#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uq4 s TYR 6 N 0.00 2.82 0.40 2.61 2.02 -1.26 -4.96 117.35 118.97 1uq4 s TYR 6 Ca 0.00 1.52 -0.26 0.00 -0.37 0.00 0.00 57.07 57.97 1uq4 s TYR 6 Cb 0.00 -3.41 -0.11 0.00 -0.40 0.00 0.00 41.96 38.05 1uq4 s TYR 6 CO 0.00 -1.62 1.21 -2.30 -1.57 0.00 0.00 175.55 171.27 1uq4 n PRO 7 N -0.57 1.83 -5.09 -1.71 -0.02 -1.26 -4.74 135.00 123.43 1uq4 n PRO 7 Ca 0.08 0.65 -0.32 0.00 -2.02 0.00 0.00 63.50 61.89 1uq4 n PRO 7 Cb 0.48 -2.28 -0.15 0.00 -0.02 0.00 0.00 33.50 31.53 1uq4 n PRO 7 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1uq4 s ILE 8 N -1.19 2.56 -0.07 4.25 1.01 -1.26 -0.83 121.20 125.68 1uq4 s ILE 8 Ca 0.60 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 60.38 1uq4 s ILE 8 Cb -0.54 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 39.98 1uq4 s ILE 8 CO 0.59 0.58 -0.20 -0.63 0.00 0.00 0.00 174.94 175.28 1uq4 s ILE 9 N -0.64 1.73 0.03 2.92 1.09 0.26 -4.97 121.20 121.63 1uq4 s ILE 9 Ca 0.10 -0.85 -0.06 0.00 -1.10 0.00 0.00 60.65 58.74 1uq4 s ILE 9 Cb -0.11 -1.50 -0.05 0.00 -1.06 0.00 0.00 42.46 39.75 1uq4 s ILE 9 CO -0.00 0.49 0.28 0.20 -0.10 0.00 0.00 174.94 175.81 1uq4 s ASN 10 N 0.25 6.49 -0.08 3.58 0.01 -1.26 -1.14 114.94 122.79 1uq4 s ASN 10 Ca -0.12 0.55 -0.09 0.00 -0.71 0.00 0.00 52.86 52.50 1uq4 s ASN 10 Cb -0.15 -2.08 0.02 0.00 0.41 0.00 0.00 41.25 39.44 1uq4 s ASN 10 CO 0.05 0.22 0.23 0.12 -1.51 0.00 0.00 177.10 176.22 1uq4 s PHE 11 N -1.36 -0.23 -0.00 2.20 5.36 -0.46 -4.90 117.98 118.58 1uq4 s PHE 11 Ca 0.30 0.55 0.07 0.00 -0.96 0.00 0.00 56.93 56.89 1uq4 s PHE 11 Cb -0.13 0.08 -0.02 0.00 -0.34 0.00 0.00 43.02 42.61 1uq4 s PHE 11 CO 0.18 -0.15 -0.22 -0.08 -1.46 0.00 0.00 175.22 173.48 1uq4 s THR 12 N -0.08 1.77 -0.38 0.12 -1.32 -1.26 -1.49 115.64 112.99 1uq4 s THR 12 Ca -0.02 -1.03 0.27 0.00 -1.21 0.00 0.00 61.69 59.70 1uq4 s THR 12 Cb -0.02 -1.49 0.33 0.00 -1.51 0.00 0.00 72.50 69.81 1uq4 s THR 12 CO 0.01 0.44 1.76 0.71 -2.21 0.00 0.00 174.62 175.33 1uq4 h THR 13 N 4.52 0.00 -2.61 5.08 1.35 -1.79 -3.38 112.91 116.08 1uq4 h THR 13 Ca -0.41 -0.63 -0.56 0.00 -0.55 0.00 0.00 66.41 64.25 1uq4 h THR 13 Cb 1.14 1.59 -0.02 0.00 -1.73 0.00 0.00 68.15 69.13 1uq4 h THR 13 CO 0.47 0.00 1.18 0.00 -0.25 0.00 0.00 175.52 176.91 1uq4 s ALA 14 N -3.31 3.30 -1.58 6.62 0.00 -1.26 -2.49 121.76 123.03 1uq4 s ALA 14 Ca 0.06 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.70 1uq4 s ALA 14 Cb 0.08 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1uq4 s ALA 14 CO 0.58 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.83 1uq4 n GLY 15 N 4.69 0.55 3.76 0.00 0.00 -1.26 -4.95 105.19 107.98 1uq4 n GLY 15 Ca 0.20 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1uq4 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uq4 s ALA 16 N -2.74 3.21 0.29 4.61 0.00 -1.04 -5.02 121.76 121.07 1uq4 s ALA 16 Ca 0.00 1.48 0.03 0.00 0.00 0.00 0.00 51.96 53.47 1uq4 s ALA 16 Cb 0.00 -3.60 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 1uq4 s ALA 16 CO 0.00 -1.25 0.06 0.95 0.00 0.00 0.00 175.76 175.52 1uq4 s THR 17 N -1.20 1.01 0.24 0.00 -4.23 -1.26 -4.98 115.64 105.22 1uq4 s THR 17 Ca 0.62 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.08 1uq4 s THR 17 Cb -0.44 -2.69 0.21 0.00 1.34 0.00 0.00 72.50 70.92 1uq4 s THR 17 CO 0.57 -0.05 1.77 0.58 -0.54 0.00 0.00 174.62 176.95 1uq4 h VAL 18 N 2.24 0.80 -0.52 2.29 2.07 -1.89 -1.28 116.25 119.95 1uq4 h VAL 18 Ca -0.40 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 66.80 1uq4 h VAL 18 Cb 1.24 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1uq4 h VAL 18 CO 0.67 0.11 -0.12 -0.61 0.02 0.00 0.00 177.57 177.64 1uq4 h GLN 19 N 0.62 0.99 -0.07 1.57 5.75 -1.97 -0.62 115.11 121.38 1uq4 h GLN 19 Ca 0.40 -0.37 -0.16 0.00 -0.15 0.00 0.00 58.65 58.37 1uq4 h GLN 19 Cb 0.48 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 1uq4 h GLN 19 CO -0.31 1.04 -0.64 0.66 -2.65 0.00 0.00 178.83 176.93 1uq4 h SER 20 N 0.88 0.32 -0.28 -0.69 4.64 -1.86 -1.46 113.55 115.10 1uq4 h SER 20 Ca 0.14 -0.19 -0.13 0.00 -0.47 0.00 0.00 61.79 61.13 1uq4 h SER 20 Cb 0.68 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1uq4 h SER 20 CO 0.05 0.88 -0.33 0.22 -0.87 0.00 0.00 176.83 176.77 1uq4 h TYR 21 N 0.20 0.88 -0.08 4.77 3.20 -1.15 -2.10 116.97 122.69 1uq4 h TYR 21 Ca -0.01 -0.28 0.03 0.00 3.14 0.00 0.00 58.73 61.61 1uq4 h TYR 21 Cb 1.17 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1uq4 h TYR 21 CO 0.03 1.04 -0.10 1.15 -1.64 0.00 0.00 178.16 178.63 1uq4 h THR 22 N 0.46 0.71 -0.74 1.81 2.02 -0.97 0.48 112.91 116.68 1uq4 h THR 22 Ca 0.04 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.36 1uq4 h THR 22 Cb 0.91 0.71 -0.10 0.00 -1.74 0.00 0.00 68.15 67.94 1uq4 h THR 22 CO 0.08 0.00 0.28 0.78 0.37 0.00 0.00 175.52 177.03 1uq4 h ASN 23 N -0.14 0.25 -0.16 4.18 2.35 -1.27 -0.57 115.58 120.22 1uq4 h ASN 23 Ca 0.07 0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.88 1uq4 h ASN 23 Cb 0.23 0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.70 1uq4 h ASN 23 CO -0.16 0.09 -0.07 0.15 -1.65 0.00 0.00 177.43 175.78 1uq4 h PHE 24 N 0.42 0.38 -0.41 1.19 3.57 -0.77 -1.19 116.94 120.13 1uq4 h PHE 24 Ca 0.41 -0.09 -0.09 0.00 3.53 0.00 0.00 57.97 61.72 1uq4 h PHE 24 Cb 0.63 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 1uq4 h PHE 24 CO -0.18 0.64 -0.12 0.82 -2.23 0.00 0.00 178.31 177.25 1uq4 h ILE 25 N 0.01 1.26 -0.62 1.41 1.08 -0.65 -1.49 117.51 118.50 1uq4 h ILE 25 Ca 0.04 -1.16 -0.02 0.00 -0.39 0.00 0.00 64.86 63.32 1uq4 h ILE 25 Cb 0.54 1.07 -0.03 0.00 -3.07 0.00 0.00 36.82 35.33 1uq4 h ILE 25 CO 0.02 0.39 0.31 -0.09 -0.69 0.00 0.00 178.15 178.10 1uq4 h ARG 26 N 0.67 0.89 -0.61 2.37 1.12 -1.03 -0.31 114.38 117.48 1uq4 h ARG 26 Ca 0.11 -0.13 -0.03 0.00 -1.11 0.00 0.00 59.98 58.83 1uq4 h ARG 26 Cb 0.59 -0.16 -0.03 0.00 -0.01 0.00 0.00 29.97 30.36 1uq4 h ARG 26 CO 0.04 0.71 0.27 0.00 -3.11 0.00 0.00 179.97 177.88 1uq4 h ALA 27 N 1.14 0.80 -0.30 2.80 0.00 -0.77 -1.21 119.26 121.71 1uq4 h ALA 27 Ca 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1uq4 h ALA 27 Cb 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1uq4 h ALA 27 CO -0.03 0.38 0.19 0.28 0.00 0.00 0.00 179.25 180.07 1uq4 h VAL 28 N 0.85 1.09 -0.95 0.00 2.07 -0.93 -1.92 116.25 116.47 1uq4 h VAL 28 Ca 0.21 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.56 1uq4 h VAL 28 Cb 0.16 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 1uq4 h VAL 28 CO -0.02 0.09 0.62 0.03 0.02 0.00 0.00 177.57 178.31 1uq4 h ARG 29 N 0.39 1.19 0.00 1.57 3.08 -0.85 -0.07 114.38 119.70 1uq4 h ARG 29 Ca 0.11 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1uq4 h ARG 29 Cb -0.02 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.76 1uq4 h ARG 29 CO -0.02 0.79 -0.24 0.78 -1.07 0.00 0.00 179.97 180.21 1uq4 h GLY 30 N 1.23 0.00 0.78 0.04 0.00 -0.76 -2.38 103.07 101.98 1uq4 h GLY 30 Ca 0.36 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.68 1uq4 h GLY 30 CO -0.10 0.00 -1.25 0.54 0.00 0.00 0.00 176.54 175.73 1uq4 n ARG 31 N -3.62 0.62 -0.05 4.80 5.12 -0.76 -4.22 116.66 118.54 1uq4 n ARG 31 Ca -0.01 0.06 -0.15 0.00 -1.93 0.00 0.00 57.85 55.82 1uq4 n ARG 31 Cb 0.37 -1.76 -0.07 0.00 -1.16 0.00 0.00 32.46 29.84 1uq4 n ARG 31 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1uq4 h LEU 32 N 0.00 0.63 -8.38 0.55 3.38 -0.54 -3.47 115.31 107.48 1uq4 h LEU 32 Ca -0.01 -0.58 -0.42 0.00 0.09 0.00 0.00 57.88 56.96 1uq4 h LEU 32 Cb 1.04 -0.18 -0.23 0.00 0.09 0.00 0.00 40.66 41.38 1uq4 h LEU 32 CO 0.00 1.09 -0.78 0.42 0.09 0.00 0.00 178.44 179.26 1uq4 s THR 33 N -3.93 1.10 -0.07 0.22 -4.23 -0.97 -4.49 115.64 103.27 1uq4 s THR 33 Ca -0.13 -1.20 -0.24 0.00 -1.18 0.00 0.00 61.69 58.95 1uq4 s THR 33 Cb 0.06 -1.04 -0.19 0.00 1.34 0.00 0.00 72.50 72.67 1uq4 s THR 33 CO 0.82 -0.15 0.90 0.71 -0.54 0.00 0.00 174.62 176.36 1uq4 h THR 34 N 4.36 1.23 0.00 3.99 1.35 -1.85 -3.43 112.91 118.56 1uq4 h THR 34 Ca -0.40 -1.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.98 1uq4 h THR 34 Cb 1.19 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 1uq4 h THR 34 CO 0.41 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 1uq4 n GLY 35 N 0.85 0.99 0.30 5.82 0.00 -1.26 -4.96 105.19 106.93 1uq4 n GLY 35 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1uq4 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uq4 h ALA 36 N 0.00 2.03 -3.07 4.61 0.00 -1.93 -3.42 119.26 117.49 1uq4 h ALA 36 Ca 0.00 -0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.39 1uq4 h ALA 36 Cb 0.00 0.01 -0.40 0.00 0.00 0.00 0.00 17.79 17.40 1uq4 h ALA 36 CO 0.00 -0.17 -0.76 0.34 0.00 0.00 0.00 179.25 178.66 1uq4 s ASP 37 N -6.65 3.04 -0.08 0.00 -1.08 -1.26 -5.09 116.67 105.56 1uq4 s ASP 37 Ca -0.05 -0.98 0.01 0.00 -0.52 0.00 0.00 52.55 51.01 1uq4 s ASP 37 Cb 0.17 -0.46 0.02 0.00 -1.46 0.00 0.00 42.92 41.19 1uq4 s ASP 37 CO 0.66 -0.37 -0.10 -0.69 0.52 0.00 0.00 175.17 175.18 1uq4 s VAL 38 N 1.98 1.06 -0.18 1.11 1.01 -1.26 -0.50 120.40 123.61 1uq4 s VAL 38 Ca 0.04 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1uq4 s VAL 38 Cb -0.16 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.23 1uq4 s VAL 38 CO -0.18 0.35 -0.19 -0.13 0.00 0.00 0.00 175.10 174.95 1uq4 s ARG 39 N 0.99 3.04 -1.46 2.72 1.81 -0.35 -4.70 118.95 121.00 1uq4 s ARG 39 Ca -0.09 -0.81 -0.10 0.00 -1.72 0.00 0.00 55.73 53.01 1uq4 s ARG 39 Cb -0.15 -2.60 0.06 0.00 -0.45 0.00 0.00 34.95 31.82 1uq4 s ARG 39 CO -0.00 -0.17 0.77 0.72 -0.68 0.00 0.00 175.30 175.94 1uq4 n HIS 40 N 4.54 -2.12 -0.92 -0.53 8.25 -1.26 -1.08 115.22 122.10 1uq4 n HIS 40 Ca -0.21 0.70 0.00 0.00 -0.26 0.00 0.00 57.72 57.96 1uq4 n HIS 40 Cb 0.50 -3.84 0.00 0.00 1.12 0.00 0.00 29.99 27.77 1uq4 n HIS 40 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1uq4 n GLU 41 N -4.29 -0.01 -3.93 -0.41 1.02 -1.26 -4.96 120.64 106.81 1uq4 n GLU 41 Ca -0.01 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.78 1uq4 n GLU 41 Cb 0.55 -2.85 -0.14 0.00 -0.02 0.00 0.00 31.44 28.98 1uq4 n GLU 41 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1uq4 s ILE 42 N -3.44 3.55 0.68 -3.67 1.01 -0.24 -5.07 121.20 114.01 1uq4 s ILE 42 Ca 0.00 -0.44 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 1uq4 s ILE 42 Cb 0.00 -2.62 0.01 0.00 0.01 0.00 0.00 42.46 39.86 1uq4 s ILE 42 CO 0.00 0.42 1.27 -2.84 0.00 0.00 0.00 174.94 173.78 1uq4 s PRO 43 N 1.42 2.39 -0.06 2.79 0.02 -1.25 -1.21 135.00 139.10 1uq4 s PRO 43 Ca 0.05 1.97 0.06 0.00 0.02 0.00 0.00 61.00 63.10 1uq4 s PRO 43 Cb -0.14 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.52 1uq4 s PRO 43 CO -0.02 -1.70 -0.23 0.08 -0.33 0.00 0.00 177.00 174.80 1uq4 s VAL 44 N -1.58 2.22 0.84 3.83 1.01 0.34 -1.52 120.40 125.53 1uq4 s VAL 44 Ca 0.80 -1.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.66 1uq4 s VAL 44 Cb -0.35 -1.81 0.10 0.00 0.00 0.00 0.00 36.38 34.32 1uq4 s VAL 44 CO 0.41 0.57 1.13 -0.76 0.00 0.00 0.00 175.10 176.45 1uq4 s LEU 45 N -0.25 2.97 0.42 3.92 1.43 0.49 -4.68 118.68 122.98 1uq4 s LEU 45 Ca -0.01 2.06 -0.26 0.00 -1.03 0.00 0.00 54.13 54.89 1uq4 s LEU 45 Cb -0.13 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.45 1uq4 s LEU 45 CO 0.03 -2.59 1.43 -2.16 0.23 0.00 0.00 176.35 173.29 1uq4 s PRO 46 N -4.67 3.87 0.13 1.29 0.04 -1.26 -4.19 135.00 130.21 1uq4 s PRO 46 Ca 0.65 2.43 -0.31 0.00 0.04 0.00 0.00 61.00 63.81 1uq4 s PRO 46 Cb -0.21 -2.78 -0.10 0.00 0.04 0.00 0.00 34.50 31.45 1uq4 s PRO 46 CO 0.56 -0.67 1.75 1.21 0.04 0.00 0.00 177.00 179.88 1uq4 s ASN 47 N -0.42 6.47 0.56 6.66 3.84 -1.26 -4.48 114.94 126.32 1uq4 s ASN 47 Ca 0.58 2.70 0.25 0.00 0.21 0.00 0.00 52.86 56.60 1uq4 s ASN 47 Cb -0.44 -2.57 1.63 0.00 -0.55 0.00 0.00 41.25 39.32 1uq4 s ASN 47 CO 0.57 -0.96 2.22 0.08 -2.79 0.00 0.00 177.10 176.22 1uq4 h ARG 48 N 8.07 0.00 -6.25 0.43 0.11 -1.91 -3.37 114.38 111.46 1uq4 h ARG 48 Ca -0.44 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 59.08 1uq4 h ARG 48 Cb 1.21 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.28 1uq4 h ARG 48 CO 0.94 0.01 1.07 0.08 0.10 0.00 0.00 179.97 182.17 1uq4 s VAL 49 N -4.76 3.68 0.00 0.08 1.01 -1.26 -2.11 120.40 117.04 1uq4 s VAL 49 Ca -0.05 0.82 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1uq4 s VAL 49 Cb 0.16 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1uq4 s VAL 49 CO 0.59 -0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1uq4 n GLY 50 N 4.12 0.77 3.68 4.51 0.00 -1.26 -5.00 105.19 112.02 1uq4 n GLY 50 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1uq4 n GLY 50 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1uq4 s LEU 51 N 0.00 4.26 0.40 0.99 2.96 -0.90 -4.98 118.68 121.41 1uq4 s LEU 51 Ca 0.00 1.87 -0.27 0.00 -0.22 0.00 0.00 54.13 55.51 1uq4 s LEU 51 Cb 0.00 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 43.04 1uq4 s LEU 51 CO 0.00 -0.68 1.48 -2.65 -1.32 0.00 0.00 176.35 173.17 1uq4 n PRO 52 N 5.76 2.55 -0.05 0.98 -0.02 -1.26 -4.90 135.00 138.06 1uq4 n PRO 52 Ca 0.13 0.90 0.15 0.00 -2.02 0.00 0.00 63.50 62.66 1uq4 n PRO 52 Cb 0.45 -2.66 0.57 0.00 -0.02 0.00 0.00 33.50 31.84 1uq4 n PRO 52 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1uq4 h ILE 53 N 2.75 0.83 0.00 4.25 6.09 -2.00 0.38 117.51 129.81 1uq4 h ILE 53 Ca -0.51 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 62.90 1uq4 h ILE 53 Cb 1.25 0.56 0.00 0.00 0.47 0.00 0.00 36.82 39.10 1uq4 h ILE 53 CO 0.63 0.05 0.00 -0.46 -3.07 0.00 0.00 178.15 175.30 1uq4 n ASN 54 N -4.45 0.00 -0.32 2.19 6.94 -1.26 -2.10 115.26 116.26 1uq4 n ASN 54 Ca 0.10 0.27 0.04 0.00 -0.02 0.00 0.00 54.58 54.97 1uq4 n ASN 54 Cb 0.46 -0.38 0.10 0.00 -2.36 0.00 0.00 39.78 37.60 1uq4 n ASN 54 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1uq4 n GLN 55 N -1.38 2.69 0.05 -3.83 6.02 0.11 -4.81 117.38 116.23 1uq4 n GLN 55 Ca 0.05 -2.01 -0.11 0.00 -0.01 0.00 0.00 57.00 54.93 1uq4 n GLN 55 Cb 0.14 -1.27 -0.13 0.00 1.02 0.00 0.00 30.24 30.00 1uq4 n GLN 55 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1uq4 h ARG 56 N 0.86 0.10 -5.34 -1.09 9.65 -1.30 -3.45 114.38 113.81 1uq4 h ARG 56 Ca 0.00 -0.17 -0.42 0.00 -1.10 0.00 0.00 59.98 58.29 1uq4 h ARG 56 Cb 0.77 0.06 -0.14 0.00 -1.39 0.00 0.00 29.97 29.27 1uq4 h ARG 56 CO 0.03 0.96 -0.69 -0.06 2.80 0.00 0.00 179.97 183.01 1uq4 s PHE 57 N -2.66 1.67 0.19 2.20 0.08 -1.26 -1.36 117.98 116.85 1uq4 s PHE 57 Ca -0.03 -0.74 0.03 0.00 0.12 0.00 0.00 56.93 56.31 1uq4 s PHE 57 Cb 0.08 -0.90 -0.05 0.00 -0.57 0.00 0.00 43.02 41.59 1uq4 s PHE 57 CO 0.84 0.18 -0.01 0.96 -0.10 0.00 0.00 175.22 177.10 1uq4 s ILE 58 N -3.16 0.83 -0.06 0.64 -4.36 -0.61 -4.49 121.20 109.99 1uq4 s ILE 58 Ca 0.25 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.67 1uq4 s ILE 58 Cb 0.03 -2.18 0.00 0.00 1.25 0.00 0.00 42.46 41.56 1uq4 s ILE 58 CO 0.08 -0.43 -0.16 -0.76 0.24 0.00 0.00 174.94 173.91 1uq4 s LEU 59 N -3.22 1.83 -0.31 0.37 1.43 -0.01 -0.89 118.68 117.90 1uq4 s LEU 59 Ca 0.25 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.97 1uq4 s LEU 59 Cb 0.06 -0.94 0.04 0.00 0.03 0.00 0.00 46.19 45.38 1uq4 s LEU 59 CO 0.05 0.11 0.03 -0.69 0.23 0.00 0.00 176.35 176.08 1uq4 s VAL 60 N 0.29 3.24 -0.31 -1.59 1.01 0.37 -0.58 120.40 122.84 1uq4 s VAL 60 Ca -0.09 -1.25 -0.18 0.00 0.00 0.00 0.00 61.98 60.46 1uq4 s VAL 60 Cb -0.13 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 1uq4 s VAL 60 CO 0.03 -0.09 0.52 -0.70 0.00 0.00 0.00 175.10 174.86 1uq4 s GLU 61 N 1.31 3.82 -0.14 2.72 2.12 -0.29 -0.62 118.70 127.62 1uq4 s GLU 61 Ca -0.03 0.06 -0.04 0.00 0.36 0.00 0.00 54.97 55.32 1uq4 s GLU 61 Cb -0.19 -3.74 -0.03 0.00 0.26 0.00 0.00 34.13 30.42 1uq4 s GLU 61 CO -0.00 -0.52 0.01 -0.51 -0.54 0.00 0.00 175.26 173.69 1uq4 s LEU 62 N 2.38 3.53 0.21 2.70 1.43 0.46 -1.36 118.68 128.05 1uq4 s LEU 62 Ca 0.20 0.02 0.09 0.00 -1.03 0.00 0.00 54.13 53.41 1uq4 s LEU 62 Cb -0.15 -1.85 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1uq4 s LEU 62 CO 0.12 0.24 -0.16 -0.44 0.23 0.00 0.00 176.35 176.33 1uq4 s SER 63 N -0.03 2.82 0.31 2.29 0.01 -0.56 -0.79 113.70 117.75 1uq4 s SER 63 Ca 0.03 -0.99 0.03 0.00 1.31 0.00 0.00 55.95 56.33 1uq4 s SER 63 Cb -0.13 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 65.88 1uq4 s SER 63 CO 0.02 -0.10 0.12 0.54 0.41 0.00 0.00 173.24 174.24 1uq4 s ASN 64 N -3.23 1.73 0.50 2.44 4.22 -0.68 -2.19 114.94 117.73 1uq4 s ASN 64 Ca 0.23 -1.50 0.17 0.00 -2.14 0.00 0.00 52.86 49.61 1uq4 s ASN 64 Cb -0.03 0.28 1.21 0.00 1.28 0.00 0.00 41.25 43.99 1uq4 s ASN 64 CO 0.09 -0.81 2.10 -0.74 -2.04 0.00 0.00 177.10 175.69 1uq4 h HIS 65 N 2.19 0.00 0.00 1.54 -0.00 -1.90 -0.20 115.15 116.77 1uq4 h HIS 65 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.01 1uq4 h HIS 65 Cb 1.25 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.66 1uq4 h HIS 65 CO 0.87 0.07 0.00 0.00 -0.00 0.00 0.00 177.93 178.87 1uq4 n ALA 66 N -2.51 1.83 -2.34 5.26 0.00 -1.26 -4.86 120.51 116.63 1uq4 n ALA 66 Ca -0.03 -0.06 -0.12 0.00 0.00 0.00 0.00 53.44 53.23 1uq4 n ALA 66 Cb 0.15 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1uq4 n ALA 66 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uq4 n GLU 67 N -1.07 -1.40 -4.34 0.00 -0.58 -0.09 -5.02 120.64 108.15 1uq4 n GLU 67 Ca 0.07 0.56 -0.33 0.00 -0.42 0.00 0.00 57.16 57.04 1uq4 n GLU 67 Cb 0.05 -4.69 -0.09 0.00 -0.57 0.00 0.00 31.44 26.14 1uq4 n GLU 67 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1uq4 s LEU 68 N -3.54 3.52 0.09 -4.62 1.43 -1.26 -4.94 118.68 109.35 1uq4 s LEU 68 Ca 0.04 0.04 0.08 0.00 -1.03 0.00 0.00 54.13 53.27 1uq4 s LEU 68 Cb -0.02 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 1uq4 s LEU 68 CO 0.05 0.32 -0.22 -0.44 0.23 0.00 0.00 176.35 176.29 1uq4 s SER 69 N -1.28 2.67 0.11 2.29 0.01 -1.26 -1.68 113.70 114.55 1uq4 s SER 69 Ca 0.17 -0.65 0.05 0.00 1.31 0.00 0.00 55.95 56.83 1uq4 s SER 69 Cb -0.11 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 1uq4 s SER 69 CO 0.07 0.12 -0.13 0.68 0.41 0.00 0.00 173.24 174.39 1uq4 s VAL 70 N -1.03 1.15 -0.23 3.43 -7.23 0.03 -4.65 120.40 111.88 1uq4 s VAL 70 Ca 0.08 -1.63 -0.02 0.00 -1.81 0.00 0.00 61.98 58.60 1uq4 s VAL 70 Cb -0.10 -1.39 0.01 0.00 0.56 0.00 0.00 36.38 35.46 1uq4 s VAL 70 CO 0.04 -0.44 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.43 1uq4 s THR 71 N -2.12 2.99 0.20 5.32 2.01 0.27 -0.40 115.64 123.91 1uq4 s THR 71 Ca 0.06 -0.81 -0.18 0.00 0.31 0.00 0.00 61.69 61.07 1uq4 s THR 71 Cb -0.05 -2.43 -0.08 0.00 0.01 0.00 0.00 72.50 69.95 1uq4 s THR 71 CO 0.02 0.32 0.68 -0.76 -0.69 0.00 0.00 174.62 174.19 1uq4 s LEU 72 N 1.38 4.35 -0.20 4.42 1.43 0.21 -0.48 118.68 129.79 1uq4 s LEU 72 Ca 0.03 1.33 -0.07 0.00 -1.03 0.00 0.00 54.13 54.39 1uq4 s LEU 72 Cb -0.15 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1uq4 s LEU 72 CO -0.05 0.06 0.06 0.00 0.23 0.00 0.00 176.35 176.64 1uq4 s ALA 73 N -1.49 3.28 -0.07 4.21 0.00 -0.44 -0.48 121.76 126.77 1uq4 s ALA 73 Ca 0.41 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1uq4 s ALA 73 Cb -0.16 -1.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.99 1uq4 s ALA 73 CO 0.20 -0.05 -0.13 -0.51 0.00 0.00 0.00 175.76 175.28 1uq4 s LEU 74 N 0.80 2.82 -0.03 0.00 1.02 -0.06 -0.64 118.68 122.58 1uq4 s LEU 74 Ca 0.03 -0.18 -0.30 0.00 0.02 0.00 0.00 54.13 53.70 1uq4 s LEU 74 Cb -0.14 -1.59 -0.03 0.00 0.02 0.00 0.00 46.19 44.45 1uq4 s LEU 74 CO 0.02 0.32 1.06 -0.62 0.02 0.00 0.00 176.35 177.15 1uq4 s ASP 75 N -0.57 7.23 0.37 2.29 -1.08 -0.33 -1.58 116.67 123.00 1uq4 s ASP 75 Ca 0.08 1.70 0.27 0.00 -0.52 0.00 0.00 52.55 54.09 1uq4 s ASP 75 Cb -0.11 -2.56 1.05 0.00 -1.46 0.00 0.00 42.92 39.83 1uq4 s ASP 75 CO 0.01 -0.41 1.81 -0.37 0.52 0.00 0.00 175.17 176.73 1uq4 h VAL 76 N 4.89 0.00 0.00 1.11 -1.51 -1.54 0.15 116.25 119.35 1uq4 h VAL 76 Ca -0.37 -0.42 -0.05 0.00 -1.23 0.00 0.00 66.70 64.64 1uq4 h VAL 76 Cb 1.19 1.29 -0.01 0.00 -2.13 0.00 0.00 31.29 31.63 1uq4 h VAL 76 CO 0.81 0.00 -0.23 0.71 -1.23 0.00 0.00 177.57 177.64 1uq4 h THR 77 N 0.00 0.43 0.00 7.19 1.35 -1.80 -3.37 112.91 116.72 1uq4 h THR 77 Ca 0.00 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 1uq4 h THR 77 Cb 0.51 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1uq4 h THR 77 CO 0.00 0.22 0.00 -0.46 -0.25 0.00 0.00 175.52 175.03 1uq4 n ASN 78 N -3.21 0.14 0.00 5.36 0.23 -1.08 -4.50 115.26 112.21 1uq4 n ASN 78 Ca 0.02 -1.05 0.00 0.00 -0.53 0.00 0.00 54.58 53.02 1uq4 n ASN 78 Cb 0.56 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1uq4 n ASN 78 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1uq4 n ALA 79 N -0.02 0.00 -2.48 -2.53 0.00 0.51 -4.98 120.51 111.01 1uq4 n ALA 79 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1uq4 n ALA 79 Cb 0.34 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.50 1uq4 n ALA 79 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1uq4 s TYR 80 N -1.17 3.53 0.01 0.00 5.04 -1.22 -4.54 117.35 118.98 1uq4 s TYR 80 Ca 0.00 0.85 -0.30 0.00 -2.44 0.00 0.00 57.07 55.18 1uq4 s TYR 80 Cb 0.00 -2.22 -0.08 0.00 0.35 0.00 0.00 41.96 40.01 1uq4 s TYR 80 CO 0.00 0.41 1.81 0.08 -1.34 0.00 0.00 175.55 176.51 1uq4 s VAL 81 N -1.58 3.23 -0.29 3.14 1.01 -1.26 -1.18 120.40 123.46 1uq4 s VAL 81 Ca 0.40 0.34 0.19 0.00 0.00 0.00 0.00 61.98 62.90 1uq4 s VAL 81 Cb -0.13 -3.22 -0.27 0.00 0.00 0.00 0.00 36.38 32.76 1uq4 s VAL 81 CO 0.20 -0.03 0.54 1.33 0.00 0.00 0.00 175.10 177.14 1uq4 n VAL 82 N 5.42 0.00 -4.00 2.92 0.24 0.19 -4.92 118.33 118.18 1uq4 n VAL 82 Ca 0.18 -0.32 0.03 0.00 -2.04 0.00 0.00 64.34 62.19 1uq4 n VAL 82 Cb 0.42 0.35 0.01 0.00 -1.47 0.00 0.00 33.84 33.15 1uq4 n VAL 82 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1uq4 n GLY 83 N 1.42 0.25 3.28 7.63 0.00 -1.24 -1.38 105.19 115.15 1uq4 n GLY 83 Ca -0.01 -0.95 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 1uq4 n GLY 83 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1uq4 s TYR 84 N -2.15 -0.11 -0.04 1.61 1.13 0.04 -1.33 117.35 116.51 1uq4 s TYR 84 Ca 0.21 -0.14 0.05 0.00 -1.41 0.00 0.00 57.07 55.78 1uq4 s TYR 84 Cb -0.00 0.14 -0.02 0.00 -1.10 0.00 0.00 41.96 40.97 1uq4 s TYR 84 CO -0.01 -0.59 -0.18 0.50 -2.51 0.00 0.00 175.55 172.75 1uq4 s ARG 85 N -3.28 2.38 -0.20 -3.49 3.52 0.37 -1.13 118.95 117.12 1uq4 s ARG 85 Ca 0.00 -0.78 -0.02 0.00 -0.13 0.00 0.00 55.73 54.81 1uq4 s ARG 85 Cb 0.01 -2.26 0.06 0.00 -1.56 0.00 0.00 34.95 31.20 1uq4 s ARG 85 CO -0.08 0.60 0.01 0.00 -0.81 0.00 0.00 175.30 175.01 1uq4 s ALA 86 N -0.68 1.26 0.00 6.12 0.00 -0.27 -0.56 121.76 127.64 1uq4 s ALA 86 Ca 0.11 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.22 1uq4 s ALA 86 Cb -0.10 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.79 1uq4 s ALA 86 CO 0.00 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 175.04 1uq4 n GLY 87 N 4.95 2.95 1.58 0.00 0.00 -1.26 -2.24 105.19 111.17 1uq4 n GLY 87 Ca -0.10 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.77 1uq4 n GLY 87 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uq4 n ASN 88 N 5.63 4.70 -4.18 1.61 5.15 -1.26 -4.88 115.26 122.02 1uq4 n ASN 88 Ca 0.00 -2.68 -0.25 0.00 -0.60 0.00 0.00 54.58 51.05 1uq4 n ASN 88 Cb 0.00 -0.63 -0.15 0.00 -0.53 0.00 0.00 39.78 38.47 1uq4 n ASN 88 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1uq4 s SER 89 N -0.67 2.10 0.07 1.20 0.01 -0.95 -1.96 113.70 113.50 1uq4 s SER 89 Ca 0.44 -0.37 0.05 0.00 1.31 0.00 0.00 55.95 57.38 1uq4 s SER 89 Cb 0.33 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 66.31 1uq4 s SER 89 CO 0.14 0.19 -0.13 0.00 0.41 0.00 0.00 173.24 173.85 1uq4 s ALA 90 N -0.52 1.09 -0.01 1.44 0.00 0.24 -1.11 121.76 122.89 1uq4 s ALA 90 Ca 0.06 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.07 1uq4 s ALA 90 Cb -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.98 1uq4 s ALA 90 CO -0.00 0.15 -0.01 0.71 0.00 0.00 0.00 175.76 176.60 1uq4 s TYR 91 N -1.26 0.27 -0.02 0.00 1.51 -0.28 -0.73 117.35 116.85 1uq4 s TYR 91 Ca -0.03 -0.02 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 1uq4 s TYR 91 Cb -0.10 -0.27 -0.01 0.00 -0.11 0.00 0.00 41.96 41.47 1uq4 s TYR 91 CO 0.02 -0.06 -0.18 -0.06 -1.11 0.00 0.00 175.55 174.15 1uq4 s PHE 92 N 0.43 1.67 0.70 2.71 0.08 -0.34 -0.78 117.98 122.45 1uq4 s PHE 92 Ca -0.04 -0.33 -0.17 0.00 0.12 0.00 0.00 56.93 56.52 1uq4 s PHE 92 Cb -0.07 -1.08 0.02 0.00 -0.57 0.00 0.00 43.02 41.32 1uq4 s PHE 92 CO -0.01 -0.04 1.26 1.19 -0.10 0.00 0.00 175.22 177.52 1uq4 n PHE 93 N 2.65 1.71 -1.63 0.36 3.72 -0.48 -0.23 117.46 123.58 1uq4 n PHE 93 Ca -0.15 0.42 -0.46 0.00 -0.05 0.00 0.00 57.45 57.20 1uq4 n PHE 93 Cb 0.54 -2.22 -0.04 0.00 -0.94 0.00 0.00 39.48 36.81 1uq4 n PHE 93 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1uq4 n HIS 94 N -2.33 2.18 -1.90 1.38 -0.00 -0.50 -4.72 115.22 109.33 1uq4 n HIS 94 Ca 0.15 -0.07 -0.39 0.00 -0.00 0.00 0.00 57.72 57.41 1uq4 n HIS 94 Cb 0.49 -2.69 0.01 0.00 -0.00 0.00 0.00 29.99 27.80 1uq4 n HIS 94 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 1uq4 s PRO 95 N 4.98 3.67 0.44 1.57 0.02 -1.26 -4.63 135.00 139.79 1uq4 s PRO 95 Ca 0.96 2.27 0.24 0.00 0.02 0.00 0.00 61.00 64.49 1uq4 s PRO 95 Cb -0.59 -2.60 0.76 0.00 0.02 0.00 0.00 34.50 32.10 1uq4 s PRO 95 CO 0.46 -0.77 1.76 -0.44 -0.33 0.00 0.00 177.00 177.67 1uq4 h ASP 96 N 2.25 0.00 -5.24 2.53 3.32 -1.94 -3.48 116.42 113.87 1uq4 h ASP 96 Ca -0.50 0.00 0.10 0.00 0.02 0.00 0.00 57.03 56.65 1uq4 h ASP 96 Cb 1.26 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.78 1uq4 h ASP 96 CO 0.61 0.18 0.44 0.54 -1.72 0.00 0.00 179.24 179.29 1uq4 s ASN 97 N -6.13 -0.05 0.19 6.45 2.20 -1.26 -5.06 114.94 111.28 1uq4 s ASN 97 Ca 0.02 -0.76 -0.06 0.00 -0.94 0.00 0.00 52.86 51.13 1uq4 s ASN 97 Cb 0.08 0.62 0.12 0.00 -2.00 0.00 0.00 41.25 40.08 1uq4 s ASN 97 CO 0.64 -1.22 1.57 -0.61 -2.94 0.00 0.00 177.10 174.54 1uq4 h GLN 98 N 2.00 0.76 -0.35 3.55 5.75 -1.99 -1.55 115.11 123.28 1uq4 h GLN 98 Ca -0.28 -0.36 -0.00 0.00 -0.15 0.00 0.00 58.65 57.86 1uq4 h GLN 98 Cb 1.23 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.76 1uq4 h GLN 98 CO 0.34 0.98 0.22 0.93 -2.65 0.00 0.00 178.83 178.65 1uq4 h GLU 99 N 0.64 0.47 -0.88 1.69 5.08 -2.00 -1.50 114.58 118.08 1uq4 h GLU 99 Ca 0.07 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1uq4 h GLU 99 Cb 0.87 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.98 1uq4 h GLU 99 CO 0.08 0.34 0.50 -0.44 -1.00 0.00 0.00 179.01 178.48 1uq4 h ASP 100 N 0.46 1.08 -0.77 1.42 3.32 -1.92 -1.41 116.42 118.59 1uq4 h ASP 100 Ca 0.13 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.04 1uq4 h ASP 100 Cb -0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 1uq4 h ASP 100 CO -0.02 0.85 0.28 0.00 -1.72 0.00 0.00 179.24 178.63 1uq4 h ALA 101 N 1.33 1.01 -0.25 3.45 0.00 -0.96 -2.24 119.26 121.59 1uq4 h ALA 101 Ca 0.31 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1uq4 h ALA 101 Cb -0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1uq4 h ALA 101 CO -0.05 0.66 -0.02 1.49 0.00 0.00 0.00 179.25 181.33 1uq4 h GLU 102 N 1.14 0.45 -0.60 0.00 4.22 -1.15 -3.23 114.58 115.41 1uq4 h GLU 102 Ca 0.25 -0.16 0.10 0.00 0.08 0.00 0.00 59.36 59.63 1uq4 h GLU 102 Cb 0.26 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1uq4 h GLU 102 CO -0.02 0.65 0.21 0.00 -2.18 0.00 0.00 179.01 177.67 1uq4 h ALA 103 N 0.79 0.76 0.00 2.92 0.00 -1.11 -1.40 119.26 121.23 1uq4 h ALA 103 Ca 0.07 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1uq4 h ALA 103 Cb 0.46 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1uq4 h ALA 103 CO 0.02 -0.21 0.00 0.44 0.00 0.00 0.00 179.25 179.49 1uq4 n ILE 104 N -5.02 0.88 0.29 0.00 -5.35 -0.86 -1.41 119.36 107.89 1uq4 n ILE 104 Ca 0.08 0.30 0.09 0.00 -0.27 0.00 0.00 62.75 62.95 1uq4 n ILE 104 Cb 0.28 -1.23 0.39 0.00 -1.74 0.00 0.00 39.64 37.33 1uq4 n ILE 104 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1uq4 n THR 105 N -2.19 1.13 1.28 7.28 -2.24 -0.53 -1.82 114.28 117.20 1uq4 n THR 105 Ca 0.02 0.42 0.13 0.00 -2.27 0.00 0.00 64.05 62.35 1uq4 n THR 105 Cb 0.20 -1.34 0.34 0.00 -2.10 0.00 0.00 70.33 67.43 1uq4 n THR 105 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1uq4 n HIS 106 N -1.96 0.00 -4.00 4.78 8.25 -0.50 -4.75 115.22 117.04 1uq4 n HIS 106 Ca 0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.11 1uq4 n HIS 106 Cb 0.12 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.16 1uq4 n HIS 106 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1uq4 s LEU 107 N -2.01 4.14 -1.41 2.41 1.43 -0.75 -4.60 118.68 117.89 1uq4 s LEU 107 Ca 0.34 0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 53.73 1uq4 s LEU 107 Cb 0.21 -2.00 0.04 0.00 0.03 0.00 0.00 46.19 44.46 1uq4 s LEU 107 CO 0.32 0.37 0.77 0.49 0.23 0.00 0.00 176.35 178.54 1uq4 n PHE 108 N 2.20 -2.01 0.29 0.29 3.72 -1.26 -4.85 117.46 115.83 1uq4 n PHE 108 Ca -0.19 0.85 0.18 0.00 -0.05 0.00 0.00 57.45 58.23 1uq4 n PHE 108 Cb 0.54 -4.13 0.80 0.00 -0.94 0.00 0.00 39.48 35.75 1uq4 n PHE 108 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1uq4 h THR 109 N -1.93 0.10 -0.02 4.37 1.35 -1.85 -2.12 112.91 112.81 1uq4 h THR 109 Ca -0.60 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1uq4 h THR 109 Cb 1.37 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 1uq4 h THR 109 CO 0.62 0.03 -0.02 -0.90 -0.25 0.00 0.00 175.52 174.99 1uq4 n ASP 110 N -3.17 1.59 -4.75 5.36 5.68 -1.26 -4.93 116.55 115.07 1uq4 n ASP 110 Ca -0.01 -1.49 -0.41 0.00 -0.50 0.00 0.00 54.79 52.38 1uq4 n ASP 110 Cb 0.26 0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.23 1uq4 n ASP 110 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1uq4 s VAL 111 N -2.04 2.31 -0.19 2.12 0.11 -0.80 -4.91 120.40 117.01 1uq4 s VAL 111 Ca 0.36 0.27 0.16 0.00 -2.93 0.00 0.00 61.98 59.84 1uq4 s VAL 111 Cb 0.21 -3.17 0.09 0.00 -1.53 0.00 0.00 36.38 31.97 1uq4 s VAL 111 CO 0.35 0.04 1.44 1.56 -3.33 0.00 0.00 175.10 175.16 1uq4 h GLN 112 N 4.80 0.00 -4.73 1.54 4.20 -1.90 -3.42 115.11 115.61 1uq4 h GLN 112 Ca -0.47 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 57.59 1uq4 h GLN 112 Cb 1.22 0.00 -0.37 0.00 0.30 0.00 0.00 27.48 28.63 1uq4 h GLN 112 CO 0.78 0.44 -0.79 -0.80 -0.67 0.00 0.00 178.83 177.79 1uq4 s ASN 113 N -6.41 4.32 -0.12 1.46 0.01 -0.83 -5.06 114.94 108.31 1uq4 s ASN 113 Ca 0.04 -1.38 0.01 0.00 -0.71 0.00 0.00 52.86 50.82 1uq4 s ASN 113 Cb 0.07 -1.46 -0.01 0.00 0.41 0.00 0.00 41.25 40.26 1uq4 s ASN 113 CO 0.74 -0.21 -0.16 -0.13 -1.51 0.00 0.00 177.10 175.83 1uq4 s ARG 114 N 1.17 3.29 -0.00 -0.60 0.52 -1.26 -0.59 118.95 121.47 1uq4 s ARG 114 Ca -0.07 -0.74 0.04 0.00 -0.52 0.00 0.00 55.73 54.44 1uq4 s ARG 114 Cb -0.20 -2.54 -0.01 0.00 0.52 0.00 0.00 34.95 32.72 1uq4 s ARG 114 CO -0.06 0.21 -0.13 0.71 0.02 0.00 0.00 175.30 176.05 1uq4 s TYR 115 N 0.34 1.18 -0.20 -0.53 2.02 0.09 -4.97 117.35 115.28 1uq4 s TYR 115 Ca -0.13 -0.24 -0.04 0.00 -0.37 0.00 0.00 57.07 56.29 1uq4 s TYR 115 Cb -0.16 -0.75 -0.02 0.00 -0.40 0.00 0.00 41.96 40.63 1uq4 s TYR 115 CO 0.07 -0.01 -0.03 0.99 -1.57 0.00 0.00 175.55 175.00 1uq4 s THR 116 N -0.38 3.63 0.73 -0.71 2.01 -1.26 -1.20 115.64 118.46 1uq4 s THR 116 Ca 0.05 -0.42 -0.15 0.00 0.31 0.00 0.00 61.69 61.48 1uq4 s THR 116 Cb -0.05 -2.64 0.04 0.00 0.01 0.00 0.00 72.50 69.86 1uq4 s THR 116 CO -0.00 0.43 1.21 -0.36 -0.69 0.00 0.00 174.62 175.21 1uq4 s PHE 117 N 1.16 2.03 -0.92 4.92 0.08 0.68 -4.92 117.98 121.02 1uq4 s PHE 117 Ca 0.02 1.60 0.27 0.00 0.12 0.00 0.00 56.93 58.95 1uq4 s PHE 117 Cb -0.15 -3.48 0.93 0.00 -0.57 0.00 0.00 43.02 39.75 1uq4 s PHE 117 CO 0.00 -2.64 1.74 0.00 -0.10 0.00 0.00 175.22 174.22 1uq4 n ALA 118 N -2.74 2.63 -2.70 5.36 0.00 -1.26 -2.82 120.51 118.99 1uq4 n ALA 118 Ca 0.13 -0.15 -0.25 0.00 0.00 0.00 0.00 53.44 53.17 1uq4 n ALA 118 Cb 0.50 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.51 1uq4 n ALA 118 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1uq4 s PHE 119 N -3.03 2.87 0.75 0.00 -0.12 -1.26 -4.76 117.98 112.43 1uq4 s PHE 119 Ca 0.12 -0.14 -0.06 0.00 -0.05 0.00 0.00 56.93 56.79 1uq4 s PHE 119 Cb 0.17 -1.34 0.10 0.00 -0.63 0.00 0.00 43.02 41.32 1uq4 s PHE 119 CO 0.60 0.55 1.05 0.20 -0.05 0.00 0.00 175.22 177.56 1uq4 s GLY 120 N -3.30 1.73 -0.22 1.99 0.00 -1.26 -1.41 107.32 104.86 1uq4 s GLY 120 Ca 0.30 -1.20 0.15 0.00 0.00 0.00 0.00 44.72 43.96 1uq4 s GLY 120 CO 0.20 -0.70 1.71 0.61 0.00 0.00 0.00 173.10 174.92 1uq4 n GLY 121 N -3.02 3.10 3.80 0.20 0.00 -1.26 -4.61 105.19 103.40 1uq4 n GLY 121 Ca 0.11 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.87 1uq4 n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uq4 s ASN 122 N -0.93 5.87 0.34 1.61 2.20 -1.26 -4.86 114.94 117.92 1uq4 s ASN 122 Ca 0.53 1.81 0.05 0.00 -0.94 0.00 0.00 52.86 54.31 1uq4 s ASN 122 Cb 0.40 -2.53 0.63 0.00 -2.00 0.00 0.00 41.25 37.75 1uq4 s ASN 122 CO 0.16 -1.11 1.88 1.88 -2.94 0.00 0.00 177.10 176.98 1uq4 h TYR 123 N 0.54 0.50 -0.23 1.54 0.05 -1.99 -1.16 116.97 116.22 1uq4 h TYR 123 Ca -0.47 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.28 1uq4 h TYR 123 Cb 1.22 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.79 1uq4 h TYR 123 CO 0.59 0.51 0.11 -0.44 -1.05 0.00 0.00 178.16 177.87 1uq4 h ASP 124 N 0.47 0.15 0.11 3.88 5.19 -1.98 -1.26 116.42 122.98 1uq4 h ASP 124 Ca 0.10 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 1uq4 h ASP 124 Cb 0.33 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.82 1uq4 h ASP 124 CO 0.01 0.12 -0.05 -0.09 -3.12 0.00 0.00 179.24 176.11 1uq4 h ARG 125 N 0.23 -0.15 -0.69 3.56 9.65 -1.82 -2.74 114.38 122.43 1uq4 h ARG 125 Ca 0.10 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1uq4 h ARG 125 Cb 0.03 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.61 1uq4 h ARG 125 CO -0.07 0.12 0.43 -0.07 2.80 0.00 0.00 179.97 183.18 1uq4 h LEU 126 N -0.41 0.81 -0.32 3.80 3.38 -1.12 -0.92 115.31 120.52 1uq4 h LEU 126 Ca -0.02 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1uq4 h LEU 126 Cb 0.34 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1uq4 h LEU 126 CO 0.03 0.61 0.01 -0.33 0.09 0.00 0.00 178.44 178.85 1uq4 h GLU 127 N 0.94 0.56 -0.23 1.13 5.08 -1.27 0.46 114.58 121.24 1uq4 h GLU 127 Ca 0.25 -0.17 0.06 0.00 -1.00 0.00 0.00 59.36 58.49 1uq4 h GLU 127 Cb -0.06 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.07 1uq4 h GLU 127 CO -0.05 0.68 -0.17 0.37 -1.00 0.00 0.00 179.01 178.85 1uq4 h GLN 128 N 0.37 -0.15 -0.41 2.33 -0.00 -1.18 0.66 115.11 116.73 1uq4 h GLN 128 Ca 0.09 0.01 -0.08 0.00 -0.00 0.00 0.00 58.65 58.68 1uq4 h GLN 128 Cb 0.42 0.03 -0.02 0.00 0.00 0.00 0.00 27.48 27.92 1uq4 h GLN 128 CO 0.01 -0.10 -0.06 -0.07 0.00 0.00 0.00 178.83 178.61 1uq4 h LEU 129 N -0.16 0.68 -1.15 -2.39 3.38 -0.88 -2.78 115.31 112.01 1uq4 h LEU 129 Ca 0.13 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1uq4 h LEU 129 Cb 0.36 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1uq4 h LEU 129 CO -0.33 0.79 -0.28 0.00 0.09 0.00 0.00 178.44 178.70 1uq4 h ALA 130 N 1.28 1.06 -0.40 1.53 0.00 0.18 -3.33 119.26 119.59 1uq4 h ALA 130 Ca 0.12 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1uq4 h ALA 130 Cb 0.49 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1uq4 h ALA 130 CO 0.03 0.35 -0.14 0.41 0.00 0.00 0.00 179.25 179.90 1uq4 n GLY 131 N 0.04 0.90 3.22 0.00 0.00 0.18 -4.80 105.19 104.73 1uq4 n GLY 131 Ca -0.00 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 1uq4 n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1uq4 s ASN 132 N -2.91 -0.25 0.58 1.61 0.02 -0.92 -5.05 114.94 108.02 1uq4 s ASN 132 Ca 0.00 0.34 -0.12 0.00 -1.02 0.00 0.00 52.86 52.06 1uq4 s ASN 132 Cb 0.00 0.47 -0.05 0.00 0.02 0.00 0.00 41.25 41.69 1uq4 s ASN 132 CO 0.00 -0.29 1.00 -0.76 0.02 0.00 0.00 177.10 177.07 1uq4 s LEU 133 N -0.63 3.36 0.44 0.60 1.43 -1.26 -4.43 118.68 118.20 1uq4 s LEU 133 Ca -0.07 1.43 0.24 0.00 -1.03 0.00 0.00 54.13 54.70 1uq4 s LEU 133 Cb -0.04 -4.44 1.24 0.00 0.03 0.00 0.00 46.19 42.98 1uq4 s LEU 133 CO 0.02 -0.77 1.79 0.03 0.23 0.00 0.00 176.35 177.65 1uq4 h ARG 134 N 0.06 0.26 0.00 1.70 3.08 -1.94 -0.34 114.38 117.20 1uq4 h ARG 134 Ca -0.45 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1uq4 h ARG 134 Cb 1.19 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.18 1uq4 h ARG 134 CO 0.62 0.17 0.00 -0.85 -1.07 0.00 0.00 179.97 178.84 1uq4 n GLU 135 N -4.49 0.03 -0.28 0.04 0.28 -1.26 -1.71 120.64 113.25 1uq4 n GLU 135 Ca 0.25 0.22 0.07 0.00 -0.16 0.00 0.00 57.16 57.53 1uq4 n GLU 135 Cb 0.97 -1.55 0.19 0.00 1.43 0.00 0.00 31.44 32.48 1uq4 n GLU 135 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1uq4 n ASN 136 N -1.61 3.29 -4.17 -1.84 5.03 -0.15 -4.70 115.26 111.12 1uq4 n ASN 136 Ca 0.04 -2.41 -0.35 0.00 0.87 0.00 0.00 54.58 52.74 1uq4 n ASN 136 Cb 0.22 -0.35 -0.14 0.00 -1.02 0.00 0.00 39.78 38.49 1uq4 n ASN 136 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1uq4 s ILE 137 N -1.73 2.93 0.29 2.41 1.01 -0.69 -4.90 121.20 120.51 1uq4 s ILE 137 Ca 0.30 -1.41 -0.30 0.00 0.00 0.00 0.00 60.65 59.24 1uq4 s ILE 137 Cb 0.21 -2.69 -0.12 0.00 0.01 0.00 0.00 42.46 39.86 1uq4 s ILE 137 CO 0.13 -0.11 1.51 -0.62 0.00 0.00 0.00 174.94 175.85 1uq4 n GLU 138 N 4.61 2.46 -4.35 2.79 1.02 -1.26 -4.20 120.64 121.71 1uq4 n GLU 138 Ca -0.13 0.87 -0.26 0.00 -0.02 0.00 0.00 57.16 57.62 1uq4 n GLU 138 Cb 0.43 -2.60 -0.10 0.00 -0.02 0.00 0.00 31.44 29.15 1uq4 n GLU 138 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1uq4 s LEU 139 N -0.46 2.77 0.00 -4.62 1.43 -0.47 -4.76 118.68 112.57 1uq4 s LEU 139 Ca 0.64 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1uq4 s LEU 139 Cb -0.54 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1uq4 s LEU 139 CO 0.51 0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.80 1uq4 n GLY 140 N -0.02 -0.19 0.22 -3.19 0.00 -1.26 -1.69 105.19 99.06 1uq4 n GLY 140 Ca -0.10 -1.70 -0.05 0.00 0.00 0.00 0.00 46.02 44.16 1uq4 n GLY 140 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1uq4 h ASN 141 N 0.00 0.51 0.05 1.61 -1.24 -1.86 -1.70 115.58 112.94 1uq4 h ASN 141 Ca 0.00 -0.21 -0.00 0.00 0.71 0.00 0.00 56.30 56.80 1uq4 h ASN 141 Cb 0.00 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 38.91 1uq4 h ASN 141 CO 0.00 0.83 -0.02 1.23 -1.29 0.00 0.00 177.43 178.17 1uq4 h GLY 142 N 1.08 -0.07 0.46 1.57 0.00 -1.92 0.15 103.07 104.34 1uq4 h GLY 142 Ca 0.04 0.03 0.12 0.00 0.00 0.00 0.00 47.33 47.52 1uq4 h GLY 142 CO 0.07 -0.02 0.58 -2.55 0.00 0.00 0.00 176.54 174.61 1uq4 h PRO 143 N -0.41 0.89 -0.10 4.80 0.11 -1.85 -1.34 132.00 134.10 1uq4 h PRO 143 Ca -0.01 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.97 1uq4 h PRO 143 Cb 0.37 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.28 1uq4 h PRO 143 CO 0.01 0.59 -0.26 1.25 -0.21 0.00 0.00 178.00 179.38 1uq4 h LEU 144 N 0.92 0.41 -0.55 2.35 5.85 -0.94 0.13 115.31 123.47 1uq4 h LEU 144 Ca 0.47 -0.58 0.11 0.00 0.84 0.00 0.00 57.88 58.71 1uq4 h LEU 144 Cb 0.48 -0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.30 1uq4 h LEU 144 CO -0.27 0.92 0.05 -0.08 -0.34 0.00 0.00 178.44 178.72 1uq4 h GLU 145 N -0.09 0.17 -0.70 1.25 4.57 -0.51 -0.41 114.58 118.87 1uq4 h GLU 145 Ca -0.00 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1uq4 h GLU 145 Cb 0.87 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.39 1uq4 h GLU 145 CO 0.06 0.11 0.14 0.93 -1.18 0.00 0.00 179.01 179.07 1uq4 h GLU 146 N 0.17 1.14 -0.63 1.92 5.08 -1.03 -2.72 114.58 118.51 1uq4 h GLU 146 Ca 0.29 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 1uq4 h GLU 146 Cb 0.43 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1uq4 h GLU 146 CO -0.42 1.02 0.05 0.00 -1.00 0.00 0.00 179.01 178.65 1uq4 h ALA 147 N 1.07 0.84 -0.63 3.43 0.00 -0.06 -0.31 119.26 123.61 1uq4 h ALA 147 Ca 0.21 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1uq4 h ALA 147 Cb 0.42 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1uq4 h ALA 147 CO 0.01 0.65 0.38 0.82 0.00 0.00 0.00 179.25 181.11 1uq4 h ILE 148 N 0.99 1.05 -0.64 0.00 2.04 -1.00 -1.15 117.51 118.81 1uq4 h ILE 148 Ca 0.18 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 1uq4 h ILE 148 Cb 0.51 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1uq4 h ILE 148 CO 0.02 0.13 0.26 0.28 0.00 0.00 0.00 178.15 178.85 1uq4 h SER 149 N 0.73 0.88 -0.61 1.72 0.02 -1.15 -1.09 113.55 114.05 1uq4 h SER 149 Ca 0.26 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 1uq4 h SER 149 Cb 0.06 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 1uq4 h SER 149 CO -0.12 0.81 0.29 0.00 -1.14 0.00 0.00 176.83 176.67 1uq4 h ALA 150 N 1.11 0.79 -0.43 3.77 0.00 -0.73 -1.51 119.26 122.27 1uq4 h ALA 150 Ca 0.21 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1uq4 h ALA 150 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1uq4 h ALA 150 CO -0.02 0.37 0.04 -0.07 0.00 0.00 0.00 179.25 179.57 1uq4 h LEU 151 N 0.84 0.70 -0.56 0.00 4.07 -1.12 -2.68 115.31 116.57 1uq4 h LEU 151 Ca 0.21 -0.28 0.09 0.00 0.08 0.00 0.00 57.88 57.98 1uq4 h LEU 151 Cb 0.14 -0.19 -0.07 0.00 1.08 0.00 0.00 40.66 41.62 1uq4 h LEU 151 CO -0.02 0.81 0.17 0.22 -1.08 0.00 0.00 178.44 178.53 1uq4 h TYR 152 N 0.58 0.28 -0.11 1.13 3.20 -0.82 -2.97 116.97 118.25 1uq4 h TYR 152 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1uq4 h TYR 152 Cb 0.42 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.65 1uq4 h TYR 152 CO 0.03 0.04 0.00 0.66 -1.64 0.00 0.00 178.16 177.25 1uq4 n TYR 153 N -5.06 0.14 -0.30 -3.82 4.01 -0.60 -4.28 117.16 107.25 1uq4 n TYR 153 Ca 0.08 -0.07 -0.03 0.00 -0.16 0.00 0.00 57.90 57.72 1uq4 n TYR 153 Cb 0.27 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.39 1uq4 n TYR 153 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1uq4 h TYR 154 N 2.27 1.02 0.00 -0.72 3.20 -1.31 -2.62 116.97 118.81 1uq4 h TYR 154 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1uq4 h TYR 154 Cb 0.49 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 1uq4 h TYR 154 CO 0.07 0.60 -0.11 0.66 -1.64 0.00 0.00 178.16 177.74 1uq4 h SER 155 N 1.07 0.00 -0.56 -2.11 4.64 -1.80 -2.48 113.55 112.31 1uq4 h SER 155 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1uq4 h SER 155 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1uq4 h SER 155 CO -0.10 0.11 0.00 0.35 -0.87 0.00 0.00 176.83 176.32 1uq4 n THR 156 N -3.44 0.85 -0.33 2.95 -2.24 -1.04 -4.96 114.28 106.08 1uq4 n THR 156 Ca -0.01 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 1uq4 n THR 156 Cb 0.27 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1uq4 n THR 156 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uq4 n GLY 157 N 1.37 0.69 0.19 3.38 0.00 -0.93 -4.95 105.19 104.94 1uq4 n GLY 157 Ca 0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.36 1uq4 n GLY 157 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1uq4 h GLY 158 N 0.00 0.00 -5.96 -0.02 0.00 -1.69 -3.44 103.07 91.96 1uq4 h GLY 158 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1uq4 h GLY 158 CO 0.00 0.00 -0.83 -1.59 0.00 0.00 0.00 176.54 174.12 1uq4 s THR 159 N -3.34 2.44 0.62 4.70 2.01 -1.24 -4.95 115.64 115.87 1uq4 s THR 159 Ca 0.06 -0.84 -0.14 0.00 0.31 0.00 0.00 61.69 61.08 1uq4 s THR 159 Cb 0.09 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1uq4 s THR 159 CO 0.56 0.52 1.05 -1.10 -0.69 0.00 0.00 174.62 174.97 1uq4 s GLN 160 N 0.96 3.27 0.23 4.92 -0.21 -1.26 -4.82 119.66 122.75 1uq4 s GLN 160 Ca -0.03 1.10 -0.06 0.00 0.02 0.00 0.00 55.36 56.39 1uq4 s GLN 160 Cb -0.15 -2.03 0.34 0.00 1.00 0.00 0.00 33.01 32.17 1uq4 s GLN 160 CO -0.03 -0.84 1.81 1.25 -2.12 0.00 0.00 175.29 175.35 1uq4 h LEU 161 N 0.12 0.64 -0.59 2.90 5.85 -1.99 -0.54 115.31 121.70 1uq4 h LEU 161 Ca -0.46 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1uq4 h LEU 161 Cb 1.21 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 1uq4 h LEU 161 CO 0.58 0.38 0.38 -0.65 -0.34 0.00 0.00 178.44 178.79 1uq4 h PRO 162 N 0.76 0.74 -0.83 5.25 0.11 -1.88 -0.78 132.00 135.37 1uq4 h PRO 162 Ca 0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1uq4 h PRO 162 Cb 0.29 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 31.19 1uq4 h PRO 162 CO -0.22 0.49 0.53 1.15 -0.21 0.00 0.00 178.00 179.74 1uq4 h THR 163 N 0.76 1.22 0.07 -1.15 2.02 -1.76 0.18 112.91 114.25 1uq4 h THR 163 Ca 0.23 -0.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.97 1uq4 h THR 163 Cb -0.04 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.39 1uq4 h THR 163 CO -0.07 0.22 -0.04 0.25 0.37 0.00 0.00 175.52 176.25 1uq4 h LEU 164 N 1.13 -0.09 -0.70 2.58 5.85 -0.56 -1.20 115.31 122.33 1uq4 h LEU 164 Ca 0.30 0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.07 1uq4 h LEU 164 Cb -0.10 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1uq4 h LEU 164 CO -0.06 -0.06 0.42 0.00 -0.34 0.00 0.00 178.44 178.40 1uq4 h ALA 165 N 0.83 0.93 -0.53 1.25 0.00 -0.94 -0.85 119.26 119.96 1uq4 h ALA 165 Ca -0.01 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1uq4 h ALA 165 Cb 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1uq4 h ALA 165 CO 0.01 0.16 0.30 -0.09 0.00 0.00 0.00 179.25 179.64 1uq4 h ARG 166 N 0.81 0.58 -0.52 0.00 2.43 -0.79 -1.47 114.38 115.42 1uq4 h ARG 166 Ca 0.30 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.40 1uq4 h ARG 166 Cb 0.09 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1uq4 h ARG 166 CO -0.14 0.38 0.20 0.77 -1.51 0.00 0.00 179.97 179.67 1uq4 h SER 167 N 0.60 0.73 -0.40 -3.80 0.02 -0.73 -0.36 113.55 109.61 1uq4 h SER 167 Ca 0.22 -0.18 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1uq4 h SER 167 Cb 0.07 -0.19 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 1uq4 h SER 167 CO -0.12 0.71 0.03 -0.26 -1.14 0.00 0.00 176.83 176.05 1uq4 h PHE 168 N 0.71 0.03 -0.74 3.45 0.04 -0.90 -0.85 116.94 118.68 1uq4 h PHE 168 Ca 0.17 0.03 0.06 0.00 2.80 0.00 0.00 57.97 61.03 1uq4 h PHE 168 Cb 0.22 0.05 -0.06 0.00 2.20 0.00 0.00 35.95 38.36 1uq4 h PHE 168 CO 0.01 -0.05 0.43 0.82 -0.60 0.00 0.00 178.31 178.92 1uq4 h ILE 169 N 0.14 0.98 0.49 -0.55 2.04 -0.63 0.24 117.51 120.23 1uq4 h ILE 169 Ca 0.20 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1uq4 h ILE 169 Cb 0.27 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1uq4 h ILE 169 CO -0.30 0.14 -0.24 0.40 0.00 0.00 0.00 178.15 178.15 1uq4 h ILE 170 N 0.77 0.51 -0.54 -0.67 2.04 -0.71 -2.72 117.51 116.20 1uq4 h ILE 170 Ca 0.33 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 1uq4 h ILE 170 Cb 0.20 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1uq4 h ILE 170 CO -0.19 0.01 0.30 0.00 0.00 0.00 0.00 178.15 178.28 1uq4 h ILE 172 N 0.72 1.15 -0.34 0.00 2.04 -0.55 -1.09 117.51 119.45 1uq4 h ILE 172 Ca 0.19 -0.39 -0.17 0.00 1.00 0.00 0.00 64.86 65.49 1uq4 h ILE 172 Cb 0.03 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1uq4 h ILE 172 CO -0.03 0.16 -0.46 1.56 0.00 0.00 0.00 178.15 179.38 1uq4 h GLN 173 N 0.56 0.90 0.00 2.37 4.20 -1.25 0.06 115.11 121.95 1uq4 h GLN 173 Ca 0.15 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.34 1uq4 h GLN 173 Cb 0.05 0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1uq4 h GLN 173 CO -0.02 1.17 0.00 -1.33 -0.67 0.00 0.00 178.83 177.97 1uq4 n MET 174 N -4.05 0.21 0.00 1.46 2.81 -0.52 -2.21 117.12 114.82 1uq4 n MET 174 Ca -0.03 0.30 -0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1uq4 n MET 174 Cb 0.58 -1.81 -0.00 0.00 -0.71 0.00 0.00 33.22 31.28 1uq4 n MET 174 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 1uq4 n ILE 175 N -2.18 0.07 0.03 2.02 5.41 -0.43 -4.56 119.36 119.71 1uq4 n ILE 175 Ca 0.04 0.14 -0.12 0.00 1.00 0.00 0.00 62.75 63.80 1uq4 n ILE 175 Cb 0.32 -1.16 -0.08 0.00 -0.71 0.00 0.00 39.64 38.02 1uq4 n ILE 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1uq4 h SER 176 N -0.01 -0.00 -0.11 4.38 0.02 -1.16 -0.95 113.55 115.72 1uq4 h SER 176 Ca 0.00 -0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.69 1uq4 h SER 176 Cb 0.01 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1uq4 h SER 176 CO 0.00 0.12 -0.40 -0.33 -1.14 0.00 0.00 176.83 175.08 1uq4 h GLU 177 N -0.12 0.64 -0.72 3.45 4.39 -1.30 -1.21 114.58 119.71 1uq4 h GLU 177 Ca -0.00 -0.33 -0.05 0.00 0.34 0.00 0.00 59.36 59.32 1uq4 h GLU 177 Cb 0.12 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.75 1uq4 h GLU 177 CO 0.00 0.93 0.25 0.00 -1.16 0.00 0.00 179.01 179.03 1uq4 h ALA 178 N 1.03 1.08 -0.77 3.43 0.00 -1.44 -0.55 119.26 122.03 1uq4 h ALA 178 Ca 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1uq4 h ALA 178 Cb 0.93 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1uq4 h ALA 178 CO 0.08 0.64 0.35 0.00 0.00 0.00 0.00 179.25 180.32 1uq4 h ALA 179 N 1.21 1.00 -0.13 0.00 0.00 -0.91 -2.98 119.26 117.45 1uq4 h ALA 179 Ca 0.24 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1uq4 h ALA 179 Cb 0.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1uq4 h ALA 179 CO -0.01 0.59 -0.31 0.00 0.00 0.00 0.00 179.25 179.51 1uq4 h ARG 180 N 1.10 0.25 -3.77 0.00 3.08 -0.88 -3.40 114.38 110.77 1uq4 h ARG 180 Ca 0.26 -0.10 -0.49 0.00 0.07 0.00 0.00 59.98 59.73 1uq4 h ARG 180 Cb 0.16 -0.01 -0.39 0.00 0.08 0.00 0.00 29.97 29.81 1uq4 h ARG 180 CO -0.03 0.54 -0.77 -0.06 -1.07 0.00 0.00 179.97 178.58 1uq4 s PHE 181 N -4.34 1.02 0.53 3.04 0.08 -0.24 0.43 117.98 118.50 1uq4 s PHE 181 Ca -0.05 -0.59 0.26 0.00 0.12 0.00 0.00 56.93 56.68 1uq4 s PHE 181 Cb 0.14 -0.99 1.41 0.00 -0.57 0.00 0.00 43.02 43.01 1uq4 s PHE 181 CO 0.76 -0.48 1.98 1.96 -0.10 0.00 0.00 175.22 179.34 1uq4 h GLN 182 N 8.26 0.00 -0.57 0.44 7.50 -1.43 -1.25 115.11 128.05 1uq4 h GLN 182 Ca -0.20 0.00 -0.09 0.00 0.50 0.00 0.00 58.65 58.86 1uq4 h GLN 182 Cb 1.12 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.63 1uq4 h GLN 182 CO 0.32 0.00 0.01 -0.92 -1.50 0.00 0.00 178.83 176.74 1uq4 h TYR 183 N 0.00 1.09 -0.02 2.96 5.03 -1.67 0.49 116.97 124.85 1uq4 h TYR 183 Ca 0.27 -0.18 -0.24 0.00 2.58 0.00 0.00 58.73 61.15 1uq4 h TYR 183 Cb 1.09 -0.29 0.02 0.00 1.55 0.00 0.00 36.73 39.11 1uq4 h TYR 183 CO 0.00 0.97 -0.94 0.82 -1.32 0.00 0.00 178.16 177.69 1uq4 h ILE 184 N 0.89 1.30 -0.77 1.81 2.04 -1.66 -1.48 117.51 119.64 1uq4 h ILE 184 Ca 0.16 -2.18 0.18 0.00 1.00 0.00 0.00 64.86 64.02 1uq4 h ILE 184 Cb 0.53 2.37 -0.13 0.00 -0.74 0.00 0.00 36.82 38.85 1uq4 h ILE 184 CO 0.03 0.67 0.05 -0.08 0.00 0.00 0.00 178.15 178.82 1uq4 h GLU 185 N 0.33 0.13 -0.73 2.37 4.81 -1.14 -1.18 114.58 119.16 1uq4 h GLU 185 Ca -0.11 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1uq4 h GLU 185 Cb 1.60 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.92 1uq4 h GLU 185 CO 0.19 0.08 0.42 0.78 -0.73 0.00 0.00 179.01 179.75 1uq4 h GLY 186 N 0.13 1.07 1.17 1.92 0.00 -0.63 -0.25 103.07 106.49 1uq4 h GLY 186 Ca 0.43 -0.46 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 1uq4 h GLY 186 CO -0.65 0.45 0.09 0.83 0.00 0.00 0.00 176.54 177.26 1uq4 h GLU 187 N 1.00 1.01 -0.34 4.80 4.39 -0.62 -1.65 114.58 123.17 1uq4 h GLU 187 Ca 0.26 -0.26 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1uq4 h GLU 187 Cb -0.00 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1uq4 h GLU 187 CO -0.05 0.94 -0.31 0.52 -1.16 0.00 0.00 179.01 178.95 1uq4 h MET 188 N 0.95 0.73 -0.65 2.33 2.86 -0.91 -2.69 114.93 117.54 1uq4 h MET 188 Ca 0.19 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1uq4 h MET 188 Cb 0.43 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.04 1uq4 h MET 188 CO 0.01 0.94 0.36 0.00 1.06 0.00 0.00 176.91 179.28 1uq4 h ARG 189 N 0.61 0.90 -0.55 1.72 3.08 -0.83 -1.57 114.38 117.74 1uq4 h ARG 189 Ca 0.07 -0.10 0.04 0.00 0.07 0.00 0.00 59.98 60.05 1uq4 h ARG 189 Cb 0.83 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 1uq4 h ARG 189 CO 0.07 0.68 0.31 1.15 -1.07 0.00 0.00 179.97 181.11 1uq4 h THR 190 N 0.89 1.01 -0.88 2.04 2.02 -1.29 0.22 112.91 116.92 1uq4 h THR 190 Ca 0.23 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1uq4 h THR 190 Cb 0.04 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 1uq4 h THR 190 CO -0.04 0.11 0.52 0.03 0.37 0.00 0.00 175.52 176.52 1uq4 h ARG 191 N 0.61 1.19 -0.02 6.66 3.08 -1.13 -1.96 114.38 122.82 1uq4 h ARG 191 Ca 0.23 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1uq4 h ARG 191 Cb 0.09 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1uq4 h ARG 191 CO -0.13 0.84 -0.00 0.82 -1.07 0.00 0.00 179.97 180.43 1uq4 h ILE 192 N 1.21 1.25 -0.69 2.04 2.04 -0.95 0.21 117.51 122.62 1uq4 h ILE 192 Ca 0.31 -0.75 0.13 0.00 1.00 0.00 0.00 64.86 65.56 1uq4 h ILE 192 Cb -0.04 1.73 -0.10 0.00 -0.74 0.00 0.00 36.82 37.67 1uq4 h ILE 192 CO -0.06 0.20 0.20 -0.09 0.00 0.00 0.00 178.15 178.40 1uq4 h ARG 193 N -0.28 0.31 -0.35 2.37 2.43 -0.29 -2.82 114.38 115.75 1uq4 h ARG 193 Ca 0.00 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1uq4 h ARG 193 Cb 0.32 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 1uq4 h ARG 193 CO 0.00 0.21 0.02 0.66 -1.51 0.00 0.00 179.97 179.35 1uq4 n TYR 194 N -5.10 1.21 -4.30 2.20 4.01 -0.76 -4.97 117.16 109.46 1uq4 n TYR 194 Ca 0.12 -1.00 -0.35 0.00 -0.16 0.00 0.00 57.90 56.51 1uq4 n TYR 194 Cb 0.39 -0.40 -0.06 0.00 -0.31 0.00 0.00 39.34 38.96 1uq4 n TYR 194 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1uq4 n ASN 195 N -0.48 -1.28 -4.78 7.72 5.15 -0.82 -4.95 115.26 115.81 1uq4 n ASN 195 Ca 0.26 -1.15 -0.36 0.00 -0.60 0.00 0.00 54.58 52.73 1uq4 n ASN 195 Cb 0.99 -2.16 -0.07 0.00 -0.53 0.00 0.00 39.78 38.01 1uq4 n ASN 195 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1uq4 s ARG 196 N -7.08 3.70 -0.10 1.20 3.52 0.68 -5.01 118.95 115.85 1uq4 s ARG 196 Ca 0.46 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.85 1uq4 s ARG 196 Cb -0.26 -3.22 -0.03 0.00 -1.56 0.00 0.00 34.95 29.88 1uq4 s ARG 196 CO 0.97 0.56 -0.09 -0.98 -0.81 0.00 0.00 175.30 174.95 1uq4 s ARG 197 N -0.41 3.05 -0.14 5.12 1.70 -1.26 -4.62 118.95 122.39 1uq4 s ARG 197 Ca 0.11 -0.60 -0.30 0.00 -0.47 0.00 0.00 55.73 54.48 1uq4 s ARG 197 Cb -0.12 -2.63 0.11 0.00 -0.57 0.00 0.00 34.95 31.74 1uq4 s ARG 197 CO 0.01 0.47 0.89 -1.54 -1.08 0.00 0.00 175.30 174.05 1uq4 s SER 198 N -0.29 -0.48 0.57 -2.89 1.04 -0.68 -4.86 113.70 106.10 1uq4 s SER 198 Ca 0.03 0.57 -0.17 0.00 0.48 0.00 0.00 55.95 56.86 1uq4 s SER 198 Cb -0.13 0.46 -0.05 0.00 0.10 0.00 0.00 66.02 66.40 1uq4 s SER 198 CO 0.03 -0.41 1.08 0.00 0.98 0.00 0.00 173.24 174.91 1uq4 s ALA 199 N -0.99 2.72 0.29 5.32 0.00 -1.26 -1.37 121.76 126.47 1uq4 s ALA 199 Ca -0.04 0.56 -0.29 0.00 0.00 0.00 0.00 51.96 52.18 1uq4 s ALA 199 Cb -0.01 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 1uq4 s ALA 199 CO 0.04 -0.76 1.36 -1.25 0.00 0.00 0.00 175.76 175.15 1uq4 s PRO 200 N -3.71 4.31 0.85 0.00 0.04 -1.26 -4.87 135.00 130.35 1uq4 s PRO 200 Ca 0.67 2.25 -0.11 0.00 0.04 0.00 0.00 61.00 63.85 1uq4 s PRO 200 Cb -0.18 -3.09 0.14 0.00 0.04 0.00 0.00 34.50 31.40 1uq4 s PRO 200 CO 0.31 -0.30 1.19 0.16 0.04 0.00 0.00 177.00 178.41 1uq4 s ASP 201 N -0.10 3.91 0.61 6.66 1.47 -1.26 -4.67 116.67 123.30 1uq4 s ASP 201 Ca 0.53 0.35 0.34 0.00 1.18 0.00 0.00 52.55 54.95 1uq4 s ASP 201 Cb -0.41 -0.65 1.99 0.00 -0.34 0.00 0.00 42.92 43.51 1uq4 s ASP 201 CO 0.49 -2.22 2.29 -0.65 0.68 0.00 0.00 175.17 175.76 1uq4 h PRO 202 N -1.17 0.00 -0.74 2.11 0.11 -1.77 -1.84 132.00 128.69 1uq4 h PRO 202 Ca -0.44 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1uq4 h PRO 202 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.35 1uq4 h PRO 202 CO 0.49 0.00 0.30 0.66 -0.21 0.00 0.00 178.00 179.24 1uq4 h SER 203 N 0.00 1.01 -0.01 -2.05 4.64 -1.61 -0.29 113.55 115.24 1uq4 h SER 203 Ca -0.00 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 1uq4 h SER 203 Cb 0.00 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.83 1uq4 h SER 203 CO 0.00 0.90 -0.07 0.58 -0.87 0.00 0.00 176.83 177.37 1uq4 h VAL 204 N 1.08 1.55 -0.41 0.95 2.07 -1.66 -2.57 116.25 117.24 1uq4 h VAL 204 Ca 0.25 -1.70 0.02 0.00 0.82 0.00 0.00 66.70 66.08 1uq4 h VAL 204 Cb 0.20 2.66 -0.03 0.00 -1.52 0.00 0.00 31.29 32.61 1uq4 h VAL 204 CO -0.02 0.45 0.24 0.40 0.02 0.00 0.00 177.57 178.66 1uq4 h ILE 205 N -0.62 1.04 -0.24 4.57 1.08 -1.33 -1.81 117.51 120.22 1uq4 h ILE 205 Ca -0.01 -0.17 -0.16 0.00 -0.39 0.00 0.00 64.86 64.14 1uq4 h ILE 205 Cb 0.78 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 35.03 1uq4 h ILE 205 CO 0.01 0.09 -0.49 0.71 -0.69 0.00 0.00 178.15 177.78 1uq4 h THR 206 N 0.49 1.30 -0.46 -0.27 1.35 -1.10 -0.88 112.91 113.35 1uq4 h THR 206 Ca 0.16 -1.70 0.03 0.00 -0.55 0.00 0.00 66.41 64.35 1uq4 h THR 206 Cb 0.01 1.65 -0.03 0.00 -1.73 0.00 0.00 68.15 68.05 1uq4 h THR 206 CO -0.08 0.54 0.26 -0.07 -0.25 0.00 0.00 175.52 175.92 1uq4 h LEU 207 N 0.51 0.40 -0.18 3.87 3.38 -1.28 0.27 115.31 122.28 1uq4 h LEU 207 Ca 0.02 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1uq4 h LEU 207 Cb 1.04 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1uq4 h LEU 207 CO 0.10 0.29 0.04 -0.33 0.09 0.00 0.00 178.44 178.62 1uq4 h GLU 208 N 0.52 0.11 -0.18 1.13 5.08 -1.03 -1.40 114.58 118.80 1uq4 h GLU 208 Ca 0.19 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 1uq4 h GLU 208 Cb 0.05 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1uq4 h GLU 208 CO -0.11 0.07 -0.07 -0.91 -1.00 0.00 0.00 179.01 177.00 1uq4 h ASN 209 N 0.11 0.26 -0.22 1.42 2.35 -0.98 -2.98 115.58 115.54 1uq4 h ASN 209 Ca 0.08 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1uq4 h ASN 209 Cb 0.07 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1uq4 h ASN 209 CO -0.10 0.37 0.00 -1.20 -1.65 0.00 0.00 177.43 174.85 1uq4 n SER 210 N -4.32 2.65 -0.33 5.81 7.64 0.07 -4.61 113.62 120.53 1uq4 n SER 210 Ca -0.00 -1.86 -0.03 0.00 1.01 0.00 0.00 58.87 57.99 1uq4 n SER 210 Cb 0.23 -0.13 0.10 0.00 -1.01 0.00 0.00 64.21 63.39 1uq4 n SER 210 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1uq4 h TRP 211 N 3.66 1.11 -0.48 1.43 7.01 -1.11 0.13 115.95 127.70 1uq4 h TRP 211 Ca 0.00 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 60.91 1uq4 h TRP 211 Cb 0.80 -0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 1uq4 h TRP 211 CO 0.13 0.68 -0.17 0.78 -2.79 0.00 0.00 178.44 177.08 1uq4 h GLY 212 N 1.19 1.03 1.42 2.65 0.00 -1.84 -1.10 103.07 106.43 1uq4 h GLY 212 Ca 0.33 -0.89 -0.16 0.00 0.00 0.00 0.00 47.33 46.62 1uq4 h GLY 212 CO -0.08 0.81 -0.50 -0.55 0.00 0.00 0.00 176.54 176.22 1uq4 h ASP 213 N 0.80 0.67 -0.70 0.19 3.32 -1.70 -1.36 116.42 117.66 1uq4 h ASP 213 Ca 0.11 -0.34 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 1uq4 h ASP 213 Cb 0.74 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1uq4 h ASP 213 CO 0.06 1.06 0.15 -0.07 -1.72 0.00 0.00 179.24 178.72 1uq4 h LEU 214 N 0.48 1.07 -0.05 1.55 3.38 -0.65 0.56 115.31 121.65 1uq4 h LEU 214 Ca 0.02 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1uq4 h LEU 214 Cb 1.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1uq4 h LEU 214 CO 0.10 1.03 -0.02 0.28 0.09 0.00 0.00 178.44 179.92 1uq4 h SER 215 N 1.06 -0.06 -0.40 -0.43 0.02 -0.99 -1.08 113.55 111.67 1uq4 h SER 215 Ca 0.22 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1uq4 h SER 215 Cb 0.39 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1uq4 h SER 215 CO 0.01 -0.02 0.21 0.74 -1.14 0.00 0.00 176.83 176.62 1uq4 h THR 216 N -0.01 1.16 -0.90 -2.27 2.02 -0.95 -2.17 112.91 109.79 1uq4 h THR 216 Ca 0.03 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1uq4 h THR 216 Cb 0.05 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1uq4 h THR 216 CO -0.06 0.17 0.53 0.00 0.37 0.00 0.00 175.52 176.54 1uq4 h ALA 217 N 1.06 1.15 -0.27 6.16 0.00 -0.74 0.32 119.26 126.95 1uq4 h ALA 217 Ca 0.14 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1uq4 h ALA 217 Cb 0.08 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1uq4 h ALA 217 CO -0.02 0.62 -0.01 0.82 0.00 0.00 0.00 179.25 180.66 1uq4 h ILE 218 N 1.24 1.26 -0.07 0.00 2.04 -1.15 -1.90 117.51 118.95 1uq4 h ILE 218 Ca 0.32 -0.95 -0.13 0.00 1.00 0.00 0.00 64.86 65.10 1uq4 h ILE 218 Cb -0.04 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1uq4 h ILE 218 CO -0.06 0.30 -0.55 1.56 0.00 0.00 0.00 178.15 179.40 1uq4 h GLN 219 N 0.26 0.20 -0.52 2.37 4.20 -0.98 -2.65 115.11 117.99 1uq4 h GLN 219 Ca 0.08 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1uq4 h GLN 219 Cb 0.44 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1uq4 h GLN 219 CO 0.02 0.70 0.00 0.39 -0.67 0.00 0.00 178.83 179.26 1uq4 n GLU 220 N -3.91 2.28 -1.32 1.46 1.02 0.11 -4.83 120.64 115.45 1uq4 n GLU 220 Ca -0.02 -1.99 -0.30 0.00 -0.02 0.00 0.00 57.16 54.83 1uq4 n GLU 220 Cb 0.58 -1.44 0.10 0.00 -0.02 0.00 0.00 31.44 30.65 1uq4 n GLU 220 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1uq4 s SER 221 N -1.08 4.32 -0.66 1.62 1.04 -0.71 -4.89 113.70 113.34 1uq4 s SER 221 Ca 0.37 1.63 -0.17 0.00 0.48 0.00 0.00 55.95 58.26 1uq4 s SER 221 Cb 0.20 -2.35 0.13 0.00 0.10 0.00 0.00 66.02 64.10 1uq4 s SER 221 CO 0.26 -2.12 0.72 0.20 0.98 0.00 0.00 173.24 173.28 1uq4 s ASN 222 N -3.52 6.34 -1.72 7.02 -0.87 -0.09 -4.36 114.94 117.74 1uq4 s ASN 222 Ca 0.61 -1.80 -0.01 0.00 -1.57 0.00 0.00 52.86 50.09 1uq4 s ASN 222 Cb -0.17 -2.28 0.00 0.00 -0.02 0.00 0.00 41.25 38.79 1uq4 s ASN 222 CO 0.56 -0.96 0.19 0.00 -2.57 0.00 0.00 177.10 174.32 1uq4 n GLN 223 N 5.70 -2.69 0.00 -0.60 6.02 -1.26 -1.71 117.38 122.85 1uq4 n GLN 223 Ca -0.03 0.98 0.00 0.00 -0.01 0.00 0.00 57.00 57.94 1uq4 n GLN 223 Cb 0.43 -5.71 0.00 0.00 1.02 0.00 0.00 30.24 25.98 1uq4 n GLN 223 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1uq4 n GLY 224 N -1.17 2.81 3.68 1.08 0.00 -1.26 -5.02 105.19 105.31 1uq4 n GLY 224 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1uq4 n GLY 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uq4 s ALA 225 N -2.61 3.49 0.24 4.61 0.00 -0.69 -1.34 121.76 125.45 1uq4 s ALA 225 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.50 1uq4 s ALA 225 Cb 0.00 -2.91 -0.09 0.00 0.00 0.00 0.00 23.12 20.12 1uq4 s ALA 225 CO 0.00 -0.36 1.07 -0.06 0.00 0.00 0.00 175.76 176.41 1uq4 s PHE 226 N 1.45 3.66 0.27 0.00 0.40 -0.34 -0.91 117.98 122.50 1uq4 s PHE 226 Ca 0.30 1.71 0.00 0.00 -0.60 0.00 0.00 56.93 58.35 1uq4 s PHE 226 Cb -0.16 -3.23 0.39 0.00 0.51 0.00 0.00 43.02 40.53 1uq4 s PHE 226 CO 0.12 -0.38 1.75 0.00 0.70 0.00 0.00 175.22 177.40 1uq4 h ALA 227 N 4.27 1.11 -3.40 5.36 0.00 -1.89 -3.43 119.26 121.30 1uq4 h ALA 227 Ca -0.46 -0.30 -0.44 0.00 0.00 0.00 0.00 54.91 53.72 1uq4 h ALA 227 Cb 1.21 -0.15 -0.35 0.00 0.00 0.00 0.00 17.79 18.50 1uq4 h ALA 227 CO 0.69 0.55 -0.78 -1.12 0.00 0.00 0.00 179.25 178.59 1uq4 s SER 228 N -6.74 1.28 0.54 0.00 0.01 -1.26 -5.14 113.70 102.40 1uq4 s SER 228 Ca -0.08 -0.16 -0.20 0.00 1.31 0.00 0.00 55.95 56.81 1uq4 s SER 228 Cb 0.14 -0.54 -0.05 0.00 0.21 0.00 0.00 66.02 65.78 1uq4 s SER 228 CO 0.80 -0.07 1.21 -2.16 0.41 0.00 0.00 173.24 173.43 1uq4 s PRO 229 N 1.12 3.26 -0.18 12.44 0.04 -1.26 -4.96 135.00 145.45 1uq4 s PRO 229 Ca -0.08 1.85 -0.06 0.00 0.04 0.00 0.00 61.00 62.75 1uq4 s PRO 229 Cb -0.14 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 1uq4 s PRO 229 CO -0.01 -0.98 0.03 0.42 0.04 0.00 0.00 177.00 176.49 1uq4 s ILE 230 N -1.56 4.37 -0.18 0.56 1.01 -0.30 -4.91 121.20 120.19 1uq4 s ILE 230 Ca 0.72 -0.18 -0.20 0.00 0.00 0.00 0.00 60.65 61.00 1uq4 s ILE 230 Cb -0.31 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 1uq4 s ILE 230 CO 0.35 0.45 0.56 -1.10 0.00 0.00 0.00 174.94 175.21 1uq4 s GLN 231 N 0.57 4.23 0.53 2.79 -1.52 -1.26 -0.36 119.66 124.64 1uq4 s GLN 231 Ca 0.01 0.52 0.03 0.00 -1.95 0.00 0.00 55.36 53.97 1uq4 s GLN 231 Cb -0.13 -3.55 0.02 0.00 -0.22 0.00 0.00 33.01 29.13 1uq4 s GLN 231 CO 0.02 -0.13 0.21 -0.51 -0.25 0.00 0.00 175.29 174.63 1uq4 s LEU 232 N 1.56 2.48 0.13 2.90 1.43 0.14 -4.96 118.68 122.36 1uq4 s LEU 232 Ca 0.27 -1.45 0.09 0.00 -1.03 0.00 0.00 54.13 52.00 1uq4 s LEU 232 Cb -0.16 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 1uq4 s LEU 232 CO 0.10 -1.00 -0.21 -1.10 0.23 0.00 0.00 176.35 174.37 1uq4 s GLN 233 N -4.10 1.23 0.90 1.70 -0.21 -1.26 -1.47 119.66 116.44 1uq4 s GLN 233 Ca 0.20 -1.27 -0.14 0.00 0.02 0.00 0.00 55.36 54.17 1uq4 s GLN 233 Cb -0.01 -1.49 0.14 0.00 1.00 0.00 0.00 33.01 32.66 1uq4 s GLN 233 CO 0.12 0.34 1.23 1.03 -2.12 0.00 0.00 175.29 175.88 1uq4 s ARG 234 N -2.18 1.22 0.56 2.91 0.52 -0.02 -3.48 118.95 118.48 1uq4 s ARG 234 Ca 0.11 -0.07 0.28 0.00 -0.52 0.00 0.00 55.73 55.52 1uq4 s ARG 234 Cb -0.09 -1.88 1.47 0.00 0.52 0.00 0.00 34.95 34.97 1uq4 s ARG 234 CO 0.05 -2.08 1.96 0.00 0.02 0.00 0.00 175.30 175.25 1uq4 h ARG 235 N -1.40 0.00 -0.09 3.54 3.08 -1.92 0.22 114.38 117.81 1uq4 h ARG 235 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1uq4 h ARG 235 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1uq4 h ARG 235 CO 0.53 0.00 0.00 0.27 -1.07 0.00 0.00 179.97 179.70 1uq4 n ASN 236 N -4.04 1.67 0.00 7.04 6.94 -1.26 -4.36 115.26 121.25 1uq4 n ASN 236 Ca 0.10 -1.62 0.00 0.00 -0.02 0.00 0.00 54.58 53.03 1uq4 n ASN 236 Cb 0.65 -0.05 0.00 0.00 -2.36 0.00 0.00 39.78 38.01 1uq4 n ASN 236 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1uq4 n GLY 237 N 1.17 0.84 3.78 4.83 0.00 0.76 -5.05 105.19 111.52 1uq4 n GLY 237 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1uq4 n GLY 237 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uq4 s SER 238 N -2.83 5.78 0.44 1.61 1.04 -1.26 -4.66 113.70 113.83 1uq4 s SER 238 Ca 0.00 2.01 -0.24 0.00 0.48 0.00 0.00 55.95 58.20 1uq4 s SER 238 Cb 0.00 -2.56 -0.08 0.00 0.10 0.00 0.00 66.02 63.48 1uq4 s SER 238 CO 0.00 -1.17 1.27 -0.54 0.98 0.00 0.00 173.24 173.77 1uq4 s LYS 239 N -3.58 3.79 -0.07 4.02 1.02 -1.26 -0.84 119.74 122.82 1uq4 s LYS 239 Ca 0.68 2.05 -0.02 0.00 0.02 0.00 0.00 55.97 58.70 1uq4 s LYS 239 Cb -0.20 -2.58 0.03 0.00 -0.52 0.00 0.00 37.83 34.57 1uq4 s LYS 239 CO 0.30 -0.61 0.04 0.12 -0.92 0.00 0.00 175.35 174.28 1uq4 s PHE 240 N -1.35 0.35 -0.08 3.18 2.19 -0.55 -4.76 117.98 116.96 1uq4 s PHE 240 Ca 0.61 -0.02 -0.17 0.00 0.33 0.00 0.00 56.93 57.68 1uq4 s PHE 240 Cb -0.35 -0.65 -0.05 0.00 -1.31 0.00 0.00 43.02 40.66 1uq4 s PHE 240 CO 0.44 -0.30 0.45 -1.12 1.83 0.00 0.00 175.22 176.53 1uq4 s SER 241 N 2.08 6.72 -0.26 6.13 0.01 -1.26 0.26 113.70 127.38 1uq4 s SER 241 Ca 0.04 0.86 -0.06 0.00 1.31 0.00 0.00 55.95 58.10 1uq4 s SER 241 Cb -0.13 -2.27 -0.00 0.00 0.21 0.00 0.00 66.02 63.83 1uq4 s SER 241 CO -0.05 0.11 0.04 -0.69 0.41 0.00 0.00 173.24 173.06 1uq4 s VAL 242 N 0.07 3.84 -0.64 3.43 1.01 0.52 -4.95 120.40 123.67 1uq4 s VAL 242 Ca 0.25 -0.55 0.14 0.00 0.00 0.00 0.00 61.98 61.82 1uq4 s VAL 242 Cb -0.16 -2.88 -0.16 0.00 0.00 0.00 0.00 36.38 33.18 1uq4 s VAL 242 CO 0.11 0.23 0.59 -1.22 0.00 0.00 0.00 175.10 174.81 1uq4 n TYR 243 N 4.85 0.00 -3.57 5.22 4.01 -1.26 -1.15 117.16 125.26 1uq4 n TYR 243 Ca -0.16 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.41 1uq4 n TYR 243 Cb 0.49 -0.02 -0.06 0.00 -0.31 0.00 0.00 39.34 39.44 1uq4 n TYR 243 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1uq4 s ASP 244 N -2.40 -0.56 0.53 7.72 -1.08 -1.26 -1.20 116.67 118.41 1uq4 s ASP 244 Ca 0.05 0.55 0.22 0.00 -0.52 0.00 0.00 52.55 52.85 1uq4 s ASP 244 Cb 0.11 0.49 1.43 0.00 -1.46 0.00 0.00 42.92 43.49 1uq4 s ASP 244 CO 0.58 -0.59 2.14 1.62 0.52 0.00 0.00 175.17 179.44 1uq4 h VAL 245 N 3.13 0.79 -0.83 1.11 3.04 -1.61 -3.23 116.25 118.64 1uq4 h VAL 245 Ca -0.28 -0.25 0.05 0.00 -1.01 0.00 0.00 66.70 65.22 1uq4 h VAL 245 Cb 1.16 1.14 -0.05 0.00 -2.01 0.00 0.00 31.29 31.53 1uq4 h VAL 245 CO 0.39 0.06 0.54 0.77 -1.01 0.00 0.00 177.57 178.33 1uq4 h SER 246 N 0.00 0.84 1.04 3.17 4.64 -1.95 0.76 113.55 122.04 1uq4 h SER 246 Ca -0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uq4 h SER 246 Cb 0.14 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1uq4 h SER 246 CO 0.01 0.56 0.00 0.00 -0.87 0.00 0.00 176.83 176.53 1uq4 n ILE 247 N -4.47 0.69 0.87 0.95 0.13 -1.22 -2.64 119.36 113.67 1uq4 n ILE 247 Ca 0.12 0.01 0.10 0.00 -1.10 0.00 0.00 62.75 61.88 1uq4 n ILE 247 Cb 0.17 -0.88 -0.06 0.00 -0.84 0.00 0.00 39.64 38.03 1uq4 n ILE 247 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 1uq4 n LEU 248 N -2.16 0.80 -0.21 9.51 4.77 0.24 -4.50 117.00 125.46 1uq4 n LEU 248 Ca 0.04 -0.34 0.02 0.00 -0.03 0.00 0.00 56.01 55.70 1uq4 n LEU 248 Cb 0.31 -0.05 0.12 0.00 -2.33 0.00 0.00 43.42 41.48 1uq4 n LEU 248 CO 0.24 0.19 0.87 0.40 -1.33 0.00 0.00 177.39 177.76 1uq4 h ILE 249 N 0.00 0.53 0.00 -0.08 2.04 -1.28 0.21 117.51 118.93 1uq4 h ILE 249 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1uq4 h ILE 249 Cb 0.57 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1uq4 h ILE 249 CO 0.00 0.03 0.00 -2.65 0.00 0.00 0.00 178.15 175.53 1uq4 n PRO 250 N -5.22 0.04 -0.08 2.37 -0.02 -1.26 -4.33 135.00 126.50 1uq4 n PRO 250 Ca 0.10 0.20 -0.15 0.00 -2.02 0.00 0.00 63.50 61.63 1uq4 n PRO 250 Cb 0.37 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.29 1uq4 n PRO 250 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1uq4 n ILE 251 N -1.46 0.87 -4.25 4.25 2.08 0.61 -4.30 119.36 117.14 1uq4 n ILE 251 Ca 0.05 -0.25 -0.34 0.00 0.56 0.00 0.00 62.75 62.76 1uq4 n ILE 251 Cb 0.18 -1.51 -0.11 0.00 -0.75 0.00 0.00 39.64 37.45 1uq4 n ILE 251 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 1uq4 s ILE 252 N -2.29 4.19 -0.12 1.39 2.07 -0.46 -1.46 121.20 124.52 1uq4 s ILE 252 Ca -0.22 -0.25 0.14 0.00 -1.41 0.00 0.00 60.65 58.92 1uq4 s ILE 252 Cb 0.08 -2.86 -0.24 0.00 0.13 0.00 0.00 42.46 39.57 1uq4 s ILE 252 CO 0.30 0.48 0.36 0.00 -1.91 0.00 0.00 174.94 174.17 1uq4 n ALA 253 N 3.57 1.48 -3.25 1.50 0.00 0.17 -4.77 120.51 119.20 1uq4 n ALA 253 Ca -0.17 -1.03 -0.14 0.00 0.00 0.00 0.00 53.44 52.10 1uq4 n ALA 253 Cb 0.52 -0.52 -0.08 0.00 0.00 0.00 0.00 19.45 19.38 1uq4 n ALA 253 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1uq4 s LEU 254 N -5.84 0.48 0.09 0.00 0.05 -1.01 -3.94 118.68 108.51 1uq4 s LEU 254 Ca -0.08 0.16 0.08 0.00 0.05 0.00 0.00 54.13 54.34 1uq4 s LEU 254 Cb 0.07 1.61 -0.03 0.00 -2.05 0.00 0.00 46.19 45.79 1uq4 s LEU 254 CO 0.82 -0.54 -0.21 -0.04 -0.55 0.00 0.00 176.35 175.84 1uq4 s MET 255 N -1.66 1.15 0.33 1.48 -1.94 -0.58 -4.84 119.30 113.23 1uq4 s MET 255 Ca -0.11 -1.13 -0.29 0.00 -1.71 0.00 0.00 55.69 52.46 1uq4 s MET 255 Cb -0.03 -1.39 -0.10 0.00 2.01 0.00 0.00 34.83 35.32 1uq4 s MET 255 CO 0.03 0.33 1.26 0.54 -0.01 0.00 0.00 175.02 177.16 1uq4 s VAL 256 N -1.12 2.89 0.06 -6.03 0.11 -1.26 -0.38 120.40 114.68 1uq4 s VAL 256 Ca 0.06 0.89 -0.31 0.00 -2.93 0.00 0.00 61.98 59.70 1uq4 s VAL 256 Cb -0.10 -3.56 -0.07 0.00 -1.53 0.00 0.00 36.38 31.12 1uq4 s VAL 256 CO 0.04 0.20 1.44 -0.47 -3.33 0.00 0.00 175.10 172.98 1uq4 s TYR 257 N -1.16 2.95 -0.00 1.54 6.14 -1.26 -4.81 117.35 120.74 1uq4 s TYR 257 Ca 0.49 0.79 0.00 0.00 0.64 0.00 0.00 57.07 58.99 1uq4 s TYR 257 Cb -0.38 -3.72 -0.00 0.00 0.42 0.00 0.00 41.96 38.28 1uq4 s TYR 257 CO 0.50 -2.67 -0.00 0.54 0.64 0.00 0.00 175.55 174.56 1uq4 n ARG 258 N 4.80 2.99 -3.60 4.97 5.12 -1.26 -4.96 116.66 124.72 1uq4 n ARG 258 Ca 0.13 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.95 1uq4 n ARG 258 Cb 0.42 -1.00 -0.03 0.00 -1.16 0.00 0.00 32.46 30.69 1uq4 n ARG 258 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1uq4 n ALA 260 N -0.35 1.72 -1.77 0.00 0.00 -1.26 -4.99 120.51 113.87 1uq4 n ALA 260 Ca -0.13 0.27 -0.40 0.00 0.00 0.00 0.00 53.44 53.18 1uq4 n ALA 260 Cb 0.63 -2.34 -0.02 0.00 0.00 0.00 0.00 19.45 17.73 1uq4 n ALA 260 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1uq4 s PRO 261 N -2.27 4.27 0.84 0.00 0.04 -1.26 -4.99 135.00 131.63 1uq4 s PRO 261 Ca 0.60 2.22 -0.11 0.00 0.04 0.00 0.00 61.00 63.74 1uq4 s PRO 261 Cb -0.48 -3.01 0.09 0.00 0.04 0.00 0.00 34.50 31.14 1uq4 s PRO 261 CO 0.59 -0.26 1.09 -1.25 0.04 0.00 0.00 177.00 177.21 1uq4 s PRO 262 N -1.89 1.74 0.66 0.56 0.04 -1.26 -4.96 135.00 129.88 1uq4 s PRO 262 Ca 0.51 0.74 -0.17 0.00 0.04 0.00 0.00 61.00 62.11 1uq4 s PRO 262 Cb -0.40 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 1uq4 s PRO 262 CO 0.53 -1.88 0.44 -2.30 0.04 0.00 0.00 177.00 173.83 1uq4 n PRO 263 N -3.63 0.36 -0.21 0.56 -0.02 -1.26 -4.84 135.00 125.96 1uq4 n PRO 263 Ca 0.07 0.15 0.02 0.00 -2.02 0.00 0.00 63.50 61.72 1uq4 n PRO 263 Cb 0.56 -1.70 0.13 0.00 -0.02 0.00 0.00 33.50 32.46 1uq4 n PRO 263 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1uq4 h SER 264 N -0.12 -0.06 -7.05 2.55 0.02 -2.05 -3.45 113.55 103.39 1uq4 h SER 264 Ca -0.45 0.13 -0.61 0.00 -0.84 0.00 0.00 61.79 60.02 1uq4 h SER 264 Cb 1.37 0.19 -0.19 0.00 0.14 0.00 0.00 62.40 63.92 1uq4 h SER 264 CO 0.44 -0.03 -0.97 -1.20 -1.14 0.00 0.00 176.83 173.93 1uq4 n SER 265 N -5.17 0.49 -4.78 3.07 7.64 -1.26 -4.93 113.62 108.67 1uq4 n SER 265 Ca 0.10 -1.27 -0.33 0.00 1.01 0.00 0.00 58.87 58.39 1uq4 n SER 265 Cb 0.37 -1.67 0.05 0.00 -1.01 0.00 0.00 64.21 61.94 1uq4 n SER 265 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1uq4 s GLN 266 N -7.35 2.82 0.00 1.43 -1.52 -1.26 -5.18 119.66 108.60 1uq4 s GLN 266 Ca 0.04 1.31 0.06 0.00 -1.95 0.00 0.00 55.36 54.82 1uq4 s GLN 266 Cb -0.02 -1.96 0.36 0.00 -0.22 0.00 0.00 33.01 31.17 1uq4 s GLN 266 CO 0.99 -1.22 0.83 0.34 -0.25 0.00 0.00 175.29 175.97