.03 0.10 0.00 0.00 175.35 177.90 1uwq s ARG 329 N -2.54 4.40 0.27 1.78 1.81 -1.26 -1.58 118.95 121.84 1uwq s ARG 329 Ca 0.02 2.11 0.07 0.00 -1.72 0.00 0.00 55.73 56.20 1uwq s ARG 329 Cb -0.04 -3.08 -0.06 0.00 -0.45 0.00 0.00 34.95 31.32 1uwq s ARG 329 CO -0.00 -0.11 -0.06 0.99 -0.68 0.00 0.00 175.30 175.44 1uwq s THR 330 N -1.16 1.63 0.11 0.02 2.01 0.32 -4.85 115.64 113.72 1uwq s THR 330 Ca 0.48 -2.13 -0.26 0.00 0.31 0.00 0.00 61.69 60.09 1uwq s THR 330 Cb -0.38 -2.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.64 1uwq s THR 330 CO 0.50 -0.32 1.65 -0.33 -0.69 0.00 0.00 174.62 175.42 1uwq h GLU 331 N 2.31 -0.38 0.00 4.92 3.07 -2.00 -2.88 114.58 119.61 1uwq h GLU 331 Ca -0.40 0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.46 1uwq h GLU 331 Cb 1.23 0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 29.23 1uwq h GLU 331 CO 0.67 -0.26 -0.13 -0.22 -1.40 0.00 0.00 179.01 177.67 1uwq h LYS 332 N -0.40 0.00 0.00 2.33 3.64 -2.02 -3.48 116.57 116.64 1uwq h LYS 332 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1uwq h LYS 332 Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1uwq h LYS 332 CO -0.13 0.13 0.00 0.41 -2.27 0.00 0.00 179.45 177.58 1uwq n GLY 333 N -0.89 -1.34 3.36 5.01 0.00 -1.09 -5.15 105.19 105.09 1uwq n GLY 333 Ca -0.02 0.50 -0.14 0.00 0.00 0.00 0.00 46.02 46.36 1uwq n GLY 333 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1uwq s TYR 334 N 0.00 -0.35 0.08 1.61 1.13 -1.26 -0.52 117.35 118.04 1uwq s TYR 334 Ca 0.00 0.43 0.06 0.00 -1.41 0.00 0.00 57.07 56.15 1uwq s TYR 334 Cb 0.00 0.26 -0.03 0.00 -1.10 0.00 0.00 41.96 41.09 1uwq s TYR 334 CO 0.00 -0.57 -0.15 0.14 -2.51 0.00 0.00 175.55 172.46 1uwq s VAL 335 N -2.11 1.26 0.24 -3.49 -7.23 -0.62 -4.87 120.40 103.59 1uwq s VAL 335 Ca -0.07 -1.41 -0.22 0.00 -1.81 0.00 0.00 61.98 58.47 1uwq s VAL 335 Cb -0.01 -1.23 -0.09 0.00 0.56 0.00 0.00 36.38 35.61 1uwq s VAL 335 CO 0.01 -0.22 0.79 -0.44 -0.31 0.00 0.00 175.10 174.93 1uwq s SER 336 N -1.87 7.17 -0.16 4.85 0.01 -1.26 -1.45 113.70 120.99 1uwq s SER 336 Ca 0.01 1.56 -0.07 0.00 1.31 0.00 0.00 55.95 58.76 1uwq s SER 336 Cb -0.09 -2.47 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1uwq s SER 336 CO 0.03 0.02 0.07 -0.76 0.41 0.00 0.00 173.24 173.02 1uwq s LEU 337 N -1.91 3.93 0.72 2.44 1.43 0.05 -4.97 118.68 120.38 1uwq s LEU 337 Ca 0.44 0.17 -0.14 0.00 -1.03 0.00 0.00 54.13 53.58 1uwq s LEU 337 Cb -0.18 -1.98 0.04 0.00 0.03 0.00 0.00 46.19 44.10 1uwq s LEU 337 CO 0.22 0.24 1.14 -0.83 0.23 0.00 0.00 176.35 177.36 1uwq s GLY 338 N -0.05 2.11 0.00 -3.19 0.00 -1.26 -3.75 107.32 101.17 1uwq s GLY 338 Ca 0.07 0.62 0.00 0.00 0.00 0.00 0.00 44.72 45.41 1uwq s GLY 338 CO 0.01 1.00 0.00 0.61 0.00 0.00 0.00 173.10 174.72 1uwq n GLY 339 N -0.24 0.87 3.35 0.20 0.00 0.05 -4.98 105.19 104.43 1uwq n GLY 339 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 1uwq n GLY 339 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uwq s TYR 340 N -3.03 1.63 0.00 1.61 2.02 -1.25 -1.11 117.35 117.22 1uwq s TYR 340 Ca 0.00 -0.92 0.00 0.00 -0.37 0.00 0.00 57.07 55.78 1uwq s TYR 340 Cb 0.00 -0.96 0.00 0.00 -0.40 0.00 0.00 41.96 40.60 1uwq s TYR 340 CO 0.00 -0.03 0.00 0.41 -1.57 0.00 0.00 175.55 174.36 1uwq n GLY 341 N -0.46 3.77 0.46 0.71 0.00 -1.25 -1.47 105.19 106.95 1uwq n GLY 341 Ca -0.05 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.07 1uwq n GLY 341 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1uwq n HIS 342 N 14.00 0.10 -1.51 1.61 1.44 -1.25 -0.80 115.22 128.82 1uwq n HIS 342 Ca 0.00 -0.05 -0.29 0.00 -2.01 0.00 0.00 57.72 55.36 1uwq n HIS 342 Cb 0.00 0.00 0.08 0.00 0.12 0.00 0.00 29.99 30.19 1uwq n HIS 342 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1uwq n GLY 343 N 1.12 5.85 3.89 -1.39 0.00 -0.54 -4.69 105.19 109.43 1uwq n GLY 343 Ca 0.18 -2.24 -0.20 0.00 0.00 0.00 0.00 46.02 43.75 1uwq n GLY 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwq s GLU 345 N -4.12 3.59 0.34 0.00 2.02 -1.26 -4.56 118.70 114.72 1uwq s GLU 345 Ca 0.46 1.83 -0.27 0.00 0.02 0.00 0.00 54.97 57.01 1uwq s GLU 345 Cb -0.05 -2.32 -0.09 0.00 0.10 0.00 0.00 34.13 31.76 1uwq s GLU 345 CO 0.28 -0.71 1.16 1.03 0.02 0.00 0.00 175.26 177.04 1uwq s ARG 346 N -2.82 4.35 -1.21 1.61 0.52 -1.26 -3.88 118.95 116.26 1uwq s ARG 346 Ca 0.66 1.87 -0.13 0.00 -0.52 0.00 0.00 55.73 57.61 1uwq s ARG 346 Cb -0.30 -2.93 -0.01 0.00 0.52 0.00 0.00 34.95 32.23 1uwq s ARG 346 CO 0.36 -0.07 0.72 0.09 0.02 0.00 0.00 175.30 176.41 1uwq n ASN 347 N 0.62 -3.81 0.00 0.23 4.13 -0.56 -4.91 115.26 110.96 1uwq n ASN 347 Ca 0.01 -0.96 0.00 0.00 1.68 0.00 0.00 54.58 55.31 1uwq n ASN 347 Cb 0.45 -3.56 0.00 0.00 -1.54 0.00 0.00 39.78 35.14 1uwq n ASN 347 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1uwq n SER 348 N -2.83 0.56 -4.02 6.41 2.88 -1.25 -4.47 113.62 110.90 1uwq n SER 348 Ca -0.17 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.22 1uwq n SER 348 Cb 0.62 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.95 1uwq n SER 348 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1uwq s VAL 349 N 0.33 0.56 0.97 2.46 1.01 -1.26 -0.68 120.40 123.79 1uwq s VAL 349 Ca 0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.23 1uwq s VAL 349 Cb 0.00 -0.53 0.17 0.00 0.00 0.00 0.00 36.38 36.02 1uwq s VAL 349 CO 0.00 -0.06 1.14 -0.94 0.00 0.00 0.00 175.10 175.24 1uwq s SER 350 N -0.74 2.94 0.65 3.32 1.04 0.11 -4.77 113.70 116.26 1uwq s SER 350 Ca -0.02 0.90 0.37 0.00 0.48 0.00 0.00 55.95 57.68 1uwq s SER 350 Cb -0.06 -1.41 2.05 0.00 0.10 0.00 0.00 66.02 66.70 1uwq s SER 350 CO 0.00 -2.90 2.19 -0.07 0.98 0.00 0.00 173.24 173.44 1uwq h LEU 351 N -1.74 0.00 -1.25 2.42 3.38 -1.46 0.14 115.31 116.80 1uwq h LEU 351 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 1uwq h LEU 351 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1uwq h LEU 351 CO 0.56 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.09 1uwq n ALA 352 N -2.06 2.46 -1.09 1.53 0.00 -1.26 -4.94 120.51 115.14 1uwq n ALA 352 Ca -0.02 -0.60 -0.03 0.00 0.00 0.00 0.00 53.44 52.79 1uwq n ALA 352 Cb 0.21 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 1uwq n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uwq n GLY 353 N 1.08 0.61 3.85 0.00 0.00 0.50 -5.03 105.19 106.20 1uwq n GLY 353 Ca 0.13 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 1uwq n GLY 353 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uwq s LEU 354 N -0.73 4.40 0.44 0.99 1.43 -1.26 -4.76 118.68 119.19 1uwq s LEU 354 Ca 0.00 0.97 -0.24 0.00 -1.03 0.00 0.00 54.13 53.83 1uwq s LEU 354 Cb 0.00 -2.96 -0.08 0.00 0.03 0.00 0.00 46.19 43.18 1uwq s LEU 354 CO 0.00 0.20 1.20 -2.16 0.23 0.00 0.00 176.35 175.82 1uwq s PRO 355 N -1.63 3.83 0.21 1.29 0.04 -1.26 0.08 135.00 137.56 1uwq s PRO 355 Ca 0.32 1.88 0.08 0.00 0.04 0.00 0.00 61.00 63.31 1uwq s PRO 355 Cb -0.16 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 1uwq s PRO 355 CO 0.17 -0.52 0.03 0.95 0.04 0.00 0.00 177.00 177.67 1uwq s THR 356 N -1.45 3.75 0.90 1.26 -4.23 0.15 -1.95 115.64 114.07 1uwq s THR 356 Ca 0.61 -1.56 -0.13 0.00 -1.18 0.00 0.00 61.69 59.43 1uwq s THR 356 Cb -0.31 -2.94 0.20 0.00 1.34 0.00 0.00 72.50 70.79 1uwq s THR 356 CO 0.39 -0.22 1.23 -1.54 -0.54 0.00 0.00 174.62 173.93 1uwq n SER 357 N -0.49 0.35 0.30 3.99 3.41 -0.42 -3.86 113.62 116.90 1uwq n SER 357 Ca -0.08 -1.60 0.17 0.00 -0.26 0.00 0.00 58.87 57.09 1uwq n SER 357 Cb 0.57 -0.91 0.88 0.00 -0.26 0.00 0.00 64.21 64.48 1uwq n SER 357 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uwq h ASP 358 N -1.47 0.00 0.02 4.04 5.19 -1.67 0.06 116.42 122.60 1uwq h ASP 358 Ca -0.40 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 1uwq h ASP 358 Cb 1.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.67 1uwq h ASP 358 CO 0.31 0.00 -0.65 0.33 -3.12 0.00 0.00 179.24 176.11 1uwq n PHE 359 N -3.08 0.00 -1.38 4.55 -0.00 -1.26 -4.68 117.46 111.61 1uwq n PHE 359 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 1uwq n PHE 359 Cb 0.35 -0.02 0.00 0.00 -0.00 0.00 0.00 39.48 39.82 1uwq n PHE 359 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1uwq n GLY 360 N 1.45 0.58 3.75 7.13 0.00 -0.10 -4.78 105.19 113.21 1uwq n GLY 360 Ca 0.07 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 1uwq n GLY 360 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uwq s TRP 361 N -2.00 3.41 0.20 1.61 0.51 -1.26 -2.21 118.94 119.20 1uwq s TRP 361 Ca 0.00 0.32 -0.30 0.00 -2.12 0.00 0.00 56.10 54.00 1uwq s TRP 361 Cb 0.00 -2.06 -0.08 0.00 -0.81 0.00 0.00 33.47 30.52 1uwq s TRP 361 CO 0.00 0.39 0.95 -2.00 -0.51 0.00 0.00 176.95 175.78 1uwq s GLU 362 N -0.10 4.81 -0.28 4.98 2.12 0.02 -1.30 118.70 128.94 1uwq s GLU 362 Ca 0.09 1.49 -0.29 0.00 0.36 0.00 0.00 54.97 56.62 1uwq s GLU 362 Cb -0.12 -3.30 -0.01 0.00 0.26 0.00 0.00 34.13 30.96 1uwq s GLU 362 CO 0.00 0.43 1.48 0.12 -0.54 0.00 0.00 175.26 176.74 1uwq s PHE 363 N -0.85 2.35 -0.45 5.30 2.19 -0.82 -4.60 117.98 121.10 1uwq s PHE 363 Ca 0.43 0.69 0.07 0.00 0.33 0.00 0.00 56.93 58.45 1uwq s PHE 363 Cb -0.25 -4.00 0.27 0.00 -1.31 0.00 0.00 43.02 37.73 1uwq s PHE 363 CO 0.32 -2.33 0.86 0.34 1.83 0.00 0.00 175.22 176.23 1uwq n PHE 364 N 8.27 -2.26 0.22 10.12 7.35 -1.26 -4.83 117.46 135.07 1uwq n PHE 364 Ca 0.17 -2.43 0.14 0.00 -0.76 0.00 0.00 57.45 54.57 1uwq n PHE 364 Cb 0.46 0.99 0.75 0.00 0.35 0.00 0.00 39.48 42.04 1uwq n PHE 364 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1uwq h PRO 365 N 3.64 0.00 -0.43 -7.13 0.13 -1.92 -2.35 132.00 123.94 1uwq h PRO 365 Ca -0.07 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.11 1uwq h PRO 365 Cb 1.01 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1uwq h PRO 365 CO 0.32 0.00 0.29 0.93 -0.23 0.00 0.00 178.00 179.31 1uwq h GLU 366 N 0.00 0.38 -0.58 0.86 3.07 -1.95 -1.71 114.58 114.65 1uwq h GLU 366 Ca 0.06 -0.02 0.12 0.00 -0.50 0.00 0.00 59.36 59.02 1uwq h GLU 366 Cb 0.27 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.06 1uwq h GLU 366 CO -0.00 0.25 0.40 0.78 -1.40 0.00 0.00 179.01 179.04 1uwq h GLY 367 N 0.39 0.40 0.95 -3.84 0.00 -1.82 -1.51 103.07 97.63 1uwq h GLY 367 Ca 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 1uwq h GLY 367 CO -0.04 0.06 0.10 -2.00 0.00 0.00 0.00 176.54 174.66 1uwq h LEU 368 N 0.27 0.65 -0.65 3.11 5.85 -1.50 0.09 115.31 123.13 1uwq h LEU 368 Ca 0.27 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1uwq h LEU 368 Cb 0.72 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1uwq h LEU 368 CO -0.06 0.71 0.42 0.22 -0.34 0.00 0.00 178.44 179.39 1uwq h TYR 369 N 0.55 0.79 -0.07 1.25 3.20 -1.43 -0.11 116.97 121.15 1uwq h TYR 369 Ca 0.13 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1uwq h TYR 369 Cb 0.32 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1uwq h TYR 369 CO 0.02 0.47 -0.16 0.22 -1.64 0.00 0.00 178.16 177.07 1uwq h ASP 370 N 0.84 -0.49 -0.03 -2.11 3.58 -0.92 -1.87 116.42 115.42 1uwq h ASP 370 Ca 0.25 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.78 1uwq h ASP 370 Cb -0.04 0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.23 1uwq h ASP 370 CO -0.08 -0.22 0.00 0.58 -2.88 0.00 0.00 179.24 176.64 1uwq h VAL 371 N -0.24 1.23 -0.38 2.25 2.07 -0.55 -0.35 116.25 120.28 1uwq h VAL 371 Ca 0.07 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.95 1uwq h VAL 371 Cb 0.34 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 1uwq h VAL 371 CO -0.21 0.18 0.14 -0.07 0.02 0.00 0.00 177.57 177.64 1uwq h LEU 372 N -0.23 0.16 -0.34 2.57 3.38 -0.99 -1.85 115.31 118.00 1uwq h LEU 372 Ca 0.01 0.04 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1uwq h LEU 372 Cb 0.29 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1uwq h LEU 372 CO 0.00 0.13 -0.61 0.71 0.09 0.00 0.00 178.44 178.76 1uwq h THR 373 N 0.30 1.30 -0.64 0.22 1.35 -1.25 -1.69 112.91 112.50 1uwq h THR 373 Ca 0.18 -1.83 0.02 0.00 -0.55 0.00 0.00 66.41 64.22 1uwq h THR 373 Cb 0.15 1.78 -0.04 0.00 -1.73 0.00 0.00 68.15 68.31 1uwq h THR 373 CO -0.17 0.58 0.41 0.11 -0.25 0.00 0.00 175.52 176.20 1uwq h LYS 374 N 0.54 0.80 -0.34 4.72 6.56 -0.88 -0.46 116.57 127.51 1uwq h LYS 374 Ca -0.00 -0.05 -0.00 0.00 -1.06 0.00 0.00 60.65 59.53 1uwq h LYS 374 Cb 1.20 -0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 32.67 1uwq h LYS 374 CO 0.13 0.53 0.20 1.88 -2.06 0.00 0.00 179.45 180.13 1uwq h TYR 375 N 0.83 0.45 -0.21 -1.35 0.05 -1.27 -2.20 116.97 113.27 1uwq h TYR 375 Ca 0.24 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.03 1uwq h TYR 375 Cb -0.05 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.53 1uwq h TYR 375 CO -0.04 0.33 0.12 2.35 -1.05 0.00 0.00 178.16 179.88 1uwq h TRP 376 N 0.44 0.23 0.00 4.88 2.91 -0.94 -1.53 115.95 121.94 1uwq h TRP 376 Ca 0.12 0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.10 1uwq h TRP 376 Cb 0.01 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 28.58 1uwq h TRP 376 CO -0.04 0.14 -0.23 -0.91 -1.03 0.00 0.00 178.44 176.37 1uwq h ASN 377 N 0.26 0.00 0.14 2.65 2.35 -1.02 -0.28 115.58 119.67 1uwq h ASN 377 Ca 0.08 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.60 1uwq h ASN 377 Cb -0.01 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.37 1uwq h ASN 377 CO -0.03 0.23 -1.07 -0.09 -1.65 0.00 0.00 177.43 174.82 1uwq h ARG 378 N 0.00 0.29 0.00 0.81 2.43 -1.06 -3.43 114.38 113.42 1uwq h ARG 378 Ca -0.00 -0.50 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1uwq h ARG 378 Cb 0.46 0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1uwq h ARG 378 CO 0.03 1.24 -1.04 0.66 -1.51 0.00 0.00 179.97 179.35 1uwq n TYR 379 N -4.03 0.00 -3.03 2.20 4.01 -0.61 -5.03 117.16 110.67 1uwq n TYR 379 Ca -0.18 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.35 1uwq n TYR 379 Cb 0.87 -0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.88 1uwq n TYR 379 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1uwq n HIS 380 N -1.73 -1.77 -3.75 -0.72 8.25 -0.12 -4.98 115.22 110.39 1uwq n HIS 380 Ca -0.01 0.40 -0.37 0.00 -0.26 0.00 0.00 57.72 57.48 1uwq n HIS 380 Cb 0.23 -3.64 -0.07 0.00 1.12 0.00 0.00 29.99 27.63 1uwq n HIS 380 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1uwq s LEU 381 N -6.42 4.35 0.75 2.41 1.43 -1.26 -5.07 118.68 114.87 1uwq s LEU 381 Ca 0.28 0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 53.74 1uwq s LEU 381 Cb -0.14 -2.19 0.05 0.00 0.03 0.00 0.00 46.19 43.95 1uwq s LEU 381 CO 0.34 0.31 1.20 -0.72 0.23 0.00 0.00 176.35 177.72 1uwq s TYR 382 N -0.58 2.00 0.23 0.29 1.13 -1.26 -4.72 117.35 114.43 1uwq s TYR 382 Ca 0.15 1.62 0.02 0.00 -1.41 0.00 0.00 57.07 57.46 1uwq s TYR 382 Cb -0.13 -3.46 -0.05 0.00 -1.10 0.00 0.00 41.96 37.23 1uwq s TYR 382 CO 0.04 -2.64 0.03 0.00 -2.51 0.00 0.00 175.55 170.47 1uwq s MET 383 N -4.02 1.31 0.05 -3.49 0.23 0.42 -1.83 119.30 111.97 1uwq s MET 383 Ca 0.73 -1.67 0.07 0.00 -1.03 0.00 0.00 55.69 53.79 1uwq s MET 383 Cb -0.28 -0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 32.56 1uwq s MET 383 CO 0.47 -0.16 -0.19 0.71 -2.03 0.00 0.00 175.02 173.81 1uwq s TYR 384 N -3.57 1.69 -0.58 3.16 2.02 -0.85 -0.68 117.35 118.53 1uwq s TYR 384 Ca 0.30 -0.37 -0.24 0.00 -0.37 0.00 0.00 57.07 56.38 1uwq s TYR 384 Cb 0.07 -1.00 0.04 0.00 -0.40 0.00 0.00 41.96 40.67 1uwq s TYR 384 CO 0.09 0.09 0.99 0.08 -1.57 0.00 0.00 175.55 175.23 1uwq s VAL 385 N -0.84 4.31 -0.31 0.71 1.01 -0.66 -0.44 120.40 124.18 1uwq s VAL 385 Ca 0.06 0.25 0.23 0.00 0.00 0.00 0.00 61.98 62.52 1uwq s VAL 385 Cb -0.09 -4.60 0.01 0.00 0.00 0.00 0.00 36.38 31.71 1uwq s VAL 385 CO 0.02 -1.23 1.10 0.71 0.00 0.00 0.00 175.10 175.69 1uwq h THR 386 N 6.03 0.00 -3.12 3.92 1.35 -1.19 0.79 112.91 120.68 1uwq h THR 386 Ca -0.27 -0.92 -0.16 0.00 -0.55 0.00 0.00 66.41 64.51 1uwq h THR 386 Cb 1.07 1.43 -0.26 0.00 -1.73 0.00 0.00 68.15 68.67 1uwq h THR 386 CO 1.12 0.00 -0.42 -1.61 -0.25 0.00 0.00 175.52 174.36 1uwq s GLU 387 N -3.33 0.30 -0.29 4.72 2.02 -1.14 -4.47 118.70 116.50 1uwq s GLU 387 Ca 0.01 0.35 -0.16 0.00 0.02 0.00 0.00 54.97 55.19 1uwq s GLU 387 Cb 0.10 0.14 0.14 0.00 0.10 0.00 0.00 34.13 34.62 1uwq s GLU 387 CO 0.78 -0.04 0.95 1.21 0.02 0.00 0.00 175.26 178.18 1uwq s ASN 388 N 0.13 -0.56 0.00 -0.19 3.84 -1.22 -0.88 114.94 116.05 1uwq s ASN 388 Ca -0.00 0.88 0.00 0.00 0.21 0.00 0.00 52.86 53.95 1uwq s ASN 388 Cb -0.02 1.29 0.00 0.00 -0.55 0.00 0.00 41.25 41.97 1uwq s ASN 388 CO 0.00 -0.14 0.00 0.61 -2.79 0.00 0.00 177.10 174.79 1uwq n GLY 389 N 3.92 -1.26 3.20 1.21 0.00 -1.26 -0.92 105.19 110.08 1uwq n GLY 389 Ca -0.18 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.82 1uwq n GLY 389 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1uwq s ILE 390 N -2.73 0.02 -0.38 -0.61 2.07 -1.26 -4.90 121.20 113.41 1uwq s ILE 390 Ca 0.00 -0.14 -0.29 0.00 -1.41 0.00 0.00 60.65 58.81 1uwq s ILE 390 Cb 0.00 -0.47 0.02 0.00 0.13 0.00 0.00 42.46 42.14 1uwq s ILE 390 CO 0.00 -0.08 1.13 0.00 -1.91 0.00 0.00 174.94 174.08 1uwq s ALA 391 N -0.24 3.34 -0.46 1.50 0.00 -1.26 -4.29 121.76 120.35 1uwq s ALA 391 Ca -0.04 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 51.76 1uwq s ALA 391 Cb -0.03 -3.78 0.19 0.00 0.00 0.00 0.00 23.12 19.50 1uwq s ALA 391 CO 0.01 -1.83 0.78 0.34 0.00 0.00 0.00 175.76 175.06 1uwq s ASP 392 N 2.14 -1.23 0.26 0.00 2.15 -0.32 -1.65 116.67 118.01 1uwq s ASP 392 Ca 0.48 -1.23 -0.04 0.00 0.43 0.00 0.00 52.55 52.19 1uwq s ASP 392 Cb -0.11 1.61 0.31 0.00 -0.30 0.00 0.00 42.92 44.43 1uwq s ASP 392 CO 0.23 -0.07 1.81 -0.78 -0.17 0.00 0.00 175.17 176.19 1uwq h ASP 393 N 5.35 0.90 1.13 -0.34 3.58 -1.91 -2.90 116.42 122.24 1uwq h ASP 393 Ca 0.04 -0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.32 1uwq h ASP 393 Cb 1.14 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.95 1uwq h ASP 393 CO 0.01 0.84 -0.13 0.00 -2.88 0.00 0.00 179.24 177.08 1uwq h ALA 394 N 1.28 0.99 -0.54 -0.78 0.00 -1.95 -3.47 119.26 114.80 1uwq h ALA 394 Ca 0.21 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 1uwq h ALA 394 Cb 0.26 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1uwq h ALA 394 CO -0.01 0.16 -0.17 -3.47 0.00 0.00 0.00 179.25 175.76 1uwq n ASP 395 N -3.23 -3.90 -0.06 0.00 2.03 -1.10 -4.96 116.55 105.34 1uwq n ASP 395 Ca 0.01 0.18 -0.10 0.00 0.52 0.00 0.00 54.79 55.40 1uwq n ASP 395 Cb 0.41 -2.32 -0.04 0.00 -0.72 0.00 0.00 41.12 38.46 1uwq n ASP 395 CO 0.00 0.00 0.00 1.88 -1.92 0.00 0.00 177.20 177.16 1uwq h TYR 396 N 0.00 0.31 0.00 -0.67 0.05 -1.91 -3.37 116.97 111.38 1uwq h TYR 396 Ca -0.18 -0.01 -0.16 0.00 0.05 0.00 0.00 58.73 58.42 1uwq h TYR 396 Cb 0.66 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.27 1uwq h TYR 396 CO 0.24 0.30 -2.16 1.04 -1.05 0.00 0.00 178.16 176.53 1uwq n GLN 397 N -4.86 0.67 -0.33 4.88 6.02 -1.26 -4.60 117.38 117.90 1uwq n GLN 397 Ca -0.03 -0.11 -0.00 0.00 -0.01 0.00 0.00 57.00 56.84 1uwq n GLN 397 Cb 0.09 -1.53 0.13 0.00 1.02 0.00 0.00 30.24 29.95 1uwq n GLN 397 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1uwq h ARG 398 N 0.00 1.09 -0.80 -1.09 2.43 -1.93 0.07 114.38 114.15 1uwq h ARG 398 Ca -0.24 -0.07 0.11 0.00 -0.81 0.00 0.00 59.98 58.98 1uwq h ARG 398 Cb 1.55 -0.25 -0.08 0.00 -0.42 0.00 0.00 29.97 30.77 1uwq h ARG 398 CO 0.01 0.72 0.42 -1.35 -1.51 0.00 0.00 179.97 178.26 1uwq h PRO 399 N 1.12 0.65 -0.17 0.20 0.11 -1.81 0.14 132.00 132.24 1uwq h PRO 399 Ca 0.37 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.37 1uwq h PRO 399 Cb 0.04 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.00 1uwq h PRO 399 CO -0.13 0.43 -0.15 1.88 -0.21 0.00 0.00 178.00 179.81 1uwq h TYR 400 N 0.67 0.48 -0.08 0.65 0.05 -1.51 -2.66 116.97 114.57 1uwq h TYR 400 Ca 0.41 -0.14 0.04 0.00 0.05 0.00 0.00 58.73 59.08 1uwq h TYR 400 Cb 0.47 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 1uwq h TYR 400 CO -0.09 0.77 -0.17 -0.92 -1.05 0.00 0.00 178.16 176.70 1uwq h TYR 401 N 0.06 -0.45 0.60 4.88 5.03 -0.41 0.10 116.97 126.78 1uwq h TYR 401 Ca 0.03 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.33 1uwq h TYR 401 Cb 0.68 0.21 0.01 0.00 1.55 0.00 0.00 36.73 39.18 1uwq h TYR 401 CO 0.08 -0.25 -0.29 1.25 -1.32 0.00 0.00 178.16 177.64 1uwq h LEU 402 N -0.24 -0.68 -0.72 2.82 5.85 -0.81 -1.71 115.31 119.82 1uwq h LEU 402 Ca 0.08 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1uwq h LEU 402 Cb 0.36 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 1uwq h LEU 402 CO -0.22 -0.47 0.41 0.58 -0.34 0.00 0.00 178.44 178.40 1uwq h VAL 403 N -0.82 1.22 -0.42 1.05 2.07 -1.41 -0.81 116.25 117.13 1uwq h VAL 403 Ca -0.08 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 1uwq h VAL 403 Cb 0.62 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1uwq h VAL 403 CO 0.13 0.23 0.17 0.28 0.02 0.00 0.00 177.57 178.41 1uwq h SER 404 N 0.99 0.57 -0.24 0.57 0.02 -0.94 -1.11 113.55 113.42 1uwq h SER 404 Ca 0.26 -0.17 -0.17 0.00 -0.84 0.00 0.00 61.79 60.87 1uwq h SER 404 Cb 0.01 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1uwq h SER 404 CO -0.04 0.58 -0.51 0.45 -1.14 0.00 0.00 176.83 176.17 1uwq h HIS 405 N 0.53 1.02 -0.87 3.45 -0.00 -1.08 -2.14 115.15 116.06 1uwq h HIS 405 Ca 0.14 -0.35 0.03 0.00 -0.00 0.00 0.00 60.37 60.19 1uwq h HIS 405 Cb 0.19 -0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 27.35 1uwq h HIS 405 CO -0.00 1.16 0.57 0.28 -0.00 0.00 0.00 177.93 179.93 1uwq h VAL 406 N 0.64 1.16 -0.70 2.45 2.07 -1.03 -1.87 116.25 118.97 1uwq h VAL 406 Ca 0.02 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 67.20 1uwq h VAL 406 Cb 1.10 -0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1uwq h VAL 406 CO 0.11 0.20 0.43 0.22 0.02 0.00 0.00 177.57 178.55 1uwq h TYR 407 N 1.11 0.79 0.00 1.57 3.20 -0.99 -1.73 116.97 120.92 1uwq h TYR 407 Ca 0.34 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.21 1uwq h TYR 407 Cb -0.02 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1uwq h TYR 407 CO -0.02 0.43 -0.13 1.96 -1.64 0.00 0.00 178.16 178.76 1uwq h GLN 408 N 0.81 0.00 -0.22 1.82 1.08 -0.68 0.12 115.11 118.05 1uwq h GLN 408 Ca 0.29 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.38 1uwq h GLN 408 Cb 0.08 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1uwq h GLN 408 CO -0.13 0.13 -0.30 0.28 -0.95 0.00 0.00 178.83 177.86 1uwq h VAL 409 N 0.00 1.33 -0.57 -0.54 2.07 -0.81 -1.10 116.25 116.63 1uwq h VAL 409 Ca -0.00 -1.50 0.10 0.00 0.82 0.00 0.00 66.70 66.12 1uwq h VAL 409 Cb 0.25 1.78 -0.08 0.00 -1.52 0.00 0.00 31.29 31.72 1uwq h VAL 409 CO 0.02 0.46 0.11 -0.74 0.02 0.00 0.00 177.57 177.44 1uwq h HIS 410 N 0.27 0.17 -0.58 1.57 -0.00 -0.72 -0.26 115.15 115.60 1uwq h HIS 410 Ca 0.02 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 1uwq h HIS 410 Cb 0.88 0.01 -0.03 0.00 -0.00 0.00 0.00 27.41 28.27 1uwq h HIS 410 CO 0.08 -0.03 0.37 -0.09 -0.00 0.00 0.00 177.93 178.26 1uwq h ARG 411 N 0.24 0.78 -0.50 5.26 2.43 -0.85 -0.79 114.38 120.95 1uwq h ARG 411 Ca 0.30 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.40 1uwq h ARG 411 Cb 0.43 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1uwq h ARG 411 CO -0.39 0.54 0.29 0.00 -1.51 0.00 0.00 179.97 178.90 1uwq h ALA 412 N 1.20 0.65 -0.40 2.80 0.00 -0.22 -1.41 119.26 121.87 1uwq h ALA 412 Ca 0.21 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1uwq h ALA 412 Cb -0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1uwq h ALA 412 CO -0.04 0.15 0.21 0.82 0.00 0.00 0.00 179.25 180.39 1uwq h ILE 413 N 0.67 1.16 -0.88 0.00 2.04 -0.81 -1.90 117.51 117.80 1uwq h ILE 413 Ca 0.18 -0.43 0.09 0.00 1.00 0.00 0.00 64.86 65.70 1uwq h ILE 413 Cb 0.03 0.71 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 1uwq h ILE 413 CO -0.03 0.17 0.57 -1.13 0.00 0.00 0.00 178.15 177.73 1uwq h ASN 414 N 0.51 0.79 0.03 1.72 -0.73 -0.91 0.22 115.58 117.22 1uwq h ASN 414 Ca 0.14 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.33 1uwq h ASN 414 Cb 0.08 -0.15 0.00 0.00 0.27 0.00 0.00 38.32 38.53 1uwq h ASN 414 CO -0.02 0.47 0.00 -1.20 -0.37 0.00 0.00 177.43 176.31 1uwq n SER 415 N -4.52 0.00 0.00 1.15 7.64 -0.55 -4.88 113.62 112.46 1uwq n SER 415 Ca 0.15 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.37 1uwq n SER 415 Cb 0.30 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 1uwq n SER 415 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uwq n GLY 416 N 0.44 0.37 3.74 0.23 0.00 0.77 -5.08 105.19 105.66 1uwq n GLY 416 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1uwq n GLY 416 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwq s ALA 417 N -2.00 3.61 -0.76 4.61 0.00 -0.76 -4.96 121.76 121.51 1uwq s ALA 417 Ca 0.00 1.27 -0.25 0.00 0.00 0.00 0.00 51.96 52.98 1uwq s ALA 417 Cb 0.00 -3.54 0.05 0.00 0.00 0.00 0.00 23.12 19.63 1uwq s ALA 417 CO 0.00 -0.69 1.21 0.34 0.00 0.00 0.00 175.76 176.62 1uwq s ASP 418 N 0.46 6.23 -0.11 0.00 -1.08 -1.26 -4.14 116.67 116.76 1uwq s ASP 418 Ca 0.60 -0.80 0.01 0.00 -0.52 0.00 0.00 52.55 51.84 1uwq s ASP 418 Cb -0.40 -2.51 0.02 0.00 -1.46 0.00 0.00 42.92 38.56 1uwq s ASP 418 CO 0.40 -1.65 -0.13 -0.69 0.52 0.00 0.00 175.17 173.62 1uwq s VAL 419 N 5.03 1.37 -1.20 1.11 1.01 -1.26 -0.44 120.40 126.03 1uwq s VAL 419 Ca 0.33 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 61.86 1uwq s VAL 419 Cb -0.09 -1.28 0.05 0.00 0.00 0.00 0.00 36.38 35.06 1uwq s VAL 419 CO 0.09 0.42 0.77 0.54 0.00 0.00 0.00 175.10 176.92 1uwq n ARG 420 N 4.38 1.07 -3.62 2.72 1.74 0.14 -4.96 116.66 118.14 1uwq n ARG 420 Ca -0.18 -0.95 -0.02 0.00 -0.77 0.00 0.00 57.85 55.93 1uwq n ARG 420 Cb 0.51 -1.16 -0.01 0.00 -1.02 0.00 0.00 32.46 30.77 1uwq n ARG 420 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1uwq s GLY 421 N -1.07 -0.35 -0.07 -0.13 0.00 -1.26 -2.21 107.32 102.23 1uwq s GLY 421 Ca 0.11 0.95 -0.01 0.00 0.00 0.00 0.00 44.72 45.77 1uwq s GLY 421 CO 0.18 0.27 -0.02 -0.47 0.00 0.00 0.00 173.10 173.05 1uwq s TYR 422 N -2.63 0.82 -0.25 1.90 6.14 0.18 -1.65 117.35 121.86 1uwq s TYR 422 Ca 0.11 -0.27 0.03 0.00 0.64 0.00 0.00 57.07 57.58 1uwq s TYR 422 Cb 0.01 -0.83 0.05 0.00 0.42 0.00 0.00 41.96 41.61 1uwq s TYR 422 CO -0.04 -0.32 -0.13 -0.51 0.64 0.00 0.00 175.55 175.20 1uwq s LEU 423 N 1.64 3.20 0.27 6.97 1.02 0.27 -0.51 118.68 131.55 1uwq s LEU 423 Ca 0.01 -1.26 -0.29 0.00 0.02 0.00 0.00 54.13 52.60 1uwq s LEU 423 Cb -0.13 -1.54 -0.09 0.00 0.02 0.00 0.00 46.19 44.45 1uwq s LEU 423 CO -0.04 -0.15 1.20 -2.28 0.02 0.00 0.00 176.35 175.09 1uwq s HIS 424 N 1.14 3.36 -0.42 0.29 2.46 -0.26 -3.46 115.29 118.40 1uwq s HIS 424 Ca -0.06 1.52 -0.17 0.00 0.47 0.00 0.00 55.06 56.82 1uwq s HIS 424 Cb -0.19 -3.46 0.02 0.00 -0.13 0.00 0.00 32.58 28.82 1uwq s HIS 424 CO -0.06 -1.20 0.42 -0.46 -2.47 0.00 0.00 174.74 170.97 1uwq s TRP 425 N -0.86 3.18 0.34 3.88 -0.11 -0.09 -2.00 118.94 123.28 1uwq s TRP 425 Ca 0.48 -0.40 0.05 0.00 1.22 0.00 0.00 56.10 57.45 1uwq s TRP 425 Cb -0.35 -2.85 -0.02 0.00 -1.50 0.00 0.00 33.47 28.75 1uwq s TRP 425 CO 0.44 -0.69 0.34 0.45 -4.62 0.00 0.00 176.95 172.88 1uwq n SER 426 N 5.54 -0.90 -0.05 5.86 2.88 -0.82 -4.08 113.62 122.05 1uwq n SER 426 Ca -0.08 -3.14 -0.10 0.00 -1.33 0.00 0.00 58.87 54.22 1uwq n SER 426 Cb 0.47 1.94 -0.04 0.00 -0.75 0.00 0.00 64.21 65.83 1uwq n SER 426 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1uwq h LEU 427 N 0.00 0.26 -8.53 2.46 5.85 -1.75 -1.02 115.31 112.58 1uwq h LEU 427 Ca -0.25 -0.08 -0.27 0.00 0.84 0.00 0.00 57.88 58.11 1uwq h LEU 427 Cb 1.21 -0.07 -0.15 0.00 0.37 0.00 0.00 40.66 42.02 1uwq h LEU 427 CO 0.35 0.27 -0.71 0.00 -0.34 0.00 0.00 178.44 178.02 1uwq s ALA 428 N -5.87 1.18 0.71 1.25 0.00 -1.26 -0.03 121.76 117.75 1uwq s ALA 428 Ca -0.13 -1.39 -0.16 0.00 0.00 0.00 0.00 51.96 50.28 1uwq s ALA 428 Cb 0.08 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1uwq s ALA 428 CO 0.70 -0.16 0.97 -0.25 0.00 0.00 0.00 175.76 177.03 1uwq n ASP 429 N -0.04 0.53 -2.40 0.00 8.00 -0.95 -4.20 116.55 117.49 1uwq n ASP 429 Ca -0.12 0.68 -0.08 0.00 0.71 0.00 0.00 54.79 55.98 1uwq n ASP 429 Cb 0.60 -1.41 0.01 0.00 -0.02 0.00 0.00 41.12 40.30 1uwq n ASP 429 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1uwq n ASN 430 N -1.65 -1.47 -4.59 -2.24 0.23 -1.26 -4.78 115.26 99.50 1uwq n ASN 430 Ca 0.13 -2.28 -0.43 0.00 -0.53 0.00 0.00 54.58 51.47 1uwq n ASN 430 Cb 0.49 2.53 -0.02 0.00 -2.08 0.00 0.00 39.78 40.70 1uwq n ASN 430 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1uwq s TYR 431 N -3.74 2.67 -1.35 -2.53 5.04 -0.56 -4.66 117.35 112.21 1uwq s TYR 431 Ca 0.16 0.60 -0.09 0.00 -2.44 0.00 0.00 57.07 55.30 1uwq s TYR 431 Cb -0.03 -4.45 0.11 0.00 0.35 0.00 0.00 41.96 37.94 1uwq s TYR 431 CO 0.11 -1.50 2.19 -1.91 -1.34 0.00 0.00 175.55 173.10 1uwq n GLU 432 N 8.11 3.82 0.00 4.97 4.07 -0.14 -4.61 120.64 136.86 1uwq n GLU 432 Ca 0.11 -3.25 0.00 0.00 -0.06 0.00 0.00 57.16 53.97 1uwq n GLU 432 Cb 0.49 -2.87 0.00 0.00 -0.06 0.00 0.00 31.44 29.00 1uwq n GLU 432 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 1uwq n TRP 433 N 3.48 0.00 0.29 4.31 7.02 -1.26 -0.77 117.44 130.50 1uwq n TRP 433 Ca 0.52 0.00 0.18 0.00 -1.02 0.00 0.00 57.50 57.18 1uwq n TRP 433 Cb 0.32 0.01 0.92 0.00 -2.42 0.00 0.00 31.31 30.14 1uwq n TRP 433 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1uwq h ALA 434 N -0.70 1.00 0.00 6.99 0.00 -1.83 -2.40 119.26 122.32 1uwq h ALA 434 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1uwq h ALA 434 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uwq h ALA 434 CO 0.00 0.00 -0.48 0.77 0.00 0.00 0.00 179.25 179.54 1uwq h SER 435 N 0.00 0.00 0.00 0.00 0.02 -1.29 -1.01 113.55 111.27 1uwq h SER 435 Ca 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1uwq h SER 435 Cb 0.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1uwq h SER 435 CO 0.00 0.05 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1uwq n GLY 436 N 1.27 -0.45 0.04 -3.77 0.00 -0.91 -4.07 105.19 97.31 1uwq n GLY 436 Ca 0.03 -1.09 0.13 0.00 0.00 0.00 0.00 46.02 45.10 1uwq n GLY 436 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uwq n PHE 437 N 0.00 0.33 0.23 1.61 3.72 -1.26 -0.97 117.46 121.12 1uwq n PHE 437 Ca 0.00 0.10 0.10 0.00 -0.05 0.00 0.00 57.45 57.60 1uwq n PHE 437 Cb 0.00 -0.66 0.53 0.00 -0.94 0.00 0.00 39.48 38.41 1uwq n PHE 437 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1uwq h SER 438 N 0.00 0.00 -3.32 4.37 4.64 -1.90 -3.39 113.55 113.95 1uwq h SER 438 Ca 0.00 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.70 1uwq h SER 438 Cb 0.54 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.50 1uwq h SER 438 CO 0.00 0.22 0.46 -0.04 -0.87 0.00 0.00 176.83 176.60 1uwq s MET 439 N -3.89 3.33 -0.34 4.77 -1.94 -1.26 -4.92 119.30 115.06 1uwq s MET 439 Ca -0.01 -0.28 -0.05 0.00 -1.71 0.00 0.00 55.69 53.64 1uwq s MET 439 Cb 0.12 -4.03 0.05 0.00 2.01 0.00 0.00 34.83 32.98 1uwq s MET 439 CO 0.63 -1.36 0.11 1.03 -0.01 0.00 0.00 175.02 175.41 1uwq s ARG 440 N 3.64 2.52 0.00 2.03 0.52 -1.26 -4.63 118.95 121.77 1uwq s ARG 440 Ca 0.29 -1.29 0.22 0.00 -0.52 0.00 0.00 55.73 54.43 1uwq s ARG 440 Cb -0.13 -3.44 0.20 0.00 0.52 0.00 0.00 34.95 32.10 1uwq s ARG 440 CO 0.19 -0.72 1.21 1.19 0.02 0.00 0.00 175.30 177.19 1uwq n PHE 441 N 4.76 0.06 -2.50 -0.53 3.01 -1.26 -1.17 117.46 119.83 1uwq n PHE 441 Ca -0.11 -0.03 -0.40 0.00 1.01 0.00 0.00 57.45 57.92 1uwq n PHE 441 Cb 0.44 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.87 1uwq n PHE 441 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1uwq s GLY 442 N -1.75 3.00 0.41 1.37 0.00 -1.26 -1.94 107.32 107.15 1uwq s GLY 442 Ca 0.27 0.85 0.07 0.00 0.00 0.00 0.00 44.72 45.91 1uwq s GLY 442 CO 0.27 1.42 2.03 1.41 0.00 0.00 0.00 173.10 178.24 1uwq h LEU 443 N 3.56 0.44 -9.15 0.66 3.38 -0.84 -3.42 115.31 109.93 1uwq h LEU 443 Ca -0.47 -0.02 -0.66 0.00 0.09 0.00 0.00 57.88 56.81 1uwq h LEU 443 Cb 1.21 -0.11 -0.17 0.00 0.09 0.00 0.00 40.66 41.68 1uwq h LEU 443 CO 0.66 0.35 -0.63 -0.76 0.09 0.00 0.00 178.44 178.16 1uwq s LEU 444 N -9.38 3.52 0.15 1.67 1.43 0.96 -2.39 118.68 114.63 1uwq s LEU 444 Ca -0.08 0.07 -0.28 0.00 -1.03 0.00 0.00 54.13 52.80 1uwq s LEU 444 Cb 0.17 -1.82 -0.07 0.00 0.03 0.00 0.00 46.19 44.50 1uwq s LEU 444 CO 0.73 0.30 0.89 -0.75 0.23 0.00 0.00 176.35 177.76 1uwq s LYS 445 N -0.43 4.69 -0.21 1.70 2.20 0.91 -2.25 119.74 126.35 1uwq s LYS 445 Ca 0.08 1.35 -0.08 0.00 -0.36 0.00 0.00 55.97 56.96 1uwq s LYS 445 Cb -0.12 -3.33 -0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1uwq s LYS 445 CO 0.02 0.37 0.08 0.08 -0.36 0.00 0.00 175.35 175.55 1uwq s VAL 446 N -0.54 4.75 -0.51 4.02 1.01 -1.26 -0.96 120.40 126.92 1uwq s VAL 446 Ca 0.42 -0.04 -0.23 0.00 0.00 0.00 0.00 61.98 62.13 1uwq s VAL 446 Cb -0.24 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.00 1uwq s VAL 446 CO 0.29 0.40 0.85 -0.62 0.00 0.00 0.00 175.10 176.02 1uwq s ASP 447 N 0.85 6.36 0.29 3.32 -1.08 -0.70 -4.93 116.67 120.78 1uwq s ASP 447 Ca 0.04 -0.31 0.25 0.00 -0.52 0.00 0.00 52.55 52.02 1uwq s ASP 447 Cb -0.13 -2.40 1.01 0.00 -1.46 0.00 0.00 42.92 39.93 1uwq s ASP 447 CO 0.02 -1.07 1.75 1.88 0.52 0.00 0.00 175.17 178.27 1uwq h TYR 448 N 9.15 0.00 -0.03 -5.34 0.05 -1.92 0.63 116.97 119.51 1uwq h TYR 448 Ca -0.26 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.49 1uwq h TYR 448 Cb 1.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.82 1uwq h TYR 448 CO 0.85 0.00 -0.11 -0.91 -1.05 0.00 0.00 178.16 176.95 1uwq h ASN 449 N 0.00 0.14 0.00 3.88 2.35 -1.92 -3.37 115.58 116.67 1uwq h ASN 449 Ca 0.00 -0.63 0.00 0.00 -0.55 0.00 0.00 56.30 55.12 1uwq h ASN 449 Cb 0.42 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.75 1uwq h ASN 449 CO 0.00 0.75 -1.36 0.35 -1.65 0.00 0.00 177.43 175.52 1uwq n THR 450 N -4.66 0.00 -1.02 2.81 -2.24 -1.08 -4.97 114.28 103.12 1uwq n THR 450 Ca -0.09 -0.19 -0.01 0.00 -2.27 0.00 0.00 64.05 61.49 1uwq n THR 450 Cb 0.38 0.62 -0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1uwq n THR 450 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1uwq n LYS 451 N -1.78 -1.30 -2.23 -0.78 4.76 0.22 -5.00 118.16 112.05 1uwq n LYS 451 Ca 0.01 0.36 -0.39 0.00 -2.87 0.00 0.00 58.31 55.42 1uwq n LYS 451 Cb 0.41 -4.35 -0.02 0.00 -1.84 0.00 0.00 35.03 29.23 1uwq n LYS 451 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1uwq s ARG 452 N -1.40 4.20 -0.05 1.97 0.52 -1.22 -4.82 118.95 118.15 1uwq s ARG 452 Ca 0.00 1.99 -0.02 0.00 -0.52 0.00 0.00 55.73 57.18 1uwq s ARG 452 Cb 0.00 -2.87 -0.04 0.00 0.52 0.00 0.00 34.95 32.56 1uwq s ARG 452 CO 0.00 -0.24 0.08 -0.51 0.02 0.00 0.00 175.30 174.65 1uwq s LEU 453 N -2.15 3.96 0.02 2.53 1.43 -1.26 -1.73 118.68 121.49 1uwq s LEU 453 Ca 0.53 0.23 0.05 0.00 -1.03 0.00 0.00 54.13 53.91 1uwq s LEU 453 Cb -0.35 -2.14 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 1uwq s LEU 453 CO 0.45 0.33 -0.16 -0.31 0.23 0.00 0.00 176.35 176.89 1uwq s TYR 454 N -1.09 1.37 -0.43 0.29 1.51 -0.13 -4.94 117.35 113.93 1uwq s TYR 454 Ca 0.19 -0.32 -0.26 0.00 -1.01 0.00 0.00 57.07 55.67 1uwq s TYR 454 Cb -0.12 -0.84 0.02 0.00 -0.11 0.00 0.00 41.96 40.92 1uwq s TYR 454 CO 0.09 0.03 0.93 -1.58 -1.11 0.00 0.00 175.55 173.91 1uwq s TRP 455 N -0.67 2.98 0.56 2.71 0.52 -1.26 -0.06 118.94 123.72 1uwq s TRP 455 Ca 0.04 0.54 -0.18 0.00 0.02 0.00 0.00 56.10 56.52 1uwq s TRP 455 Cb -0.07 -3.85 -0.05 0.00 -1.15 0.00 0.00 33.47 28.34 1uwq s TRP 455 CO 0.01 -1.00 1.08 1.03 0.02 0.00 0.00 176.95 178.09 1uwq s ARG 456 N 3.66 3.35 0.42 4.98 0.52 -1.01 -4.91 118.95 125.96 1uwq s ARG 456 Ca 0.38 1.40 0.17 0.00 -0.52 0.00 0.00 55.73 57.16 1uwq s ARG 456 Cb -0.11 -2.02 1.08 0.00 0.52 0.00 0.00 34.95 34.42 1uwq s ARG 456 CO 0.23 -0.81 1.87 -1.35 0.02 0.00 0.00 175.30 175.26 1uwq h PRO 457 N 0.86 0.40 -0.52 3.54 0.11 -1.93 0.21 132.00 134.68 1uwq h PRO 457 Ca -0.48 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 65.75 1uwq h PRO 457 Cb 1.24 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1uwq h PRO 457 CO 0.57 0.26 0.45 0.77 -0.21 0.00 0.00 178.00 179.84 1uwq h SER 458 N 0.41 0.00 -0.23 -2.05 0.02 -1.89 -0.78 113.55 109.03 1uwq h SER 458 Ca 0.45 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.21 1uwq h SER 458 Cb 1.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1uwq h SER 458 CO -0.17 0.00 -0.57 0.00 -1.14 0.00 0.00 176.83 174.95 1uwq h ALA 459 N 1.60 0.48 -0.66 3.77 0.00 -0.73 0.43 119.26 124.14 1uwq h ALA 459 Ca 0.25 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1uwq h ALA 459 Cb 1.13 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1uwq h ALA 459 CO -0.00 0.68 0.18 -0.07 0.00 0.00 0.00 179.25 180.04 1uwq h LEU 460 N 0.63 0.96 -0.24 0.00 3.38 -1.19 -0.70 115.31 118.15 1uwq h LEU 460 Ca 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1uwq h LEU 460 Cb 1.18 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1uwq h LEU 460 CO 0.12 0.91 0.11 0.58 0.09 0.00 0.00 178.44 180.26 1uwq h VAL 461 N 0.98 1.15 -0.77 1.22 2.07 -1.21 -2.39 116.25 117.31 1uwq h VAL 461 Ca 0.21 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1uwq h VAL 461 Cb 0.32 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1uwq h VAL 461 CO -0.00 0.15 0.48 0.22 0.02 0.00 0.00 177.57 178.44 1uwq h TYR 462 N 0.25 0.99 -0.73 1.57 3.20 -0.68 -2.04 116.97 119.52 1uwq h TYR 462 Ca 0.08 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1uwq h TYR 462 Cb 0.14 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 1uwq h TYR 462 CO -0.02 0.64 0.42 -0.09 -1.64 0.00 0.00 178.16 177.47 1uwq h ARG 463 N 1.05 1.01 -0.45 1.82 2.43 -0.92 0.66 114.38 119.98 1uwq h ARG 463 Ca 0.28 -0.10 0.07 0.00 -0.81 0.00 0.00 59.98 59.41 1uwq h ARG 463 Cb -0.08 -0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.21 1uwq h ARG 463 CO -0.06 0.73 0.11 0.93 -1.51 0.00 0.00 179.97 180.18 1uwq h GLU 464 N 1.00 0.24 -0.03 0.20 4.39 -0.89 -0.98 114.58 118.52 1uwq h GLU 464 Ca 0.26 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.94 1uwq h GLU 464 Cb 0.00 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1uwq h GLU 464 CO -0.05 0.16 0.02 0.82 -1.16 0.00 0.00 179.01 178.80 1uwq h ILE 465 N 0.25 1.09 -0.16 3.13 2.04 -0.70 -2.96 117.51 120.20 1uwq h ILE 465 Ca 0.22 -0.27 -0.16 0.00 1.00 0.00 0.00 64.86 65.64 1uwq h ILE 465 Cb 0.26 1.22 0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1uwq h ILE 465 CO -0.27 0.08 -0.54 0.00 0.00 0.00 0.00 178.15 177.42 1uwq h ALA 466 N 0.90 0.28 0.00 1.87 0.00 -0.58 0.11 119.26 121.84 1uwq h ALA 466 Ca 0.01 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1uwq h ALA 466 Cb 0.11 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1uwq h ALA 466 CO -0.00 0.49 -0.15 1.79 0.00 0.00 0.00 179.25 181.37 1uwq h THR 467 N 0.32 0.47 0.00 0.00 1.35 -1.27 -2.90 112.91 110.87 1uwq h THR 467 Ca -0.02 -0.80 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1uwq h THR 467 Cb 1.17 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1uwq h THR 467 CO 0.12 0.15 -1.35 0.59 -0.25 0.00 0.00 175.52 174.78 1uwq n ASN 468 N -3.43 0.61 -2.98 5.36 3.02 -1.12 -4.97 115.26 111.75 1uwq n ASN 468 Ca -0.01 -0.57 -0.22 0.00 -0.03 0.00 0.00 54.58 53.75 1uwq n ASN 468 Cb 0.33 1.32 0.03 0.00 -0.61 0.00 0.00 39.78 40.85 1uwq n ASN 468 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uwq n GLY 469 N 1.40 -0.52 3.53 7.41 0.00 0.34 -4.90 105.19 112.44 1uwq n GLY 469 Ca 0.01 0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 1uwq n GLY 469 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uwq s ALA 470 N -3.15 -1.80 -0.36 4.61 0.00 -0.89 -0.95 121.76 119.22 1uwq s ALA 470 Ca 0.28 1.33 -0.29 0.00 0.00 0.00 0.00 51.96 53.28 1uwq s ALA 470 Cb -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1uwq s ALA 470 CO 0.35 -0.38 1.38 0.42 0.00 0.00 0.00 175.76 177.52 1uwq s ILE 471 N -1.34 3.98 0.75 0.00 1.01 -0.03 -4.22 121.20 121.34 1uwq s ILE 471 Ca -0.08 1.04 -0.12 0.00 0.00 0.00 0.00 60.65 61.50 1uwq s ILE 471 Cb -0.00 -4.16 0.04 0.00 0.01 0.00 0.00 42.46 38.35 1uwq s ILE 471 CO 0.07 -0.63 1.11 0.42 0.00 0.00 0.00 174.94 175.90 1uwq s THR 472 N 5.04 3.16 0.31 2.92 -4.23 -1.26 -1.01 115.64 120.56 1uwq s THR 472 Ca 0.60 0.38 0.01 0.00 -1.18 0.00 0.00 61.69 61.50 1uwq s THR 472 Cb -0.15 -3.30 0.28 0.00 1.34 0.00 0.00 72.50 70.67 1uwq s THR 472 CO 0.29 -0.49 1.92 0.44 -0.54 0.00 0.00 174.62 176.24 1uwq h ASP 473 N -0.84 0.88 0.65 3.99 3.32 -1.95 -2.64 116.42 119.83 1uwq h ASP 473 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1uwq h ASP 473 Cb 1.27 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1uwq h ASP 473 CO 0.63 0.57 0.00 1.05 -1.72 0.00 0.00 179.24 179.77 1uwq h GLU 474 N 1.00 0.00 -0.02 3.56 9.09 -2.02 -3.02 114.58 123.17 1uwq h GLU 474 Ca 0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.78 1uwq h GLU 474 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1uwq h GLU 474 CO -0.13 0.00 0.00 0.44 0.05 0.00 0.00 179.01 179.37 1uwq n ILE 475 N -2.69 0.46 0.32 -1.06 -5.35 -1.02 -4.73 119.36 105.30 1uwq n ILE 475 Ca 0.00 -0.73 0.20 0.00 -0.27 0.00 0.00 62.75 61.96 1uwq n ILE 475 Cb 0.21 0.78 1.10 0.00 -1.74 0.00 0.00 39.64 39.99 1uwq n ILE 475 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1uwq h GLU 476 N 0.19 0.00 0.00 6.28 4.81 -1.36 -1.20 114.58 123.30 1uwq h GLU 476 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1uwq h GLU 476 Cb 0.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1uwq h GLU 476 CO 0.00 0.01 -0.08 1.12 -0.73 0.00 0.00 179.01 179.33 1uwq h HIS 477 N 0.00 0.00 0.00 0.92 2.07 -1.85 -2.17 115.15 114.12 1uwq h HIS 477 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1uwq h HIS 477 Cb 0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.03 1uwq h HIS 477 CO 0.00 0.08 0.00 1.28 -3.07 0.00 0.00 177.93 176.22 1uwq n LEU 478 N -3.32 0.07 -3.43 6.12 4.77 -0.45 -3.86 117.00 116.89 1uwq n LEU 478 Ca -0.01 0.52 -0.35 0.00 -0.03 0.00 0.00 56.01 56.13 1uwq n LEU 478 Cb 0.26 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.82 1uwq n LEU 478 CO 0.28 -0.27 2.65 -3.20 -1.33 0.00 0.00 177.39 175.51 1uwq n ASN 479 N -1.58 5.16 -3.67 -1.43 4.05 -0.82 -3.95 115.26 113.03 1uwq n ASN 479 Ca 0.03 -2.58 -0.07 0.00 0.45 0.00 0.00 54.58 52.42 1uwq n ASN 479 Cb 0.18 -1.34 -0.01 0.00 1.23 0.00 0.00 39.78 39.84 1uwq n ASN 479 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1uwq s SER 480 N 3.40 -0.19 0.09 1.20 1.04 -1.25 -4.94 113.70 113.04 1uwq s SER 480 Ca 0.53 -0.67 -0.30 0.00 0.48 0.00 0.00 55.95 55.99 1uwq s SER 480 Cb 0.14 0.71 -0.05 0.00 0.10 0.00 0.00 66.02 66.91 1uwq s SER 480 CO -0.02 -1.33 1.02 -0.69 0.98 0.00 0.00 173.24 173.21 1uwq s VAL 481 N -3.49 4.43 0.04 5.02 1.01 -1.26 -4.75 120.40 121.40 1uwq s VAL 481 Ca 0.12 1.91 -0.37 0.00 0.00 0.00 0.00 61.98 63.65 1uwq s VAL 481 Cb -0.05 -4.22 -0.16 0.00 0.00 0.00 0.00 36.38 31.95 1uwq s VAL 481 CO 0.07 0.24 1.44 -2.65 0.00 0.00 0.00 175.10 174.21 1uwq n PRO 482 N 3.16 1.32 -1.65 2.72 -0.02 -1.26 -4.85 135.00 134.43 1uwq n PRO 482 Ca 0.04 0.48 -0.49 0.00 -2.02 0.00 0.00 63.50 61.51 1uwq n PRO 482 Cb 0.49 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.77 1uwq n PRO 482 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1uwq n PRO 483 N 3.15 1.78 0.04 0.52 -0.02 -1.26 -4.83 135.00 134.39 1uwq n PRO 483 Ca 0.19 0.64 -0.01 0.00 -2.02 0.00 0.00 63.50 62.30 1uwq n PRO 483 Cb 0.20 -2.38 -0.08 0.00 -0.02 0.00 0.00 33.50 31.22 1uwq n PRO 483 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1uwq h VAL 484 N 3.81 0.65 -0.53 -1.45 -1.51 -1.93 -3.39 116.25 111.89 1uwq h VAL 484 Ca -0.46 -2.19 0.10 0.00 -1.23 0.00 0.00 66.70 62.91 1uwq h VAL 484 Cb 1.28 2.17 -0.08 0.00 -2.13 0.00 0.00 31.29 32.54 1uwq h VAL 484 CO 0.86 0.37 0.09 0.50 -1.23 0.00 0.00 177.57 178.16 1uwq h LYS 485 N 0.00 0.21 0.00 5.19 3.11 -1.98 -1.74 116.57 121.37 1uwq h LYS 485 Ca -0.16 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.67 1uwq h LYS 485 Cb 1.64 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 32.82 1uwq h LYS 485 CO 0.06 0.14 0.00 -2.30 -2.81 0.00 0.00 179.45 174.54 1uwq n PRO 486 N -5.14 0.12 -2.73 1.90 -0.02 -1.26 -4.86 135.00 123.00 1uwq n PRO 486 Ca 0.07 0.04 -0.26 0.00 -2.02 0.00 0.00 63.50 61.33 1uwq n PRO 486 Cb 0.27 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1uwq n PRO 486 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uwq s LEU 487 N -2.86 3.56 0.37 2.45 1.43 -0.65 -5.06 118.68 117.92 1uwq s LEU 487 Ca 0.17 0.66 -0.28 0.00 -1.03 0.00 0.00 54.13 53.65 1uwq s LEU 487 Cb 0.17 -3.55 -0.11 0.00 0.03 0.00 0.00 46.19 42.73 1uwq s LEU 487 CO 0.46 -0.71 1.48 -0.60 0.23 0.00 0.00 176.35 177.20 1uwq s ARG 488 N -4.72 4.12 0.00 1.70 3.52 -1.26 -5.02 118.95 117.29 1uwq s ARG 488 Ca 0.49 2.55 0.08 0.00 -0.13 0.00 0.00 55.73 58.72 1uwq s ARG 488 Cb -0.10 -2.98 0.06 0.00 -1.56 0.00 0.00 34.95 30.38 1uwq s ARG 488 CO 0.42 -0.52 0.75 0.72 -0.81 0.00 0.00 175.30 175.86