#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 3.18 -0.08 1.12 2.02 -0.48 -4.99 117.35 118.12 1uwq s TYR 2 Ca 0.00 -2.59 -0.10 0.00 -0.37 0.00 0.00 57.07 54.01 1uwq s TYR 2 Cb 0.00 -2.50 -0.05 0.00 -0.40 0.00 0.00 41.96 39.01 1uwq s TYR 2 CO 0.00 -0.92 0.23 -1.12 -1.57 0.00 0.00 175.55 172.17 1uwq s SER 3 N 1.11 6.53 0.21 2.29 0.01 -1.26 -1.15 113.70 121.43 1uwq s SER 3 Ca 0.08 0.63 0.05 0.00 1.31 0.00 0.00 55.95 58.02 1uwq s SER 3 Cb -0.19 -2.13 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 1uwq s SER 3 CO -0.12 0.38 0.29 -0.36 0.41 0.00 0.00 173.24 173.85 1uwq s PHE 4 N -1.03 3.38 0.63 2.43 0.40 -0.24 -5.00 117.98 118.55 1uwq s PHE 4 Ca 0.18 0.00 -0.17 0.00 -0.60 0.00 0.00 56.93 56.34 1uwq s PHE 4 Cb -0.14 -1.57 -0.05 0.00 0.51 0.00 0.00 43.02 41.78 1uwq s PHE 4 CO 0.07 0.48 0.80 -2.30 0.70 0.00 0.00 175.22 174.98 1uwq n PRO 5 N -1.04 0.65 0.28 0.24 -0.02 -1.26 -4.86 135.00 128.99 1uwq n PRO 5 Ca -0.08 0.26 0.14 0.00 -2.02 0.00 0.00 63.50 61.81 1uwq n PRO 5 Cb 0.56 -2.03 0.86 0.00 -0.02 0.00 0.00 33.50 32.88 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 0.16 0.00 0.96 2.55 2.35 -1.97 -1.86 115.58 117.77 1uwq h ASN 6 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1uwq h ASN 6 Cb 1.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.74 1uwq h ASN 6 CO 0.48 0.00 -0.63 0.77 -1.65 0.00 0.00 177.43 176.40 1uwq h SER 7 N 0.00 0.00 -3.31 5.81 4.64 -1.97 -3.47 113.55 115.25 1uwq h SER 7 Ca 0.02 -0.16 -0.53 0.00 -0.47 0.00 0.00 61.79 60.65 1uwq h SER 7 Cb 0.08 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.24 1uwq h SER 7 CO -0.00 0.08 0.82 0.12 -0.87 0.00 0.00 176.83 176.99 1uwq s PHE 8 N -3.20 2.91 -0.06 4.77 2.19 -0.70 -4.96 117.98 118.92 1uwq s PHE 8 Ca 0.05 0.89 0.04 0.00 0.33 0.00 0.00 56.93 58.24 1uwq s PHE 8 Cb 0.12 -3.94 -0.02 0.00 -1.31 0.00 0.00 43.02 37.88 1uwq s PHE 8 CO 0.72 -3.13 -0.18 1.03 1.83 0.00 0.00 175.22 175.49 1uwq s ARG 9 N -0.30 2.64 -0.16 10.12 0.52 -0.89 -4.94 118.95 125.94 1uwq s ARG 9 Ca 0.62 -0.78 -0.09 0.00 -0.52 0.00 0.00 55.73 54.97 1uwq s ARG 9 Cb -0.45 -2.33 -0.05 0.00 0.52 0.00 0.00 34.95 32.65 1uwq s ARG 9 CO 0.44 0.47 0.14 -0.06 0.02 0.00 0.00 175.30 176.31 1uwq s PHE 10 N -0.35 3.50 0.00 -0.53 0.08 -1.26 -1.20 117.98 118.22 1uwq s PHE 10 Ca 0.03 0.43 0.00 0.00 0.12 0.00 0.00 56.93 57.50 1uwq s PHE 10 Cb -0.12 -2.06 0.00 0.00 -0.57 0.00 0.00 43.02 40.26 1uwq s PHE 10 CO 0.02 0.50 0.00 0.41 -0.10 0.00 0.00 175.22 176.05 1uwq n GLY 11 N 2.81 3.08 3.45 4.36 0.00 0.18 -0.27 105.19 118.80 1uwq n GLY 11 Ca -0.18 -0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 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 0.36 -0.19 0.13 1.61 -2.14 -1.03 -1.19 118.94 116.49 1uwq s TRP 12 Ca 0.00 -0.12 0.09 0.00 2.66 0.00 0.00 56.10 58.72 1uwq s TRP 12 Cb 0.00 0.38 -0.04 0.00 -3.10 0.00 0.00 33.47 30.71 1uwq s TRP 12 CO 0.00 -0.85 -0.21 -1.12 -2.66 0.00 0.00 176.95 172.11 1uwq s SER 13 N -2.84 2.68 0.21 -2.66 0.01 -0.92 -1.41 113.70 108.78 1uwq s SER 13 Ca 0.06 -0.76 -0.17 0.00 1.31 0.00 0.00 55.95 56.40 1uwq s SER 13 Cb -0.00 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.09 1uwq s SER 13 CO -0.07 0.04 0.53 0.00 0.41 0.00 0.00 173.24 174.15 1uwq s GLN 14 N -2.25 1.45 0.15 12.44 -2.07 -0.70 -4.26 119.66 124.43 1uwq s GLN 14 Ca 0.11 -0.96 0.10 0.00 -1.82 0.00 0.00 55.36 52.78 1uwq s GLN 14 Cb -0.08 0.52 -0.04 0.00 -1.09 0.00 0.00 33.01 32.31 1uwq s GLN 14 CO 0.05 -0.62 -0.17 0.00 -1.32 0.00 0.00 175.29 173.24 1uwq s ALA 15 N -3.91 2.72 0.07 2.60 0.00 -1.26 -4.13 121.76 117.84 1uwq s ALA 15 Ca 0.12 -1.46 -0.26 0.00 0.00 0.00 0.00 51.96 50.37 1uwq s ALA 15 Cb -0.01 -0.59 -0.17 0.00 0.00 0.00 0.00 23.12 22.35 1uwq s ALA 15 CO 0.01 0.52 1.62 0.78 0.00 0.00 0.00 175.76 178.68 1uwq h GLY 16 N 3.38 -0.28 1.66 0.00 0.00 -1.91 -2.41 103.07 103.51 1uwq h GLY 16 Ca -0.48 0.10 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1uwq h GLY 16 CO 0.48 -0.10 -0.16 -2.75 0.00 0.00 0.00 176.54 174.01 1uwq h PHE 17 N -0.35 0.44 0.02 5.60 3.57 -1.95 -0.16 116.94 124.10 1uwq h PHE 17 Ca -0.03 -0.07 -0.20 0.00 3.53 0.00 0.00 57.97 61.20 1uwq h PHE 17 Cb 0.27 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1uwq h PHE 17 CO -0.04 0.56 -0.92 1.96 -2.23 0.00 0.00 178.31 177.63 1uwq h GLN 18 N 0.37 0.16 0.00 1.11 4.20 -1.80 -3.40 115.11 115.76 1uwq h GLN 18 Ca 0.07 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 1uwq h GLN 18 Cb 0.51 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 1uwq h GLN 18 CO 0.03 0.97 -1.18 0.43 -0.67 0.00 0.00 178.83 178.41 1uwq n SER 19 N -3.60 4.18 0.07 1.46 7.64 -0.91 -1.44 113.62 121.01 1uwq n SER 19 Ca -0.03 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.72 1uwq n SER 19 Cb 0.84 1.00 -0.09 0.00 -1.01 0.00 0.00 64.21 64.96 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 -0.17 -7.27 1.43 5.08 -1.20 -0.05 114.58 112.40 1uwq h GLU 20 Ca -0.03 0.01 -0.51 0.00 -1.00 0.00 0.00 59.36 57.84 1uwq h GLU 20 Cb 0.46 0.04 0.09 0.00 0.50 0.00 0.00 28.75 29.84 1uwq h GLU 20 CO 0.00 0.16 0.36 -1.64 -1.00 0.00 0.00 179.01 176.89 1uwq s MET 21 N -4.80 2.90 0.00 2.33 -1.94 -1.26 -1.31 119.30 115.22 1uwq s MET 21 Ca -0.15 1.13 0.00 0.00 -1.71 0.00 0.00 55.69 54.96 1uwq s MET 21 Cb 0.03 -1.98 0.00 0.00 2.01 0.00 0.00 34.83 34.89 1uwq s MET 21 CO 0.62 -1.14 0.00 0.41 -0.01 0.00 0.00 175.02 174.90 1uwq n GLY 22 N -1.33 2.05 3.73 -0.03 0.00 -1.18 -0.47 105.19 107.95 1uwq n GLY 22 Ca 0.09 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 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 5.14 0.17 2.61 -4.23 -1.26 -4.70 115.64 113.37 1uwq s THR 23 Ca 0.00 1.04 -0.32 0.00 -1.18 0.00 0.00 61.69 61.22 1uwq s THR 23 Cb 0.00 -3.85 -0.16 0.00 1.34 0.00 0.00 72.50 69.83 1uwq s THR 23 CO 0.00 0.34 1.06 -2.65 -0.54 0.00 0.00 174.62 172.83 1uwq n PRO 24 N 3.52 0.94 -0.02 3.99 -0.02 -1.26 -1.58 135.00 140.57 1uwq n PRO 24 Ca -0.07 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1uwq n PRO 24 Cb 0.52 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 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 1.88 0.33 0.22 -1.23 0.00 -1.26 -4.94 105.19 100.18 1uwq n GLY 25 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 1.24 -4.73 1.61 3.41 -0.62 -4.99 113.62 109.55 1uwq n SER 26 Ca 0.00 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.19 1uwq n SER 26 Cb 0.00 0.48 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 1uwq n SER 26 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1uwq n GLU 27 N -0.81 2.75 -3.74 4.33 4.71 -1.26 -4.70 120.64 121.91 1uwq n GLU 27 Ca 0.08 0.99 -0.30 0.00 -0.01 0.00 0.00 57.16 57.92 1uwq n GLU 27 Cb 0.38 -2.81 -0.13 0.00 -1.01 0.00 0.00 31.44 27.87 1uwq n GLU 27 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1uwq s ASP 28 N 0.91 3.74 0.00 1.62 2.15 -1.26 -4.96 116.67 118.87 1uwq s ASP 28 Ca 0.71 -2.64 0.19 0.00 0.43 0.00 0.00 52.55 51.25 1uwq s ASP 28 Cb -0.50 -1.10 1.05 0.00 -0.30 0.00 0.00 42.92 42.07 1uwq s ASP 28 CO 0.39 -0.27 1.69 -0.81 -0.17 0.00 0.00 175.17 176.00 1uwq n PRO 29 N 3.54 1.16 -1.27 4.34 -0.04 -1.26 -4.43 135.00 137.04 1uwq n PRO 29 Ca 0.08 -0.24 -0.29 0.00 -0.04 0.00 0.00 63.50 63.01 1uwq n PRO 29 Cb 0.34 -1.32 0.12 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.55 5.88 -4.43 3.54 5.03 -1.26 -4.63 115.26 118.84 1uwq n ASN 30 Ca 0.15 -3.68 -0.22 0.00 0.87 0.00 0.00 54.58 51.69 1uwq n ASN 30 Cb 0.12 -0.91 -0.10 0.00 -1.02 0.00 0.00 39.78 37.87 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 -4.05 2.23 0.19 3.41 -4.23 -1.26 -1.07 115.64 110.85 1uwq s THR 31 Ca 0.60 -2.32 -0.12 0.00 -1.18 0.00 0.00 61.69 58.68 1uwq s THR 31 Cb 0.49 -2.20 0.10 0.00 1.34 0.00 0.00 72.50 72.23 1uwq s THR 31 CO 0.04 -0.45 1.77 -2.24 -0.54 0.00 0.00 174.62 173.21 1uwq h ASP 32 N 2.43 0.34 -0.59 3.99 2.03 -1.21 -2.42 116.42 120.98 1uwq h ASP 32 Ca -0.40 0.04 0.01 0.00 -0.73 0.00 0.00 57.03 55.95 1uwq h ASP 32 Cb 1.24 -0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 39.70 1uwq h ASP 32 CO 0.60 0.23 0.39 -0.50 -1.03 0.00 0.00 179.24 178.92 1uwq h TRP 33 N 0.48 0.74 -0.02 4.15 4.06 -1.92 0.24 115.95 123.68 1uwq h TRP 33 Ca 0.25 0.02 0.01 0.00 2.06 0.00 0.00 58.89 61.23 1uwq h TRP 33 Cb 0.21 -0.25 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1uwq h TRP 33 CO -0.12 0.47 -0.04 -0.92 -3.56 0.00 0.00 178.44 174.27 1uwq h TYR 34 N 0.79 -0.09 -0.63 0.49 5.03 -1.86 -0.52 116.97 120.19 1uwq h TYR 34 Ca 0.21 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.54 1uwq h TYR 34 Cb -0.09 0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.20 1uwq h TYR 34 CO -0.03 -0.06 0.41 -0.22 -1.32 0.00 0.00 178.16 176.94 1uwq h LYS 35 N -0.06 0.81 -0.34 1.82 3.64 -1.17 -2.28 116.57 118.99 1uwq h LYS 35 Ca 0.02 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1uwq h LYS 35 Cb 0.09 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 1uwq h LYS 35 CO -0.06 0.54 0.15 2.35 -2.27 0.00 0.00 179.45 180.16 1uwq h TRP 36 N 0.84 0.28 0.00 1.91 2.91 -0.07 -2.01 115.95 119.81 1uwq h TRP 36 Ca 0.24 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.27 1uwq h TRP 36 Cb -0.07 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 28.50 1uwq h TRP 36 CO -0.03 0.15 0.00 -0.39 -1.03 0.00 0.00 178.44 177.13 1uwq h VAL 37 N 0.32 0.00 -0.01 2.65 -1.51 -0.95 -2.68 116.25 114.07 1uwq h VAL 37 Ca 0.14 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 65.05 1uwq h VAL 37 Cb 0.07 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 1uwq h VAL 37 CO -0.11 0.00 -0.16 1.41 -1.23 0.00 0.00 177.57 177.48 1uwq n HIS 38 N -2.43 0.00 -2.07 5.19 8.25 -0.87 -4.74 115.22 118.55 1uwq n HIS 38 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.09 1uwq n HIS 38 Cb 0.44 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.39 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 -2.43 6.72 0.26 0.41 2.15 -0.78 -4.90 116.67 118.09 1uwq s ASP 39 Ca 0.28 2.24 -0.02 0.00 0.43 0.00 0.00 52.55 55.48 1uwq s ASP 39 Cb 0.20 -2.55 0.51 0.00 -0.30 0.00 0.00 42.92 40.77 1uwq s ASP 39 CO 0.48 -0.85 1.75 -0.65 -0.17 0.00 0.00 175.17 175.73 1uwq h PRO 40 N 8.64 0.54 -0.24 4.34 0.11 -1.91 -1.27 132.00 142.21 1uwq h PRO 40 Ca -0.39 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.56 1uwq h PRO 40 Cb 1.18 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1uwq h PRO 40 CO 0.93 0.36 -0.34 0.93 -0.21 0.00 0.00 178.00 179.67 1uwq h GLU 41 N 0.55 0.65 -0.78 1.05 5.08 -1.97 -1.34 114.58 117.81 1uwq h GLU 41 Ca 0.44 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1uwq h GLU 41 Cb 0.65 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.88 1uwq h GLU 41 CO -0.38 0.99 0.52 -0.91 -1.00 0.00 0.00 179.01 178.23 1uwq h ASN 42 N 0.36 0.84 -0.19 1.42 2.35 -1.78 -0.74 115.58 117.83 1uwq h ASN 42 Ca 0.03 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.70 1uwq h ASN 42 Cb 0.92 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.09 1uwq h ASN 42 CO 0.08 0.58 -0.12 0.24 -1.65 0.00 0.00 177.43 176.56 1uwq h MET 43 N 0.98 0.42 -0.08 0.81 2.86 -1.08 -1.12 114.93 117.71 1uwq h MET 43 Ca 0.31 -0.20 -0.06 0.00 -2.06 0.00 0.00 59.70 57.70 1uwq h MET 43 Cb 0.02 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1uwq h MET 43 CO -0.09 0.74 -0.21 0.00 1.06 0.00 0.00 176.91 178.41 1uwq h ALA 44 N 0.67 1.51 0.00 6.32 0.00 -0.94 -2.02 119.26 124.81 1uwq h ALA 44 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1uwq h ALA 44 Cb 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1uwq h ALA 44 CO 0.03 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.64 1uwq n ALA 45 N -2.49 2.13 -1.03 0.00 0.00 -0.31 -4.91 120.51 113.91 1uwq n ALA 45 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 1uwq n ALA 45 Cb 0.30 -1.44 -0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 1.01 0.47 0.25 0.00 0.00 -0.76 -4.92 105.19 101.25 1uwq n GLY 46 Ca 0.05 -0.21 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 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 0.58 -9.31 0.99 3.38 -1.47 -3.43 115.31 106.05 1uwq h LEU 47 Ca -0.02 -0.20 -0.60 0.00 0.09 0.00 0.00 57.88 57.15 1uwq h LEU 47 Cb 0.21 -0.16 -0.13 0.00 0.09 0.00 0.00 40.66 40.67 1uwq h LEU 47 CO 0.03 0.81 -0.73 0.68 0.09 0.00 0.00 178.44 179.32 1uwq s VAL 48 N -4.53 2.84 0.06 1.22 -7.23 -1.16 -4.09 120.40 107.51 1uwq s VAL 48 Ca -0.08 -2.14 0.22 0.00 -1.81 0.00 0.00 61.98 58.17 1uwq s VAL 48 Cb 0.13 -2.48 0.20 0.00 0.56 0.00 0.00 36.38 34.79 1uwq s VAL 48 CO 0.80 -0.33 1.74 0.77 -0.31 0.00 0.00 175.10 177.77 1uwq h SER 49 N 2.32 0.00 0.00 4.85 4.64 -1.28 -3.42 113.55 120.65 1uwq h SER 49 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1uwq h SER 49 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1uwq h SER 49 CO 0.58 0.28 0.00 0.61 -0.87 0.00 0.00 176.83 177.44 1uwq n GLY 50 N 0.40 1.89 3.77 -0.77 0.00 -1.26 -5.04 105.19 104.18 1uwq n GLY 50 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.53 5.72 -0.03 1.61 1.01 -1.26 -5.04 116.67 117.14 1uwq s ASP 51 Ca 0.00 2.20 0.06 0.00 0.71 0.00 0.00 52.55 55.52 1uwq s ASP 51 Cb 0.00 -2.58 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 1uwq s ASP 51 CO 0.00 -1.22 -0.20 -0.76 0.21 0.00 0.00 175.17 173.20 1uwq s LEU 52 N -3.76 2.01 0.58 1.23 1.43 -1.26 -4.92 118.68 113.98 1uwq s LEU 52 Ca 0.73 -0.38 0.35 0.00 -1.03 0.00 0.00 54.13 53.80 1uwq s LEU 52 Cb -0.25 -1.07 1.74 0.00 0.03 0.00 0.00 46.19 46.65 1uwq s LEU 52 CO 0.28 0.22 2.14 1.55 0.23 0.00 0.00 176.35 180.77 1uwq h PRO 53 N 5.85 0.00 0.00 1.29 0.13 -1.96 -2.11 132.00 135.20 1uwq h PRO 53 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 1uwq h PRO 53 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1uwq h PRO 53 CO 0.48 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.44 1uwq n GLU 54 N -3.26 0.01 -0.92 0.86 0.00 -1.26 -1.79 120.64 114.29 1uwq n GLU 54 Ca -0.01 0.25 -0.03 0.00 0.00 0.00 0.00 57.16 57.37 1uwq n GLU 54 Cb 0.21 -1.50 0.31 0.00 0.00 0.00 0.00 31.44 30.46 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 -1.49 4.82 -2.43 -1.84 3.02 -0.79 -3.13 115.26 113.43 1uwq n ASN 55 Ca 0.04 -3.05 0.00 0.00 -0.03 0.00 0.00 54.58 51.54 1uwq n ASN 55 Cb 0.16 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 38.62 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 0.08 -1.32 0.02 7.41 0.00 -0.74 -4.89 105.19 105.76 1uwq n GLY 56 Ca 0.35 -1.61 0.13 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.77 0.05 -2.79 1.61 -0.04 -1.07 -4.27 135.00 127.72 1uwq n PRO 57 Ca 0.00 0.08 -0.08 0.00 -0.04 0.00 0.00 63.50 63.46 1uwq n PRO 57 Cb 0.00 -1.57 0.03 0.00 -0.04 0.00 0.00 33.50 31.92 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 1.26 0.40 0.26 0.55 0.00 0.38 -4.88 105.19 103.17 1uwq n GLY 58 Ca 0.06 -0.35 0.09 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.85 0.00 -0.46 1.61 3.20 -0.45 0.15 116.97 120.16 1uwq h TYR 59 Ca -0.19 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.72 1uwq h TYR 59 Cb 1.12 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.35 1uwq h TYR 59 CO 0.16 0.00 0.21 2.35 -1.64 0.00 0.00 178.16 179.25 1uwq h TRP 60 N 0.00 0.39 0.00 -3.82 2.91 -1.41 -0.95 115.95 113.07 1uwq h TRP 60 Ca 0.00 0.02 -0.27 0.00 1.13 0.00 0.00 58.89 59.78 1uwq h TRP 60 Cb 0.01 -0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 28.51 1uwq h TRP 60 CO 0.00 0.18 -1.88 0.41 -1.03 0.00 0.00 178.44 176.13 1uwq n GLY 61 N -1.24 -1.05 1.36 2.65 0.00 -1.13 -4.51 105.19 101.26 1uwq n GLY 61 Ca 0.04 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 45.95 1uwq n GLY 61 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uwq n ASN 62 N -2.86 4.42 -0.22 1.61 3.02 0.03 -4.67 115.26 116.59 1uwq n ASN 62 Ca -0.19 -2.49 0.18 0.00 -0.03 0.00 0.00 54.58 52.04 1uwq n ASN 62 Cb 1.00 -0.53 0.51 0.00 -0.61 0.00 0.00 39.78 40.15 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 3.44 0.53 -0.94 3.10 -0.00 -1.38 -1.34 116.97 120.37 1uwq h TYR 63 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.74 1uwq h TYR 63 Cb 1.37 -0.16 -0.05 0.00 -0.00 0.00 0.00 36.73 37.89 1uwq h TYR 63 CO 0.66 0.16 0.56 0.87 -0.00 0.00 0.00 178.16 180.41 1uwq h LYS 64 N 0.41 1.27 -0.14 0.10 1.57 -1.87 -0.67 116.57 117.24 1uwq h LYS 64 Ca 0.44 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1uwq h LYS 64 Cb 1.08 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1uwq h LYS 64 CO -0.16 0.89 0.07 1.15 -0.57 0.00 0.00 179.45 180.84 1uwq h THR 65 N 1.29 1.10 -0.36 -0.16 2.02 -1.63 0.56 112.91 115.74 1uwq h THR 65 Ca 0.34 -0.29 0.07 0.00 0.77 0.00 0.00 66.41 67.30 1uwq h THR 65 Cb -0.05 1.04 -0.07 0.00 -1.74 0.00 0.00 68.15 67.34 1uwq h THR 65 CO -0.06 0.09 -0.11 -0.26 0.37 0.00 0.00 175.52 175.55 1uwq h PHE 66 N 0.12 -0.25 -0.26 3.16 -1.00 -1.18 -1.23 116.94 116.28 1uwq h PHE 66 Ca 0.05 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.73 1uwq h PHE 66 Cb 0.09 0.17 -0.01 0.00 3.61 0.00 0.00 35.95 39.81 1uwq h PHE 66 CO -0.04 -0.18 -0.40 0.45 -1.61 0.00 0.00 178.31 176.53 1uwq h HIS 67 N -0.03 0.74 -0.21 -0.55 3.86 -0.93 -0.92 115.15 117.11 1uwq h HIS 67 Ca 0.18 -0.22 0.05 0.00 -1.16 0.00 0.00 60.37 59.22 1uwq h HIS 67 Cb 0.30 -0.16 -0.05 0.00 1.06 0.00 0.00 27.41 28.56 1uwq h HIS 67 CO -0.35 0.93 -0.13 -0.44 0.86 0.00 0.00 177.93 178.80 1uwq h ASP 68 N 0.51 -0.42 -0.63 2.45 3.32 -0.43 0.10 116.42 121.32 1uwq h ASP 68 Ca 0.04 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 1uwq h ASP 68 Cb 0.92 0.22 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 1uwq h ASP 68 CO 0.08 -0.17 0.25 0.78 -1.72 0.00 0.00 179.24 178.46 1uwq h ASN 69 N -0.12 0.88 -0.88 6.45 2.35 -0.94 -1.15 115.58 122.17 1uwq h ASN 69 Ca 0.12 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1uwq h ASN 69 Cb 0.29 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.40 1uwq h ASN 69 CO -0.28 0.81 0.51 0.00 -1.65 0.00 0.00 177.43 176.82 1uwq h ALA 70 N 1.10 1.12 -0.33 -0.83 0.00 -0.91 -0.14 119.26 119.28 1uwq h ALA 70 Ca 0.21 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1uwq h ALA 70 Cb 0.21 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1uwq h ALA 70 CO -0.02 0.61 0.07 0.37 0.00 0.00 0.00 179.25 180.27 1uwq h GLN 71 N 1.22 0.53 -0.13 0.00 4.15 -0.78 -1.19 115.11 118.90 1uwq h GLN 71 Ca 0.31 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 1uwq h GLN 71 Cb -0.01 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.61 1uwq h GLN 71 CO -0.05 0.61 0.03 0.87 -1.93 0.00 0.00 178.83 178.36 1uwq h LYS 72 N 0.37 0.18 0.00 1.69 1.57 -0.88 -0.18 116.57 119.32 1uwq h LYS 72 Ca 0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1uwq h LYS 72 Cb 0.32 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1uwq h LYS 72 CO 0.00 0.18 0.00 -0.12 -0.57 0.00 0.00 179.45 178.94 1uwq n MET 73 N -4.46 0.28 -1.08 3.15 1.56 -0.09 -4.90 117.12 111.59 1uwq n MET 73 Ca -0.01 0.02 -0.01 0.00 -0.27 0.00 0.00 57.70 57.43 1uwq n MET 73 Cb 0.13 -1.50 -0.00 0.00 2.15 0.00 0.00 33.22 33.99 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 0.42 3.79 -5.12 0.00 -0.08 -4.13 105.19 101.31 1uwq n GLY 74 Ca 0.11 -1.06 -0.36 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.13 4.11 0.00 0.99 1.43 -0.49 -4.39 118.68 120.20 1uwq s LEU 75 Ca 0.00 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 1uwq s LEU 75 Cb 0.00 -4.25 0.00 0.00 0.03 0.00 0.00 46.19 41.97 1uwq s LEU 75 CO 0.00 -0.46 0.42 0.29 0.23 0.00 0.00 176.35 176.83 1uwq n LYS 76 N -0.16 -0.14 -3.77 1.70 4.01 0.62 -4.71 118.16 115.71 1uwq n LYS 76 Ca 0.05 -0.49 -0.13 0.00 -0.51 0.00 0.00 58.31 57.24 1uwq n LYS 76 Cb 0.50 -0.83 -0.09 0.00 -0.51 0.00 0.00 35.03 34.10 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 -0.13 0.04 -0.03 -0.18 2.07 -1.19 -1.10 121.20 120.68 1uwq s ILE 77 Ca 0.00 -0.35 -0.03 0.00 -1.41 0.00 0.00 60.65 58.86 1uwq s ILE 77 Cb 0.00 -0.55 0.01 0.00 0.13 0.00 0.00 42.46 42.05 1uwq s ILE 77 CO 0.00 -0.19 0.08 0.00 -1.91 0.00 0.00 174.94 172.92 1uwq s ALA 78 N -0.88 -0.19 -0.12 1.50 0.00 -0.22 -2.46 121.76 119.39 1uwq s ALA 78 Ca -0.10 0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.08 1uwq s ALA 78 Cb -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.97 1uwq s ALA 78 CO 0.03 -0.05 -0.20 0.50 0.00 0.00 0.00 175.76 176.04 1uwq s ARG 79 N -0.04 2.78 0.19 0.00 3.00 -0.50 -1.05 118.95 123.32 1uwq s ARG 79 Ca -0.01 -0.77 0.00 0.00 -1.00 0.00 0.00 55.73 53.95 1uwq s ARG 79 Cb -0.01 -2.22 -0.04 0.00 0.00 0.00 0.00 34.95 32.67 1uwq s ARG 79 CO 0.00 0.03 0.06 -0.51 0.00 0.00 0.00 175.30 174.88 1uwq s LEU 80 N 0.73 1.74 0.21 -0.88 1.43 -1.03 -1.72 118.68 119.16 1uwq s LEU 80 Ca -0.10 -1.27 0.10 0.00 -1.03 0.00 0.00 54.13 51.82 1uwq s LEU 80 Cb -0.16 0.13 -0.05 0.00 0.03 0.00 0.00 46.19 46.14 1uwq s LEU 80 CO 0.01 -0.70 -0.18 0.54 0.23 0.00 0.00 176.35 176.25 1uwq s ASN 81 N -3.18 2.99 0.16 2.29 4.22 -1.26 -0.70 114.94 119.46 1uwq s ASN 81 Ca 0.30 -0.95 -0.17 0.00 -2.14 0.00 0.00 52.86 49.90 1uwq s ASN 81 Cb 0.07 -0.20 -0.07 0.00 1.28 0.00 0.00 41.25 42.33 1uwq s ASN 81 CO 0.07 -0.03 0.61 0.68 -2.04 0.00 0.00 177.10 176.39 1uwq s VAL 82 N -2.37 4.75 -0.41 3.54 -7.23 -1.18 -4.45 120.40 113.06 1uwq s VAL 82 Ca 0.22 1.04 -0.22 0.00 -1.81 0.00 0.00 61.98 61.20 1uwq s VAL 82 Cb -0.04 -3.80 0.02 0.00 0.56 0.00 0.00 36.38 33.11 1uwq s VAL 82 CO 0.09 0.28 0.73 -1.61 -0.31 0.00 0.00 175.10 174.29 1uwq s GLU 83 N -1.83 3.53 0.22 4.82 0.41 -1.26 -4.61 118.70 119.98 1uwq s GLU 83 Ca 0.38 -0.01 -0.14 0.00 -0.41 0.00 0.00 54.97 54.79 1uwq s GLU 83 Cb -0.16 -3.88 0.26 0.00 -1.78 0.00 0.00 34.13 28.57 1uwq s GLU 83 CO 0.20 -0.95 1.41 1.87 -0.49 0.00 0.00 175.26 177.30 1uwq n TRP 84 N 6.43 0.10 0.19 1.61 -0.00 -1.26 -0.63 117.44 123.88 1uwq n TRP 84 Ca 0.01 1.12 0.16 0.00 -0.00 0.00 0.00 57.50 58.79 1uwq n TRP 84 Cb 0.48 -0.88 0.79 0.00 -0.00 0.00 0.00 31.31 31.70 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 0.00 0.10 5.87 4.64 -1.87 0.10 113.55 122.38 1uwq h SER 85 Ca 0.34 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.43 1uwq h SER 85 Cb 0.57 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1uwq h SER 85 CO -0.91 0.00 -0.92 0.03 -0.87 0.00 0.00 176.83 174.16 1uwq h ARG 86 N 0.00 0.60 0.24 4.77 3.08 -1.24 -2.75 114.38 119.07 1uwq h ARG 86 Ca 0.09 -0.59 -0.32 0.00 0.07 0.00 0.00 59.98 59.23 1uwq h ARG 86 Cb 0.44 0.15 0.04 0.00 0.08 0.00 0.00 29.97 30.68 1uwq h ARG 86 CO -0.00 1.20 -1.41 0.82 -1.07 0.00 0.00 179.97 179.51 1uwq h ILE 87 N 0.37 1.30 -2.62 2.04 1.08 -1.19 -3.41 117.51 115.08 1uwq h ILE 87 Ca -0.09 -2.67 -0.60 0.00 -0.39 0.00 0.00 64.86 61.11 1uwq h ILE 87 Cb 1.55 3.04 -0.41 0.00 -3.07 0.00 0.00 36.82 37.93 1uwq h ILE 87 CO 0.17 0.80 -0.70 0.49 -0.69 0.00 0.00 178.15 178.22 1uwq n PHE 88 N -3.76 2.30 0.33 1.37 3.72 -0.08 -0.23 117.46 121.10 1uwq n PHE 88 Ca -0.17 -4.03 0.15 0.00 -0.05 0.00 0.00 57.45 53.35 1uwq n PHE 88 Cb 1.08 -0.43 0.55 0.00 -0.94 0.00 0.00 39.48 39.74 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 4.97 0.00 -6.45 -1.08 0.13 -1.71 -3.42 132.00 124.45 1uwq h PRO 89 Ca 0.18 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.64 1uwq h PRO 89 Cb 0.77 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.73 1uwq h PRO 89 CO 0.67 0.00 -0.73 -0.80 -0.23 0.00 0.00 178.00 176.90 1uwq s ASN 90 N -5.24 4.43 0.38 1.44 0.02 -1.26 -4.79 114.94 109.92 1uwq s ASN 90 Ca 0.03 -0.29 -0.28 0.00 -1.02 0.00 0.00 52.86 51.30 1uwq s ASN 90 Cb 0.09 -0.91 -0.11 0.00 0.02 0.00 0.00 41.25 40.34 1uwq s ASN 90 CO 0.52 0.23 1.49 -2.16 0.02 0.00 0.00 177.10 177.20 1uwq s PRO 91 N -1.82 4.07 0.23 -0.60 0.04 -1.26 -5.01 135.00 130.66 1uwq s PRO 91 Ca 0.19 2.58 -0.13 0.00 0.04 0.00 0.00 61.00 63.68 1uwq s PRO 91 Cb -0.11 -2.94 -0.08 0.00 0.04 0.00 0.00 34.50 31.41 1uwq s PRO 91 CO 0.11 -0.57 0.62 -0.51 0.04 0.00 0.00 177.00 176.68 1uwq s LEU 92 N -2.15 4.20 0.26 -3.56 1.43 -1.26 -5.04 118.68 112.56 1uwq s LEU 92 Ca 0.53 1.11 -0.31 0.00 -1.03 0.00 0.00 54.13 54.44 1uwq s LEU 92 Cb -0.47 -3.68 -0.13 0.00 0.03 0.00 0.00 46.19 41.94 1uwq s LEU 92 CO 0.63 -0.05 1.44 -0.81 0.23 0.00 0.00 176.35 177.78 1uwq n PRO 93 N 0.12 2.18 -1.58 1.29 -0.04 -1.26 -4.89 135.00 130.83 1uwq n PRO 93 Ca -0.00 0.78 -0.52 0.00 -0.04 0.00 0.00 63.50 63.71 1uwq n PRO 93 Cb 0.52 -2.45 -0.06 0.00 -0.04 0.00 0.00 33.50 31.47 1uwq n PRO 93 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1uwq n ARG 94 N 1.91 1.02 0.00 0.54 0.00 -1.26 -5.21 116.66 113.66 1uwq n ARG 94 Ca 0.10 0.37 0.00 0.00 -0.00 0.00 0.00 57.85 58.32 1uwq n ARG 94 Cb 0.33 -1.96 0.00 0.00 -0.00 0.00 0.00 32.46 30.83 1uwq n ARG 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 1uwq n PRO 95 N 2.25 0.00 0.00 2.89 -0.04 -1.26 -5.26 135.00 133.58 1uwq n PRO 95 Ca 0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1uwq n PRO 95 Cb 0.19 -0.14 0.00 0.00 -0.04 0.00 0.00 33.50 33.51 1uwq n PRO 95 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1uwq n PHE 98 N 0.00 0.00 -3.63 0.54 7.35 -1.26 -5.18 117.46 115.29 1uwq n PHE 98 Ca 0.00 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.29 1uwq n PHE 98 Cb 0.00 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 39.72 1uwq n PHE 98 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1uwq s ASP 99 N 0.00 5.60 0.00 -2.13 2.15 -1.26 -4.98 116.67 116.05 1uwq s ASP 99 Ca 0.00 -1.34 0.13 0.00 0.43 0.00 0.00 52.55 51.76 1uwq s ASP 99 Cb 0.00 -1.97 0.54 0.00 -0.30 0.00 0.00 42.92 41.19 1uwq s ASP 99 CO 0.00 -0.47 1.40 1.21 -0.17 0.00 0.00 175.17 177.14 1uwq n GLU 100 N 4.91 0.00 0.03 4.34 2.13 -1.26 -2.41 120.64 128.39 1uwq n GLU 100 Ca -0.11 0.28 0.12 0.00 0.66 0.00 0.00 57.16 58.11 1uwq n GLU 100 Cb 0.44 -1.50 0.18 0.00 0.27 0.00 0.00 31.44 30.82 1uwq n GLU 100 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1uwq n SER 101 N -1.50 0.61 -4.73 4.31 3.41 -1.26 -4.73 113.62 109.72 1uwq n SER 101 Ca 0.03 -0.08 -0.41 0.00 -0.26 0.00 0.00 58.87 58.15 1uwq n SER 101 Cb 0.15 0.31 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 1uwq n SER 101 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1uwq s LYS 102 N -3.11 4.45 0.07 4.33 3.01 -1.01 -4.96 119.74 122.51 1uwq s LYS 102 Ca 0.08 1.93 -0.16 0.00 -1.01 0.00 0.00 55.97 56.81 1uwq s LYS 102 Cb 0.15 -3.23 -0.15 0.00 -1.01 0.00 0.00 37.83 33.59 1uwq s LYS 102 CO 0.73 -0.17 1.29 1.96 0.51 0.00 0.00 175.35 179.67 1uwq h GLN 103 N 5.47 0.62 -5.97 1.68 4.20 -1.90 -3.45 115.11 115.77 1uwq h GLN 103 Ca -0.44 -0.46 -0.61 0.00 0.06 0.00 0.00 58.65 57.21 1uwq h GLN 103 Cb 1.21 0.08 -0.06 0.00 0.30 0.00 0.00 27.48 29.01 1uwq h GLN 103 CO 0.76 1.08 -0.20 -0.51 -0.67 0.00 0.00 178.83 179.28 1uwq s ASP 104 N -6.73 6.78 -0.46 1.46 1.11 -1.26 -4.99 116.67 112.59 1uwq s ASP 104 Ca -0.12 0.93 -0.01 0.00 0.18 0.00 0.00 52.55 53.53 1uwq s ASP 104 Cb 0.07 -2.25 0.12 0.00 1.07 0.00 0.00 42.92 41.93 1uwq s ASP 104 CO 0.84 0.29 0.23 -0.69 1.18 0.00 0.00 175.17 177.03 1uwq s VAL 105 N -0.89 3.12 -0.15 -1.27 1.01 -1.26 -4.95 120.40 116.01 1uwq s VAL 105 Ca 0.24 -2.45 0.18 0.00 0.00 0.00 0.00 61.98 59.94 1uwq s VAL 105 Cb -0.16 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.99 1uwq s VAL 105 CO 0.13 -0.73 0.95 0.71 0.00 0.00 0.00 175.10 176.15 1uwq h THR 106 N 6.07 0.45 -2.94 3.92 1.35 -1.96 -3.47 112.91 116.32 1uwq h THR 106 Ca -0.08 -1.83 -0.14 0.00 -0.55 0.00 0.00 66.41 63.81 1uwq h THR 106 Cb 1.00 1.99 -0.24 0.00 -1.73 0.00 0.00 68.15 69.17 1uwq h THR 106 CO 0.67 0.25 -0.31 -0.70 -0.25 0.00 0.00 175.52 175.18 1uwq s GLU 107 N -3.01 0.46 -0.15 4.72 2.12 -1.26 -4.85 118.70 116.73 1uwq s GLU 107 Ca -0.02 0.32 -0.01 0.00 0.36 0.00 0.00 54.97 55.62 1uwq s GLU 107 Cb 0.09 0.22 0.04 0.00 0.26 0.00 0.00 34.13 34.73 1uwq s GLU 107 CO 0.80 -0.08 -0.02 0.08 -0.54 0.00 0.00 175.26 175.50 1uwq s VAL 108 N -0.16 0.76 -0.16 3.70 1.01 -1.26 -5.11 120.40 119.18 1uwq s VAL 108 Ca -0.03 -0.40 -0.28 0.00 0.00 0.00 0.00 61.98 61.27 1uwq s VAL 108 Cb -0.03 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.33 1uwq s VAL 108 CO 0.01 0.09 0.96 -1.61 0.00 0.00 0.00 175.10 174.55 1uwq s GLU 109 N 1.78 4.34 -0.06 2.72 8.01 -1.26 -4.92 118.70 129.31 1uwq s GLU 109 Ca 0.02 1.26 0.01 0.00 0.01 0.00 0.00 54.97 56.26 1uwq s GLU 109 Cb -0.15 -3.58 0.02 0.00 -4.31 0.00 0.00 34.13 26.11 1uwq s GLU 109 CO -0.07 -0.40 -0.06 0.42 0.01 0.00 0.00 175.26 175.15 1uwq s ILE 110 N 2.38 0.72 0.32 -1.63 1.01 -1.26 -5.07 121.20 117.66 1uwq s ILE 110 Ca 0.44 -0.19 0.05 0.00 0.00 0.00 0.00 60.65 60.94 1uwq s ILE 110 Cb -0.17 -0.73 -0.03 0.00 0.01 0.00 0.00 42.46 41.54 1uwq s ILE 110 CO 0.13 0.28 0.20 0.54 0.00 0.00 0.00 174.94 176.09 1uwq s ASN 111 N 1.09 1.69 0.30 3.58 2.20 -1.26 -5.04 114.94 117.50 1uwq s ASN 111 Ca -0.08 -1.65 0.05 0.00 -0.94 0.00 0.00 52.86 50.24 1uwq s ASN 111 Cb -0.14 0.48 0.70 0.00 -2.00 0.00 0.00 41.25 40.29 1uwq s ASN 111 CO -0.01 -0.96 1.81 -0.08 -2.94 0.00 0.00 177.10 174.91 1uwq h GLU 112 N 2.14 0.80 -0.17 3.55 4.57 -1.99 -1.10 114.58 122.38 1uwq h GLU 112 Ca -0.30 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 57.67 1uwq h GLU 112 Cb 1.25 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1uwq h GLU 112 CO 0.46 0.53 -0.50 -0.91 -1.18 0.00 0.00 179.01 177.42 1uwq h ASN 113 N 0.82 0.72 -0.98 1.04 2.35 -1.99 -1.53 115.58 116.02 1uwq h ASN 113 Ca 0.54 -0.59 0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1uwq h ASN 113 Cb 0.76 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.87 1uwq h ASN 113 CO -0.32 1.19 0.65 -0.08 -1.65 0.00 0.00 177.43 177.22 1uwq h GLU 114 N 0.30 1.29 -0.52 0.81 4.81 -1.83 -1.60 114.58 117.84 1uwq h GLU 114 Ca -0.01 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.10 1uwq h GLU 114 Cb 1.12 -0.29 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 1uwq h GLU 114 CO 0.11 0.85 0.17 -0.07 -0.73 0.00 0.00 179.01 179.33 1uwq h LEU 115 N 1.32 0.75 -1.55 1.64 3.38 -1.10 -1.33 115.31 118.42 1uwq h LEU 115 Ca 0.36 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1uwq h LEU 115 Cb -0.14 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1uwq h LEU 115 CO -0.08 0.76 0.08 0.11 0.09 0.00 0.00 178.44 179.39 1uwq h LYS 116 N 0.71 0.37 -0.10 1.13 1.57 -0.95 0.29 116.57 119.59 1uwq h LYS 116 Ca 0.17 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.80 1uwq h LYS 116 Cb 0.27 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1uwq h LYS 116 CO -0.01 0.34 -0.36 0.00 -0.57 0.00 0.00 179.45 178.85 1uwq h ARG 117 N 0.37 0.42 -0.69 3.15 3.08 -0.97 -3.12 114.38 116.63 1uwq h ARG 117 Ca 0.09 -0.32 0.05 0.00 0.07 0.00 0.00 59.98 59.88 1uwq h ARG 117 Cb 0.12 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.17 1uwq h ARG 117 CO -0.01 0.94 0.39 -0.07 -1.07 0.00 0.00 179.97 180.16 1uwq h LEU 118 N -0.02 0.60 -1.60 3.04 3.38 -0.99 -1.91 115.31 117.82 1uwq h LEU 118 Ca -0.02 0.02 0.40 0.00 0.09 0.00 0.00 57.88 58.38 1uwq h LEU 118 Cb 0.99 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1uwq h LEU 118 CO 0.08 0.39 0.90 -0.78 0.09 0.00 0.00 178.44 179.12 1uwq h ASP 119 N 0.73 0.20 1.75 -0.43 3.58 -0.88 0.13 116.42 121.51 1uwq h ASP 119 Ca 0.30 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.83 1uwq h ASP 119 Cb 0.16 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.27 1uwq h ASP 119 CO -0.17 -0.07 0.00 -0.08 -2.88 0.00 0.00 179.24 176.05 1uwq h GLU 120 N 0.12 0.00 0.00 0.28 4.57 -1.36 -3.04 114.58 115.15 1uwq h GLU 120 Ca 0.74 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.92 1uwq h GLU 120 Cb 2.48 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 31.07 1uwq h GLU 120 CO -0.26 0.00 -1.00 0.66 -1.18 0.00 0.00 179.01 177.24 1uwq n TYR 121 N -2.81 0.79 -2.42 0.92 4.01 0.43 -4.98 117.16 113.10 1uwq n TYR 121 Ca 0.04 0.23 -0.38 0.00 -0.16 0.00 0.00 57.90 57.63 1uwq n TYR 121 Cb 0.48 -0.84 -0.03 0.00 -0.31 0.00 0.00 39.34 38.64 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 -3.33 3.19 -0.26 -0.72 0.00 -1.12 -4.84 121.76 114.69 1uwq s ALA 122 Ca 0.01 0.86 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 1uwq s ALA 122 Cb 0.11 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.90 1uwq s ALA 122 CO 0.79 -0.34 1.27 1.21 0.00 0.00 0.00 175.76 178.69 1uwq s ASN 123 N -1.23 6.79 0.16 0.00 3.84 0.68 -4.91 114.94 120.27 1uwq s ASN 123 Ca 0.55 1.36 0.05 0.00 0.21 0.00 0.00 52.86 55.03 1uwq s ASN 123 Cb -0.28 -2.54 -0.03 0.00 -0.55 0.00 0.00 41.25 37.85 1uwq s ASN 123 CO 0.35 -0.95 1.37 0.11 -2.79 0.00 0.00 177.10 175.19 1uwq h LYS 124 N 8.81 0.09 0.03 0.43 1.79 -1.93 -2.21 116.57 123.58 1uwq h LYS 124 Ca -0.26 -0.11 0.02 0.00 -2.18 0.00 0.00 60.65 58.13 1uwq h LYS 124 Cb 1.10 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 31.75 1uwq h LYS 124 CO 1.01 0.92 -0.15 -0.44 -1.08 0.00 0.00 179.45 179.72 1uwq h ASP 125 N 0.04 -0.42 -0.59 0.86 3.32 -1.97 0.29 116.42 117.95 1uwq h ASP 125 Ca -0.03 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1uwq h ASP 125 Cb 1.56 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 41.25 1uwq h ASP 125 CO 0.13 -0.21 0.37 0.00 -1.72 0.00 0.00 179.24 177.81 1uwq h ALA 126 N 0.66 0.74 -0.46 3.45 0.00 -1.86 0.48 119.26 122.28 1uwq h ALA 126 Ca 0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1uwq h ALA 126 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1uwq h ALA 126 CO -0.12 0.20 0.22 1.25 0.00 0.00 0.00 179.25 180.81 1uwq h LEU 127 N 0.79 0.60 -0.75 0.00 5.85 -1.26 -1.62 115.31 118.92 1uwq h LEU 127 Ca 0.21 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1uwq h LEU 127 Cb -0.05 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1uwq h LEU 127 CO -0.04 0.56 -0.04 0.78 -0.34 0.00 0.00 178.44 179.35 1uwq h ASN 128 N 0.60 0.88 0.11 1.25 -0.26 -0.66 -1.87 115.58 115.63 1uwq h ASN 128 Ca 0.16 -0.25 -0.01 0.00 -0.56 0.00 0.00 56.30 55.64 1uwq h ASN 128 Cb 0.12 -0.24 0.00 0.00 -1.06 0.00 0.00 38.32 37.14 1uwq h ASN 128 CO -0.02 0.97 -0.05 -0.74 -1.06 0.00 0.00 177.43 176.53 1uwq h HIS 129 N 0.82 -0.13 -0.68 1.19 2.76 -0.75 -0.93 115.15 117.43 1uwq h HIS 129 Ca 0.15 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.42 1uwq h HIS 129 Cb 0.55 0.04 -0.08 0.00 1.55 0.00 0.00 27.41 29.48 1uwq h HIS 129 CO 0.03 0.02 0.28 1.88 -1.30 0.00 0.00 177.93 178.85 1uwq h TYR 130 N -0.26 0.50 -0.51 5.26 0.05 -1.30 0.87 116.97 121.57 1uwq h TYR 130 Ca -0.01 0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.86 1uwq h TYR 130 Cb 0.21 -0.12 -0.05 0.00 1.01 0.00 0.00 36.73 37.78 1uwq h TYR 130 CO -0.03 0.13 0.21 -0.09 -1.05 0.00 0.00 178.16 177.33 1uwq h ARG 131 N 0.47 0.40 -0.38 4.88 2.43 -1.15 0.10 114.38 121.14 1uwq h ARG 131 Ca 0.35 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1uwq h ARG 131 Cb 0.44 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1uwq h ARG 131 CO -0.32 0.27 0.23 0.93 -1.51 0.00 0.00 179.97 179.57 1uwq h GLU 132 N 0.42 0.51 -0.06 0.20 5.08 -0.03 -0.78 114.58 119.91 1uwq h GLU 132 Ca 0.24 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1uwq h GLU 132 Cb 0.22 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1uwq h GLU 132 CO -0.22 0.37 -0.06 0.82 -1.00 0.00 0.00 179.01 178.93 1uwq h ILE 133 N 0.50 0.83 0.00 3.13 2.04 -0.40 -1.77 117.51 121.83 1uwq h ILE 133 Ca 0.14 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.92 1uwq h ILE 133 Cb -0.01 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1uwq h ILE 133 CO -0.03 0.00 -0.36 -0.26 0.00 0.00 0.00 178.15 177.51 1uwq h PHE 134 N -0.07 0.00 -0.10 1.37 0.04 -0.64 -0.66 116.94 116.87 1uwq h PHE 134 Ca 0.05 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.72 1uwq h PHE 134 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 1uwq h PHE 134 CO -0.16 0.36 -0.32 0.87 -0.60 0.00 0.00 178.31 178.46 1uwq h LYS 135 N 0.00 0.39 -0.89 1.51 1.57 -1.00 -1.06 116.57 117.10 1uwq h LYS 135 Ca -0.00 -0.29 0.03 0.00 -1.87 0.00 0.00 60.65 58.51 1uwq h LYS 135 Cb 0.73 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.04 1uwq h LYS 135 CO 0.05 0.91 0.58 0.22 -0.57 0.00 0.00 179.45 180.64 1uwq h ASP 136 N -0.05 0.98 0.23 0.86 3.58 -0.99 -1.00 116.42 120.02 1uwq h ASP 136 Ca -0.01 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 1uwq h ASP 136 Cb 0.94 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1uwq h ASP 136 CO 0.07 0.68 -0.11 0.25 -2.88 0.00 0.00 179.24 177.25 1uwq h LEU 137 N 1.14 -0.26 -1.50 2.28 5.85 -1.00 -2.97 115.31 118.85 1uwq h LEU 137 Ca 0.34 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.05 1uwq h LEU 137 Cb -0.04 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1uwq h LEU 137 CO -0.09 -0.16 0.27 0.11 -0.34 0.00 0.00 178.44 178.22 1uwq h LYS 138 N -0.34 0.60 0.00 1.25 1.79 -0.86 -2.57 116.57 116.44 1uwq h LYS 138 Ca -0.03 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1uwq h LYS 138 Cb 0.26 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 1uwq h LYS 138 CO 0.05 0.43 0.00 0.66 -1.08 0.00 0.00 179.45 179.51 1uwq h SER 139 N 0.62 0.00 -0.05 0.86 4.64 -1.03 -1.49 113.55 117.09 1uwq h SER 139 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1uwq h SER 139 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1uwq h SER 139 CO -0.03 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.47 1uwq n ARG 140 N -2.93 1.24 -1.17 4.77 5.12 -0.97 -4.90 116.66 117.83 1uwq n ARG 140 Ca 0.00 -0.37 -0.02 0.00 -1.93 0.00 0.00 57.85 55.54 1uwq n ARG 140 Cb 0.26 -1.33 -0.01 0.00 -1.16 0.00 0.00 32.46 30.22 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 0.91 0.51 3.61 -0.13 0.00 -0.56 -4.93 105.19 104.59 1uwq n GLY 141 Ca 0.15 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.47 4.12 0.27 0.99 1.43 -1.21 -4.76 118.68 119.05 1uwq s LEU 142 Ca 0.00 0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 53.34 1uwq s LEU 142 Cb 0.00 -2.95 -0.13 0.00 0.03 0.00 0.00 46.19 43.15 1uwq s LEU 142 CO 0.00 -0.55 1.47 0.00 0.23 0.00 0.00 176.35 177.50 1uwq n TYR 143 N 6.04 2.44 -3.99 0.29 9.36 -0.26 -4.40 117.16 126.65 1uwq n TYR 143 Ca 0.01 0.38 -0.34 0.00 3.32 0.00 0.00 57.90 61.28 1uwq n TYR 143 Cb 0.48 -2.51 -0.14 0.00 -0.63 0.00 0.00 39.34 36.54 1uwq n TYR 143 CO 0.00 0.00 0.00 0.12 0.22 0.00 0.00 176.86 177.20 1uwq s PHE 144 N -0.17 3.16 -0.36 2.98 5.36 -1.26 -1.05 117.98 126.64 1uwq s PHE 144 Ca 0.65 -1.89 -0.16 0.00 -0.96 0.00 0.00 56.93 54.57 1uwq s PHE 144 Cb -0.58 -2.02 -0.00 0.00 -0.34 0.00 0.00 43.02 40.07 1uwq s PHE 144 CO 0.51 -0.80 0.40 0.42 -1.46 0.00 0.00 175.22 174.28 1uwq s ILE 145 N 1.23 5.13 -0.21 3.12 1.01 -0.22 -0.78 121.20 130.49 1uwq s ILE 145 Ca -0.04 -0.01 -0.13 0.00 0.00 0.00 0.00 60.65 60.48 1uwq s ILE 145 Cb -0.18 -3.89 -0.05 0.00 0.01 0.00 0.00 42.46 38.36 1uwq s ILE 145 CO -0.04 -0.18 0.27 -0.22 0.00 0.00 0.00 174.94 174.77 1uwq s LEU 146 N 2.09 4.16 -0.13 2.97 2.96 -0.37 -2.47 118.68 127.88 1uwq s LEU 146 Ca 0.13 0.34 -0.07 0.00 -0.22 0.00 0.00 54.13 54.31 1uwq s LEU 146 Cb -0.17 -2.30 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 1uwq s LEU 146 CO 0.12 0.03 0.10 0.21 -1.32 0.00 0.00 176.35 175.49 1uwq s ASN 147 N 0.90 6.06 0.16 3.68 2.47 0.12 -0.89 114.94 127.44 1uwq s ASN 147 Ca 0.13 0.33 0.13 0.00 0.42 0.00 0.00 52.86 53.87 1uwq s ASN 147 Cb -0.14 -1.95 -0.08 0.00 -1.45 0.00 0.00 41.25 37.63 1uwq s ASN 147 CO 0.05 0.34 1.20 0.24 -3.72 0.00 0.00 177.10 175.21 1uwq h MET 148 N 5.45 0.00 -2.84 0.43 2.86 -1.07 -3.12 114.93 116.64 1uwq h MET 148 Ca -0.50 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 56.95 1uwq h MET 148 Cb 1.20 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 32.55 1uwq h MET 148 CO 0.61 0.59 -0.49 -0.47 1.06 0.00 0.00 176.91 178.21 1uwq s TYR 149 N -2.85 -0.45 -0.32 -0.22 5.04 -1.00 -4.63 117.35 112.92 1uwq s TYR 149 Ca 0.01 1.01 0.16 0.00 -2.44 0.00 0.00 57.07 55.81 1uwq s TYR 149 Cb 0.08 0.04 0.47 0.00 0.35 0.00 0.00 41.96 42.90 1uwq s TYR 149 CO 0.79 -0.34 1.06 1.58 -1.34 0.00 0.00 175.55 177.29 1uwq n HIS 150 N 5.05 1.77 0.00 4.97 -0.00 -1.26 -0.75 115.22 125.00 1uwq n HIS 150 Ca -0.12 -2.56 0.00 0.00 -0.00 0.00 0.00 57.72 55.04 1uwq n HIS 150 Cb 0.51 -0.28 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 1uwq n HIS 150 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 1uwq n TRP 151 N -0.38 0.00 -1.95 1.57 8.01 -1.26 -4.86 117.44 118.56 1uwq n TRP 151 Ca 0.18 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.96 1uwq n TRP 151 Cb 0.81 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.09 1uwq n TRP 151 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.69 174.54 1uwq s PRO 152 N 0.00 4.23 0.04 -0.99 0.02 -1.26 -4.94 135.00 132.10 1uwq s PRO 152 Ca 0.00 2.38 0.04 0.00 0.02 0.00 0.00 61.00 63.44 1uwq s PRO 152 Cb 0.00 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.41 1uwq s PRO 152 CO 0.00 -0.46 -0.05 -0.51 -0.33 0.00 0.00 177.00 175.65 1uwq s LEU 153 N -0.62 3.26 0.25 -5.54 1.43 -1.26 -4.78 118.68 111.42 1uwq s LEU 153 Ca 0.59 -0.18 -0.29 0.00 -1.03 0.00 0.00 54.13 53.22 1uwq s LEU 153 Cb -0.43 -1.93 -0.15 0.00 0.03 0.00 0.00 46.19 43.70 1uwq s LEU 153 CO 0.46 0.24 0.99 -2.65 0.23 0.00 0.00 176.35 175.62 1uwq n PRO 154 N 1.14 1.15 0.17 1.29 -0.02 -1.26 -0.91 135.00 136.56 1uwq n PRO 154 Ca -0.14 0.40 0.14 0.00 -2.02 0.00 0.00 63.50 61.89 1uwq n PRO 154 Cb 0.52 -1.76 0.71 0.00 -0.02 0.00 0.00 33.50 32.95 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 2.21 0.00 -0.50 2.45 3.38 -1.31 -0.79 115.31 120.75 1uwq h LEU 155 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1uwq h LEU 155 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1uwq h LEU 155 CO 0.62 0.00 0.00 -2.67 0.09 0.00 0.00 178.44 176.48 1uwq n TRP 156 N -4.29 0.61 0.15 1.13 4.27 -1.26 -2.36 117.44 115.69 1uwq n TRP 156 Ca 0.02 0.24 0.09 0.00 -3.89 0.00 0.00 57.50 53.96 1uwq n TRP 156 Cb 0.31 -0.88 -0.14 0.00 -1.36 0.00 0.00 31.31 29.24 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 -2.05 0.16 -3.60 5.67 4.77 -0.33 -4.82 117.00 116.80 1uwq n LEU 157 Ca 0.03 -0.09 -0.07 0.00 -0.03 0.00 0.00 56.01 55.84 1uwq n LEU 157 Cb 0.22 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 1uwq n LEU 157 CO 0.19 0.04 0.05 -2.28 -1.33 0.00 0.00 177.39 174.05 1uwq s HIS 158 N -3.20 -0.89 -0.47 -1.77 5.04 -0.99 -0.47 115.29 112.54 1uwq s HIS 158 Ca -0.04 1.54 -0.09 0.00 -1.54 0.00 0.00 55.06 54.92 1uwq s HIS 158 Cb 0.12 0.34 0.11 0.00 0.04 0.00 0.00 32.58 33.19 1uwq s HIS 158 CO 0.77 -0.55 0.34 0.34 -2.34 0.00 0.00 174.74 173.31 1uwq s ASP 159 N 2.65 5.72 0.38 9.88 -1.08 -0.33 -4.32 116.67 129.56 1uwq s ASP 159 Ca 0.00 -1.85 0.20 0.00 -0.52 0.00 0.00 52.55 50.38 1uwq s ASP 159 Cb -0.13 -2.02 0.66 0.00 -1.46 0.00 0.00 42.92 39.97 1uwq s ASP 159 CO -0.14 -0.68 1.72 1.55 0.52 0.00 0.00 175.17 178.13 1uwq h PRO 160 N 8.47 0.00 -0.16 4.34 0.13 -1.87 -3.05 132.00 139.86 1uwq h PRO 160 Ca -0.22 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.71 1uwq h PRO 160 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1uwq h PRO 160 CO 0.86 0.35 -0.71 0.82 -0.23 0.00 0.00 178.00 179.08 1uwq h ILE 161 N 0.00 1.31 0.02 -3.56 1.08 -1.93 -0.65 117.51 113.78 1uwq h ILE 161 Ca -0.00 -1.97 0.01 0.00 -0.39 0.00 0.00 64.86 62.51 1uwq h ILE 161 Cb 0.93 1.94 -0.02 0.00 -3.07 0.00 0.00 36.82 36.60 1uwq h ILE 161 CO 0.05 0.62 -0.08 -0.09 -0.69 0.00 0.00 178.15 177.95 1uwq h ARG 162 N 0.48 -0.15 -0.59 2.37 2.43 -1.87 -1.22 114.38 115.83 1uwq h ARG 162 Ca -0.03 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1uwq h ARG 162 Cb 1.31 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.87 1uwq h ARG 162 CO 0.14 -0.10 0.36 0.28 -1.51 0.00 0.00 179.97 179.14 1uwq h VAL 163 N -0.16 1.17 -0.80 0.20 2.07 -1.55 -1.32 116.25 115.88 1uwq h VAL 163 Ca 0.03 -0.38 0.13 0.00 0.82 0.00 0.00 66.70 67.29 1uwq h VAL 163 Cb 0.18 0.36 -0.09 0.00 -1.52 0.00 0.00 31.29 30.23 1uwq h VAL 163 CO -0.07 0.18 0.40 -0.09 0.02 0.00 0.00 177.57 178.01 1uwq h ARG 164 N 0.80 0.60 0.00 1.57 1.12 -0.86 0.11 114.38 117.72 1uwq h ARG 164 Ca 0.21 -0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.05 1uwq h ARG 164 Cb -0.03 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 29.80 1uwq h ARG 164 CO -0.04 0.39 0.00 0.54 -3.11 0.00 0.00 179.97 177.75 1uwq n ARG 165 N -4.87 0.32 -0.68 0.20 1.74 -0.48 -4.84 116.66 108.04 1uwq n ARG 165 Ca 0.15 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1uwq n ARG 165 Cb 0.37 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 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 0.13 0.61 3.52 -0.13 0.00 0.40 -5.03 105.19 104.69 1uwq n GLY 166 Ca 0.09 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.40 6.22 -0.25 1.61 -1.08 -0.53 -4.97 116.67 115.27 1uwq s ASP 167 Ca 0.00 -0.38 0.13 0.00 -0.52 0.00 0.00 52.55 51.79 1uwq s ASP 167 Cb 0.00 -2.23 0.71 0.00 -1.46 0.00 0.00 42.92 39.94 1uwq s ASP 167 CO 0.00 -0.49 1.67 0.49 0.52 0.00 0.00 175.17 177.36 1uwq n PHE 168 N 5.60 1.84 1.13 -5.34 3.72 -1.26 -3.50 117.46 119.66 1uwq n PHE 168 Ca -0.07 -0.94 0.13 0.00 -0.05 0.00 0.00 57.45 56.51 1uwq n PHE 168 Cb 0.48 -0.51 0.37 0.00 -0.94 0.00 0.00 39.48 38.88 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 0.02 0.00 -2.86 4.37 -2.24 -1.26 -4.93 114.28 107.38 1uwq n THR 169 Ca 0.30 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1uwq n THR 169 Cb 1.17 0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 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 3.13 3.68 3.38 0.00 -1.26 -5.04 105.19 110.49 1uwq n GLY 170 Ca 0.09 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.59 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 -0.04 4.19 -0.09 1.61 0.02 -1.26 -4.88 135.00 134.56 1uwq s PRO 171 Ca 0.00 2.29 0.12 0.00 0.02 0.00 0.00 61.00 63.43 1uwq s PRO 171 Cb 0.00 -3.77 0.30 0.00 0.02 0.00 0.00 34.50 31.05 1uwq s PRO 171 CO 0.00 -0.78 1.22 -1.13 -0.33 0.00 0.00 177.00 175.98 1uwq n SER 172 N 6.25 2.85 0.00 2.53 3.41 -1.15 -1.19 113.62 126.31 1uwq n SER 172 Ca 0.16 -2.58 0.00 0.00 -0.26 0.00 0.00 58.87 56.19 1uwq n SER 172 Cb 0.41 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.52 3.38 0.00 5.00 0.00 0.38 -1.94 105.19 111.49 1uwq n GLY 173 Ca 0.13 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 46.07 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 14.00 0.00 1.31 1.61 7.02 -1.26 -1.93 117.44 138.19 1uwq n TRP 174 Ca 0.00 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.62 1uwq n TRP 174 Cb 0.00 -0.32 0.70 0.00 -2.42 0.00 0.00 31.31 29.27 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 -1.32 0.00 -4.25 -0.99 4.77 -0.82 -4.25 117.00 110.15 1uwq n LEU 175 Ca 0.05 0.29 -0.32 0.00 -0.03 0.00 0.00 56.01 56.00 1uwq n LEU 175 Cb 0.10 -0.29 -0.17 0.00 -2.33 0.00 0.00 43.42 40.73 1uwq n LEU 175 CO 0.09 -0.02 -0.55 -0.55 -1.33 0.00 0.00 177.39 175.03 1uwq s SER 176 N -2.58 3.20 0.65 -1.43 0.15 -0.81 -4.97 113.70 107.91 1uwq s SER 176 Ca 0.26 -0.52 0.42 0.00 0.70 0.00 0.00 55.95 56.81 1uwq s SER 176 Cb 0.19 -1.34 2.25 0.00 -1.71 0.00 0.00 66.02 65.41 1uwq s SER 176 CO 0.43 0.18 2.32 0.71 1.20 0.00 0.00 173.24 178.07 1uwq h THR 177 N 5.56 0.04 -1.00 6.45 1.35 -1.86 -1.79 112.91 121.66 1uwq h THR 177 Ca -0.22 -0.08 0.08 0.00 -0.55 0.00 0.00 66.41 65.64 1uwq h THR 177 Cb 1.23 1.07 -0.07 0.00 -1.73 0.00 0.00 68.15 68.65 1uwq h THR 177 CO 0.48 0.00 0.64 -0.09 -0.25 0.00 0.00 175.52 176.30 1uwq h ARG 178 N 0.00 1.10 -0.58 4.72 9.65 -1.91 -0.21 114.38 127.15 1uwq h ARG 178 Ca -0.00 -0.07 -0.05 0.00 -1.10 0.00 0.00 59.98 58.76 1uwq h ARG 178 Cb 0.07 -0.25 -0.03 0.00 -1.39 0.00 0.00 29.97 28.38 1uwq h ARG 178 CO 0.00 0.73 0.14 1.15 2.80 0.00 0.00 179.97 184.79 1uwq h THR 179 N 1.13 1.23 -0.22 0.20 2.02 -1.55 -0.62 112.91 115.11 1uwq h THR 179 Ca 0.45 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1uwq h THR 179 Cb 0.24 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1uwq h THR 179 CO -0.19 0.32 0.09 0.58 0.37 0.00 0.00 175.52 176.68 1uwq h VAL 180 N 0.86 1.16 -0.37 3.16 2.07 -1.26 -0.46 116.25 121.41 1uwq h VAL 180 Ca 0.19 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1uwq h VAL 180 Cb 0.30 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1uwq h VAL 180 CO -0.00 0.16 0.17 0.22 0.02 0.00 0.00 177.57 178.14 1uwq h TYR 181 N 0.20 0.55 -0.04 1.57 3.20 -0.83 -2.25 116.97 119.36 1uwq h TYR 181 Ca 0.07 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.76 1uwq h TYR 181 Cb 0.17 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 1uwq h TYR 181 CO -0.01 0.47 -0.65 0.93 -1.64 0.00 0.00 178.16 177.26 1uwq h GLU 182 N 0.46 0.17 -0.58 1.82 4.39 -1.00 -2.81 114.58 117.04 1uwq h GLU 182 Ca 0.13 -0.13 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 1uwq h GLU 182 Cb 0.13 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1uwq h GLU 182 CO -0.02 0.76 0.11 0.35 -1.16 0.00 0.00 179.01 179.06 1uwq h PHE 183 N 0.12 1.00 -0.63 4.33 3.57 -0.90 0.24 116.94 124.68 1uwq h PHE 183 Ca -0.01 -0.13 0.07 0.00 3.53 0.00 0.00 57.97 61.43 1uwq h PHE 183 Cb 1.17 -0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.57 1uwq h PHE 183 CO 0.02 0.87 0.31 0.00 -2.23 0.00 0.00 178.31 177.28 1uwq h ALA 184 N 1.02 0.83 -0.36 2.41 0.00 -1.30 -0.61 119.26 121.25 1uwq h ALA 184 Ca 0.18 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 1uwq h ALA 184 Cb 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1uwq h ALA 184 CO 0.01 -0.05 -0.36 0.00 0.00 0.00 0.00 179.25 178.85 1uwq h ARG 185 N 0.57 0.88 -0.35 0.00 3.08 -1.17 -2.12 114.38 115.27 1uwq h ARG 185 Ca 0.29 -0.46 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 1uwq h ARG 185 Cb 0.24 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1uwq h ARG 185 CO -0.21 1.11 0.20 0.35 -1.07 0.00 0.00 179.97 180.35 1uwq h PHE 186 N 0.69 0.47 -0.41 3.04 3.57 -0.18 -1.44 116.94 122.67 1uwq h PHE 186 Ca 0.06 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.46 1uwq h PHE 186 Cb 0.95 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1uwq h PHE 186 CO 0.07 0.35 -0.10 0.77 -2.23 0.00 0.00 178.31 177.17 1uwq h SER 187 N 0.45 0.80 -0.61 0.41 0.02 -1.01 -0.24 113.55 113.37 1uwq h SER 187 Ca 0.12 -0.36 0.03 0.00 -0.84 0.00 0.00 61.79 60.74 1uwq h SER 187 Cb 0.03 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 1uwq h SER 187 CO -0.02 0.97 0.36 0.00 -1.14 0.00 0.00 176.83 177.01 1uwq h ALA 188 N 0.85 0.79 -0.73 3.77 0.00 -1.34 -1.81 119.26 120.78 1uwq h ALA 188 Ca 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1uwq h ALA 188 Cb 0.63 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1uwq h ALA 188 CO 0.04 0.09 0.35 -0.92 0.00 0.00 0.00 179.25 178.81 1uwq h TYR 189 N 0.71 1.05 -0.16 0.00 3.20 -0.76 -0.66 116.97 120.35 1uwq h TYR 189 Ca 0.25 -0.05 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1uwq h TYR 189 Cb 0.04 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 1uwq h TYR 189 CO -0.06 0.78 -0.11 0.82 -1.64 0.00 0.00 178.16 177.95 1uwq h ILE 190 N 1.02 1.33 -0.88 1.81 1.08 -0.83 -1.33 117.51 119.70 1uwq h ILE 190 Ca 0.25 -1.21 0.11 0.00 -0.39 0.00 0.00 64.86 63.61 1uwq h ILE 190 Cb 0.12 1.77 -0.06 0.00 -3.07 0.00 0.00 36.82 35.58 1uwq h ILE 190 CO -0.03 0.36 0.57 0.00 -0.69 0.00 0.00 178.15 178.36 1uwq h ALA 191 N 0.65 1.69 -0.59 1.87 0.00 -1.20 0.11 119.26 121.79 1uwq h ALA 191 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1uwq h ALA 191 Cb 0.62 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1uwq h ALA 191 CO 0.03 0.11 0.32 2.35 0.00 0.00 0.00 179.25 182.07 1uwq h TRP 192 N 0.82 0.82 0.01 0.00 7.01 -0.76 -0.80 115.95 123.06 1uwq h TRP 192 Ca 0.42 -0.02 -0.20 0.00 2.11 0.00 0.00 58.89 61.19 1uwq h TRP 192 Cb 0.48 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.26 1uwq h TRP 192 CO -0.00 0.59 -0.96 0.87 -2.79 0.00 0.00 178.44 176.15 1uwq h LYS 193 N 0.80 0.05 -0.02 2.65 1.79 -0.41 -3.39 116.57 118.04 1uwq h LYS 193 Ca 0.21 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1uwq h LYS 193 Cb 0.05 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1uwq h LYS 193 CO -0.03 0.96 0.00 1.19 -1.08 0.00 0.00 179.45 180.49 1uwq n PHE 194 N -3.46 0.02 -0.04 -1.35 3.72 -0.05 -4.75 117.46 111.55 1uwq n PHE 194 Ca -0.01 -0.07 0.22 0.00 -0.05 0.00 0.00 57.45 57.54 1uwq n PHE 194 Cb 0.89 -0.01 0.70 0.00 -0.94 0.00 0.00 39.48 40.12 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 0.65 0.00 0.58 4.37 3.58 -1.34 0.31 116.42 124.57 1uwq h ASP 195 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1uwq h ASP 195 Cb 0.20 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.25 1uwq h ASP 195 CO 0.00 0.00 -0.06 -2.24 -2.88 0.00 0.00 179.24 174.06 1uwq h ASP 196 N 0.00 0.00 0.00 2.28 2.03 -1.86 -3.15 116.42 115.72 1uwq h ASP 196 Ca 0.29 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.49 1uwq h ASP 196 Cb 1.17 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.65 1uwq h ASP 196 CO -0.00 0.06 -2.07 0.18 -1.03 0.00 0.00 179.24 176.38 1uwq n LEU 197 N -3.29 0.00 -4.82 0.15 4.77 0.11 -5.01 117.00 108.91 1uwq n LEU 197 Ca -0.01 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.59 1uwq n LEU 197 Cb 0.24 0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1uwq n LEU 197 CO 0.27 0.13 0.26 -0.69 -1.33 0.00 0.00 177.39 176.04 1uwq s VAL 198 N -3.19 4.77 -0.26 4.08 1.01 -0.97 -4.77 120.40 121.07 1uwq s VAL 198 Ca -0.08 1.11 -0.09 0.00 0.00 0.00 0.00 61.98 62.92 1uwq s VAL 198 Cb 0.11 -3.85 -0.15 0.00 0.00 0.00 0.00 36.38 32.49 1uwq s VAL 198 CO 0.86 0.46 -0.22 0.47 0.00 0.00 0.00 175.10 176.67 1uwq n ASP 199 N 1.43 1.97 -4.09 3.32 8.00 0.04 -4.94 116.55 122.28 1uwq n ASP 199 Ca -0.09 0.17 -0.08 0.00 0.71 0.00 0.00 54.79 55.50 1uwq n ASP 199 Cb 0.51 -0.69 -0.10 0.00 -0.02 0.00 0.00 41.12 40.82 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 -2.50 0.80 0.11 -1.24 2.02 -0.93 -4.46 118.70 112.49 1uwq s GLU 200 Ca -0.36 -1.29 0.10 0.00 0.02 0.00 0.00 54.97 53.44 1uwq s GLU 200 Cb 0.12 0.25 -0.04 0.00 0.10 0.00 0.00 34.13 34.56 1uwq s GLU 200 CO 0.56 -0.21 -0.24 0.71 0.02 0.00 0.00 175.26 176.10 1uwq s TYR 201 N -3.97 2.08 0.00 1.61 2.02 0.05 -1.24 117.35 117.90 1uwq s TYR 201 Ca 0.15 -0.40 0.06 0.00 -0.37 0.00 0.00 57.07 56.51 1uwq s TYR 201 Cb 0.07 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.47 1uwq s TYR 201 CO -0.04 0.26 -0.20 0.45 -1.57 0.00 0.00 175.55 174.45 1uwq s SER 202 N -1.89 2.30 -0.03 2.29 0.15 -0.07 -0.25 113.70 116.21 1uwq s SER 202 Ca 0.11 -0.39 -0.23 0.00 0.70 0.00 0.00 55.95 56.13 1uwq s SER 202 Cb -0.10 -0.24 -0.22 0.00 -1.71 0.00 0.00 66.02 63.76 1uwq s SER 202 CO 0.05 0.21 1.11 0.71 1.20 0.00 0.00 173.24 176.52 1uwq h THR 203 N 4.58 1.49 -3.55 6.45 1.35 -1.40 -1.34 112.91 120.49 1uwq h THR 203 Ca -0.39 -1.80 -0.06 0.00 -0.55 0.00 0.00 66.41 63.61 1uwq h THR 203 Cb 1.15 2.55 -0.12 0.00 -1.73 0.00 0.00 68.15 70.00 1uwq h THR 203 CO 0.47 0.50 -0.14 0.00 -0.25 0.00 0.00 175.52 176.10 1uwq s MET 204 N -3.41 1.20 -0.17 4.72 0.23 -1.26 -2.38 119.30 118.23 1uwq s MET 204 Ca -0.15 -0.94 -0.01 0.00 -1.03 0.00 0.00 55.69 53.56 1uwq s MET 204 Cb 0.02 0.45 -0.00 0.00 -1.53 0.00 0.00 34.83 33.76 1uwq s MET 204 CO 0.75 -0.47 -0.13 1.21 -2.03 0.00 0.00 175.02 174.35 1uwq s ASN 205 N -2.89 3.85 -1.30 -1.18 2.47 0.07 -1.55 114.94 114.43 1uwq s ASN 205 Ca 0.10 -0.43 -0.14 0.00 0.42 0.00 0.00 52.86 52.81 1uwq s ASN 205 Cb 0.01 -1.61 0.01 0.00 -1.45 0.00 0.00 41.25 38.21 1uwq s ASN 205 CO -0.04 0.07 0.55 -0.62 -3.72 0.00 0.00 177.10 173.34 1uwq n GLU 206 N 4.13 -1.69 0.12 0.43 1.02 0.20 -4.75 120.64 120.11 1uwq n GLU 206 Ca -0.19 0.31 0.05 0.00 -0.02 0.00 0.00 57.16 57.31 1uwq n GLU 206 Cb 0.52 -3.85 0.48 0.00 -0.02 0.00 0.00 31.44 28.56 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 -2.03 0.27 -0.29 3.49 0.13 -1.88 -1.58 132.00 130.11 1uwq h PRO 207 Ca -0.66 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 64.49 1uwq h PRO 207 Cb 1.38 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 1uwq h PRO 207 CO 0.57 0.26 0.20 -2.95 -0.23 0.00 0.00 178.00 175.84 1uwq h ASN 208 N 0.28 0.13 0.47 1.44 -1.07 -1.93 -2.29 115.58 112.60 1uwq h ASN 208 Ca 0.07 -0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.14 1uwq h ASN 208 Cb 0.11 -0.03 0.02 0.00 -2.07 0.00 0.00 38.32 36.35 1uwq h ASN 208 CO -0.00 0.09 -1.34 0.58 0.07 0.00 0.00 177.43 176.83 1uwq h VAL 209 N 0.15 1.41 -0.22 6.14 2.07 -1.66 -0.69 116.25 123.45 1uwq h VAL 209 Ca 0.13 -2.89 0.05 0.00 0.82 0.00 0.00 66.70 64.81 1uwq h VAL 209 Cb 0.32 2.97 -0.05 0.00 -1.52 0.00 0.00 31.29 33.01 1uwq h VAL 209 CO -0.02 0.85 -0.11 0.58 0.02 0.00 0.00 177.57 178.89 1uwq h VAL 210 N 0.11 0.65 0.08 2.57 2.07 -1.21 -0.16 116.25 120.35 1uwq h VAL 210 Ca -0.18 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.08 1uwq h VAL 210 Cb 2.05 0.65 0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1uwq h VAL 210 CO 0.23 0.00 -1.11 1.23 0.02 0.00 0.00 177.57 177.94 1uwq h GLY 211 N -0.09 0.41 0.62 2.17 0.00 -1.49 -2.27 103.07 102.42 1uwq h GLY 211 Ca 0.12 -0.87 -0.02 0.00 0.00 0.00 0.00 47.33 46.56 1uwq h GLY 211 CO -0.28 0.77 -0.22 -1.33 0.00 0.00 0.00 176.54 175.48 1uwq h GLY 212 N 1.29 -0.64 1.77 4.60 0.00 -1.02 -3.07 103.07 106.00 1uwq h GLY 212 Ca -0.12 0.24 -0.19 0.00 0.00 0.00 0.00 47.33 47.26 1uwq h GLY 212 CO 0.19 -0.23 -0.84 1.41 0.00 0.00 0.00 176.54 177.07 1uwq h LEU 213 N -0.99 0.27 -1.38 3.11 3.38 -1.18 -1.03 115.31 117.49 1uwq h LEU 213 Ca -0.06 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1uwq h LEU 213 Cb 0.57 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1uwq h LEU 213 CO 0.10 0.99 0.43 1.23 0.09 0.00 0.00 178.44 181.29 1uwq h GLY 214 N 1.77 0.91 0.00 0.83 0.00 -1.50 -3.33 103.07 101.74 1uwq h GLY 214 Ca -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1uwq h GLY 214 CO 0.13 0.30 0.00 -1.72 0.00 0.00 0.00 176.54 175.25 1uwq n TYR 215 N -4.45 0.00 0.07 5.60 4.01 -1.16 -1.50 117.16 119.74 1uwq n TYR 215 Ca 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1uwq n TYR 215 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.20 0.63 -0.97 -0.72 0.31 -0.49 -0.51 118.33 116.37 1uwq n VAL 216 Ca 0.00 0.21 -0.29 0.00 -0.01 0.00 0.00 64.34 64.25 1uwq n VAL 216 Cb 0.07 -1.07 -0.02 0.00 -0.91 0.00 0.00 33.84 31.91 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 2.73 3.48 0.28 2.92 0.00 -0.61 -4.70 105.19 109.30 1uwq n GLY 217 Ca 0.00 -1.10 0.17 0.00 0.00 0.00 0.00 46.02 45.10 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 3.39 0.02 0.00 1.61 -1.51 -1.87 -1.06 116.25 116.83 1uwq h VAL 218 Ca 0.61 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 65.58 1uwq h VAL 218 Cb 0.24 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1uwq h VAL 218 CO 1.60 0.01 0.00 0.11 -1.23 0.00 0.00 177.57 178.05 1uwq h LYS 219 N 0.00 0.00 0.00 5.19 1.57 -1.89 -2.61 116.57 118.82 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 0.43 -0.57 0.00 0.00 179.45 179.31 1uwq n SER 220 N -2.63 0.20 -3.15 0.86 7.64 -0.40 -4.89 113.62 111.25 1uwq n SER 220 Ca 0.00 0.56 -0.20 0.00 1.01 0.00 0.00 58.87 60.24 1uwq n SER 220 Cb 0.21 -0.60 0.07 0.00 -1.01 0.00 0.00 64.21 62.88 1uwq n SER 220 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uwq n GLY 221 N -0.28 -0.33 3.88 0.23 0.00 -0.98 -4.66 105.19 103.05 1uwq n GLY 221 Ca 0.02 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.28 3.60 0.46 1.61 0.40 -1.26 -4.61 117.98 114.89 1uwq s PHE 222 Ca 0.47 0.54 -0.23 0.00 -0.60 0.00 0.00 56.93 57.11 1uwq s PHE 222 Cb -0.21 -1.95 -0.07 0.00 0.51 0.00 0.00 43.02 41.29 1uwq s PHE 222 CO 0.63 0.70 1.18 -1.25 0.70 0.00 0.00 175.22 177.17 1uwq s PRO 223 N -1.27 3.76 0.00 0.24 0.04 -1.26 -1.27 135.00 135.24 1uwq s PRO 223 Ca 0.19 1.81 0.19 0.00 0.04 0.00 0.00 61.00 63.22 1uwq s PRO 223 Cb -0.13 -2.43 0.58 0.00 0.04 0.00 0.00 34.50 32.57 1uwq s PRO 223 CO 0.09 -0.56 1.45 -0.35 0.04 0.00 0.00 177.00 177.67 1uwq n PRO 224 N -0.45 1.91 -3.22 0.56 -0.04 -1.25 -4.47 135.00 128.04 1uwq n PRO 224 Ca 0.07 -1.39 -0.20 0.00 -0.04 0.00 0.00 63.50 61.94 1uwq n PRO 224 Cb 0.48 -1.39 0.05 0.00 -0.04 0.00 0.00 33.50 32.60 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 1.19 -0.35 3.36 0.55 0.00 -0.40 -3.66 105.19 105.89 1uwq n GLY 225 Ca 0.16 0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.20 3.21 -0.36 1.61 5.04 -1.04 -4.86 117.35 117.75 1uwq s TYR 226 Ca 0.40 -0.97 -0.29 0.00 -2.44 0.00 0.00 57.07 53.77 1uwq s TYR 226 Cb -0.18 -2.35 0.01 0.00 0.35 0.00 0.00 41.96 39.79 1uwq s TYR 226 CO 0.50 -0.61 1.21 -1.17 -1.34 0.00 0.00 175.55 174.14 1uwq s LEU 227 N 1.53 3.80 -0.30 6.97 2.96 -1.26 -4.22 118.68 128.16 1uwq s LEU 227 Ca 0.02 0.94 -0.11 0.00 -0.22 0.00 0.00 54.13 54.76 1uwq s LEU 227 Cb -0.18 -3.54 0.18 0.00 0.50 0.00 0.00 46.19 43.14 1uwq s LEU 227 CO 0.05 -1.11 0.93 -0.55 -1.32 0.00 0.00 176.35 174.35 1uwq s SER 228 N 2.53 -0.70 0.18 3.68 0.15 0.33 -5.02 113.70 114.85 1uwq s SER 228 Ca 0.52 0.54 -0.13 0.00 0.70 0.00 0.00 55.95 57.58 1uwq s SER 228 Cb -0.13 1.63 0.16 0.00 -1.71 0.00 0.00 66.02 65.97 1uwq s SER 228 CO 0.24 -0.13 1.75 -0.26 1.20 0.00 0.00 173.24 176.04 1uwq h PHE 229 N 7.89 0.33 -0.13 3.44 0.04 -1.92 -1.44 116.94 125.16 1uwq h PHE 229 Ca -0.16 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.63 1uwq h PHE 229 Cb 1.16 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.22 1uwq h PHE 229 CO 0.11 0.12 0.06 1.49 -0.60 0.00 0.00 178.31 179.49 1uwq h GLU 230 N 0.37 0.18 0.00 1.51 4.81 -1.95 -1.95 114.58 117.55 1uwq h GLU 230 Ca 0.23 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 1uwq h GLU 230 Cb 0.22 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1uwq h GLU 230 CO -0.22 0.26 -0.41 -0.07 -0.73 0.00 0.00 179.01 177.84 1uwq h LEU 231 N 0.07 0.00 -0.26 1.64 3.38 -1.93 -1.69 115.31 116.51 1uwq h LEU 231 Ca 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1uwq h LEU 231 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1uwq h LEU 231 CO -0.00 0.41 0.12 -1.28 0.09 0.00 0.00 178.44 177.77 1uwq h SER 232 N 0.00 0.35 -0.45 -0.43 0.87 -0.96 0.47 113.55 113.40 1uwq h SER 232 Ca -0.00 -0.14 0.06 0.00 -1.23 0.00 0.00 61.79 60.47 1uwq h SER 232 Cb 0.72 -0.09 -0.05 0.00 -0.44 0.00 0.00 62.40 62.54 1uwq h SER 232 CO 0.05 0.39 0.16 0.03 -0.53 0.00 0.00 176.83 176.94 1uwq h ARG 233 N 0.29 0.32 -0.40 2.24 3.08 -1.09 -1.98 114.38 116.83 1uwq h ARG 233 Ca 0.09 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1uwq h ARG 233 Cb 0.14 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1uwq h ARG 233 CO -0.01 0.21 0.22 -0.09 -1.07 0.00 0.00 179.97 179.23 1uwq h ARG 234 N 0.33 0.56 -0.76 0.04 2.43 -1.04 -0.29 114.38 115.65 1uwq h ARG 234 Ca 0.21 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.37 1uwq h ARG 234 Cb 0.21 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 29.59 1uwq h ARG 234 CO -0.22 0.45 0.45 0.00 -1.51 0.00 0.00 179.97 179.15 1uwq h ALA 235 N 1.07 1.03 -0.25 2.80 0.00 -0.70 -1.10 119.26 122.11 1uwq h ALA 235 Ca 0.14 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 1uwq h ALA 235 Cb 0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1uwq h ALA 235 CO -0.02 0.18 -0.54 0.52 0.00 0.00 0.00 179.25 179.38 1uwq h MET 236 N 0.84 0.75 -0.16 0.00 2.86 -1.03 -0.48 114.93 117.70 1uwq h MET 236 Ca 0.33 -0.47 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1uwq h MET 236 Cb 0.15 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1uwq h MET 236 CO -0.17 1.10 0.06 -0.92 1.06 0.00 0.00 176.91 178.04 1uwq h TYR 237 N 0.58 0.10 -0.70 -0.22 3.20 -0.64 -1.16 116.97 118.13 1uwq h TYR 237 Ca 0.01 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1uwq h TYR 237 Cb 1.13 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 39.34 1uwq h TYR 237 CO 0.06 0.05 0.38 -0.91 -1.64 0.00 0.00 178.16 176.11 1uwq h ASN 238 N 0.13 0.87 -0.03 -2.11 2.35 -1.04 -2.34 115.58 113.42 1uwq h ASN 238 Ca 0.07 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.63 1uwq h ASN 238 Cb 0.04 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 1uwq h ASN 238 CO -0.07 0.71 -0.26 -0.29 -1.65 0.00 0.00 177.43 175.87 1uwq h ILE 239 N 0.96 1.26 0.15 2.81 2.10 -0.94 0.21 117.51 124.07 1uwq h ILE 239 Ca 0.25 -1.27 -0.01 0.00 1.08 0.00 0.00 64.86 64.91 1uwq h ILE 239 Cb 0.03 1.37 0.00 0.00 -1.09 0.00 0.00 36.82 37.14 1uwq h ILE 239 CO -0.04 0.40 -0.07 0.40 -1.08 0.00 0.00 178.15 177.76 1uwq h ILE 240 N 0.40 0.88 -0.97 2.19 2.04 -0.97 0.74 117.51 121.81 1uwq h ILE 240 Ca 0.06 -0.11 0.08 0.00 1.00 0.00 0.00 64.86 65.89 1uwq h ILE 240 Cb 0.67 0.95 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 1uwq h ILE 240 CO 0.05 0.03 0.62 1.56 0.00 0.00 0.00 178.15 180.40 1uwq h GLN 241 N -0.26 1.04 -0.52 2.37 4.20 -1.17 -1.01 115.11 119.77 1uwq h GLN 241 Ca -0.02 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.55 1uwq h GLN 241 Cb 0.20 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1uwq h GLN 241 CO 0.03 0.69 0.02 0.00 -0.67 0.00 0.00 178.83 178.90 1uwq h ALA 242 N 1.47 1.06 -0.09 3.87 0.00 -0.21 -1.01 119.26 124.35 1uwq h ALA 242 Ca 0.44 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1uwq h ALA 242 Cb 0.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1uwq h ALA 242 CO -0.21 0.59 0.03 1.25 0.00 0.00 0.00 179.25 180.91 1uwq h HIS 243 N 0.80 0.16 -0.54 0.00 -0.00 0.44 0.07 115.15 116.07 1uwq h HIS 243 Ca 0.16 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.53 1uwq h HIS 243 Cb 0.45 -0.04 -0.03 0.00 -0.00 0.00 0.00 27.41 27.79 1uwq h HIS 243 CO 0.03 0.32 0.33 0.00 -0.00 0.00 0.00 177.93 178.60 1uwq h ALA 244 N 0.82 0.69 -0.15 5.26 0.00 -1.11 0.22 119.26 124.99 1uwq h ALA 244 Ca 0.03 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1uwq h ALA 244 Cb 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1uwq h ALA 244 CO -0.00 0.05 -0.28 0.00 0.00 0.00 0.00 179.25 179.01 1uwq h ARG 245 N 0.65 0.28 -0.09 0.00 -0.00 -1.13 -1.57 114.38 112.53 1uwq h ARG 245 Ca 0.22 -0.10 -0.15 0.00 -0.50 0.00 0.00 59.98 59.44 1uwq h ARG 245 Cb 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 29.95 1uwq h ARG 245 CO -0.09 0.55 -0.59 0.00 0.00 0.00 0.00 179.97 179.83 1uwq h ALA 246 N 1.46 0.83 0.15 0.04 0.00 -0.41 -0.65 119.26 120.68 1uwq h ALA 246 Ca 0.04 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1uwq h ALA 246 Cb 0.64 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1uwq h ALA 246 CO 0.05 0.72 -0.07 -0.92 0.00 0.00 0.00 179.25 179.02 1uwq h TYR 247 N 0.22 -0.19 -0.62 0.00 5.03 -0.44 -0.82 116.97 120.15 1uwq h TYR 247 Ca -0.00 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.37 1uwq h TYR 247 Cb 1.10 0.06 -0.06 0.00 1.55 0.00 0.00 36.73 39.39 1uwq h TYR 247 CO 0.03 0.00 0.31 -0.44 -1.32 0.00 0.00 178.16 176.74 1uwq h ASP 248 N -0.35 0.43 -0.03 -2.11 3.32 -1.29 -0.54 116.42 115.85 1uwq h ASP 248 Ca -0.02 0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1uwq h ASP 248 Cb 0.28 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 1uwq h ASP 248 CO 0.03 0.28 -0.26 1.23 -1.72 0.00 0.00 179.24 178.80 1uwq h GLY 249 N 0.58 -0.38 1.01 2.75 0.00 -0.93 -1.19 103.07 104.90 1uwq h GLY 249 Ca 0.28 0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.88 1uwq h GLY 249 CO -0.20 -0.21 0.15 -2.22 0.00 0.00 0.00 176.54 174.05 1uwq h ILE 250 N -0.39 1.25 0.00 2.60 2.04 -0.92 -2.50 117.51 119.59 1uwq h ILE 250 Ca 0.07 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.05 1uwq h ILE 250 Cb 0.49 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1uwq h ILE 250 CO -0.25 0.33 0.00 0.11 0.00 0.00 0.00 178.15 178.34 1uwq h LYS 251 N 0.82 0.00 0.00 2.37 1.79 -0.78 0.15 116.57 120.92 1uwq h LYS 251 Ca 0.18 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1uwq h LYS 251 Cb 0.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.98 1uwq h LYS 251 CO 0.00 0.00 0.00 0.66 -1.08 0.00 0.00 179.45 179.03 1uwq h SER 252 N 0.00 0.00 0.00 0.86 4.64 -0.75 -3.29 113.55 115.01 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 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1uwq h SER 252 CO 0.00 0.00 0.00 0.52 -0.87 0.00 0.00 176.83 176.48 1uwq n VAL 253 N -2.89 0.00 -3.77 0.95 0.31 -0.36 -5.06 118.33 107.51 1uwq n VAL 253 Ca 0.03 -0.48 -0.13 0.00 -0.01 0.00 0.00 64.34 63.75 1uwq n VAL 253 Cb 0.42 1.01 -0.09 0.00 -0.91 0.00 0.00 33.84 34.27 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 -0.62 -0.20 0.00 4.52 0.15 0.40 -4.87 113.70 113.08 1uwq s SER 254 Ca 0.00 0.19 0.24 0.00 0.70 0.00 0.00 55.95 57.09 1uwq s SER 254 Cb 0.00 0.38 0.36 0.00 -1.71 0.00 0.00 66.02 65.05 1uwq s SER 254 CO 0.00 -0.35 1.32 0.29 1.20 0.00 0.00 173.24 175.70 1uwq n LYS 255 N 1.72 0.99 -1.62 5.44 4.76 -1.26 -4.23 118.16 123.96 1uwq n LYS 255 Ca -0.19 -0.72 -0.31 0.00 -2.87 0.00 0.00 58.31 54.21 1uwq n LYS 255 Cb 0.56 -1.49 0.05 0.00 -1.84 0.00 0.00 35.03 32.32 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 -2.51 2.95 0.32 1.97 1.02 -1.26 -4.98 119.74 117.25 1uwq s LYS 256 Ca 0.21 1.01 -0.29 0.00 0.02 0.00 0.00 55.97 56.92 1uwq s LYS 256 Cb 0.19 -1.99 -0.11 0.00 -0.52 0.00 0.00 37.83 35.40 1uwq s LYS 256 CO 0.56 -1.09 1.50 -2.14 -0.92 0.00 0.00 175.35 173.26 1uwq s PRO 257 N -4.87 4.16 -0.14 -1.68 0.02 -1.26 -4.86 135.00 126.36 1uwq s PRO 257 Ca 0.59 2.51 0.01 0.00 0.02 0.00 0.00 61.00 64.13 1uwq s PRO 257 Cb -0.15 -3.02 0.02 0.00 0.02 0.00 0.00 34.50 31.38 1uwq s PRO 257 CO 0.52 -0.52 -0.16 0.08 -0.33 0.00 0.00 177.00 176.59 1uwq s VAL 258 N -0.56 1.66 0.00 3.83 1.01 -1.26 -0.77 120.40 124.32 1uwq s VAL 258 Ca 0.57 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1uwq s VAL 258 Cb -0.46 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1uwq s VAL 258 CO 0.54 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.72 1uwq n GLY 259 N 4.54 6.61 3.22 4.51 0.00 0.66 -0.94 105.19 123.80 1uwq n GLY 259 Ca -0.18 -1.76 -0.12 0.00 0.00 0.00 0.00 46.02 43.96 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 0.44 0.08 -0.12 -0.61 2.07 -1.17 -1.07 121.20 120.82 1uwq s ILE 260 Ca 0.00 -0.68 0.03 0.00 -1.41 0.00 0.00 60.65 58.58 1uwq s ILE 260 Cb 0.00 -0.82 0.00 0.00 0.13 0.00 0.00 42.46 41.77 1uwq s ILE 260 CO 0.00 -0.38 -0.21 -0.63 -1.91 0.00 0.00 174.94 171.81 1uwq s ILE 261 N -2.18 2.22 0.06 2.00 1.01 -0.59 0.19 121.20 123.91 1uwq s ILE 261 Ca -0.08 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 59.68 1uwq s ILE 261 Cb -0.02 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 1uwq s ILE 261 CO -0.01 0.55 -0.16 -0.47 0.00 0.00 0.00 174.94 174.85 1uwq s TYR 262 N 0.53 1.38 -0.37 3.97 5.04 -0.61 0.61 117.35 127.91 1uwq s TYR 262 Ca -0.13 -0.40 -0.26 0.00 -2.44 0.00 0.00 57.07 53.83 1uwq s TYR 262 Cb -0.17 -0.79 0.02 0.00 0.35 0.00 0.00 41.96 41.37 1uwq s TYR 262 CO 0.04 0.08 0.94 0.00 -1.34 0.00 0.00 175.55 175.27 1uwq s ALA 263 N -1.05 3.40 0.13 3.97 0.00 -1.26 -2.15 121.76 124.80 1uwq s ALA 263 Ca 0.02 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 51.61 1uwq s ALA 263 Cb -0.09 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.44 1uwq s ALA 263 CO 0.02 -1.62 -0.03 -0.80 0.00 0.00 0.00 175.76 173.34 1uwq s ASN 264 N 1.88 4.76 0.10 0.00 0.01 -0.50 -4.99 114.94 116.21 1uwq s ASN 264 Ca 0.39 -0.32 0.06 0.00 -0.71 0.00 0.00 52.86 52.27 1uwq s ASN 264 Cb -0.12 -1.03 -0.03 0.00 0.41 0.00 0.00 41.25 40.48 1uwq s ASN 264 CO 0.19 0.14 -0.14 -0.55 -1.51 0.00 0.00 177.10 175.23 1uwq s SER 265 N -2.56 1.87 -0.32 -1.22 0.15 -1.26 -4.31 113.70 106.05 1uwq s SER 265 Ca 0.25 -0.74 -0.19 0.00 0.70 0.00 0.00 55.95 55.97 1uwq s SER 265 Cb -0.10 -0.06 -0.01 0.00 -1.71 0.00 0.00 66.02 64.14 1uwq s SER 265 CO 0.17 -0.12 0.55 -0.55 1.20 0.00 0.00 173.24 174.49 1uwq s SER 266 N -2.20 6.39 -0.13 5.45 0.15 -1.19 -4.88 113.70 117.29 1uwq s SER 266 Ca 0.05 0.22 -0.23 0.00 0.70 0.00 0.00 55.95 56.69 1uwq s SER 266 Cb -0.07 -2.29 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 1uwq s SER 266 CO 0.03 -0.44 0.71 -0.36 1.20 0.00 0.00 173.24 174.38 1uwq s PHE 267 N 2.45 3.48 0.01 3.44 0.08 -1.26 -0.55 117.98 125.62 1uwq s PHE 267 Ca 0.21 1.15 0.05 0.00 0.12 0.00 0.00 56.93 58.46 1uwq s PHE 267 Cb -0.15 -2.85 -0.02 0.00 -0.57 0.00 0.00 43.02 39.43 1uwq s PHE 267 CO 0.12 -0.07 -0.15 -0.65 -0.10 0.00 0.00 175.22 174.36 1uwq s GLN 268 N 1.47 1.18 0.06 0.44 -1.52 -0.37 -4.95 119.66 115.97 1uwq s GLN 268 Ca 0.35 -0.63 -0.30 0.00 -1.95 0.00 0.00 55.36 52.83 1uwq s GLN 268 Cb -0.17 -1.16 -0.05 0.00 -0.22 0.00 0.00 33.01 31.41 1uwq s GLN 268 CO 0.14 0.31 1.04 -1.25 -0.25 0.00 0.00 175.29 175.29 1uwq s PRO 269 N -0.61 4.56 0.10 2.91 0.04 -1.26 -0.73 135.00 140.01 1uwq s PRO 269 Ca 0.05 1.55 -0.25 0.00 0.04 0.00 0.00 61.00 62.39 1uwq s PRO 269 Cb -0.07 -3.39 -0.11 0.00 0.04 0.00 0.00 34.50 30.97 1uwq s PRO 269 CO 0.00 -0.03 1.68 1.25 0.04 0.00 0.00 177.00 179.95 1uwq h LEU 270 N 6.32 -0.38 -9.45 -3.56 5.85 -1.61 -3.45 115.31 109.03 1uwq h LEU 270 Ca -0.42 0.04 -0.55 0.00 0.84 0.00 0.00 57.88 57.79 1uwq h LEU 270 Cb 1.22 0.14 -0.13 0.00 0.37 0.00 0.00 40.66 42.25 1uwq h LEU 270 CO 0.75 -0.21 -0.60 0.42 -0.34 0.00 0.00 178.44 178.47 1uwq s THR 271 N -6.14 1.53 -1.32 1.05 -4.23 -1.26 -5.03 115.64 100.25 1uwq s THR 271 Ca -0.15 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.46 1uwq s THR 271 Cb 0.07 -2.85 0.15 0.00 1.34 0.00 0.00 72.50 71.21 1uwq s THR 271 CO 0.66 0.00 1.24 -0.90 -0.54 0.00 0.00 174.62 175.08 1uwq n ASP 272 N -0.85 0.00 -1.04 3.99 5.68 -1.26 -2.13 116.55 120.94 1uwq n ASP 272 Ca -0.04 0.23 0.06 0.00 -0.50 0.00 0.00 54.79 54.55 1uwq n ASP 272 Cb 0.67 -0.34 0.22 0.00 -1.14 0.00 0.00 41.12 40.53 1uwq n ASP 272 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1uwq n LYS 273 N -1.34 2.57 -0.11 0.11 0.00 -1.26 -4.33 118.16 113.81 1uwq n LYS 273 Ca 0.04 -1.76 0.07 0.00 -0.00 0.00 0.00 58.31 56.65 1uwq n LYS 273 Cb 0.09 -1.59 0.12 0.00 -0.00 0.00 0.00 35.03 33.65 1uwq n LYS 273 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1uwq n ASP 274 N 0.67 2.49 -0.23 -5.58 8.00 -0.91 -4.74 116.55 116.26 1uwq n ASP 274 Ca 0.16 -2.70 -0.01 0.00 0.71 0.00 0.00 54.79 52.95 1uwq n ASP 274 Cb 0.56 -0.31 0.20 0.00 -0.02 0.00 0.00 41.12 41.54 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 0.38 1.03 -0.46 -1.24 2.86 -1.79 -1.83 114.93 113.87 1uwq h MET 275 Ca 0.00 -0.10 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 1uwq h MET 275 Cb 0.90 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 1uwq h MET 275 CO 0.03 0.74 -0.14 1.49 1.06 0.00 0.00 176.91 180.09 1uwq h GLU 276 N 1.05 0.87 -0.66 1.72 4.81 -1.95 -2.71 114.58 117.71 1uwq h GLU 276 Ca 0.27 -0.32 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 1uwq h GLU 276 Cb -0.01 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1uwq h GLU 276 CO -0.05 0.95 0.43 0.00 -0.73 0.00 0.00 179.01 179.62 1uwq h ALA 277 N 1.06 1.56 -0.31 2.92 0.00 -1.69 -0.68 119.26 122.13 1uwq h ALA 277 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uwq h ALA 277 Cb 0.66 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1uwq h ALA 277 CO 0.05 0.40 0.18 0.28 0.00 0.00 0.00 179.25 180.16 1uwq h VAL 278 N 0.86 1.11 -0.41 0.00 2.07 -1.16 -1.05 116.25 117.68 1uwq h VAL 278 Ca 0.25 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1uwq h VAL 278 Cb -0.06 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1uwq h VAL 278 CO -0.06 0.11 0.23 -0.33 0.02 0.00 0.00 177.57 177.55 1uwq h GLU 279 N 0.39 0.56 -0.80 1.57 5.08 -1.09 0.12 114.58 120.40 1uwq h GLU 279 Ca 0.11 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1uwq h GLU 279 Cb 0.02 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1uwq h GLU 279 CO -0.02 0.44 0.53 0.52 -1.00 0.00 0.00 179.01 179.48 1uwq h MET 280 N 0.53 1.06 -0.58 2.33 2.86 -1.05 0.26 114.93 120.34 1uwq h MET 280 Ca 0.14 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1uwq h MET 280 Cb 0.03 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.43 1uwq h MET 280 CO -0.02 0.70 0.31 0.00 1.06 0.00 0.00 176.91 178.96 1uwq h ALA 281 N 1.30 0.74 -0.80 6.32 0.00 -0.73 -0.54 119.26 125.55 1uwq h ALA 281 Ca 0.30 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1uwq h ALA 281 Cb -0.12 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.40 1uwq h ALA 281 CO -0.07 0.26 0.32 0.93 0.00 0.00 0.00 179.25 180.70 1uwq h GLU 282 N 0.78 1.20 0.08 0.00 5.08 -0.20 -1.01 114.58 120.51 1uwq h GLU 282 Ca 0.20 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1uwq h GLU 282 Cb 0.06 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1uwq h GLU 282 CO -0.03 0.97 -0.11 -0.91 -1.00 0.00 0.00 179.01 177.92 1uwq h ASN 283 N 1.17 -0.31 0.85 1.42 2.35 -0.69 -0.89 115.58 119.48 1uwq h ASN 283 Ca 0.27 0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.99 1uwq h ASN 283 Cb 0.22 0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 1uwq h ASN 283 CO -0.02 -0.17 -0.31 0.44 -1.65 0.00 0.00 177.43 175.72 1uwq h ASP 284 N -0.23 0.00 0.00 5.81 3.32 -0.85 -1.94 116.42 122.53 1uwq h ASP 284 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1uwq h ASP 284 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1uwq h ASP 284 CO -0.06 0.31 -0.83 0.59 -1.72 0.00 0.00 179.24 177.54 1uwq n ASN 285 N -3.50 1.37 0.09 6.45 3.02 -0.40 -4.87 115.26 117.42 1uwq n ASN 285 Ca -0.00 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 1uwq n ASN 285 Cb 0.47 1.17 0.00 0.00 -0.61 0.00 0.00 39.78 40.81 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 -1.46 0.00 -0.12 3.52 0.63 -0.44 -4.89 116.66 113.90 1uwq n ARG 286 Ca 0.00 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.86 1uwq n ARG 286 Cb 0.18 -0.08 0.09 0.00 0.45 0.00 0.00 32.46 33.10 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 0.95 -0.87 -0.14 -0.00 -1.33 -2.06 115.95 112.50 1uwq h TRP 287 Ca 0.00 -0.18 0.09 0.00 -0.00 0.00 0.00 58.89 58.79 1uwq h TRP 287 Cb 0.00 -0.24 -0.07 0.00 -0.00 0.00 0.00 29.16 28.85 1uwq h TRP 287 CO 0.00 0.92 0.52 0.11 -0.00 0.00 0.00 178.44 179.99 1uwq h TRP 288 N 0.77 0.95 -0.03 0.49 5.08 -1.59 0.26 115.95 121.88 1uwq h TRP 288 Ca 0.13 0.03 -0.04 0.00 1.08 0.00 0.00 58.89 60.08 1uwq h TRP 288 Cb 0.62 -0.30 0.00 0.00 -3.00 0.00 0.00 29.16 26.49 1uwq h TRP 288 CO 0.04 0.42 -0.14 0.35 -1.28 0.00 0.00 178.44 177.82 1uwq h PHE 289 N 0.89 0.21 -0.03 0.12 3.04 -1.69 -2.87 116.94 116.61 1uwq h PHE 289 Ca 0.41 -0.09 -0.15 0.00 3.98 0.00 0.00 57.97 62.12 1uwq h PHE 289 Cb 0.31 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 38.78 1uwq h PHE 289 CO -0.04 0.78 -0.66 0.74 -2.02 0.00 0.00 178.31 177.11 1uwq h PHE 290 N -0.42 0.16 -0.61 0.41 -1.00 -1.19 -2.76 116.94 111.52 1uwq h PHE 290 Ca -0.01 -0.07 -0.00 0.00 2.81 0.00 0.00 57.97 60.70 1uwq h PHE 290 Cb 0.80 -0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.30 1uwq h PHE 290 CO 0.14 0.74 0.37 -0.44 -1.61 0.00 0.00 178.31 177.51 1uwq h ASP 291 N 0.08 0.73 0.55 2.17 3.32 -0.57 -0.26 116.42 122.45 1uwq h ASP 291 Ca -0.01 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 1uwq h ASP 291 Cb 1.19 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.55 1uwq h ASP 291 CO 0.09 0.57 -0.31 0.00 -1.72 0.00 0.00 179.24 177.87 1uwq h ALA 292 N 1.56 -0.81 0.00 3.45 0.00 -1.20 -0.07 119.26 122.19 1uwq h ALA 292 Ca 0.22 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1uwq h ALA 292 Cb -0.03 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1uwq h ALA 292 CO -0.04 -0.96 -0.28 0.44 0.00 0.00 0.00 179.25 178.41 1uwq n ILE 293 N -5.45 0.02 -0.10 0.00 -5.35 -1.10 -1.12 119.36 106.26 1uwq n ILE 293 Ca -0.12 -0.01 -0.19 0.00 -0.27 0.00 0.00 62.75 62.16 1uwq n ILE 293 Cb 0.34 -0.10 -0.08 0.00 -1.74 0.00 0.00 39.64 38.06 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 -1.53 1.12 0.54 7.28 5.41 -0.12 -1.44 119.36 130.62 1uwq n ILE 294 Ca 0.06 -0.34 0.07 0.00 1.00 0.00 0.00 62.75 63.55 1uwq n ILE 294 Cb 0.34 -1.56 0.07 0.00 -0.71 0.00 0.00 39.64 37.78 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 -3.60 1.17 -0.89 0.38 1.74 -0.13 -0.33 116.66 114.99 1uwq n ARG 295 Ca -0.38 -1.44 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 1uwq n ARG 295 Cb 0.81 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 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 0.82 0.32 3.65 -0.13 0.00 -0.28 -4.75 105.19 104.83 1uwq n GLY 296 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.86 4.20 0.11 1.61 2.02 -0.90 -0.86 118.70 124.02 1uwq s GLU 297 Ca 0.00 1.22 -0.09 0.00 0.02 0.00 0.00 54.97 56.12 1uwq s GLU 297 Cb 0.00 -3.66 -0.00 0.00 0.10 0.00 0.00 34.13 30.57 1uwq s GLU 297 CO 0.00 -0.67 0.23 -1.50 0.02 0.00 0.00 175.26 173.34 1uwq s ILE 298 N 3.23 0.12 -0.16 -1.63 2.07 -0.59 -2.43 121.20 121.81 1uwq s ILE 298 Ca 0.43 -1.17 -0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1uwq s ILE 298 Cb -0.14 -1.44 -0.01 0.00 0.13 0.00 0.00 42.46 41.00 1uwq s ILE 298 CO 0.08 -0.55 -0.13 -0.89 -1.91 0.00 0.00 174.94 171.55 1uwq s THR 299 N -3.88 2.90 -0.01 4.00 2.01 -1.26 -0.43 115.64 118.98 1uwq s THR 299 Ca 0.07 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 61.41 1uwq s THR 299 Cb 0.04 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.27 1uwq s THR 299 CO -0.09 0.50 0.06 -1.14 -0.69 0.00 0.00 174.62 173.27 1uwq n ARG 300 N 3.99 0.17 -1.32 4.92 0.63 -1.26 -5.01 116.66 118.78 1uwq n ARG 300 Ca -0.19 -0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.72 1uwq n ARG 300 Cb 0.52 -1.06 0.00 0.00 0.45 0.00 0.00 32.46 32.37 1uwq n ARG 300 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1uwq n GLU 303 N -1.59 -2.14 -3.66 -0.14 -0.58 -1.26 -5.08 120.64 106.19 1uwq n GLU 303 Ca -0.01 1.61 -0.39 0.00 -0.42 0.00 0.00 57.16 57.96 1uwq n GLU 303 Cb 0.07 -2.14 -0.12 0.00 -0.57 0.00 0.00 31.44 28.69 1uwq n GLU 303 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1uwq s LYS 304 N -3.62 2.93 0.39 3.49 -0.14 -1.26 -5.00 119.74 116.53 1uwq s LYS 304 Ca 0.00 -0.99 0.03 0.00 -1.36 0.00 0.00 55.97 53.65 1uwq s LYS 304 Cb 0.00 -3.60 -0.04 0.00 -1.68 0.00 0.00 37.83 32.51 1uwq s LYS 304 CO 0.00 -0.60 0.10 0.96 -0.76 0.00 0.00 175.35 175.05 1uwq s ILE 305 N 1.53 0.83 -0.21 2.17 -4.36 0.43 -4.97 121.20 116.63 1uwq s ILE 305 Ca 0.02 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.39 1uwq s ILE 305 Cb -0.18 -2.48 0.01 0.00 1.25 0.00 0.00 42.46 41.05 1uwq s ILE 305 CO 0.05 0.00 -0.10 -0.69 0.24 0.00 0.00 174.94 174.44 1uwq s VAL 306 N -3.22 2.84 -0.27 8.37 1.01 -1.26 -1.55 120.40 126.32 1uwq s VAL 306 Ca 0.27 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 1uwq s VAL 306 Cb 0.05 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1uwq s VAL 306 CO 0.14 0.43 0.13 -0.13 0.00 0.00 0.00 175.10 175.67 1uwq s ARG 307 N 1.39 3.76 0.39 2.72 0.52 -0.04 -4.97 118.95 122.72 1uwq s ARG 307 Ca 0.05 -0.43 0.16 0.00 -0.52 0.00 0.00 55.73 54.99 1uwq s ARG 307 Cb -0.14 -3.50 0.79 0.00 0.52 0.00 0.00 34.95 32.62 1uwq s ARG 307 CO -0.07 -0.21 1.82 -0.44 0.02 0.00 0.00 175.30 176.42 1uwq h ASP 308 N 8.31 0.00 0.87 0.23 3.32 -1.95 -2.09 116.42 125.10 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 0.36 0.00 -0.90 -1.72 0.00 0.00 179.24 177.54 1uwq n ASP 309 N -3.85 0.25 -0.10 6.45 5.75 -1.26 -3.50 116.55 120.29 1uwq n ASP 309 Ca -0.01 0.54 -0.14 0.00 -0.01 0.00 0.00 54.79 55.17 1uwq n ASP 309 Cb 0.42 -0.60 -0.14 0.00 -1.03 0.00 0.00 41.12 39.77 1uwq n ASP 309 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1uwq n LEU 310 N -1.76 1.40 -4.69 -2.12 4.77 -0.85 -4.84 117.00 108.91 1uwq n LEU 310 Ca 0.05 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.59 1uwq n LEU 310 Cb 0.28 -0.18 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1uwq n LEU 310 CO 0.22 0.69 0.92 1.17 -1.33 0.00 0.00 177.39 179.05 1uwq n LYS 311 N -3.02 2.08 -1.48 3.23 4.81 -0.85 -3.10 118.16 119.83 1uwq n LYS 311 Ca -0.37 0.73 -0.15 0.00 -0.87 0.00 0.00 58.31 57.65 1uwq n LYS 311 Cb 1.08 -2.33 -0.06 0.00 0.02 0.00 0.00 35.03 33.74 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 1.16 1.45 2.52 3.14 0.00 0.55 -4.89 105.19 109.12 1uwq n GLY 312 Ca 0.07 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.56 3.35 -3.62 1.61 3.00 -0.52 -4.85 116.66 113.07 1uwq n ARG 313 Ca -0.15 -2.93 -0.04 0.00 -0.01 0.00 0.00 57.85 54.72 1uwq n ARG 313 Cb 0.50 -2.34 -0.06 0.00 0.00 0.00 0.00 32.46 30.56 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 -2.40 -0.77 -0.17 0.55 2.96 -1.26 -4.86 118.68 112.74 1uwq s LEU 314 Ca 0.56 1.19 0.17 0.00 -0.22 0.00 0.00 54.13 55.83 1uwq s LEU 314 Cb 0.31 2.07 -0.25 0.00 0.50 0.00 0.00 46.19 48.83 1uwq s LEU 314 CO -0.19 -0.18 0.19 0.47 -1.32 0.00 0.00 176.35 175.31 1uwq n ASP 315 N 4.24 0.20 -3.55 3.68 8.00 -0.11 -5.04 116.55 123.96 1uwq n ASP 315 Ca -0.18 0.08 -0.13 0.00 0.71 0.00 0.00 54.79 55.27 1uwq n ASP 315 Cb 0.57 0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 42.40 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 -2.51 -0.41 -0.17 1.24 1.48 -1.25 -4.42 118.94 112.90 1uwq s TRP 316 Ca -0.09 0.35 -0.02 0.00 -1.06 0.00 0.00 56.10 55.28 1uwq s TRP 316 Cb 0.06 0.37 -0.01 0.00 -1.16 0.00 0.00 33.47 32.73 1uwq s TRP 316 CO 0.83 -0.69 -0.09 0.42 -4.06 0.00 0.00 176.95 173.35 1uwq s ILE 317 N -2.91 3.19 -0.35 0.66 1.01 -0.73 -3.05 121.20 119.03 1uwq s ILE 317 Ca -0.03 -0.59 -0.18 0.00 0.00 0.00 0.00 60.65 59.86 1uwq s ILE 317 Cb -0.00 -2.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.07 1uwq s ILE 317 CO -0.05 0.48 0.51 -0.83 0.00 0.00 0.00 174.94 175.05 1uwq s GLY 318 N 0.86 1.82 -0.34 6.18 0.00 0.13 -2.12 107.32 113.85 1uwq s GLY 318 Ca -0.03 -1.00 -0.16 0.00 0.00 0.00 0.00 44.72 43.53 1uwq s GLY 318 CO 0.01 1.26 0.41 0.14 0.00 0.00 0.00 173.10 174.92 1uwq s VAL 319 N 2.38 5.12 -0.23 1.40 1.01 0.03 -1.57 120.40 128.54 1uwq s VAL 319 Ca 0.19 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.24 1uwq s VAL 319 Cb -0.15 -3.86 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 1uwq s VAL 319 CO 0.13 -0.11 0.17 0.20 0.00 0.00 0.00 175.10 175.49 1uwq s ASN 320 N 1.73 6.14 -0.01 3.32 0.01 -0.92 -0.52 114.94 124.70 1uwq s ASN 320 Ca 0.14 0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.44 1uwq s ASN 320 Cb -0.16 -2.11 0.02 0.00 0.41 0.00 0.00 41.25 39.41 1uwq s ASN 320 CO 0.12 0.07 0.01 -0.47 -1.51 0.00 0.00 177.10 175.32 1uwq s TYR 321 N 0.99 0.05 0.00 2.20 5.04 -0.04 -1.41 117.35 124.19 1uwq s TYR 321 Ca 0.08 0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.77 1uwq s TYR 321 Cb -0.13 -0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.01 1uwq s TYR 321 CO 0.04 -0.06 0.00 0.66 -1.34 0.00 0.00 175.55 174.85 1uwq n TYR 322 N 3.72 0.00 -3.84 4.97 4.01 -1.26 -4.09 117.16 120.68 1uwq n TYR 322 Ca -0.21 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.48 1uwq n TYR 322 Cb 0.54 0.01 0.01 0.00 -0.31 0.00 0.00 39.34 39.59 1uwq n TYR 322 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1uwq s THR 323 N -1.78 0.00 0.68 -0.72 -1.32 -1.26 -4.70 115.64 106.54 1uwq s THR 323 Ca 0.00 -0.70 -0.03 0.00 -1.21 0.00 0.00 61.69 59.76 1uwq s THR 323 Cb 0.00 -2.68 0.09 0.00 -1.51 0.00 0.00 72.50 68.40 1uwq s THR 323 CO 0.00 0.00 0.96 0.00 -2.21 0.00 0.00 174.62 173.37 1uwq s ARG 324 N -2.47 1.97 -0.06 7.08 1.70 -1.26 -3.14 118.95 122.77 1uwq s ARG 324 Ca 0.18 -0.77 -0.01 0.00 -0.47 0.00 0.00 55.73 54.67 1uwq s ARG 324 Cb -0.03 -2.30 0.03 0.00 -0.57 0.00 0.00 34.95 32.07 1uwq s ARG 324 CO 0.06 -1.25 -0.01 0.99 -1.08 0.00 0.00 175.30 174.01 1uwq s THR 325 N -3.11 0.37 -0.09 4.99 2.01 0.29 -3.75 115.64 116.35 1uwq s THR 325 Ca 0.63 0.08 -0.18 0.00 0.31 0.00 0.00 61.69 62.52 1uwq s THR 325 Cb -0.08 -0.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.89 1uwq s THR 325 CO 0.43 0.24 0.50 -0.69 -0.69 0.00 0.00 174.62 174.41 1uwq s VAL 326 N 1.66 5.13 0.17 3.82 1.01 -1.26 -1.24 120.40 129.69 1uwq s VAL 326 Ca 0.00 1.01 0.10 0.00 0.00 0.00 0.00 61.98 63.08 1uwq s VAL 326 Cb -0.13 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 1uwq s VAL 326 CO -0.04 0.35 -0.21 0.68 0.00 0.00 0.00 175.10 175.88 1uwq s VAL 327 N 0.40 2.03 0.07 2.92 -7.23 0.09 -0.99 120.40 117.69 1uwq s VAL 327 Ca 0.27 -1.90 0.05 0.00 -1.81 0.00 0.00 61.98 58.58 1uwq s VAL 327 Cb -0.16 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.83 1uwq s VAL 327 CO 0.12 -0.18 -0.13 -1.59 -0.31 0.00 0.00 175.10 173.01 1uwq s LYS 328 N -2.59 0.78 0.28 4.82 -2.85 -0.32 -1.54 119.74 118.33 1uwq s LYS 328 Ca 0.16 -0.94 -0.30 0.00 -1.00 0.00 0.00 55.97 53.90 1uwq s LYS 328 Cb -0.07 -0.72 -0.10 0.00 -2.06 0.00 0.00 37.83 34.87 1uwq s LYS 328 CO 0.07 0.16 1.44 0.50 0.10 0.00 0.00 175.35 177.62 1uwq s ARG 329 N -1.79 4.25 0.38 1.78 3.00 -1.26 -1.30 118.95 124.01 1uwq s ARG 329 Ca -0.03 2.35 0.08 0.00 -1.00 0.00 0.00 55.73 57.14 1uwq s ARG 329 Cb -0.10 -3.07 -0.07 0.00 0.00 0.00 0.00 34.95 31.71 1uwq s ARG 329 CO 0.02 -0.42 -0.02 0.99 0.00 0.00 0.00 175.30 175.87 1uwq s THR 330 N -0.35 2.12 0.10 4.11 2.01 0.15 -4.83 115.64 118.94 1uwq s THR 330 Ca 0.57 -2.07 -0.24 0.00 0.31 0.00 0.00 61.69 60.26 1uwq s THR 330 Cb -0.43 -2.86 -0.13 0.00 0.01 0.00 0.00 72.50 69.09 1uwq s THR 330 CO 0.48 -0.08 1.70 1.05 -0.69 0.00 0.00 174.62 177.08 1uwq h GLU 331 N 1.85 -0.19 0.00 4.92 9.09 -2.00 -3.03 114.58 125.23 1uwq h GLU 331 Ca -0.43 0.01 -0.03 0.00 0.05 0.00 0.00 59.36 58.96 1uwq h GLU 331 Cb 1.24 0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 28.38 1uwq h GLU 331 CO 0.76 -0.13 -0.15 1.57 0.05 0.00 0.00 179.01 181.11 1uwq h LYS 332 N -0.20 0.00 0.00 1.06 5.09 -2.02 -3.48 116.57 117.02 1uwq h LYS 332 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.75 1uwq h LYS 332 Cb 0.19 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.52 1uwq h LYS 332 CO -0.03 0.15 0.00 0.41 -2.09 0.00 0.00 179.45 177.90 1uwq n GLY 333 N -0.09 -1.38 3.31 0.07 0.00 -1.14 -5.14 105.19 100.81 1uwq n GLY 333 Ca -0.00 0.54 -0.14 0.00 0.00 0.00 0.00 46.02 46.42 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 -0.28 0.11 1.61 1.13 -1.26 0.32 117.35 118.98 1uwq s TYR 334 Ca 0.00 0.36 0.07 0.00 -1.41 0.00 0.00 57.07 56.10 1uwq s TYR 334 Cb 0.00 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 41.01 1uwq s TYR 334 CO 0.00 -0.49 -0.18 0.14 -2.51 0.00 0.00 175.55 172.51 1uwq s VAL 335 N -1.78 1.53 0.25 -3.49 -7.23 -0.42 -4.85 120.40 104.42 1uwq s VAL 335 Ca -0.10 -1.57 -0.18 0.00 -1.81 0.00 0.00 61.98 58.32 1uwq s VAL 335 Cb -0.03 -1.48 -0.08 0.00 0.56 0.00 0.00 36.38 35.35 1uwq s VAL 335 CO 0.02 -0.19 0.73 -0.44 -0.31 0.00 0.00 175.10 174.92 1uwq s SER 336 N -2.06 6.98 -0.16 4.85 0.01 -1.26 -1.17 113.70 120.89 1uwq s SER 336 Ca 0.06 1.38 -0.05 0.00 1.31 0.00 0.00 55.95 58.65 1uwq s SER 336 Cb -0.09 -2.41 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1uwq s SER 336 CO 0.04 -0.04 0.02 -0.76 0.41 0.00 0.00 173.24 172.91 1uwq s LEU 337 N -2.29 3.60 0.70 2.44 1.43 -0.16 -4.97 118.68 119.43 1uwq s LEU 337 Ca 0.47 0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 53.44 1uwq s LEU 337 Cb -0.15 -1.88 0.02 0.00 0.03 0.00 0.00 46.19 44.21 1uwq s LEU 337 CO 0.20 0.21 1.16 -0.83 0.23 0.00 0.00 176.35 177.31 1uwq s GLY 338 N 0.16 2.25 0.00 -3.19 0.00 -1.26 -3.72 107.32 101.57 1uwq s GLY 338 Ca 0.02 0.72 0.00 0.00 0.00 0.00 0.00 44.72 45.46 1uwq s GLY 338 CO 0.01 1.10 0.00 0.61 0.00 0.00 0.00 173.10 174.82 1uwq n GLY 339 N -0.04 0.85 3.32 0.20 0.00 -0.20 -4.97 105.19 104.35 1uwq n GLY 339 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.57 1.54 0.00 1.61 2.02 -1.24 -0.85 117.35 117.85 1uwq s TYR 340 Ca 0.00 -1.02 0.00 0.00 -0.37 0.00 0.00 57.07 55.68 1uwq s TYR 340 Cb 0.00 -0.91 0.00 0.00 -0.40 0.00 0.00 41.96 40.65 1uwq s TYR 340 CO 0.00 -0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.24 1uwq n GLY 341 N -0.43 3.71 0.35 0.71 0.00 -1.26 -1.09 105.19 107.19 1uwq n GLY 341 Ca -0.04 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.20 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 0.02 -1.58 1.61 1.44 -1.25 -0.46 115.22 129.01 1uwq n HIS 342 Ca 0.00 -0.01 -0.33 0.00 -2.01 0.00 0.00 57.72 55.37 1uwq n HIS 342 Cb 0.00 0.00 0.06 0.00 0.12 0.00 0.00 29.99 30.17 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 1.11 5.97 3.87 -1.39 0.00 -0.25 -4.71 105.19 109.80 1uwq n GLY 343 Ca 0.20 -2.42 -0.21 0.00 0.00 0.00 0.00 46.02 43.59 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 3.90 0.29 0.00 2.02 -1.26 -4.53 118.70 114.99 1uwq s GLU 345 Ca 0.48 1.69 -0.29 0.00 0.02 0.00 0.00 54.97 56.86 1uwq s GLU 345 Cb -0.03 -2.46 -0.10 0.00 0.10 0.00 0.00 34.13 31.65 1uwq s GLU 345 CO 0.27 -0.41 1.32 1.03 0.02 0.00 0.00 175.26 177.49 1uwq s ARG 346 N -2.62 4.37 -1.16 1.61 0.52 -1.26 -3.95 118.95 116.46 1uwq s ARG 346 Ca 0.61 2.17 -0.18 0.00 -0.52 0.00 0.00 55.73 57.81 1uwq s ARG 346 Cb -0.26 -3.11 -0.01 0.00 0.52 0.00 0.00 34.95 32.09 1uwq s ARG 346 CO 0.32 -0.21 0.77 0.09 0.02 0.00 0.00 175.30 176.30 1uwq n ASN 347 N 1.42 -4.93 0.00 0.23 4.13 -0.38 -4.91 115.26 110.82 1uwq n ASN 347 Ca 0.02 -1.00 0.00 0.00 1.68 0.00 0.00 54.58 55.28 1uwq n ASN 347 Cb 0.42 -3.45 0.00 0.00 -1.54 0.00 0.00 39.78 35.21 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 -2.72 0.00 -4.28 6.41 2.88 -1.25 -4.44 113.62 110.21 1uwq n SER 348 Ca -0.11 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.20 1uwq n SER 348 Cb 0.60 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.94 1uwq n SER 348 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1uwq s VAL 349 N -0.76 1.67 0.98 2.46 -7.23 -1.26 -1.04 120.40 115.22 1uwq s VAL 349 Ca 0.00 -1.61 -0.15 0.00 -1.81 0.00 0.00 61.98 58.41 1uwq s VAL 349 Cb 0.00 -1.58 0.18 0.00 0.56 0.00 0.00 36.38 35.55 1uwq s VAL 349 CO 0.00 -0.14 1.18 -0.94 -0.31 0.00 0.00 175.10 174.88 1uwq s SER 350 N -2.08 2.90 0.65 4.85 1.04 0.10 -4.76 113.70 116.40 1uwq s SER 350 Ca 0.08 0.72 0.39 0.00 0.48 0.00 0.00 55.95 57.62 1uwq s SER 350 Cb -0.09 -1.10 2.17 0.00 0.10 0.00 0.00 66.02 67.11 1uwq s SER 350 CO 0.04 -2.91 2.27 -0.07 0.98 0.00 0.00 173.24 173.56 1uwq h LEU 351 N -1.75 0.00 -0.91 2.42 3.38 -1.33 0.21 115.31 117.33 1uwq h LEU 351 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1uwq h LEU 351 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1uwq h LEU 351 CO 0.51 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.04 1uwq n ALA 352 N -2.11 2.56 -0.89 1.53 0.00 -1.26 -4.94 120.51 115.41 1uwq n ALA 352 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1uwq n ALA 352 Cb 0.14 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 1.13 0.52 3.86 0.00 0.00 0.06 -5.04 105.19 105.73 1uwq n GLY 353 Ca 0.18 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 4.41 0.50 0.99 1.43 -1.26 -4.76 118.68 119.99 1uwq s LEU 354 Ca 0.00 0.70 -0.22 0.00 -1.03 0.00 0.00 54.13 53.58 1uwq s LEU 354 Cb 0.00 -2.50 -0.06 0.00 0.03 0.00 0.00 46.19 43.65 1uwq s LEU 354 CO 0.00 0.31 1.24 -2.16 0.23 0.00 0.00 176.35 175.97 1uwq s PRO 355 N -1.33 3.47 0.22 1.29 0.04 -1.26 0.00 135.00 137.43 1uwq s PRO 355 Ca 0.23 1.94 0.09 0.00 0.04 0.00 0.00 61.00 63.30 1uwq s PRO 355 Cb -0.14 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 1uwq s PRO 355 CO 0.12 -0.83 -0.05 0.95 0.04 0.00 0.00 177.00 177.22 1uwq s THR 356 N -1.46 3.33 0.82 1.26 -4.23 -0.21 -1.56 115.64 113.59 1uwq s THR 356 Ca 0.68 -1.77 -0.10 0.00 -1.18 0.00 0.00 61.69 59.31 1uwq s THR 356 Cb -0.33 -2.71 0.18 0.00 1.34 0.00 0.00 72.50 70.98 1uwq s THR 356 CO 0.39 -0.23 1.12 -1.54 -0.54 0.00 0.00 174.62 173.82 1uwq n SER 357 N -0.39 0.46 0.29 3.99 3.41 -0.63 -3.85 113.62 116.89 1uwq n SER 357 Ca -0.09 -1.64 0.18 0.00 -0.26 0.00 0.00 58.87 57.07 1uwq n SER 357 Cb 0.57 -0.82 0.94 0.00 -0.26 0.00 0.00 64.21 64.64 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 -1.26 0.00 0.05 4.04 3.32 -1.60 0.26 116.42 121.23 1uwq h ASP 358 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1uwq h ASP 358 Cb 1.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.65 1uwq h ASP 358 CO 0.29 0.00 -0.34 0.33 -1.72 0.00 0.00 179.24 177.81 1uwq n PHE 359 N -3.25 0.00 -2.07 4.55 -0.00 -1.26 -4.66 117.46 110.77 1uwq n PHE 359 Ca -0.01 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.39 1uwq n PHE 359 Cb 0.28 -0.03 -0.00 0.00 -0.00 0.00 0.00 39.48 39.73 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 1.38 0.18 3.69 7.13 0.00 -0.06 -4.77 105.19 112.74 1uwq n GLY 360 Ca 0.11 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.24 3.35 0.28 1.61 0.51 -1.26 -2.30 118.94 118.88 1uwq s TRP 361 Ca 0.00 0.23 -0.29 0.00 -2.12 0.00 0.00 56.10 53.92 1uwq s TRP 361 Cb 0.00 -2.15 -0.10 0.00 -0.81 0.00 0.00 33.47 30.42 1uwq s TRP 361 CO 0.00 0.22 1.24 -2.00 -0.51 0.00 0.00 176.95 175.89 1uwq s GLU 362 N 0.45 4.46 -0.26 4.98 2.12 0.39 -1.61 118.70 129.24 1uwq s GLU 362 Ca 0.06 2.03 -0.29 0.00 0.36 0.00 0.00 54.97 57.13 1uwq s GLU 362 Cb -0.12 -3.15 -0.01 0.00 0.26 0.00 0.00 34.13 31.11 1uwq s GLU 362 CO -0.01 -0.07 1.46 0.12 -0.54 0.00 0.00 175.26 176.23 1uwq s PHE 363 N -0.80 2.38 -0.46 5.30 2.19 -0.60 -4.61 117.98 121.38 1uwq s PHE 363 Ca 0.49 0.70 0.07 0.00 0.33 0.00 0.00 56.93 58.52 1uwq s PHE 363 Cb -0.36 -3.94 0.25 0.00 -1.31 0.00 0.00 43.02 37.66 1uwq s PHE 363 CO 0.45 -2.35 0.82 0.34 1.83 0.00 0.00 175.22 176.31 1uwq n PHE 364 N 8.03 -2.52 0.27 10.12 7.35 -1.26 -4.82 117.46 134.63 1uwq n PHE 364 Ca 0.17 -2.27 0.13 0.00 -0.76 0.00 0.00 57.45 54.72 1uwq n PHE 364 Cb 0.46 1.07 0.75 0.00 0.35 0.00 0.00 39.48 42.12 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 3.87 0.00 -0.42 -7.13 0.13 -1.92 -2.49 132.00 124.05 1uwq h PRO 365 Ca -0.09 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.09 1uwq h PRO 365 Cb 1.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1uwq h PRO 365 CO 0.35 0.10 0.28 0.93 -0.23 0.00 0.00 178.00 179.43 1uwq h GLU 366 N 0.00 0.37 -0.61 0.86 3.07 -1.95 -1.86 114.58 114.46 1uwq h GLU 366 Ca -0.00 -0.02 0.18 0.00 -0.50 0.00 0.00 59.36 59.01 1uwq h GLU 366 Cb 0.28 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.08 1uwq h GLU 366 CO 0.01 0.25 0.45 0.78 -1.40 0.00 0.00 179.01 179.09 1uwq h GLY 367 N 0.38 0.00 1.24 -3.84 0.00 -1.84 -1.33 103.07 97.68 1uwq h GLY 367 Ca 0.18 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.32 1uwq h GLY 367 CO -0.04 0.00 -0.58 -2.00 0.00 0.00 0.00 176.54 173.91 1uwq h LEU 368 N 0.00 0.89 -0.58 3.11 5.85 -1.53 -0.25 115.31 122.80 1uwq h LEU 368 Ca 0.29 -0.49 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 1uwq h LEU 368 Cb 1.18 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1uwq h LEU 368 CO -0.00 1.28 0.24 0.22 -0.34 0.00 0.00 178.44 179.83 1uwq h TYR 369 N 0.60 0.87 -0.11 1.25 3.20 -1.40 -0.88 116.97 120.49 1uwq h TYR 369 Ca 0.00 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1uwq h TYR 369 Cb 1.18 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.19 1uwq h TYR 369 CO 0.07 0.70 0.08 0.22 -1.64 0.00 0.00 178.16 177.58 1uwq h ASP 370 N 0.79 0.13 -0.11 -2.11 3.58 -1.09 -1.94 116.42 115.67 1uwq h ASP 370 Ca 0.19 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.61 1uwq h ASP 370 Cb 0.19 -0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 1uwq h ASP 370 CO -0.02 0.10 -0.01 0.58 -2.88 0.00 0.00 179.24 177.01 1uwq h VAL 371 N 0.15 1.27 -0.23 2.25 2.07 -0.79 -0.83 116.25 120.13 1uwq h VAL 371 Ca 0.04 -0.88 0.02 0.00 0.82 0.00 0.00 66.70 66.71 1uwq h VAL 371 Cb -0.01 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1uwq h VAL 371 CO -0.01 0.25 0.08 -0.07 0.02 0.00 0.00 177.57 177.84 1uwq h LEU 372 N -0.08 0.09 -0.57 2.57 3.38 -1.16 -2.00 115.31 117.54 1uwq h LEU 372 Ca 0.03 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 1uwq h LEU 372 Cb 0.39 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1uwq h LEU 372 CO 0.01 0.08 -0.45 0.71 0.09 0.00 0.00 178.44 178.88 1uwq h THR 373 N 0.19 1.30 -0.36 0.22 1.35 -1.31 -1.97 112.91 112.33 1uwq h THR 373 Ca 0.10 -1.64 0.01 0.00 -0.55 0.00 0.00 66.41 64.34 1uwq h THR 373 Cb 0.07 1.59 -0.02 0.00 -1.73 0.00 0.00 68.15 68.06 1uwq h THR 373 CO -0.10 0.52 0.21 0.11 -0.25 0.00 0.00 175.52 176.01 1uwq h LYS 374 N 0.51 0.42 -0.61 4.72 6.56 -0.98 -0.28 116.57 126.91 1uwq h LYS 374 Ca 0.03 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.59 1uwq h LYS 374 Cb 0.98 -0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 32.52 1uwq h LYS 374 CO 0.09 0.28 0.33 1.88 -2.06 0.00 0.00 179.45 179.97 1uwq h TYR 375 N 0.43 0.83 -0.28 -1.35 0.05 -1.31 -2.29 116.97 113.06 1uwq h TYR 375 Ca 0.14 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.88 1uwq h TYR 375 Cb 0.00 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.46 1uwq h TYR 375 CO -0.07 0.60 0.09 2.35 -1.05 0.00 0.00 178.16 180.08 1uwq h TRP 376 N 0.82 0.45 -0.03 4.88 2.91 -1.10 -1.58 115.95 122.30 1uwq h TRP 376 Ca 0.21 -0.04 -0.07 0.00 1.13 0.00 0.00 58.89 60.12 1uwq h TRP 376 Cb 0.04 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.55 1uwq h TRP 376 CO -0.01 0.47 -0.31 -0.91 -1.03 0.00 0.00 178.44 176.65 1uwq h ASN 377 N 0.30 0.05 0.16 2.65 2.35 -0.95 -0.77 115.58 119.36 1uwq h ASN 377 Ca 0.09 -0.01 -0.25 0.00 -0.55 0.00 0.00 56.30 55.58 1uwq h ASN 377 Cb 0.23 -0.01 0.02 0.00 0.05 0.00 0.00 38.32 38.61 1uwq h ASN 377 CO -0.00 0.36 -1.13 -0.09 -1.65 0.00 0.00 177.43 174.92 1uwq h ARG 378 N 0.04 0.35 0.00 0.81 2.43 -1.24 -3.43 114.38 113.35 1uwq h ARG 378 Ca 0.00 -0.60 -0.01 0.00 -0.81 0.00 0.00 59.98 58.56 1uwq h ARG 378 Cb 0.58 0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.35 1uwq h ARG 378 CO 0.04 1.29 -1.11 0.66 -1.51 0.00 0.00 179.97 179.34 1uwq n TYR 379 N -3.97 0.00 -3.21 2.20 4.01 -0.61 -5.03 117.16 110.56 1uwq n TYR 379 Ca -0.17 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.34 1uwq n TYR 379 Cb 0.91 -0.06 0.01 0.00 -0.31 0.00 0.00 39.34 39.89 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 -1.76 -1.86 -3.64 -0.72 8.25 -0.30 -4.99 115.22 110.20 1uwq n HIS 380 Ca -0.01 0.48 -0.37 0.00 -0.26 0.00 0.00 57.72 57.56 1uwq n HIS 380 Cb 0.24 -3.56 -0.06 0.00 1.12 0.00 0.00 29.99 27.73 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 -6.55 4.43 0.79 2.41 1.43 -1.26 -5.08 118.68 114.85 1uwq s LEU 381 Ca 0.35 0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 54.10 1uwq s LEU 381 Cb -0.18 -2.48 0.07 0.00 0.03 0.00 0.00 46.19 43.63 1uwq s LEU 381 CO 0.44 0.33 1.14 -0.72 0.23 0.00 0.00 176.35 177.77 1uwq s TYR 382 N -1.12 2.15 0.14 0.29 1.13 -1.26 -4.75 117.35 113.93 1uwq s TYR 382 Ca 0.22 1.64 0.05 0.00 -1.41 0.00 0.00 57.07 57.57 1uwq s TYR 382 Cb -0.15 -3.27 -0.04 0.00 -1.10 0.00 0.00 41.96 37.40 1uwq s TYR 382 CO 0.11 -2.31 -0.11 -1.64 -2.51 0.00 0.00 175.55 169.10 1uwq s MET 383 N -4.45 1.03 0.00 -3.49 -1.94 0.51 -1.77 119.30 109.19 1uwq s MET 383 Ca 0.67 -1.38 0.07 0.00 -1.71 0.00 0.00 55.69 53.34 1uwq s MET 383 Cb -0.22 -0.65 -0.02 0.00 2.01 0.00 0.00 34.83 35.94 1uwq s MET 383 CO 0.52 0.09 -0.22 0.71 -0.01 0.00 0.00 175.02 176.10 1uwq s TYR 384 N -3.03 2.00 -0.61 -0.03 2.02 -0.90 -0.63 117.35 116.16 1uwq s TYR 384 Ca 0.14 -0.38 -0.27 0.00 -0.37 0.00 0.00 57.07 56.19 1uwq s TYR 384 Cb 0.01 -1.26 0.03 0.00 -0.40 0.00 0.00 41.96 40.35 1uwq s TYR 384 CO 0.01 0.01 1.15 0.08 -1.57 0.00 0.00 175.55 175.23 1uwq s VAL 385 N -0.62 4.04 -0.42 0.71 1.01 -0.70 -0.79 120.40 123.63 1uwq s VAL 385 Ca 0.09 0.62 0.23 0.00 0.00 0.00 0.00 61.98 62.91 1uwq s VAL 385 Cb -0.09 -4.73 -0.01 0.00 0.00 0.00 0.00 36.38 31.55 1uwq s VAL 385 CO 0.00 -1.42 1.11 0.35 0.00 0.00 0.00 175.10 175.15 1uwq n THR 386 N 6.48 0.45 -3.73 3.92 -2.24 0.33 -0.25 114.28 119.23 1uwq n THR 386 Ca 0.05 -0.41 -0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1uwq n THR 386 Cb 0.49 -0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 68.44 1uwq n THR 386 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1uwq s GLU 387 N -3.28 0.47 -0.29 -0.78 2.02 -1.15 -4.51 118.70 111.18 1uwq s GLU 387 Ca 0.02 0.58 -0.16 0.00 0.02 0.00 0.00 54.97 55.43 1uwq s GLU 387 Cb 0.12 0.22 0.15 0.00 0.10 0.00 0.00 34.13 34.71 1uwq s GLU 387 CO 0.77 -0.06 0.96 1.21 0.02 0.00 0.00 175.26 178.16 1uwq s ASN 388 N 0.29 -0.54 0.00 -0.19 3.84 -1.23 -0.86 114.94 116.25 1uwq s ASN 388 Ca -0.01 0.85 0.00 0.00 0.21 0.00 0.00 52.86 53.91 1uwq s ASN 388 Cb -0.03 1.28 0.00 0.00 -0.55 0.00 0.00 41.25 41.95 1uwq s ASN 388 CO -0.00 -0.13 0.00 0.61 -2.79 0.00 0.00 177.10 174.79 1uwq n GLY 389 N 3.91 -1.24 3.23 1.21 0.00 -1.26 -0.70 105.19 110.35 1uwq n GLY 389 Ca -0.17 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.84 0.01 -0.43 -0.61 2.07 -1.26 -4.90 121.20 113.25 1uwq s ILE 390 Ca 0.00 -0.11 -0.29 0.00 -1.41 0.00 0.00 60.65 58.84 1uwq s ILE 390 Cb 0.00 -0.50 0.02 0.00 0.13 0.00 0.00 42.46 42.11 1uwq s ILE 390 CO 0.00 -0.06 1.17 0.00 -1.91 0.00 0.00 174.94 174.14 1uwq s ALA 391 N -0.17 3.22 -0.45 1.50 0.00 -1.26 -4.28 121.76 120.33 1uwq s ALA 391 Ca -0.03 -0.31 0.05 0.00 0.00 0.00 0.00 51.96 51.67 1uwq s ALA 391 Cb -0.03 -3.85 0.19 0.00 0.00 0.00 0.00 23.12 19.43 1uwq s ALA 391 CO 0.01 -2.09 0.74 0.34 0.00 0.00 0.00 175.76 174.76 1uwq s ASP 392 N 2.51 -1.32 0.23 0.00 2.15 -0.18 -1.43 116.67 118.63 1uwq s ASP 392 Ca 0.50 -1.11 -0.04 0.00 0.43 0.00 0.00 52.55 52.33 1uwq s ASP 392 Cb -0.10 1.71 0.24 0.00 -0.30 0.00 0.00 42.92 44.47 1uwq s ASP 392 CO 0.28 -0.10 1.68 -0.78 -0.17 0.00 0.00 175.17 176.08 1uwq h ASP 393 N 5.83 0.78 1.28 -0.34 3.58 -1.91 -2.87 116.42 122.76 1uwq h ASP 393 Ca 0.04 -0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.24 1uwq h ASP 393 Cb 1.15 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.99 1uwq h ASP 393 CO 0.03 0.93 -0.03 0.00 -2.88 0.00 0.00 179.24 177.29 1uwq h ALA 394 N 1.14 1.00 -0.87 -0.78 0.00 -1.95 -3.47 119.26 114.32 1uwq h ALA 394 Ca 0.11 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.75 1uwq h ALA 394 Cb 0.63 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 1uwq h ALA 394 CO 0.04 0.04 -0.24 -3.47 0.00 0.00 0.00 179.25 175.62 1uwq n ASP 395 N -3.13 -4.27 -0.04 0.00 2.03 -1.09 -4.95 116.55 105.11 1uwq n ASP 395 Ca 0.01 0.21 -0.12 0.00 0.52 0.00 0.00 54.79 55.42 1uwq n ASP 395 Cb 0.39 -2.99 -0.07 0.00 -0.72 0.00 0.00 41.12 37.72 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 0.23 0.00 -0.67 0.05 -1.91 -3.36 116.97 111.31 1uwq h TYR 396 Ca -0.25 -0.04 -0.26 0.00 0.05 0.00 0.00 58.73 58.22 1uwq h TYR 396 Cb 0.89 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.52 1uwq h TYR 396 CO 0.33 0.48 -1.88 1.04 -1.05 0.00 0.00 178.16 177.08 1uwq n GLN 397 N -4.78 0.65 -0.25 4.88 6.02 -1.26 -4.59 117.38 118.06 1uwq n GLN 397 Ca -0.06 0.14 0.04 0.00 -0.01 0.00 0.00 57.00 57.11 1uwq n GLN 397 Cb 0.22 -1.68 0.17 0.00 1.02 0.00 0.00 30.24 29.97 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 0.45 -0.72 -1.09 2.43 -1.93 0.19 114.38 113.71 1uwq h ARG 398 Ca -0.32 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 58.91 1uwq h ARG 398 Cb 1.90 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 31.28 1uwq h ARG 398 CO 0.05 0.30 0.38 -1.35 -1.51 0.00 0.00 179.97 177.83 1uwq h PRO 399 N 0.46 0.64 -0.27 0.20 0.11 -1.81 0.32 132.00 131.65 1uwq h PRO 399 Ca 0.39 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.39 1uwq h PRO 399 Cb 0.57 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1uwq h PRO 399 CO -0.38 0.42 -0.13 1.88 -0.21 0.00 0.00 178.00 179.59 1uwq h TYR 400 N 0.66 0.65 -0.04 0.65 -1.99 -1.49 -2.29 116.97 113.12 1uwq h TYR 400 Ca 0.35 -0.16 0.02 0.00 2.00 0.00 0.00 58.73 60.94 1uwq h TYR 400 Cb 0.33 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.88 1uwq h TYR 400 CO -0.09 0.81 -0.09 -0.92 -0.00 0.00 0.00 178.16 177.87 1uwq h TYR 401 N 0.31 -0.24 0.75 4.88 5.03 -0.08 -0.50 116.97 127.12 1uwq h TYR 401 Ca 0.06 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.35 1uwq h TYR 401 Cb 0.64 0.11 0.01 0.00 1.55 0.00 0.00 36.73 39.04 1uwq h TYR 401 CO 0.06 -0.15 -0.36 1.25 -1.32 0.00 0.00 178.16 177.64 1uwq h LEU 402 N -0.14 -0.86 -0.64 2.82 5.85 -0.43 -1.61 115.31 120.31 1uwq h LEU 402 Ca 0.05 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.82 1uwq h LEU 402 Cb 0.21 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1uwq h LEU 402 CO -0.13 -0.61 0.41 0.58 -0.34 0.00 0.00 178.44 178.35 1uwq h VAL 403 N -1.01 1.11 -0.69 1.05 2.07 -1.36 -1.77 116.25 115.64 1uwq h VAL 403 Ca -0.10 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 1uwq h VAL 403 Cb 0.78 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1uwq h VAL 403 CO 0.17 0.15 0.34 0.28 0.02 0.00 0.00 177.57 178.52 1uwq h SER 404 N 0.81 0.90 0.17 0.57 0.02 -1.01 -0.86 113.55 114.14 1uwq h SER 404 Ca 0.25 -0.13 -0.20 0.00 -0.84 0.00 0.00 61.79 60.87 1uwq h SER 404 Cb -0.02 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.29 1uwq h SER 404 CO -0.09 0.77 -0.76 0.45 -1.14 0.00 0.00 176.83 176.07 1uwq h HIS 405 N 0.96 0.67 -0.62 3.45 -0.00 -1.01 -2.09 115.15 116.51 1uwq h HIS 405 Ca 0.24 -0.30 -0.03 0.00 -0.00 0.00 0.00 60.37 60.27 1uwq h HIS 405 Cb 0.11 -0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 27.39 1uwq h HIS 405 CO 0.00 1.08 0.27 0.28 -0.00 0.00 0.00 177.93 179.56 1uwq h VAL 406 N 0.33 1.23 -0.67 2.45 2.07 -1.14 -1.81 116.25 118.71 1uwq h VAL 406 Ca -0.04 -0.68 0.06 0.00 0.82 0.00 0.00 66.70 66.86 1uwq h VAL 406 Cb 1.35 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.59 1uwq h VAL 406 CO 0.14 0.27 0.37 0.22 0.02 0.00 0.00 177.57 178.59 1uwq h TYR 407 N 0.86 0.68 -0.36 1.57 3.20 -0.97 -1.95 116.97 120.00 1uwq h TYR 407 Ca 0.21 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.09 1uwq h TYR 407 Cb 0.17 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 1uwq h TYR 407 CO 0.01 0.32 0.15 1.96 -1.64 0.00 0.00 178.16 178.95 1uwq h GLN 408 N 0.68 0.50 -0.39 1.82 1.08 -0.65 0.33 115.11 118.49 1uwq h GLN 408 Ca 0.30 -0.06 -0.05 0.00 -1.45 0.00 0.00 58.65 57.39 1uwq h GLN 408 Cb 0.19 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 1uwq h GLN 408 CO -0.19 0.42 0.04 0.28 -0.95 0.00 0.00 178.83 178.43 1uwq h VAL 409 N 0.50 1.25 -0.56 -0.54 2.07 -0.65 -0.82 116.25 117.50 1uwq h VAL 409 Ca 0.13 -0.91 0.09 0.00 0.82 0.00 0.00 66.70 66.82 1uwq h VAL 409 Cb 0.10 1.09 -0.07 0.00 -1.52 0.00 0.00 31.29 30.89 1uwq h VAL 409 CO -0.01 0.31 0.19 -0.74 0.02 0.00 0.00 177.57 177.34 1uwq h HIS 410 N 0.49 0.33 -0.58 1.57 -0.00 -0.73 -1.12 115.15 115.11 1uwq h HIS 410 Ca 0.12 0.03 0.07 0.00 -0.00 0.00 0.00 60.37 60.59 1uwq h HIS 410 Cb 0.40 -0.06 -0.06 0.00 -0.00 0.00 0.00 27.41 27.69 1uwq h HIS 410 CO 0.03 0.08 0.25 0.00 -0.00 0.00 0.00 177.93 178.29 1uwq h ARG 411 N 0.36 0.45 -0.26 5.26 2.47 -0.66 -0.09 114.38 121.93 1uwq h ARG 411 Ca 0.28 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.96 1uwq h ARG 411 Cb 0.34 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1uwq h ARG 411 CO -0.30 0.30 0.09 0.00 0.56 0.00 0.00 179.97 180.63 1uwq h ALA 412 N 1.36 0.34 -0.78 0.04 0.00 -0.31 -1.80 119.26 118.10 1uwq h ALA 412 Ca 0.28 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1uwq h ALA 412 Cb 0.28 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1uwq h ALA 412 CO -0.24 -0.05 0.47 0.82 0.00 0.00 0.00 179.25 180.24 1uwq h ILE 413 N 0.26 1.22 -0.51 0.00 2.04 -0.97 -2.00 117.51 117.56 1uwq h ILE 413 Ca 0.08 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1uwq h ILE 413 Cb 0.21 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.40 1uwq h ILE 413 CO -0.00 0.23 0.27 -1.13 0.00 0.00 0.00 178.15 177.52 1uwq h ASN 414 N 1.07 0.62 0.15 1.72 -0.73 -0.77 -0.45 115.58 117.19 1uwq h ASN 414 Ca 0.28 -0.04 0.00 0.00 1.87 0.00 0.00 56.30 58.41 1uwq h ASN 414 Cb -0.04 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 38.40 1uwq h ASN 414 CO -0.05 0.50 -0.00 -1.54 -0.37 0.00 0.00 177.43 175.97 1uwq n SER 415 N -4.40 0.06 0.00 1.15 3.41 -0.70 -4.91 113.62 108.23 1uwq n SER 415 Ca 0.04 -0.79 0.00 0.00 -0.26 0.00 0.00 58.87 57.86 1uwq n SER 415 Cb 0.10 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1uwq n SER 415 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwq n GLY 416 N 1.09 0.73 3.75 5.00 0.00 -0.18 -5.09 105.19 110.49 1uwq n GLY 416 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 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 3.54 -0.82 4.61 0.00 -0.80 -4.96 121.76 121.32 1uwq s ALA 417 Ca 0.00 1.20 -0.21 0.00 0.00 0.00 0.00 51.96 52.95 1uwq s ALA 417 Cb 0.00 -3.50 0.09 0.00 0.00 0.00 0.00 23.12 19.71 1uwq s ALA 417 CO 0.00 -0.61 1.12 0.34 0.00 0.00 0.00 175.76 176.62 1uwq s ASP 418 N 0.07 6.40 -0.10 0.00 -1.08 -1.26 -4.11 116.67 116.58 1uwq s ASP 418 Ca 0.55 -1.43 0.04 0.00 -0.52 0.00 0.00 52.55 51.19 1uwq s ASP 418 Cb -0.39 -2.44 0.00 0.00 -1.46 0.00 0.00 42.92 38.63 1uwq s ASP 418 CO 0.44 -1.33 -0.24 -0.69 0.52 0.00 0.00 175.17 173.87 1uwq s VAL 419 N 3.79 2.09 -0.58 1.11 1.01 -1.26 -0.36 120.40 126.20 1uwq s VAL 419 Ca 0.31 -1.01 0.06 0.00 0.00 0.00 0.00 61.98 61.34 1uwq s VAL 419 Cb -0.09 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.51 1uwq s VAL 419 CO -0.00 0.56 0.54 0.54 0.00 0.00 0.00 175.10 176.74 1uwq n ARG 420 N 3.55 1.51 -3.60 2.72 1.74 0.20 -4.95 116.66 117.83 1uwq n ARG 420 Ca -0.19 -0.58 -0.04 0.00 -0.77 0.00 0.00 57.85 56.27 1uwq n ARG 420 Cb 0.53 -1.00 -0.02 0.00 -1.02 0.00 0.00 32.46 30.96 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 -0.80 -0.34 -0.10 -0.13 0.00 -1.26 -2.09 107.32 102.61 1uwq s GLY 421 Ca 0.05 1.28 -0.01 0.00 0.00 0.00 0.00 44.72 46.04 1uwq s GLY 421 CO 0.12 0.40 -0.06 -0.47 0.00 0.00 0.00 173.10 173.09 1uwq s TYR 422 N -2.55 1.30 -0.26 1.90 6.14 -0.34 -1.72 117.35 121.83 1uwq s TYR 422 Ca 0.10 -0.61 0.00 0.00 0.64 0.00 0.00 57.07 57.20 1uwq s TYR 422 Cb 0.00 -1.13 0.04 0.00 0.42 0.00 0.00 41.96 41.29 1uwq s TYR 422 CO -0.05 -0.47 -0.07 -0.51 0.64 0.00 0.00 175.55 175.09 1uwq s LEU 423 N 1.76 3.38 0.26 6.97 1.02 0.65 -0.65 118.68 132.06 1uwq s LEU 423 Ca 0.05 -1.15 -0.30 0.00 0.02 0.00 0.00 54.13 52.75 1uwq s LEU 423 Cb -0.12 -1.62 -0.09 0.00 0.02 0.00 0.00 46.19 44.37 1uwq s LEU 423 CO -0.07 -0.17 1.12 -2.28 0.02 0.00 0.00 176.35 174.96 1uwq s HIS 424 N 1.22 3.54 -0.39 0.29 2.46 -0.33 -3.36 115.29 118.72 1uwq s HIS 424 Ca -0.04 1.64 -0.16 0.00 0.47 0.00 0.00 55.06 56.97 1uwq s HIS 424 Cb -0.18 -3.32 0.01 0.00 -0.13 0.00 0.00 32.58 28.96 1uwq s HIS 424 CO -0.04 -0.68 0.37 -0.46 -2.47 0.00 0.00 174.74 171.45 1uwq s TRP 425 N -0.89 3.20 0.32 3.88 -0.11 0.13 -2.16 118.94 123.31 1uwq s TRP 425 Ca 0.46 -0.34 0.06 0.00 1.22 0.00 0.00 56.10 57.50 1uwq s TRP 425 Cb -0.32 -2.72 -0.03 0.00 -1.50 0.00 0.00 33.47 28.90 1uwq s TRP 425 CO 0.40 -0.58 0.27 0.45 -4.62 0.00 0.00 176.95 172.87 1uwq s SER 426 N 1.75 1.53 0.13 5.86 0.15 -0.86 -4.04 113.70 118.22 1uwq s SER 426 Ca 0.09 -1.72 -0.17 0.00 0.70 0.00 0.00 55.95 54.85 1uwq s SER 426 Cb -0.17 0.55 -0.02 0.00 -1.71 0.00 0.00 66.02 64.66 1uwq s SER 426 CO 0.12 -1.05 1.74 0.25 1.20 0.00 0.00 173.24 175.49 1uwq h LEU 427 N 2.18 0.41 -8.51 3.45 5.85 -1.75 -0.48 115.31 116.46 1uwq h LEU 427 Ca -0.26 -0.08 -0.27 0.00 0.84 0.00 0.00 57.88 58.11 1uwq h LEU 427 Cb 1.23 -0.11 -0.15 0.00 0.37 0.00 0.00 40.66 42.01 1uwq h LEU 427 CO 0.38 0.38 -0.71 0.00 -0.34 0.00 0.00 178.44 178.15 1uwq s ALA 428 N -5.88 1.16 0.72 1.25 0.00 -1.26 -0.23 121.76 117.52 1uwq s ALA 428 Ca -0.13 -1.38 -0.16 0.00 0.00 0.00 0.00 51.96 50.29 1uwq s ALA 428 Cb 0.10 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.32 1uwq s ALA 428 CO 0.72 -0.16 0.86 -0.25 0.00 0.00 0.00 175.76 176.93 1uwq n ASP 429 N -0.01 0.04 -2.58 0.00 8.00 -0.97 -4.16 116.55 116.87 1uwq n ASP 429 Ca -0.12 0.64 -0.09 0.00 0.71 0.00 0.00 54.79 55.93 1uwq n ASP 429 Cb 0.60 -1.36 0.01 0.00 -0.02 0.00 0.00 41.12 40.35 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 -1.35 -1.68 -4.61 -2.24 0.23 -1.26 -4.77 115.26 99.58 1uwq n ASN 430 Ca 0.12 -2.45 -0.43 0.00 -0.53 0.00 0.00 54.58 51.30 1uwq n ASN 430 Cb 0.50 2.88 -0.02 0.00 -2.08 0.00 0.00 39.78 41.05 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 -3.23 2.76 -1.40 -2.53 5.04 -0.52 -4.67 117.35 112.79 1uwq s TYR 431 Ca 0.17 0.78 -0.08 0.00 -2.44 0.00 0.00 57.07 55.51 1uwq s TYR 431 Cb -0.03 -4.26 0.07 0.00 0.35 0.00 0.00 41.96 38.09 1uwq s TYR 431 CO 0.13 -1.40 2.42 -1.91 -1.34 0.00 0.00 175.55 173.44 1uwq n GLU 432 N 7.72 4.05 0.00 4.97 4.07 0.31 -4.60 120.64 137.15 1uwq n GLU 432 Ca 0.13 -3.10 0.00 0.00 -0.06 0.00 0.00 57.16 54.13 1uwq n GLU 432 Cb 0.48 -2.78 0.00 0.00 -0.06 0.00 0.00 31.44 29.08 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 2.95 0.00 0.29 4.31 7.02 -1.26 -0.97 117.44 129.77 1uwq n TRP 433 Ca 0.61 0.00 0.16 0.00 -1.02 0.00 0.00 57.50 57.25 1uwq n TRP 433 Cb 0.28 0.00 0.89 0.00 -2.42 0.00 0.00 31.31 30.06 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 -0.63 1.27 0.00 6.99 0.00 -1.83 -2.21 119.26 122.86 1uwq h ALA 434 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1uwq h ALA 434 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1uwq h ALA 434 CO 0.00 0.06 0.00 0.77 0.00 0.00 0.00 179.25 180.08 1uwq h SER 435 N 0.00 0.00 0.00 0.00 0.02 -1.39 -0.11 113.55 112.07 1uwq h SER 435 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1uwq h SER 435 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1uwq h SER 435 CO 0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 1uwq n GLY 436 N 0.95 -0.30 0.03 -3.77 0.00 -0.83 -4.09 105.19 97.18 1uwq n GLY 436 Ca 0.04 -1.07 0.14 0.00 0.00 0.00 0.00 46.02 45.12 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 0.00 0.23 1.61 3.72 -1.26 -0.53 117.46 121.22 1uwq n PHE 437 Ca 0.00 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 1uwq n PHE 437 Cb 0.00 -0.33 0.54 0.00 -0.94 0.00 0.00 39.48 38.75 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 0.17 0.00 -3.50 4.37 4.64 -1.90 -3.39 113.55 113.94 1uwq h SER 438 Ca 0.00 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.67 1uwq h SER 438 Cb 0.45 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.39 1uwq h SER 438 CO 0.00 0.21 0.23 -0.04 -0.87 0.00 0.00 176.83 176.36 1uwq s MET 439 N -3.87 3.29 -0.34 4.77 -1.94 -1.26 -4.92 119.30 115.03 1uwq s MET 439 Ca -0.01 -0.37 -0.06 0.00 -1.71 0.00 0.00 55.69 53.54 1uwq s MET 439 Cb 0.12 -3.98 0.05 0.00 2.01 0.00 0.00 34.83 33.02 1uwq s MET 439 CO 0.63 -1.13 0.11 1.03 -0.01 0.00 0.00 175.02 175.64 1uwq s ARG 440 N 3.05 2.55 0.00 2.03 0.52 -1.26 -4.63 118.95 121.22 1uwq s ARG 440 Ca 0.24 -1.25 0.19 0.00 -0.52 0.00 0.00 55.73 54.39 1uwq s ARG 440 Cb -0.14 -3.45 0.24 0.00 0.52 0.00 0.00 34.95 32.13 1uwq s ARG 440 CO 0.19 -0.70 1.19 1.19 0.02 0.00 0.00 175.30 177.18 1uwq n PHE 441 N 4.78 0.20 -2.52 -0.53 3.01 -1.26 -1.01 117.46 120.12 1uwq n PHE 441 Ca -0.12 -0.12 -0.38 0.00 1.01 0.00 0.00 57.45 57.84 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 -1.45 2.90 0.45 1.37 0.00 -1.26 -2.02 107.32 107.30 1uwq s GLY 442 Ca 0.27 0.78 0.17 0.00 0.00 0.00 0.00 44.72 45.94 1uwq s GLY 442 CO 0.25 1.29 1.97 1.41 0.00 0.00 0.00 173.10 178.02 1uwq h LEU 443 N 3.14 0.00 -8.91 0.66 3.38 -0.57 -3.42 115.31 109.58 1uwq h LEU 443 Ca -0.47 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 56.83 1uwq h LEU 443 Cb 1.21 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.75 1uwq h LEU 443 CO 0.65 0.21 -0.71 -0.76 0.09 0.00 0.00 178.44 177.92 1uwq s LEU 444 N -8.16 3.07 0.22 1.67 1.43 0.67 -2.53 118.68 115.06 1uwq s LEU 444 Ca -0.03 -0.13 -0.30 0.00 -1.03 0.00 0.00 54.13 52.64 1uwq s LEU 444 Cb 0.15 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.59 1uwq s LEU 444 CO 0.67 0.26 0.94 -0.75 0.23 0.00 0.00 176.35 177.71 1uwq s LYS 445 N -0.22 4.83 -0.21 1.70 2.20 0.12 -2.29 119.74 125.87 1uwq s LYS 445 Ca 0.03 1.49 -0.06 0.00 -0.36 0.00 0.00 55.97 57.06 1uwq s LYS 445 Cb -0.13 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.86 1uwq s LYS 445 CO 0.03 0.46 0.04 0.08 -0.36 0.00 0.00 175.35 175.60 1uwq s VAL 446 N -0.97 4.30 -0.50 4.02 1.01 -1.26 -0.62 120.40 126.39 1uwq s VAL 446 Ca 0.42 -0.19 -0.24 0.00 0.00 0.00 0.00 61.98 61.97 1uwq s VAL 446 Cb -0.26 -2.96 0.03 0.00 0.00 0.00 0.00 36.38 33.20 1uwq s VAL 446 CO 0.32 0.41 0.86 -0.62 0.00 0.00 0.00 175.10 176.07 1uwq s ASP 447 N 1.01 6.38 0.41 3.32 -1.08 -0.71 -4.93 116.67 121.06 1uwq s ASP 447 Ca 0.03 -0.23 0.29 0.00 -0.52 0.00 0.00 52.55 52.11 1uwq s ASP 447 Cb -0.14 -2.41 1.13 0.00 -1.46 0.00 0.00 42.92 40.03 1uwq s ASP 447 CO 0.02 -1.07 1.84 1.88 0.52 0.00 0.00 175.17 178.37 1uwq h TYR 448 N 9.14 0.00 -0.40 -5.34 0.05 -1.92 0.55 116.97 119.04 1uwq h TYR 448 Ca -0.25 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.38 1uwq h TYR 448 Cb 1.08 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.81 1uwq h TYR 448 CO 0.86 0.00 -0.32 -0.91 -1.05 0.00 0.00 178.16 176.73 1uwq h ASN 449 N 0.00 0.96 0.00 3.88 2.35 -1.92 -3.37 115.58 117.48 1uwq h ASN 449 Ca 0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1uwq h ASN 449 Cb 0.49 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1uwq h ASN 449 CO 0.00 1.19 -0.29 0.35 -1.65 0.00 0.00 177.43 177.03 1uwq n THR 450 N -4.07 0.00 -1.07 2.81 -2.24 -0.91 -4.99 114.28 103.81 1uwq n THR 450 Ca -0.01 -0.37 -0.03 0.00 -2.27 0.00 0.00 64.05 61.37 1uwq n THR 450 Cb 0.51 0.95 -0.01 0.00 -2.10 0.00 0.00 70.33 69.67 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 -1.15 -1.32 -2.21 -0.78 4.76 0.19 -4.99 118.16 112.66 1uwq n LYS 451 Ca 0.01 0.46 -0.40 0.00 -2.87 0.00 0.00 58.31 55.51 1uwq n LYS 451 Cb 0.07 -4.51 -0.02 0.00 -1.84 0.00 0.00 35.03 28.72 1uwq n LYS 451 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1uwq s ARG 452 N -1.70 4.23 -0.11 1.97 3.52 -1.22 -4.81 118.95 120.83 1uwq s ARG 452 Ca 0.00 2.04 -0.04 0.00 -0.13 0.00 0.00 55.73 57.59 1uwq s ARG 452 Cb 0.00 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.44 1uwq s ARG 452 CO 0.00 -0.23 0.06 -0.51 -0.81 0.00 0.00 175.30 173.81 1uwq s LEU 453 N -2.07 3.91 0.08 -0.88 1.43 -1.26 -1.74 118.68 118.15 1uwq s LEU 453 Ca 0.52 0.27 0.09 0.00 -1.03 0.00 0.00 54.13 53.98 1uwq s LEU 453 Cb -0.36 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 43.90 1uwq s LEU 453 CO 0.46 0.38 -0.24 -0.31 0.23 0.00 0.00 176.35 176.87 1uwq s TYR 454 N -0.85 2.07 -0.47 0.29 1.51 0.21 -4.95 117.35 115.18 1uwq s TYR 454 Ca 0.13 -0.40 -0.25 0.00 -1.01 0.00 0.00 57.07 55.54 1uwq s TYR 454 Cb -0.12 -1.18 0.03 0.00 -0.11 0.00 0.00 41.96 40.58 1uwq s TYR 454 CO 0.03 0.20 0.93 -1.58 -1.11 0.00 0.00 175.55 174.01 1uwq s TRP 455 N -0.95 2.91 0.56 2.71 0.52 -1.26 0.10 118.94 123.52 1uwq s TRP 455 Ca 0.10 0.36 -0.19 0.00 0.02 0.00 0.00 56.10 56.39 1uwq s TRP 455 Cb -0.10 -3.99 -0.05 0.00 -1.15 0.00 0.00 33.47 28.18 1uwq s TRP 455 CO 0.04 -1.12 1.13 1.03 0.02 0.00 0.00 176.95 178.05 1uwq s ARG 456 N 3.79 3.28 0.39 4.98 0.52 -1.05 -4.92 118.95 125.94 1uwq s ARG 456 Ca 0.37 1.61 0.19 0.00 -0.52 0.00 0.00 55.73 57.38 1uwq s ARG 456 Cb -0.10 -2.00 1.12 0.00 0.52 0.00 0.00 34.95 34.50 1uwq s ARG 456 CO 0.26 -0.91 1.73 -1.35 0.02 0.00 0.00 175.30 175.06 1uwq h PRO 457 N 1.08 0.35 -0.79 3.54 0.11 -1.93 0.12 132.00 134.49 1uwq h PRO 457 Ca -0.50 -0.02 0.20 0.00 0.11 0.00 0.00 66.00 65.79 1uwq h PRO 457 Cb 1.26 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1uwq h PRO 457 CO 0.57 0.23 0.54 0.77 -0.21 0.00 0.00 178.00 179.90 1uwq h SER 458 N 0.37 0.20 -0.40 -2.05 0.02 -1.89 -0.47 113.55 109.33 1uwq h SER 458 Ca 0.65 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 61.50 1uwq h SER 458 Cb 1.65 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 64.15 1uwq h SER 458 CO -0.36 0.09 -0.19 0.00 -1.14 0.00 0.00 176.83 175.23 1uwq h ALA 459 N 1.63 0.82 -0.71 3.77 0.00 -0.90 0.13 119.26 123.99 1uwq h ALA 459 Ca 0.39 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1uwq h ALA 459 Cb 1.22 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1uwq h ALA 459 CO -0.08 0.65 0.20 -0.07 0.00 0.00 0.00 179.25 179.95 1uwq h LEU 460 N 0.78 1.05 -0.21 0.00 3.38 -1.14 0.09 115.31 119.25 1uwq h LEU 460 Ca 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1uwq h LEU 460 Cb 0.73 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1uwq h LEU 460 CO 0.06 0.99 0.07 0.58 0.09 0.00 0.00 178.44 180.22 1uwq h VAL 461 N 1.06 1.18 -0.87 1.22 2.07 -0.97 -2.56 116.25 117.38 1uwq h VAL 461 Ca 0.23 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1uwq h VAL 461 Cb 0.33 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 1uwq h VAL 461 CO -0.00 0.18 0.54 0.22 0.02 0.00 0.00 177.57 178.53 1uwq h TYR 462 N 0.17 1.13 -0.68 1.57 3.20 -0.52 -2.04 116.97 119.81 1uwq h TYR 462 Ca 0.07 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.01 1uwq h TYR 462 Cb 0.22 -0.37 -0.06 0.00 1.54 0.00 0.00 36.73 38.06 1uwq h TYR 462 CO -0.00 0.74 0.37 -0.09 -1.64 0.00 0.00 178.16 177.54 1uwq h ARG 463 N 1.19 0.66 -0.48 1.82 2.43 -0.84 0.24 114.38 119.41 1uwq h ARG 463 Ca 0.31 -0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.52 1uwq h ARG 463 Cb -0.07 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.27 1uwq h ARG 463 CO -0.06 0.44 0.14 0.93 -1.51 0.00 0.00 179.97 179.90 1uwq h GLU 464 N 0.68 0.28 0.01 0.20 4.39 -0.97 -0.91 114.58 118.26 1uwq h GLU 464 Ca 0.31 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 1uwq h GLU 464 Cb 0.21 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1uwq h GLU 464 CO -0.19 0.19 -0.00 0.82 -1.16 0.00 0.00 179.01 178.66 1uwq h ILE 465 N 0.29 1.20 -0.25 3.13 2.04 -0.77 -2.96 117.51 120.19 1uwq h ILE 465 Ca 0.24 -0.62 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 1uwq h ILE 465 Cb 0.28 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1uwq h ILE 465 CO -0.27 0.16 -0.06 0.00 0.00 0.00 0.00 178.15 177.97 1uwq h ALA 466 N 0.72 0.35 0.00 1.87 0.00 -0.28 0.71 119.26 122.63 1uwq h ALA 466 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1uwq h ALA 466 Cb 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1uwq h ALA 466 CO 0.00 0.15 -0.20 1.79 0.00 0.00 0.00 179.25 180.99 1uwq h THR 467 N 0.23 0.62 -0.01 0.00 1.35 -1.28 -2.80 112.91 111.03 1uwq h THR 467 Ca 0.06 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1uwq h THR 467 Cb 0.53 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.55 1uwq h THR 467 CO 0.03 0.20 -0.71 0.59 -0.25 0.00 0.00 175.52 175.37 1uwq n ASN 468 N -3.54 1.33 -3.11 5.36 3.02 -1.12 -4.97 115.26 112.24 1uwq n ASN 468 Ca -0.01 -1.11 -0.22 0.00 -0.03 0.00 0.00 54.58 53.21 1uwq n ASN 468 Cb 0.35 0.68 0.01 0.00 -0.61 0.00 0.00 39.78 40.22 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 1.46 -0.50 3.49 7.41 0.00 0.19 -4.90 105.19 112.34 1uwq n GLY 469 Ca 0.07 0.09 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.99 -1.73 -0.31 4.61 0.00 -0.89 -1.08 121.76 119.36 1uwq s ALA 470 Ca 0.31 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 53.03 1uwq s ALA 470 Cb -0.15 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.23 1uwq s ALA 470 CO 0.38 -0.52 1.30 0.42 0.00 0.00 0.00 175.76 177.34 1uwq s ILE 471 N -2.15 4.13 0.69 0.00 1.01 -0.30 -4.13 121.20 120.46 1uwq s ILE 471 Ca -0.05 1.27 -0.11 0.00 0.00 0.00 0.00 60.65 61.76 1uwq s ILE 471 Cb -0.00 -4.18 0.00 0.00 0.01 0.00 0.00 42.46 38.29 1uwq s ILE 471 CO 0.00 -0.51 1.07 0.42 0.00 0.00 0.00 174.94 175.92 1uwq s THR 472 N 4.44 3.92 0.26 2.92 -4.23 -1.26 -1.39 115.64 120.30 1uwq s THR 472 Ca 0.56 0.62 -0.01 0.00 -1.18 0.00 0.00 61.69 61.68 1uwq s THR 472 Cb -0.16 -3.52 0.24 0.00 1.34 0.00 0.00 72.50 70.40 1uwq s THR 472 CO 0.24 -0.81 1.77 0.44 -0.54 0.00 0.00 174.62 175.72 1uwq h ASP 473 N -0.63 0.56 0.66 3.99 3.32 -1.95 -2.46 116.42 119.91 1uwq h ASP 473 Ca -0.45 0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1uwq h ASP 473 Cb 1.23 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1uwq h ASP 473 CO 0.61 0.25 0.00 1.05 -1.72 0.00 0.00 179.24 179.43 1uwq h GLU 474 N 0.66 0.00 -0.09 3.56 9.09 -2.02 -2.95 114.58 122.82 1uwq h GLU 474 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 1uwq h GLU 474 Cb 0.61 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.71 1uwq h GLU 474 CO -0.34 0.00 0.00 0.44 0.05 0.00 0.00 179.01 179.16 1uwq n ILE 475 N -2.98 0.77 0.30 -1.06 -5.35 -0.95 -4.72 119.36 105.38 1uwq n ILE 475 Ca -0.00 -0.89 0.16 0.00 -0.27 0.00 0.00 62.75 61.75 1uwq n ILE 475 Cb 0.22 0.63 0.92 0.00 -1.74 0.00 0.00 39.64 39.67 1uwq n ILE 475 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1uwq h GLU 476 N 0.67 0.00 0.00 6.28 5.08 -1.31 -1.47 114.58 123.83 1uwq h GLU 476 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1uwq h GLU 476 Cb 0.48 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1uwq h GLU 476 CO 0.00 0.03 -0.06 1.12 -1.00 0.00 0.00 179.01 179.09 1uwq h HIS 477 N 0.00 0.00 0.00 4.33 2.07 -1.84 -2.37 115.15 117.33 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 0.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.07 1uwq h HIS 477 CO 0.00 0.06 0.00 1.28 -3.07 0.00 0.00 177.93 176.20 1uwq n LEU 478 N -3.36 0.00 -3.65 6.12 4.77 -0.55 -3.88 117.00 116.45 1uwq n LEU 478 Ca -0.01 0.37 -0.41 0.00 -0.03 0.00 0.00 56.01 55.92 1uwq n LEU 478 Cb 0.22 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 40.94 1uwq n LEU 478 CO 0.27 -0.14 2.81 -3.20 -1.33 0.00 0.00 177.39 175.80 1uwq n ASN 479 N -1.37 4.87 -3.71 -1.43 4.05 -0.90 -3.96 115.26 112.81 1uwq n ASN 479 Ca 0.07 -2.80 -0.06 0.00 0.45 0.00 0.00 54.58 52.25 1uwq n ASN 479 Cb 0.18 -1.63 -0.01 0.00 1.23 0.00 0.00 39.78 39.54 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 2.92 -0.19 0.09 1.20 1.04 -1.25 -4.94 113.70 112.57 1uwq s SER 480 Ca 0.51 -0.58 -0.30 0.00 0.48 0.00 0.00 55.95 56.06 1uwq s SER 480 Cb 0.15 0.64 -0.06 0.00 0.10 0.00 0.00 66.02 66.85 1uwq s SER 480 CO -0.08 -1.19 1.06 -0.69 0.98 0.00 0.00 173.24 173.31 1uwq s VAL 481 N -3.44 4.31 0.10 5.02 1.01 -1.26 -4.75 120.40 121.38 1uwq s VAL 481 Ca 0.12 1.81 -0.36 0.00 0.00 0.00 0.00 61.98 63.55 1uwq s VAL 481 Cb -0.04 -4.16 -0.16 0.00 0.00 0.00 0.00 36.38 32.02 1uwq s VAL 481 CO 0.06 0.22 1.40 -2.65 0.00 0.00 0.00 175.10 174.13 1uwq n PRO 482 N 3.18 1.36 -1.69 2.72 -0.02 -1.26 -4.84 135.00 134.45 1uwq n PRO 482 Ca 0.05 0.49 -0.44 0.00 -2.02 0.00 0.00 63.50 61.58 1uwq n PRO 482 Cb 0.48 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.76 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 2.76 2.57 0.09 0.52 -0.02 -1.26 -4.82 135.00 134.84 1uwq n PRO 483 Ca 0.18 0.93 -0.02 0.00 -2.02 0.00 0.00 63.50 62.57 1uwq n PRO 483 Cb 0.21 -2.78 -0.05 0.00 -0.02 0.00 0.00 33.50 30.86 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 4.31 1.17 -0.45 -1.45 -1.51 -1.93 -3.38 116.25 113.00 1uwq h VAL 484 Ca -0.46 -2.70 0.09 0.00 -1.23 0.00 0.00 66.70 62.41 1uwq h VAL 484 Cb 1.23 2.56 -0.09 0.00 -2.13 0.00 0.00 31.29 32.86 1uwq h VAL 484 CO 0.94 0.67 -0.14 0.50 -1.23 0.00 0.00 177.57 178.30 1uwq h LYS 485 N 0.00 -0.03 0.00 5.19 3.11 -1.98 -1.16 116.57 121.69 1uwq h LYS 485 Ca -0.03 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 1uwq h LYS 485 Cb 1.58 0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.82 1uwq h LYS 485 CO 0.09 -0.02 0.00 -2.30 -2.81 0.00 0.00 179.45 174.41 1uwq n PRO 486 N -5.35 0.09 -2.73 1.90 -0.02 -1.26 -4.85 135.00 122.78 1uwq n PRO 486 Ca 0.03 0.22 -0.26 0.00 -2.02 0.00 0.00 63.50 61.47 1uwq n PRO 486 Cb 0.26 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 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 -3.61 3.62 0.38 2.45 1.43 -0.44 -5.05 118.68 117.46 1uwq s LEU 487 Ca 0.09 0.78 -0.27 0.00 -1.03 0.00 0.00 54.13 53.69 1uwq s LEU 487 Cb 0.12 -3.70 -0.10 0.00 0.03 0.00 0.00 46.19 42.55 1uwq s LEU 487 CO 0.42 -0.62 1.37 -0.60 0.23 0.00 0.00 176.35 177.14 1uwq s ARG 488 N -4.71 4.11 0.00 1.70 3.52 -1.26 -5.01 118.95 117.30 1uwq s ARG 488 Ca 0.47 2.31 0.08 0.00 -0.13 0.00 0.00 55.73 58.47 1uwq s ARG 488 Cb -0.10 -2.91 0.07 0.00 -1.56 0.00 0.00 34.95 30.45 1uwq s ARG 488 CO 0.43 -0.43 0.77 0.72 -0.81 0.00 0.00 175.30 175.97