#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sx4 n ALA 3 N 0.00 1.10 -2.69 0.00 0.00 -1.26 -4.95 120.51 112.71 1sx4 n ALA 3 Ca 0.00 0.28 -0.25 0.00 0.00 0.00 0.00 53.44 53.47 1sx4 n ALA 3 Cb 0.00 -2.23 -0.07 0.00 0.00 0.00 0.00 19.45 17.15 1sx4 n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1sx4 s LYS 4 N -2.11 2.50 -0.30 0.00 -0.14 -1.26 -2.94 119.74 115.49 1sx4 s LYS 4 Ca 0.60 -1.13 -0.04 0.00 -1.36 0.00 0.00 55.97 54.04 1sx4 s LYS 4 Cb -0.53 -2.38 0.04 0.00 -1.68 0.00 0.00 37.83 33.28 1sx4 s LYS 4 CO 0.59 0.43 0.04 0.34 -0.76 0.00 0.00 175.35 175.99 1sx4 s ASP 5 N -3.21 4.97 -0.17 2.83 -1.08 0.57 -4.72 116.67 115.86 1sx4 s ASP 5 Ca 0.29 -1.06 -0.08 0.00 -0.52 0.00 0.00 52.55 51.17 1sx4 s ASP 5 Cb -0.09 -1.78 -0.05 0.00 -1.46 0.00 0.00 42.92 39.55 1sx4 s ASP 5 CO 0.20 -0.25 0.12 0.68 0.52 0.00 0.00 175.17 176.44 1sx4 s VAL 6 N 1.36 5.30 -0.02 1.11 -7.23 -1.26 -2.49 120.40 117.16 1sx4 s VAL 6 Ca -0.02 0.14 0.07 0.00 -1.81 0.00 0.00 61.98 60.36 1sx4 s VAL 6 Cb -0.19 -3.38 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 1sx4 s VAL 6 CO 0.00 0.50 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.52 1sx4 s LYS 7 N -0.07 1.92 0.48 4.82 1.02 0.15 -4.97 119.74 123.10 1sx4 s LYS 7 Ca 0.09 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.30 1sx4 s LYS 7 Cb -0.11 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.34 1sx4 s LYS 7 CO 0.00 0.48 0.08 -0.06 -0.92 0.00 0.00 175.35 174.92 1sx4 s PHE 8 N -0.48 2.10 0.00 3.18 0.40 -1.26 -0.73 117.98 121.18 1sx4 s PHE 8 Ca 0.07 -0.82 0.00 0.00 -0.60 0.00 0.00 56.93 55.58 1sx4 s PHE 8 Cb -0.09 -1.74 0.00 0.00 0.51 0.00 0.00 43.02 41.70 1sx4 s PHE 8 CO -0.00 0.19 0.00 0.41 0.70 0.00 0.00 175.22 176.52 1sx4 n GLY 9 N -1.25 0.00 0.18 4.36 0.00 0.27 -0.93 105.19 107.81 1sx4 n GLY 9 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 1sx4 n GLY 9 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1sx4 h ASN 10 N 0.00 0.51 -0.17 1.61 -1.24 -1.95 0.68 115.58 115.01 1sx4 h ASN 10 Ca 0.00 -0.27 0.02 0.00 0.71 0.00 0.00 56.30 56.75 1sx4 h ASN 10 Cb 0.00 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 1sx4 h ASN 10 CO 0.00 0.66 -0.10 0.47 -1.29 0.00 0.00 177.43 177.16 1sx4 n ASP 11 N -4.60 -0.18 -0.25 1.15 9.92 -1.24 0.13 116.55 121.48 1sx4 n ASP 11 Ca -0.02 0.60 -0.05 0.00 -0.53 0.00 0.00 54.79 54.79 1sx4 n ASP 11 Cb 0.23 -0.19 0.10 0.00 -0.64 0.00 0.00 41.12 40.62 1sx4 n ASP 11 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1sx4 h ALA 12 N -0.21 1.09 0.36 2.24 0.00 0.96 -3.01 119.26 120.69 1sx4 h ALA 12 Ca 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1sx4 h ALA 12 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1sx4 h ALA 12 CO -0.16 0.64 -0.27 0.00 0.00 0.00 0.00 179.25 179.46 1sx4 h ARG 13 N 1.08 -0.60 -0.63 0.00 3.08 -0.75 -0.85 114.38 115.71 1sx4 h ARG 13 Ca 0.24 0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.45 1sx4 h ARG 13 Cb 0.24 0.14 -0.12 0.00 0.08 0.00 0.00 29.97 30.30 1sx4 h ARG 13 CO -0.02 -0.40 -0.29 0.28 -1.07 0.00 0.00 179.97 178.47 1sx4 h VAL 14 N -0.62 0.20 -0.33 2.04 2.07 -0.19 0.26 116.25 119.67 1sx4 h VAL 14 Ca -0.03 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1sx4 h VAL 14 Cb 0.54 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1sx4 h VAL 14 CO 0.00 0.00 0.20 0.11 0.02 0.00 0.00 177.57 177.91 1sx4 h LYS 15 N -0.12 0.40 -0.99 1.57 1.79 -1.40 -1.09 116.57 116.74 1sx4 h LYS 15 Ca 0.26 -0.02 0.21 0.00 -2.18 0.00 0.00 60.65 58.92 1sx4 h LYS 15 Cb 0.54 -0.09 -0.09 0.00 -1.58 0.00 0.00 32.23 31.01 1sx4 h LYS 15 CO -0.70 0.27 0.62 1.98 -1.08 0.00 0.00 179.45 180.54 1sx4 h MET 16 N 0.41 0.57 0.10 3.15 4.05 0.70 -2.33 114.93 121.59 1sx4 h MET 16 Ca 0.13 -0.03 -0.16 0.00 -0.28 0.00 0.00 59.70 59.36 1sx4 h MET 16 Cb -0.02 -0.13 0.02 0.00 -0.80 0.00 0.00 31.60 30.67 1sx4 h MET 16 CO -0.05 0.38 -0.67 1.25 0.23 0.00 0.00 176.91 178.05 1sx4 h LEU 17 N 0.59 0.42 -1.47 3.39 5.85 0.61 -1.77 115.31 122.93 1sx4 h LEU 17 Ca 0.56 -0.92 0.39 0.00 0.84 0.00 0.00 57.88 58.74 1sx4 h LEU 17 Cb 1.11 -0.13 -0.11 0.00 0.37 0.00 0.00 40.66 41.89 1sx4 h LEU 17 CO -0.31 1.31 0.83 0.03 -0.34 0.00 0.00 178.44 179.95 1sx4 h ARG 18 N -0.40 0.15 0.61 1.25 3.08 -1.10 0.81 114.38 118.79 1sx4 h ARG 18 Ca -0.11 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1sx4 h ARG 18 Cb 1.50 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 31.52 1sx4 h ARG 18 CO 0.13 0.10 -0.29 0.78 -1.07 0.00 0.00 179.97 179.61 1sx4 h GLY 19 N 0.16 -0.86 0.34 0.04 0.00 -1.09 0.99 103.07 102.65 1sx4 h GLY 19 Ca 0.75 0.32 0.15 0.00 0.00 0.00 0.00 47.33 48.54 1sx4 h GLY 19 CO -0.34 -0.31 0.62 -2.08 0.00 0.00 0.00 176.54 174.43 1sx4 h VAL 20 N -1.12 0.84 -0.41 4.60 2.07 -0.20 -2.50 116.25 119.52 1sx4 h VAL 20 Ca -0.08 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 1sx4 h VAL 20 Cb 0.67 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1sx4 h VAL 20 CO 0.14 0.17 0.07 0.78 0.02 0.00 0.00 177.57 178.74 1sx4 h ASN 21 N 0.91 0.66 -0.13 0.57 -0.26 0.11 0.75 115.58 118.18 1sx4 h ASN 21 Ca 0.53 -0.26 -0.01 0.00 -0.56 0.00 0.00 56.30 56.00 1sx4 h ASN 21 Cb 0.64 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.72 1sx4 h ASN 21 CO -0.31 0.75 0.04 0.58 -1.06 0.00 0.00 177.43 177.43 1sx4 h VAL 22 N 0.54 1.18 0.60 2.81 2.07 -0.38 0.21 116.25 123.28 1sx4 h VAL 22 Ca 0.13 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1sx4 h VAL 22 Cb 0.38 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1sx4 h VAL 22 CO 0.01 0.16 -0.43 0.25 0.02 0.00 0.00 177.57 177.58 1sx4 h LEU 23 N 0.03 -1.13 -0.67 2.57 7.12 -1.38 -2.85 115.31 118.99 1sx4 h LEU 23 Ca 0.04 0.08 0.11 0.00 0.13 0.00 0.00 57.88 58.24 1sx4 h LEU 23 Cb 0.22 0.35 -0.08 0.00 -0.53 0.00 0.00 40.66 40.61 1sx4 h LEU 23 CO -0.00 -0.64 0.25 0.00 -0.13 0.00 0.00 178.44 177.92 1sx4 h ALA 24 N -0.77 0.89 -0.79 1.25 0.00 0.13 0.28 119.26 120.25 1sx4 h ALA 24 Ca -0.07 0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1sx4 h ALA 24 Cb 0.83 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1sx4 h ALA 24 CO 0.03 -0.21 0.52 -0.44 0.00 0.00 0.00 179.25 179.16 1sx4 h ASP 25 N 0.41 0.87 0.77 0.00 5.19 -0.56 0.23 116.42 123.33 1sx4 h ASP 25 Ca 0.35 -0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.71 1sx4 h ASP 25 Cb 0.48 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 1sx4 h ASP 25 CO -0.36 0.61 -0.18 0.00 -3.12 0.00 0.00 179.24 176.19 1sx4 h ALA 26 N 1.52 1.08 0.12 3.45 0.00 -0.24 -3.06 119.26 122.13 1sx4 h ALA 26 Ca 0.30 -0.17 -0.32 0.00 0.00 0.00 0.00 54.91 54.73 1sx4 h ALA 26 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1sx4 h ALA 26 CO -0.08 0.23 -1.70 0.28 0.00 0.00 0.00 179.25 177.98 1sx4 h VAL 27 N 0.00 0.82 -0.98 0.00 2.07 0.38 -3.33 116.25 115.21 1sx4 h VAL 27 Ca -0.00 -2.36 0.27 0.00 0.82 0.00 0.00 66.70 65.42 1sx4 h VAL 27 Cb 0.62 2.56 -0.13 0.00 -1.52 0.00 0.00 31.29 32.82 1sx4 h VAL 27 CO 0.02 0.76 0.53 0.11 0.02 0.00 0.00 177.57 179.01 1sx4 h LYS 28 N -0.17 0.42 0.00 1.57 1.57 -1.08 -2.67 116.57 116.21 1sx4 h LYS 28 Ca -0.37 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 1sx4 h LYS 28 Cb 1.87 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 34.09 1sx4 h LYS 28 CO 0.05 0.28 0.21 -0.39 -0.57 0.00 0.00 179.45 179.03 1sx4 h VAL 29 N 0.43 0.00 -0.47 0.50 -1.51 -1.65 -0.99 116.25 112.57 1sx4 h VAL 29 Ca 0.66 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 66.07 1sx4 h VAL 29 Cb 1.35 0.78 -0.04 0.00 -2.13 0.00 0.00 31.29 31.25 1sx4 h VAL 29 CO -0.54 0.00 0.08 0.35 -1.23 0.00 0.00 177.57 176.22 1sx4 n THR 30 N -2.94 2.10 -3.70 7.19 -2.24 -1.01 -1.90 114.28 111.78 1sx4 n THR 30 Ca -0.02 -1.07 -0.37 0.00 -2.27 0.00 0.00 64.05 60.31 1sx4 n THR 30 Cb 0.27 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 1sx4 n THR 30 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1sx4 s LEU 31 N -2.06 4.35 0.12 3.22 2.96 -0.38 -4.62 118.68 122.27 1sx4 s LEU 31 Ca 0.40 0.55 0.00 0.00 -0.22 0.00 0.00 54.13 54.86 1sx4 s LEU 31 Cb 0.31 -2.25 0.00 0.00 0.50 0.00 0.00 46.19 44.75 1sx4 s LEU 31 CO 0.11 0.29 0.00 0.61 -1.32 0.00 0.00 176.35 176.04 1sx4 n GLY 32 N 2.48 -1.63 0.34 7.98 0.00 -1.26 -3.71 105.19 109.39 1sx4 n GLY 32 Ca -0.16 -1.41 -0.04 0.00 0.00 0.00 0.00 46.02 44.41 1sx4 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1sx4 h PRO 33 N -0.43 1.16 -0.99 1.61 0.13 -1.92 0.52 132.00 132.08 1sx4 h PRO 33 Ca 0.00 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1sx4 h PRO 33 Cb 0.42 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1sx4 h PRO 33 CO 0.01 0.79 0.00 1.63 -0.23 0.00 0.00 178.00 180.19 1sx4 n LYS 34 N -4.45 0.86 -1.08 0.86 5.02 -1.26 -4.89 118.16 113.22 1sx4 n LYS 34 Ca 0.09 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.07 1sx4 n LYS 34 Cb 0.03 -1.27 0.12 0.00 -0.02 0.00 0.00 35.03 33.90 1sx4 n LYS 34 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1sx4 s GLY 35 N 0.38 1.80 0.44 0.72 0.00 0.18 -4.66 107.32 106.18 1sx4 s GLY 35 Ca 0.00 0.50 0.04 0.00 0.00 0.00 0.00 44.72 45.26 1sx4 s GLY 35 CO 0.00 0.89 0.02 0.50 0.00 0.00 0.00 173.10 174.51 1sx4 s ARG 36 N -4.61 2.02 0.19 2.90 0.52 -0.80 -4.93 118.95 114.24 1sx4 s ARG 36 Ca 0.66 -2.22 0.06 0.00 -0.52 0.00 0.00 55.73 53.70 1sx4 s ARG 36 Cb -0.21 -1.40 -0.04 0.00 0.52 0.00 0.00 34.95 33.81 1sx4 s ARG 36 CO 0.54 -0.24 0.13 -0.80 0.02 0.00 0.00 175.30 174.96 1sx4 s ASN 37 N -3.75 5.41 0.15 0.23 0.01 -1.26 -3.94 114.94 111.79 1sx4 s ASN 37 Ca 0.22 -0.21 0.09 0.00 -0.71 0.00 0.00 52.86 52.25 1sx4 s ASN 37 Cb 0.06 -1.37 -0.04 0.00 0.41 0.00 0.00 41.25 40.31 1sx4 s ASN 37 CO 0.11 0.04 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.93 1sx4 s VAL 38 N -1.87 3.11 -0.15 1.60 1.01 -0.31 -4.93 120.40 118.86 1sx4 s VAL 38 Ca 0.31 -1.56 -0.00 0.00 0.00 0.00 0.00 61.98 60.73 1sx4 s VAL 38 Cb -0.09 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1sx4 s VAL 38 CO 0.23 -0.01 -0.14 -0.69 0.00 0.00 0.00 175.10 174.49 1sx4 s VAL 39 N -1.47 2.88 -0.10 2.92 1.01 -1.26 -1.26 120.40 123.12 1sx4 s VAL 39 Ca 0.22 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1sx4 s VAL 39 Cb -0.10 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 1sx4 s VAL 39 CO 0.13 0.51 -0.16 -0.76 0.00 0.00 0.00 175.10 174.82 1sx4 s LEU 40 N 0.64 2.54 0.88 3.92 1.43 -0.58 -4.98 118.68 122.54 1sx4 s LEU 40 Ca -0.07 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 52.54 1sx4 s LEU 40 Cb -0.16 -1.54 0.16 0.00 0.03 0.00 0.00 46.19 44.69 1sx4 s LEU 40 CO 0.03 0.21 1.23 -0.62 0.23 0.00 0.00 176.35 177.42 1sx4 s ASP 41 N 0.08 3.62 -0.30 2.29 -1.08 -1.26 -2.01 116.67 118.00 1sx4 s ASP 41 Ca -0.07 0.22 -0.08 0.00 -0.52 0.00 0.00 52.55 52.10 1sx4 s ASP 41 Cb -0.15 -0.42 0.15 0.00 -1.46 0.00 0.00 42.92 41.03 1sx4 s ASP 41 CO 0.05 -2.40 0.67 -0.54 0.52 0.00 0.00 175.17 173.47 1sx4 s LYS 42 N -5.67 0.55 0.25 4.34 1.02 -1.26 -4.80 119.74 114.16 1sx4 s LYS 42 Ca 0.70 1.30 -0.06 0.00 0.02 0.00 0.00 55.97 57.93 1sx4 s LYS 42 Cb -0.05 0.77 0.28 0.00 -0.52 0.00 0.00 37.83 38.30 1sx4 s LYS 42 CO 0.50 -0.28 1.91 0.66 -0.92 0.00 0.00 175.35 177.22 1sx4 h SER 43 N 7.97 1.07 0.00 2.83 4.64 -1.99 -3.26 113.55 124.81 1sx4 h SER 43 Ca -0.19 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1sx4 h SER 43 Cb 1.11 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1sx4 h SER 43 CO 0.13 0.75 0.00 0.49 -0.87 0.00 0.00 176.83 177.33 1sx4 n PHE 44 N -4.45 0.00 -0.86 4.77 3.72 -1.26 -5.02 117.46 114.36 1sx4 n PHE 44 Ca 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.52 1sx4 n PHE 44 Cb 0.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1sx4 n PHE 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sx4 n GLY 45 N 0.00 5.58 3.62 1.37 0.00 -1.23 -5.12 105.19 109.41 1sx4 n GLY 45 Ca 0.00 -1.02 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 1sx4 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sx4 n ALA 46 N -3.00 0.28 -0.45 4.61 0.00 -1.26 -4.55 120.51 116.14 1sx4 n ALA 46 Ca 0.00 0.14 -0.27 0.00 0.00 0.00 0.00 53.44 53.31 1sx4 n ALA 46 Cb 0.00 -2.11 0.22 0.00 0.00 0.00 0.00 19.45 17.57 1sx4 n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1sx4 n PRO 47 N -0.32 -3.03 -4.25 0.00 -0.02 -1.26 -4.75 135.00 121.36 1sx4 n PRO 47 Ca 0.11 -0.89 -0.27 0.00 -2.02 0.00 0.00 63.50 60.43 1sx4 n PRO 47 Cb 0.43 -1.79 -0.17 0.00 -0.02 0.00 0.00 33.50 31.95 1sx4 n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1sx4 s THR 48 N -2.18 1.30 -0.25 3.45 2.01 -0.85 -4.94 115.64 114.17 1sx4 s THR 48 Ca 0.57 -0.50 -0.11 0.00 0.31 0.00 0.00 61.69 61.95 1sx4 s THR 48 Cb -0.13 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.11 1sx4 s THR 48 CO 0.54 0.40 0.19 -0.63 -0.69 0.00 0.00 174.62 174.44 1sx4 s ILE 49 N 1.21 5.33 0.05 1.82 1.01 -1.26 -1.52 121.20 127.84 1sx4 s ILE 49 Ca -0.03 0.23 -0.05 0.00 0.00 0.00 0.00 60.65 60.79 1sx4 s ILE 49 Cb -0.14 -3.53 -0.01 0.00 0.01 0.00 0.00 42.46 38.79 1sx4 s ILE 49 CO -0.04 0.31 0.09 0.28 0.00 0.00 0.00 174.94 175.58 1sx4 s THR 50 N 1.29 0.15 -1.03 2.92 -1.32 -0.39 -4.49 115.64 112.76 1sx4 s THR 50 Ca 0.08 -1.20 0.13 0.00 -1.21 0.00 0.00 61.69 59.50 1sx4 s THR 50 Cb -0.14 -1.04 0.38 0.00 -1.51 0.00 0.00 72.50 70.19 1sx4 s THR 50 CO 0.07 -0.66 1.32 1.17 -2.21 0.00 0.00 174.62 174.30 1sx4 n LYS 51 N 0.56 2.89 -3.67 7.08 4.81 -1.26 -1.16 118.16 127.40 1sx4 n LYS 51 Ca -0.18 -2.21 -0.39 0.00 -0.87 0.00 0.00 58.31 54.66 1sx4 n LYS 51 Cb 0.59 -1.37 -0.11 0.00 0.02 0.00 0.00 35.03 34.17 1sx4 n LYS 51 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1sx4 s ASP 52 N -1.06 5.50 0.25 3.14 2.15 -1.26 -4.85 116.67 120.55 1sx4 s ASP 52 Ca 0.29 -1.35 -0.09 0.00 0.43 0.00 0.00 52.55 51.83 1sx4 s ASP 52 Cb 0.16 -1.93 0.42 0.00 -0.30 0.00 0.00 42.92 41.26 1sx4 s ASP 52 CO 0.18 -0.44 1.60 1.23 -0.17 0.00 0.00 175.17 177.57 1sx4 h GLY 53 N 8.31 0.71 2.00 2.66 0.00 -1.92 0.10 103.07 114.94 1sx4 h GLY 53 Ca -0.23 0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 1sx4 h GLY 53 CO 0.68 -0.33 -0.25 -0.24 0.00 0.00 0.00 176.54 176.40 1sx4 h VAL 54 N 0.02 0.73 -0.12 4.60 3.04 -1.87 0.11 116.25 122.76 1sx4 h VAL 54 Ca 0.42 -1.04 -0.04 0.00 -1.01 0.00 0.00 66.70 65.04 1sx4 h VAL 54 Cb 0.70 1.65 -0.00 0.00 -2.01 0.00 0.00 31.29 31.63 1sx4 h VAL 54 CO -0.83 0.24 -0.07 0.28 -1.01 0.00 0.00 177.57 176.18 1sx4 h SER 55 N 0.00 0.26 -0.21 3.17 0.02 -1.21 -2.58 113.55 113.01 1sx4 h SER 55 Ca -0.00 -0.43 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 1sx4 h SER 55 Cb 0.63 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1sx4 h SER 55 CO 0.03 0.64 0.11 0.58 -1.14 0.00 0.00 176.83 177.05 1sx4 h VAL 56 N -0.11 1.12 0.65 2.27 2.07 -1.15 -3.31 116.25 117.80 1sx4 h VAL 56 Ca 0.02 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 1sx4 h VAL 56 Cb 0.55 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1sx4 h VAL 56 CO 0.02 0.12 -0.40 0.00 0.02 0.00 0.00 177.57 177.33 1sx4 h ALA 57 N 0.98 -1.02 -0.58 1.67 0.00 -0.73 -1.25 119.26 118.33 1sx4 h ALA 57 Ca 0.07 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 54.95 1sx4 h ALA 57 Cb 0.09 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1sx4 h ALA 57 CO -0.01 -1.09 1.11 0.54 0.00 0.00 0.00 179.25 179.80 1sx4 n ARG 58 N -5.54 0.02 0.10 0.00 5.12 -0.98 0.05 116.66 115.43 1sx4 n ARG 58 Ca -0.13 0.97 0.12 0.00 -1.93 0.00 0.00 57.85 56.88 1sx4 n ARG 58 Cb 0.43 -2.51 0.22 0.00 -1.16 0.00 0.00 32.46 29.43 1sx4 n ARG 58 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1sx4 h GLU 59 N 0.00 0.00 -6.41 5.56 4.39 -1.32 -3.46 114.58 113.34 1sx4 h GLU 59 Ca 0.27 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.44 1sx4 h GLU 59 Cb 2.49 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 31.12 1sx4 h GLU 59 CO -0.00 0.00 0.33 0.42 -1.16 0.00 0.00 179.01 178.60 1sx4 s ILE 60 N -3.18 4.79 -0.15 3.13 -1.09 0.11 -5.00 121.20 119.81 1sx4 s ILE 60 Ca 0.07 1.99 -0.12 0.00 -2.23 0.00 0.00 60.65 60.36 1sx4 s ILE 60 Cb 0.12 -4.29 0.04 0.00 -1.58 0.00 0.00 42.46 36.75 1sx4 s ILE 60 CO 0.69 0.21 0.39 -0.70 -1.23 0.00 0.00 174.94 174.30 1sx4 s GLU 61 N 0.70 0.43 0.35 2.79 2.12 -1.26 -4.90 118.70 118.93 1sx4 s GLU 61 Ca 0.49 0.60 0.09 0.00 0.36 0.00 0.00 54.97 56.50 1sx4 s GLU 61 Cb -0.21 0.16 -0.05 0.00 0.26 0.00 0.00 34.13 34.28 1sx4 s GLU 61 CO 0.27 -0.08 0.03 -0.51 -0.54 0.00 0.00 175.26 174.44 1sx4 s LEU 62 N 0.50 3.00 -0.07 2.70 1.02 -1.26 -5.03 118.68 119.54 1sx4 s LEU 62 Ca -0.02 -1.02 -0.13 0.00 0.02 0.00 0.00 54.13 52.98 1sx4 s LEU 62 Cb -0.04 -1.34 -0.30 0.00 0.02 0.00 0.00 46.19 44.53 1sx4 s LEU 62 CO -0.03 -0.29 0.64 -0.08 0.02 0.00 0.00 176.35 176.62 1sx4 h GLU 63 N 1.76 0.34 -6.10 1.70 4.81 -2.00 -3.43 114.58 111.66 1sx4 h GLU 63 Ca -0.43 -0.58 -0.58 0.00 -0.13 0.00 0.00 59.36 57.64 1sx4 h GLU 63 Cb 1.25 0.22 0.01 0.00 0.63 0.00 0.00 28.75 30.85 1sx4 h GLU 63 CO 0.68 1.28 1.41 -3.47 -0.73 0.00 0.00 179.01 178.17 1sx4 n ASP 64 N -3.74 3.45 0.09 1.04 2.03 -1.26 -4.83 116.55 113.34 1sx4 n ASP 64 Ca -0.24 0.43 0.18 0.00 0.52 0.00 0.00 54.79 55.68 1sx4 n ASP 64 Cb 1.00 -1.53 0.72 0.00 -0.72 0.00 0.00 41.12 40.60 1sx4 n ASP 64 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1sx4 h LYS 65 N 13.51 0.00 0.22 -0.67 1.79 -1.92 0.31 116.57 129.80 1sx4 h LYS 65 Ca -0.43 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 57.70 1sx4 h LYS 65 Cb 1.25 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.92 1sx4 h LYS 65 CO 0.96 0.00 -1.61 0.74 -1.08 0.00 0.00 179.45 178.45 1sx4 h PHE 66 N 0.00 0.83 -0.47 -1.35 0.04 -1.94 -2.66 116.94 111.39 1sx4 h PHE 66 Ca 0.18 -0.61 -0.03 0.00 2.80 0.00 0.00 57.97 60.31 1sx4 h PHE 66 Cb 0.77 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.86 1sx4 h PHE 66 CO 0.00 1.62 0.17 0.93 -0.60 0.00 0.00 178.31 180.43 1sx4 h GLU 67 N 0.11 0.72 -0.62 1.51 5.08 -1.34 -2.38 114.58 117.66 1sx4 h GLU 67 Ca -0.30 -0.14 0.12 0.00 -1.00 0.00 0.00 59.36 58.03 1sx4 h GLU 67 Cb 2.12 -0.11 -0.09 0.00 0.50 0.00 0.00 28.75 31.17 1sx4 h GLU 67 CO 0.22 0.67 0.14 -0.97 -1.00 0.00 0.00 179.01 178.07 1sx4 h ASN 68 N 0.63 0.02 -0.58 1.42 -1.24 -0.48 -0.07 115.58 115.27 1sx4 h ASN 68 Ca 0.16 0.11 0.11 0.00 0.71 0.00 0.00 56.30 57.38 1sx4 h ASN 68 Cb 0.23 0.15 -0.08 0.00 0.73 0.00 0.00 38.32 39.35 1sx4 h ASN 68 CO -0.01 0.02 0.12 0.24 -1.29 0.00 0.00 177.43 176.51 1sx4 h MET 69 N 0.27 0.25 -0.29 6.67 2.86 -1.09 0.53 114.93 124.14 1sx4 h MET 69 Ca 0.33 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.98 1sx4 h MET 69 Cb 0.49 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.05 1sx4 h MET 69 CO -0.41 0.16 -0.26 0.78 1.06 0.00 0.00 176.91 178.24 1sx4 h GLY 70 N 0.26 -1.65 1.84 8.32 0.00 -0.56 -1.27 103.07 110.00 1sx4 h GLY 70 Ca 0.30 0.87 -0.07 0.00 0.00 0.00 0.00 47.33 48.43 1sx4 h GLY 70 CO -0.38 -0.49 -0.24 0.00 0.00 0.00 0.00 176.54 175.43 1sx4 h ALA 71 N -0.56 1.40 0.00 3.60 0.00 0.22 -0.89 119.26 123.04 1sx4 h ALA 71 Ca 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1sx4 h ALA 71 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1sx4 h ALA 71 CO -0.34 0.42 0.00 1.04 0.00 0.00 0.00 179.25 180.37 1sx4 n GLN 72 N -4.19 0.13 -0.09 0.00 1.13 0.16 -1.59 117.38 112.93 1sx4 n GLN 72 Ca -0.01 0.11 -0.14 0.00 -1.94 0.00 0.00 57.00 55.01 1sx4 n GLN 72 Cb 0.34 -1.65 -0.07 0.00 0.11 0.00 0.00 30.24 28.97 1sx4 n GLN 72 CO 0.00 0.00 0.00 0.52 -1.44 0.00 0.00 177.06 176.14 1sx4 h MET 73 N 0.00 0.00 -0.28 -1.09 2.86 -0.01 -3.36 114.93 113.04 1sx4 h MET 73 Ca 0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1sx4 h MET 73 Cb 0.61 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1sx4 h MET 73 CO 0.00 0.54 0.21 -0.39 1.06 0.00 0.00 176.91 178.33 1sx4 h VAL 74 N -1.00 0.83 0.00 -2.22 -1.51 -1.47 0.41 116.25 111.29 1sx4 h VAL 74 Ca -0.19 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.28 1sx4 h VAL 74 Cb 0.94 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 30.95 1sx4 h VAL 74 CO -0.12 0.00 0.54 0.50 -1.23 0.00 0.00 177.57 177.27 1sx4 h LYS 75 N 0.00 0.00 0.00 5.19 3.64 -1.44 0.02 116.57 123.98 1sx4 h LYS 75 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1sx4 h LYS 75 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1sx4 h LYS 75 CO -0.00 0.00 -0.42 1.49 -2.27 0.00 0.00 179.45 178.25 1sx4 h GLU 76 N 0.00 0.00 0.58 1.90 4.81 -1.08 -1.82 114.58 118.97 1sx4 h GLU 76 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1sx4 h GLU 76 Cb 1.09 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.47 1sx4 h GLU 76 CO 0.00 0.00 -0.28 -0.39 -0.73 0.00 0.00 179.01 177.61 1sx4 h VAL 77 N 0.00 0.09 -0.95 0.32 -1.51 -1.15 -0.70 116.25 112.34 1sx4 h VAL 77 Ca 0.00 -0.42 0.19 0.00 -1.23 0.00 0.00 66.70 65.24 1sx4 h VAL 77 Cb 0.97 0.13 -0.08 0.00 -2.13 0.00 0.00 31.29 30.18 1sx4 h VAL 77 CO 0.00 0.02 0.61 0.00 -1.23 0.00 0.00 177.57 176.96 1sx4 h ALA 78 N -1.11 1.96 -0.34 5.19 0.00 -1.63 0.71 119.26 124.05 1sx4 h ALA 78 Ca -0.08 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1sx4 h ALA 78 Cb 0.63 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1sx4 h ALA 78 CO 0.13 -0.27 -0.41 1.03 0.00 0.00 0.00 179.25 179.73 1sx4 h SER 79 N 0.59 0.89 0.13 0.00 0.87 -0.83 -3.13 113.55 112.07 1sx4 h SER 79 Ca 0.51 -0.42 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 1sx4 h SER 79 Cb 1.01 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 1sx4 h SER 79 CO -0.26 1.19 -0.06 0.50 -0.53 0.00 0.00 176.83 177.66 1sx4 h LYS 80 N 0.68 -0.17 -0.38 2.24 3.11 0.07 -2.78 116.57 119.34 1sx4 h LYS 80 Ca 0.05 0.01 0.12 0.00 -2.81 0.00 0.00 60.65 58.02 1sx4 h LYS 80 Cb 0.98 0.04 -0.07 0.00 -1.00 0.00 0.00 32.23 32.18 1sx4 h LYS 80 CO 0.09 0.28 0.06 0.00 -2.81 0.00 0.00 179.45 177.07 1sx4 n ALA 81 N -2.58 0.24 0.01 5.00 0.00 0.13 -0.43 120.51 122.88 1sx4 n ALA 81 Ca -0.07 0.40 -0.08 0.00 0.00 0.00 0.00 53.44 53.68 1sx4 n ALA 81 Cb 0.27 -0.32 -0.13 0.00 0.00 0.00 0.00 19.45 19.26 1sx4 n ALA 81 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1sx4 h ASN 82 N 0.00 0.01 1.68 0.00 -0.73 -1.46 -2.47 115.58 112.61 1sx4 h ASN 82 Ca 0.25 -0.02 -0.03 0.00 1.87 0.00 0.00 56.30 58.38 1sx4 h ASN 82 Cb 0.57 -0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.15 1sx4 h ASN 82 CO -0.34 1.02 -0.12 0.44 -0.37 0.00 0.00 177.43 178.06 1sx4 h ASP 83 N 0.00 0.00 0.18 1.15 3.32 -0.47 0.49 116.42 121.09 1sx4 h ASP 83 Ca -0.20 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.50 1sx4 h ASP 83 Cb 1.94 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.47 1sx4 h ASP 83 CO 0.10 0.12 -1.91 0.00 -1.72 0.00 0.00 179.24 175.83 1sx4 h ALA 84 N 1.88 0.40 0.00 3.45 0.00 -1.04 -3.43 119.26 120.51 1sx4 h ALA 84 Ca -0.00 -1.34 0.00 0.00 0.00 0.00 0.00 54.91 53.57 1sx4 h ALA 84 Cb 0.99 0.63 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1sx4 h ALA 84 CO 0.02 1.27 -0.36 0.00 0.00 0.00 0.00 179.25 180.17 1sx4 n ALA 85 N -2.93 1.99 -4.24 0.00 0.00 -0.93 -5.03 120.51 109.38 1sx4 n ALA 85 Ca -0.29 -0.73 -0.34 0.00 0.00 0.00 0.00 53.44 52.08 1sx4 n ALA 85 Cb 1.05 -0.36 -0.08 0.00 0.00 0.00 0.00 19.45 20.06 1sx4 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 86 N 0.00 -0.24 0.00 0.00 0.00 0.16 -4.50 105.19 100.62 1sx4 n GLY 86 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1sx4 n GLY 86 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sx4 n ASP 87 N -2.42 0.00 0.00 1.61 -0.08 -1.26 -4.68 116.55 109.72 1sx4 n ASP 87 Ca -0.10 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.18 1sx4 n ASP 87 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 1sx4 n ASP 87 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1sx4 n GLY 88 N -0.08 0.64 0.34 0.27 0.00 -1.26 -4.69 105.19 100.41 1sx4 n GLY 88 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1sx4 n GLY 88 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sx4 h THR 89 N 0.00 0.95 -0.85 2.61 1.35 -1.87 0.38 112.91 115.47 1sx4 h THR 89 Ca 0.00 -0.32 -0.03 0.00 -0.55 0.00 0.00 66.41 65.51 1sx4 h THR 89 Cb 0.00 -0.07 -0.04 0.00 -1.73 0.00 0.00 68.15 66.31 1sx4 h THR 89 CO 0.00 0.17 0.43 0.74 -0.25 0.00 0.00 175.52 176.61 1sx4 h THR 90 N 0.94 1.26 0.61 6.82 2.02 -1.92 -0.78 112.91 121.86 1sx4 h THR 90 Ca 0.44 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 1sx4 h THR 90 Cb 0.36 0.15 0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1sx4 h THR 90 CO -0.24 0.30 -0.29 0.74 0.37 0.00 0.00 175.52 176.40 1sx4 h THR 91 N 1.21 0.26 -0.15 3.16 2.02 -1.38 -0.90 112.91 117.11 1sx4 h THR 91 Ca 0.30 -0.31 0.01 0.00 0.77 0.00 0.00 66.41 67.18 1sx4 h THR 91 Cb 0.09 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 1sx4 h THR 91 CO -0.04 0.03 -0.09 0.00 0.37 0.00 0.00 175.52 175.79 1sx4 n ALA 92 N -2.60 -0.10 -0.29 6.16 0.00 0.11 -0.30 120.51 123.49 1sx4 n ALA 92 Ca -0.12 0.13 0.04 0.00 0.00 0.00 0.00 53.44 53.50 1sx4 n ALA 92 Cb 0.35 0.27 0.13 0.00 0.00 0.00 0.00 19.45 20.20 1sx4 n ALA 92 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1sx4 h THR 93 N 0.00 0.20 -0.60 0.00 2.02 -0.75 0.55 112.91 114.33 1sx4 h THR 93 Ca 0.02 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1sx4 h THR 93 Cb 0.06 0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.62 1sx4 h THR 93 CO -0.15 0.00 0.34 0.58 0.37 0.00 0.00 175.52 176.66 1sx4 h VAL 94 N 0.02 1.19 0.00 3.16 2.07 0.66 -0.84 116.25 122.51 1sx4 h VAL 94 Ca 0.41 -0.47 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 1sx4 h VAL 94 Cb 0.68 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1sx4 h VAL 94 CO -0.82 0.20 -0.19 -0.07 0.02 0.00 0.00 177.57 176.72 1sx4 h LEU 95 N 0.81 0.00 0.07 2.57 3.38 0.32 -2.86 115.31 119.60 1sx4 h LEU 95 Ca 0.21 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.05 1sx4 h LEU 95 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1sx4 h LEU 95 CO -0.04 0.19 -0.65 0.00 0.09 0.00 0.00 178.44 178.04 1sx4 h ALA 96 N 1.81 0.02 -0.01 1.53 0.00 -0.70 0.20 119.26 122.12 1sx4 h ALA 96 Ca -0.00 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1sx4 h ALA 96 Cb 0.40 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1sx4 h ALA 96 CO 0.03 0.34 0.29 0.37 0.00 0.00 0.00 179.25 180.28 1sx4 h GLN 97 N -0.66 0.00 0.02 0.00 5.75 -1.12 0.48 115.11 119.58 1sx4 h GLN 97 Ca -0.14 0.00 -0.37 0.00 -0.15 0.00 0.00 58.65 58.00 1sx4 h GLN 97 Cb 1.39 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.89 1sx4 h GLN 97 CO 0.05 0.00 -2.08 0.00 -2.65 0.00 0.00 178.83 174.15 1sx4 n ALA 98 N -1.92 1.07 -0.07 3.38 0.00 -0.91 -1.79 120.51 120.27 1sx4 n ALA 98 Ca -0.02 -0.84 -0.09 0.00 0.00 0.00 0.00 53.44 52.48 1sx4 n ALA 98 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 1sx4 n ALA 98 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1sx4 h ILE 99 N -0.62 1.08 -0.27 0.00 2.04 0.19 -2.73 117.51 117.21 1sx4 h ILE 99 Ca -0.53 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 65.20 1sx4 h ILE 99 Cb 1.66 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 1sx4 h ILE 99 CO -0.21 0.08 -0.03 0.40 0.00 0.00 0.00 178.15 178.39 1sx4 h ILE 100 N 0.36 0.76 -0.72 -0.67 2.04 -1.08 -1.60 117.51 116.60 1sx4 h ILE 100 Ca 0.10 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.98 1sx4 h ILE 100 Cb -0.02 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 1sx4 h ILE 100 CO -0.02 0.01 0.44 0.74 0.00 0.00 0.00 178.15 179.32 1sx4 h THR 101 N 0.04 1.07 0.08 -0.27 2.02 -1.14 -1.65 112.91 113.06 1sx4 h THR 101 Ca 0.13 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1sx4 h THR 101 Cb 0.19 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1sx4 h THR 101 CO -0.25 0.15 -0.04 -0.33 0.37 0.00 0.00 175.52 175.43 1sx4 h GLU 102 N 0.85 -0.10 -0.57 6.66 4.39 -1.48 -2.97 114.58 121.36 1sx4 h GLU 102 Ca 0.30 0.01 0.08 0.00 0.34 0.00 0.00 59.36 60.09 1sx4 h GLU 102 Cb 0.07 0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 28.63 1sx4 h GLU 102 CO -0.13 0.41 -0.45 0.78 -1.16 0.00 0.00 179.01 178.46 1sx4 h GLY 103 N -0.93 -0.53 0.52 -3.84 0.00 -1.17 0.45 103.07 97.57 1sx4 h GLY 103 Ca -0.01 0.59 0.19 0.00 0.00 0.00 0.00 47.33 48.09 1sx4 h GLY 103 CO 0.02 -0.15 0.54 1.41 0.00 0.00 0.00 176.54 178.35 1sx4 h LEU 104 N -0.24 0.26 -0.33 3.11 3.38 -1.38 -1.33 115.31 118.77 1sx4 h LEU 104 Ca 0.17 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 1sx4 h LEU 104 Cb 0.56 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1sx4 h LEU 104 CO -0.68 0.12 -0.62 0.50 0.09 0.00 0.00 178.44 177.85 1sx4 h LYS 105 N 0.26 0.00 0.00 1.13 3.64 0.03 -1.40 116.57 120.23 1sx4 h LYS 105 Ca 0.39 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.56 1sx4 h LYS 105 Cb 1.14 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.92 1sx4 h LYS 105 CO -0.10 0.62 -1.08 0.00 -2.27 0.00 0.00 179.45 176.62 1sx4 h ALA 106 N 1.38 0.45 -0.32 5.00 0.00 -0.86 -2.16 119.26 122.75 1sx4 h ALA 106 Ca -0.01 -0.96 -0.04 0.00 0.00 0.00 0.00 54.91 53.91 1sx4 h ALA 106 Cb 1.33 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1sx4 h ALA 106 CO 0.08 1.25 0.04 0.28 0.00 0.00 0.00 179.25 180.89 1sx4 h VAL 107 N 0.00 1.17 0.00 0.00 2.07 -0.22 -1.17 116.25 118.10 1sx4 h VAL 107 Ca -0.06 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 1sx4 h VAL 107 Cb 1.77 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1sx4 h VAL 107 CO 0.12 0.23 -0.18 0.00 0.02 0.00 0.00 177.57 177.75 1sx4 h ALA 108 N 1.58 1.34 0.00 1.67 0.00 -1.24 0.17 119.26 122.78 1sx4 h ALA 108 Ca 0.11 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1sx4 h ALA 108 Cb 0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1sx4 h ALA 108 CO 0.00 0.23 -0.31 0.00 0.00 0.00 0.00 179.25 179.17 1sx4 h ALA 109 N 1.82 0.98 0.00 0.00 0.00 -0.56 -3.47 119.26 118.02 1sx4 h ALA 109 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1sx4 h ALA 109 Cb 0.43 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1sx4 h ALA 109 CO 0.02 0.39 0.00 0.41 0.00 0.00 0.00 179.25 180.07 1sx4 n GLY 110 N 0.31 1.44 3.75 0.00 0.00 0.05 -5.09 105.19 105.64 1sx4 n GLY 110 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1sx4 n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sx4 s MET 111 N -0.12 2.40 -0.50 1.61 -1.94 -1.03 -4.98 119.30 114.74 1sx4 s MET 111 Ca 0.00 1.46 -0.28 0.00 -1.71 0.00 0.00 55.69 55.16 1sx4 s MET 111 Cb 0.00 -1.89 0.03 0.00 2.01 0.00 0.00 34.83 34.98 1sx4 s MET 111 CO 0.00 -1.57 1.09 1.21 -0.01 0.00 0.00 175.02 175.74 1sx4 s ASN 112 N -2.59 6.54 0.45 3.03 2.47 -1.26 -4.64 114.94 118.94 1sx4 s ASN 112 Ca 0.68 0.25 0.13 0.00 0.42 0.00 0.00 52.86 54.34 1sx4 s ASN 112 Cb -0.22 -2.52 1.02 0.00 -1.45 0.00 0.00 41.25 38.07 1sx4 s ASN 112 CO 0.46 -1.26 2.03 -0.65 -3.72 0.00 0.00 177.10 173.97 1sx4 h PRO 113 N 9.28 0.13 -0.12 0.43 0.11 -1.94 0.24 132.00 140.13 1sx4 h PRO 113 Ca -0.24 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.86 1sx4 h PRO 113 Cb 1.06 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1sx4 h PRO 113 CO 1.12 0.19 0.08 0.52 -0.21 0.00 0.00 178.00 179.70 1sx4 h MET 114 N 0.13 0.12 0.11 1.05 2.86 -1.93 0.16 114.93 117.44 1sx4 h MET 114 Ca 0.03 -0.01 -0.28 0.00 -2.06 0.00 0.00 59.70 57.39 1sx4 h MET 114 Cb 0.18 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 1sx4 h MET 114 CO 0.01 0.08 -1.30 -0.44 1.06 0.00 0.00 176.91 176.32 1sx4 h ASP 115 N 0.12 0.37 -0.35 1.22 3.32 -0.92 -2.30 116.42 117.87 1sx4 h ASP 115 Ca 0.05 -0.43 0.07 0.00 0.02 0.00 0.00 57.03 56.74 1sx4 h ASP 115 Cb 0.04 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.40 1sx4 h ASP 115 CO -0.01 1.34 -0.06 -0.07 -1.72 0.00 0.00 179.24 178.72 1sx4 h LEU 116 N 0.07 -0.27 0.02 1.55 3.38 -0.89 -1.04 115.31 118.13 1sx4 h LEU 116 Ca -0.15 0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1sx4 h LEU 116 Cb 1.97 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.89 1sx4 h LEU 116 CO 0.19 -0.09 -0.14 0.50 0.09 0.00 0.00 178.44 178.99 1sx4 h LYS 117 N 0.03 -0.23 -0.58 1.13 3.64 -0.68 -0.52 116.57 119.36 1sx4 h LYS 117 Ca 0.17 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.68 1sx4 h LYS 117 Cb 0.26 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.04 1sx4 h LYS 117 CO -0.34 -0.15 0.11 0.00 -2.27 0.00 0.00 179.45 176.79 1sx4 h ARG 118 N -0.24 0.23 -0.06 1.90 3.08 -0.74 0.33 114.38 118.88 1sx4 h ARG 118 Ca 0.04 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1sx4 h ARG 118 Cb 0.29 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 1sx4 h ARG 118 CO -0.12 0.16 0.02 0.78 -1.07 0.00 0.00 179.97 179.73 1sx4 h GLY 119 N 0.24 0.11 -0.18 0.04 0.00 -1.06 0.16 103.07 102.38 1sx4 h GLY 119 Ca 0.30 -0.07 0.19 0.00 0.00 0.00 0.00 47.33 47.75 1sx4 h GLY 119 CO -0.40 0.06 0.23 -2.22 0.00 0.00 0.00 176.54 174.21 1sx4 h ILE 120 N -0.11 0.46 0.06 2.60 2.04 -0.67 -0.46 117.51 121.44 1sx4 h ILE 120 Ca 0.02 -0.10 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 1sx4 h ILE 120 Cb 0.23 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1sx4 h ILE 120 CO -0.00 0.05 -0.03 0.44 0.00 0.00 0.00 178.15 178.61 1sx4 h ASP 121 N 0.29 -0.07 -0.14 1.72 3.32 0.36 -1.48 116.42 120.41 1sx4 h ASP 121 Ca 0.47 -0.41 0.03 0.00 0.02 0.00 0.00 57.03 57.14 1sx4 h ASP 121 Cb 0.86 0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.36 1sx4 h ASP 121 CO -0.55 0.39 -0.54 0.50 -1.72 0.00 0.00 179.24 177.32 1sx4 h LYS 122 N -0.55 -0.55 -0.38 3.56 3.64 -0.40 1.08 116.57 122.96 1sx4 h LYS 122 Ca -0.01 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1sx4 h LYS 122 Cb 0.48 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.37 1sx4 h LYS 122 CO 0.01 -0.37 -0.17 0.00 -2.27 0.00 0.00 179.45 176.65 1sx4 n ALA 123 N -3.00 -0.11 -0.14 5.00 0.00 -0.21 -0.61 120.51 121.44 1sx4 n ALA 123 Ca -0.06 0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.66 1sx4 n ALA 123 Cb 0.37 -0.13 0.06 0.00 0.00 0.00 0.00 19.45 19.75 1sx4 n ALA 123 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sx4 h VAL 124 N 0.00 1.27 0.00 0.00 2.07 0.22 -1.07 116.25 118.74 1sx4 h VAL 124 Ca 0.11 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1sx4 h VAL 124 Cb 0.21 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1sx4 h VAL 124 CO -0.37 0.44 -0.19 0.74 0.02 0.00 0.00 177.57 178.20 1sx4 h THR 125 N 0.80 1.07 0.05 2.57 2.02 0.12 0.63 112.91 120.18 1sx4 h THR 125 Ca 0.12 -0.68 -0.24 0.00 0.77 0.00 0.00 66.41 66.39 1sx4 h THR 125 Cb 0.67 1.37 0.02 0.00 -1.74 0.00 0.00 68.15 68.48 1sx4 h THR 125 CO 0.05 0.19 -0.98 0.00 0.37 0.00 0.00 175.52 175.15 1sx4 h ALA 126 N 1.81 0.05 -0.34 6.16 0.00 -1.17 -2.92 119.26 122.84 1sx4 h ALA 126 Ca -0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 54.91 54.14 1sx4 h ALA 126 Cb 0.36 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1sx4 h ALA 126 CO 0.03 0.57 -0.14 0.00 0.00 0.00 0.00 179.25 179.71 1sx4 h ALA 127 N 0.31 1.14 -0.55 0.00 0.00 0.38 -2.30 119.26 118.23 1sx4 h ALA 127 Ca -0.14 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1sx4 h ALA 127 Cb 1.67 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 1sx4 h ALA 127 CO 0.19 0.54 -0.03 0.28 0.00 0.00 0.00 179.25 180.23 1sx4 h VAL 128 N 0.54 1.26 0.02 0.00 2.07 -0.98 -1.29 116.25 117.87 1sx4 h VAL 128 Ca 0.09 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.46 1sx4 h VAL 128 Cb 0.55 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1sx4 h VAL 128 CO 0.03 0.41 -0.03 -0.33 0.02 0.00 0.00 177.57 177.68 1sx4 h GLU 129 N 0.89 -0.06 -0.49 1.57 3.07 -1.30 -0.58 114.58 117.68 1sx4 h GLU 129 Ca 0.16 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 59.11 1sx4 h GLU 129 Cb 0.57 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 28.41 1sx4 h GLU 129 CO 0.03 -0.04 0.03 0.93 -1.40 0.00 0.00 179.01 178.57 1sx4 h GLU 130 N -0.06 0.15 -0.61 2.33 4.39 -1.06 0.15 114.58 119.87 1sx4 h GLU 130 Ca 0.01 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.73 1sx4 h GLU 130 Cb 0.07 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.64 1sx4 h GLU 130 CO -0.02 0.10 0.37 -0.07 -1.16 0.00 0.00 179.01 178.23 1sx4 h LEU 131 N 0.15 0.59 -2.03 1.33 3.38 -1.08 -1.77 115.31 115.89 1sx4 h LEU 131 Ca 0.25 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1sx4 h LEU 131 Cb 0.36 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1sx4 h LEU 131 CO -0.38 0.41 0.00 0.11 0.09 0.00 0.00 178.44 178.67 1sx4 h LYS 132 N 0.72 0.00 0.00 1.13 1.57 0.90 -0.41 116.57 120.49 1sx4 h LYS 132 Ca 0.25 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.91 1sx4 h LYS 132 Cb 0.05 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1sx4 h LYS 132 CO -0.11 0.00 -1.02 0.00 -0.57 0.00 0.00 179.45 177.75 1sx4 h ALA 133 N 2.03 0.65 0.00 3.86 0.00 -0.37 -3.28 119.26 122.15 1sx4 h ALA 133 Ca 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 1sx4 h ALA 133 Cb 0.22 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1sx4 h ALA 133 CO 0.00 0.69 -0.96 -0.07 0.00 0.00 0.00 179.25 178.91 1sx4 h LEU 134 N 0.00 0.00 -9.80 0.00 4.07 -0.44 -3.47 115.31 105.67 1sx4 h LEU 134 Ca -0.09 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.35 1sx4 h LEU 134 Cb 1.43 0.00 0.07 0.00 1.08 0.00 0.00 40.66 43.24 1sx4 h LEU 134 CO 0.05 0.08 0.79 -0.55 -1.08 0.00 0.00 178.44 177.72 1sx4 s SER 135 N -5.51 6.55 0.02 -0.43 0.15 -0.65 -4.85 113.70 108.99 1sx4 s SER 135 Ca -0.00 2.80 0.05 0.00 0.70 0.00 0.00 55.95 59.49 1sx4 s SER 135 Cb 0.09 -2.63 -0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1sx4 s SER 135 CO 0.78 -0.77 -0.14 0.68 1.20 0.00 0.00 173.24 174.99 1sx4 s VAL 136 N -0.26 1.11 0.48 4.45 -7.23 -1.10 -4.91 120.40 112.95 1sx4 s VAL 136 Ca 0.59 -0.84 -0.23 0.00 -1.81 0.00 0.00 61.98 59.69 1sx4 s VAL 136 Cb -0.44 -0.98 -0.07 0.00 0.56 0.00 0.00 36.38 35.46 1sx4 s VAL 136 CO 0.48 0.13 1.24 -2.84 -0.31 0.00 0.00 175.10 173.79 1sx4 s PRO 137 N -0.82 3.59 -0.36 4.82 0.02 -1.26 -1.27 135.00 139.72 1sx4 s PRO 137 Ca 0.03 1.95 -0.02 0.00 0.02 0.00 0.00 61.00 62.98 1sx4 s PRO 137 Cb -0.07 -2.40 0.08 0.00 0.02 0.00 0.00 34.50 32.14 1sx4 s PRO 137 CO 0.01 -0.74 0.11 0.00 -0.33 0.00 0.00 177.00 176.05 1sx4 n SER 139 N 4.60 0.41 -4.87 0.00 3.41 -1.26 -4.48 113.62 111.42 1sx4 n SER 139 Ca -0.06 -0.08 -0.31 0.00 -0.26 0.00 0.00 58.87 58.16 1sx4 n SER 139 Cb 0.42 0.25 0.03 0.00 -0.26 0.00 0.00 64.21 64.65 1sx4 n SER 139 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1sx4 s ASP 140 N -0.33 5.89 0.44 4.04 1.47 -1.26 -4.97 116.67 121.95 1sx4 s ASP 140 Ca 0.00 1.30 0.18 0.00 1.18 0.00 0.00 52.55 55.21 1sx4 s ASP 140 Cb 0.00 -2.24 1.02 0.00 -0.34 0.00 0.00 42.92 41.36 1sx4 s ASP 140 CO 0.00 -1.08 1.94 0.28 0.68 0.00 0.00 175.17 176.99 1sx4 h SER 141 N -0.47 0.00 -0.14 2.11 0.02 -1.97 -2.91 113.55 110.20 1sx4 h SER 141 Ca -0.44 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.47 1sx4 h SER 141 Cb 1.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.75 1sx4 h SER 141 CO 0.63 0.24 -0.06 0.50 -1.14 0.00 0.00 176.83 176.99 1sx4 h LYS 142 N 0.00 0.29 0.01 3.45 3.64 -1.99 -2.05 116.57 119.92 1sx4 h LYS 142 Ca -0.00 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1sx4 h LYS 142 Cb 0.49 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1sx4 h LYS 142 CO 0.03 0.61 -0.00 0.00 -2.27 0.00 0.00 179.45 177.82 1sx4 h ALA 143 N 0.66 -0.01 -0.85 5.00 0.00 -1.94 -1.53 119.26 120.59 1sx4 h ALA 143 Ca 0.03 -0.07 0.19 0.00 0.00 0.00 0.00 54.91 55.06 1sx4 h ALA 143 Cb 0.53 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.17 1sx4 h ALA 143 CO 0.02 -0.44 -0.08 0.82 0.00 0.00 0.00 179.25 179.57 1sx4 h ILE 144 N -0.16 0.19 -0.80 0.00 2.04 -1.56 0.32 117.51 117.55 1sx4 h ILE 144 Ca -0.00 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 65.88 1sx4 h ILE 144 Cb 0.15 0.15 -0.05 0.00 -0.74 0.00 0.00 36.82 36.33 1sx4 h ILE 144 CO 0.00 0.01 0.52 0.00 0.00 0.00 0.00 178.15 178.68 1sx4 h ALA 145 N 1.83 1.53 -0.08 1.87 0.00 -0.84 -1.24 119.26 122.33 1sx4 h ALA 145 Ca 0.45 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.21 1sx4 h ALA 145 Cb 0.79 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1sx4 h ALA 145 CO -0.81 0.38 -0.48 1.96 0.00 0.00 0.00 179.25 180.31 1sx4 h GLN 146 N 0.97 0.19 -0.01 0.00 4.20 0.46 0.85 115.11 121.77 1sx4 h GLN 146 Ca 0.32 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 1sx4 h GLN 146 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1sx4 h GLN 146 CO -0.10 0.63 -0.18 -0.39 -0.67 0.00 0.00 178.83 178.12 1sx4 h VAL 147 N 0.15 1.55 -0.59 -0.54 -1.51 0.21 -2.43 116.25 113.08 1sx4 h VAL 147 Ca 0.01 -1.86 0.09 0.00 -1.23 0.00 0.00 66.70 63.71 1sx4 h VAL 147 Cb 0.90 2.73 -0.11 0.00 -2.13 0.00 0.00 31.29 32.69 1sx4 h VAL 147 CO 0.07 0.50 -0.41 1.23 -1.23 0.00 0.00 177.57 177.74 1sx4 h GLY 148 N -0.54 -0.36 0.50 5.19 0.00 -1.13 -1.02 103.07 105.71 1sx4 h GLY 148 Ca -0.02 0.53 0.09 0.00 0.00 0.00 0.00 47.33 47.93 1sx4 h GLY 148 CO 0.04 -0.17 0.38 -0.84 0.00 0.00 0.00 176.54 175.94 1sx4 h THR 149 N -0.20 0.87 -0.09 4.70 2.02 0.75 -0.57 112.91 120.39 1sx4 h THR 149 Ca 0.20 -0.22 -0.20 0.00 0.77 0.00 0.00 66.41 66.95 1sx4 h THR 149 Cb 0.56 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1sx4 h THR 149 CO -0.69 0.12 -0.77 -0.29 0.37 0.00 0.00 175.52 174.25 1sx4 h ILE 150 N 0.65 1.35 -0.70 3.11 6.09 -0.85 -0.57 117.51 126.59 1sx4 h ILE 150 Ca 0.35 -2.12 0.05 0.00 -1.37 0.00 0.00 64.86 61.77 1sx4 h ILE 150 Cb 0.35 2.11 -0.04 0.00 0.47 0.00 0.00 36.82 39.71 1sx4 h ILE 150 CO -0.26 0.65 0.46 -1.28 -3.07 0.00 0.00 178.15 174.66 1sx4 h SER 151 N 0.35 0.67 -0.91 2.19 0.87 -0.66 -3.09 113.55 112.96 1sx4 h SER 151 Ca -0.04 -0.00 -0.46 0.00 -1.23 0.00 0.00 61.79 60.06 1sx4 h SER 151 Cb 1.37 -0.14 -0.17 0.00 -0.44 0.00 0.00 62.40 63.01 1sx4 h SER 151 CO 0.14 0.44 0.42 0.00 -0.53 0.00 0.00 176.83 177.30 1sx4 n ALA 152 N -2.45 6.10 -2.84 6.23 0.00 -0.27 -4.69 120.51 122.59 1sx4 n ALA 152 Ca 0.10 -2.70 -0.08 0.00 0.00 0.00 0.00 53.44 50.75 1sx4 n ALA 152 Cb 0.20 -1.93 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 1sx4 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1sx4 n ASN 153 N 0.67 -1.36 -0.17 0.00 4.05 -1.17 -1.22 115.26 116.06 1sx4 n ASN 153 Ca 0.44 0.19 0.00 0.00 0.45 0.00 0.00 54.58 55.66 1sx4 n ASN 153 Cb 0.56 -1.27 0.00 0.00 1.23 0.00 0.00 39.78 40.30 1sx4 n ASN 153 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1sx4 n SER 154 N -1.69 -1.01 -4.35 1.20 7.64 -0.28 -4.90 113.62 110.22 1sx4 n SER 154 Ca 0.01 0.00 -0.46 0.00 1.01 0.00 0.00 58.87 59.43 1sx4 n SER 154 Cb 0.50 -0.34 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 1sx4 n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1sx4 s ASP 155 N -2.67 6.38 0.58 6.43 -1.08 -0.36 -4.90 116.67 121.06 1sx4 s ASP 155 Ca 0.00 -1.94 0.28 0.00 -0.52 0.00 0.00 52.55 50.37 1sx4 s ASP 155 Cb 0.00 -2.26 1.62 0.00 -1.46 0.00 0.00 42.92 40.82 1sx4 s ASP 155 CO 0.00 -0.89 2.08 -0.33 0.52 0.00 0.00 175.17 176.55 1sx4 h GLU 156 N 8.69 0.00 0.05 4.34 5.08 -1.90 -1.53 114.58 129.31 1sx4 h GLU 156 Ca -0.15 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 57.96 1sx4 h GLU 156 Cb 1.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.33 1sx4 h GLU 156 CO 0.99 0.00 -1.07 1.15 -1.00 0.00 0.00 179.01 179.08 1sx4 h THR 157 N 0.00 1.37 -0.11 1.13 2.02 -1.97 -1.76 112.91 113.60 1sx4 h THR 157 Ca 0.10 -2.52 -0.01 0.00 0.77 0.00 0.00 66.41 64.75 1sx4 h THR 157 Cb 0.55 2.55 -0.00 0.00 -1.74 0.00 0.00 68.15 69.51 1sx4 h THR 157 CO -0.00 0.75 0.02 0.58 0.37 0.00 0.00 175.52 177.24 1sx4 h VAL 158 N 0.24 1.22 -0.38 3.16 2.07 -1.69 -1.14 116.25 119.74 1sx4 h VAL 158 Ca -0.12 -0.69 0.08 0.00 0.82 0.00 0.00 66.70 66.79 1sx4 h VAL 158 Cb 1.72 1.47 -0.08 0.00 -1.52 0.00 0.00 31.29 32.89 1sx4 h VAL 158 CO 0.19 0.20 -0.20 1.23 0.02 0.00 0.00 177.57 179.01 1sx4 h GLY 159 N -0.05 0.07 0.99 2.17 0.00 -1.27 -0.42 103.07 104.55 1sx4 h GLY 159 Ca 0.03 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1sx4 h GLY 159 CO 0.00 -0.19 0.26 1.70 0.00 0.00 0.00 176.54 178.31 1sx4 h LYS 160 N -0.13 0.57 -0.35 4.80 3.64 -1.28 -0.69 116.57 123.12 1sx4 h LYS 160 Ca 0.19 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 1sx4 h LYS 160 Cb 0.42 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1sx4 h LYS 160 CO -0.46 0.40 -0.07 1.25 -2.27 0.00 0.00 179.45 178.30 1sx4 h LEU 161 N 0.56 0.66 0.47 5.20 5.85 0.07 0.39 115.31 128.51 1sx4 h LEU 161 Ca 0.15 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 1sx4 h LEU 161 Cb -0.03 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 1sx4 h LEU 161 CO -0.03 0.87 -0.36 0.40 -0.34 0.00 0.00 178.44 178.97 1sx4 h ILE 162 N 0.45 0.26 -0.67 4.05 2.04 -1.03 -0.63 117.51 121.98 1sx4 h ILE 162 Ca 0.09 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.09 1sx4 h ILE 162 Cb 0.57 0.26 -0.12 0.00 -0.74 0.00 0.00 36.82 36.79 1sx4 h ILE 162 CO 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.16 1sx4 h ALA 163 N -0.43 0.64 -0.62 1.87 0.00 -0.78 0.09 119.26 120.04 1sx4 h ALA 163 Ca -0.05 0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.15 1sx4 h ALA 163 Cb 0.70 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1sx4 h ALA 163 CO -0.00 -0.41 0.32 0.93 0.00 0.00 0.00 179.25 180.09 1sx4 h GLU 164 N 0.09 0.57 0.20 0.00 5.08 0.20 -2.27 114.58 118.45 1sx4 h GLU 164 Ca 0.35 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1sx4 h GLU 164 Cb 0.59 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1sx4 h GLU 164 CO -0.60 0.38 -0.10 0.00 -1.00 0.00 0.00 179.01 177.69 1sx4 h ALA 165 N 1.35 -0.27 -1.27 3.43 0.00 -0.08 -2.64 119.26 119.77 1sx4 h ALA 165 Ca 0.28 -0.19 0.37 0.00 0.00 0.00 0.00 54.91 55.37 1sx4 h ALA 165 Cb 0.22 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1sx4 h ALA 165 CO -0.20 -0.46 0.95 0.52 0.00 0.00 0.00 179.25 180.06 1sx4 h MET 166 N -0.67 0.00 0.14 0.00 2.86 -0.95 0.73 114.93 117.04 1sx4 h MET 166 Ca -0.03 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.31 1sx4 h MET 166 Cb 0.48 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.17 1sx4 h MET 166 CO 0.05 0.00 -1.28 0.22 1.06 0.00 0.00 176.91 176.96 1sx4 h ASP 167 N 0.00 0.88 0.10 1.22 3.58 -1.07 -3.18 116.42 117.95 1sx4 h ASP 167 Ca 0.60 -0.83 -0.25 0.00 0.42 0.00 0.00 57.03 56.98 1sx4 h ASP 167 Cb 2.50 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 43.26 1sx4 h ASP 167 CO -0.01 1.63 -1.28 0.11 -2.88 0.00 0.00 179.24 176.82 1sx4 h LYS 168 N 0.26 0.21 0.00 0.28 1.57 0.77 -3.31 116.57 116.35 1sx4 h LYS 168 Ca -0.20 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 1sx4 h LYS 168 Cb 1.95 0.13 0.00 0.00 0.08 0.00 0.00 32.23 34.40 1sx4 h LYS 168 CO 0.24 1.17 0.00 1.33 -0.57 0.00 0.00 179.45 181.62 1sx4 n VAL 169 N -4.02 0.64 -3.55 0.50 0.24 -0.58 -4.59 118.33 106.97 1sx4 n VAL 169 Ca -0.24 0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 1sx4 n VAL 169 Cb 0.85 -0.83 0.00 0.00 -1.47 0.00 0.00 33.84 32.38 1sx4 n VAL 169 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1sx4 n GLY 170 N 0.68 -1.49 0.13 7.63 0.00 -1.20 -2.85 105.19 108.09 1sx4 n GLY 170 Ca 0.04 -1.38 0.03 0.00 0.00 0.00 0.00 46.02 44.71 1sx4 n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sx4 h LYS 171 N 0.00 0.00 -0.41 1.61 1.57 -1.93 -3.34 116.57 114.07 1sx4 h LYS 171 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1sx4 h LYS 171 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 1sx4 h LYS 171 CO 0.00 0.38 0.05 0.39 -0.57 0.00 0.00 179.45 179.70 1sx4 n GLU 172 N -3.08 3.05 -4.05 3.15 1.02 -1.26 -4.99 120.64 114.49 1sx4 n GLU 172 Ca -0.02 -2.99 -0.34 0.00 -0.02 0.00 0.00 57.16 53.80 1sx4 n GLU 172 Cb 0.75 -1.96 -0.07 0.00 -0.02 0.00 0.00 31.44 30.15 1sx4 n GLU 172 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1sx4 s GLY 173 N -1.77 2.06 0.32 0.62 0.00 -1.21 -3.59 107.32 103.75 1sx4 s GLY 173 Ca 0.47 -0.82 -0.14 0.00 0.00 0.00 0.00 44.72 44.23 1sx4 s GLY 173 CO 0.09 -0.68 0.72 0.14 0.00 0.00 0.00 173.10 173.37 1sx4 s VAL 174 N -1.19 4.73 -0.09 1.40 1.01 -1.24 -4.90 120.40 120.11 1sx4 s VAL 174 Ca 0.22 0.84 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1sx4 s VAL 174 Cb -0.12 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.66 1sx4 s VAL 174 CO 0.13 -0.21 -0.06 -0.63 0.00 0.00 0.00 175.10 174.33 1sx4 s ILE 175 N -2.01 0.86 0.11 2.22 1.01 -1.26 -1.43 121.20 120.70 1sx4 s ILE 175 Ca 0.53 -0.22 0.09 0.00 0.00 0.00 0.00 60.65 61.05 1sx4 s ILE 175 Cb -0.10 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 1sx4 s ILE 175 CO 0.19 0.33 -0.23 0.42 0.00 0.00 0.00 174.94 175.66 1sx4 s THR 176 N 1.49 1.88 -0.08 2.92 -4.23 -0.95 -5.01 115.64 111.67 1sx4 s THR 176 Ca -0.00 -1.63 0.01 0.00 -1.18 0.00 0.00 61.69 58.90 1sx4 s THR 176 Cb -0.13 -1.70 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 1sx4 s THR 176 CO -0.05 -0.03 -0.11 0.68 -0.54 0.00 0.00 174.62 174.57 1sx4 s VAL 177 N -1.17 3.29 0.08 2.29 -7.23 -1.26 -0.54 120.40 115.86 1sx4 s VAL 177 Ca 0.09 -0.62 -0.11 0.00 -1.81 0.00 0.00 61.98 59.53 1sx4 s VAL 177 Cb -0.10 -2.34 0.01 0.00 0.56 0.00 0.00 36.38 34.51 1sx4 s VAL 177 CO 0.05 0.57 0.25 -1.83 -0.31 0.00 0.00 175.10 173.83 1sx4 s GLU 178 N -0.41 0.86 0.34 4.82 -1.05 -0.52 -4.97 118.70 117.77 1sx4 s GLU 178 Ca 0.05 -0.80 -0.27 0.00 -0.15 0.00 0.00 54.97 53.81 1sx4 s GLU 178 Cb -0.12 0.36 -0.13 0.00 -0.44 0.00 0.00 34.13 33.80 1sx4 s GLU 178 CO 0.02 -0.29 1.07 -0.25 0.95 0.00 0.00 175.26 176.76 1sx4 n ASP 179 N 0.10 1.60 -5.02 0.83 9.92 -1.26 -3.00 116.55 119.73 1sx4 n ASP 179 Ca -0.16 1.15 -0.19 0.00 -0.53 0.00 0.00 54.79 55.05 1sx4 n ASP 179 Cb 0.62 -1.35 0.04 0.00 -0.64 0.00 0.00 41.12 39.79 1sx4 n ASP 179 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1sx4 s GLY 180 N -0.55 1.84 -0.18 0.44 0.00 -0.63 -4.74 107.32 103.50 1sx4 s GLY 180 Ca 0.59 -1.95 -0.19 0.00 0.00 0.00 0.00 44.72 43.17 1sx4 s GLY 180 CO 0.60 -1.64 0.31 -0.91 0.00 0.00 0.00 173.10 171.46 1sx4 h THR 181 N 0.37 0.92 -1.01 0.90 1.35 -1.91 -3.48 112.91 110.06 1sx4 h THR 181 Ca -0.34 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 63.28 1sx4 h THR 181 Cb 1.29 2.39 0.00 0.00 -1.73 0.00 0.00 68.15 70.09 1sx4 h THR 181 CO 0.43 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.78 1sx4 n GLY 182 N 1.57 1.82 0.07 5.82 0.00 -1.26 -5.00 105.19 108.21 1sx4 n GLY 182 Ca -0.30 -1.87 -0.01 0.00 0.00 0.00 0.00 46.02 43.84 1sx4 n GLY 182 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sx4 n LEU 183 N 0.00 0.26 -4.90 0.99 4.77 -1.26 -3.36 117.00 113.49 1sx4 n LEU 183 Ca 0.00 0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.76 1sx4 n LEU 183 Cb 0.00 0.22 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1sx4 n LEU 183 CO 0.00 0.24 -0.12 -1.10 -1.33 0.00 0.00 177.39 175.08 1sx4 s GLN 184 N -2.94 3.49 0.44 3.23 1.11 -1.26 -3.54 119.66 120.19 1sx4 s GLN 184 Ca -0.07 -0.27 -0.24 0.00 0.01 0.00 0.00 55.36 54.79 1sx4 s GLN 184 Cb 0.09 -3.06 -0.08 0.00 -1.01 0.00 0.00 33.01 28.96 1sx4 s GLN 184 CO 0.85 0.64 1.20 -0.51 0.01 0.00 0.00 175.29 177.48 1sx4 s ASP 185 N -2.04 6.23 -0.05 5.90 1.01 -1.26 -4.11 116.67 122.35 1sx4 s ASP 185 Ca 0.30 2.41 -0.02 0.00 0.71 0.00 0.00 52.55 55.95 1sx4 s ASP 185 Cb -0.13 -2.61 0.03 0.00 1.01 0.00 0.00 42.92 41.22 1sx4 s ASP 185 CO 0.21 -0.88 0.11 -0.70 0.21 0.00 0.00 175.17 174.12 1sx4 s GLU 186 N -2.52 0.06 -0.27 8.23 2.12 -0.09 -4.96 118.70 121.28 1sx4 s GLU 186 Ca 0.61 0.30 -0.08 0.00 0.36 0.00 0.00 54.97 56.16 1sx4 s GLU 186 Cb -0.32 -0.16 -0.01 0.00 0.26 0.00 0.00 34.13 33.90 1sx4 s GLU 186 CO 0.39 -0.15 0.09 -1.17 -0.54 0.00 0.00 175.26 173.89 1sx4 s LEU 187 N 1.00 3.70 -0.03 2.70 2.96 -1.26 -0.31 118.68 127.44 1sx4 s LEU 187 Ca -0.08 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.35 1sx4 s LEU 187 Cb -0.10 -1.93 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 1sx4 s LEU 187 CO -0.04 -0.11 0.27 -1.81 -1.32 0.00 0.00 176.35 173.34 1sx4 s ASP 188 N 1.59 6.55 -0.18 3.68 1.01 0.02 -4.99 116.67 124.36 1sx4 s ASP 188 Ca 0.05 0.65 -0.03 0.00 0.71 0.00 0.00 52.55 53.93 1sx4 s ASP 188 Cb -0.16 -2.13 0.06 0.00 1.01 0.00 0.00 42.92 41.70 1sx4 s ASP 188 CO 0.04 0.31 0.05 -0.69 0.21 0.00 0.00 175.17 175.09 1sx4 s VAL 189 N -1.17 0.29 0.11 -1.27 1.01 -1.26 -0.67 120.40 117.44 1sx4 s VAL 189 Ca 0.23 -0.37 -0.23 0.00 0.00 0.00 0.00 61.98 61.62 1sx4 s VAL 189 Cb -0.14 -0.83 -0.07 0.00 0.00 0.00 0.00 36.38 35.34 1sx4 s VAL 189 CO 0.12 -0.20 0.68 -0.69 0.00 0.00 0.00 175.10 175.01 1sx4 s VAL 190 N 1.97 4.57 -0.23 2.92 1.01 0.04 -5.00 120.40 125.68 1sx4 s VAL 190 Ca 0.00 1.48 -0.16 0.00 0.00 0.00 0.00 61.98 63.31 1sx4 s VAL 190 Cb -0.16 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1sx4 s VAL 190 CO -0.08 0.52 0.40 -1.61 0.00 0.00 0.00 175.10 174.33 1sx4 s GLU 191 N -0.99 4.12 5.68 2.72 0.41 -1.26 -3.11 118.70 126.25 1sx4 s GLU 191 Ca 0.33 0.17 0.00 0.00 -0.41 0.00 0.00 54.97 55.06 1sx4 s GLU 191 Cb -0.21 -3.58 0.00 0.00 -1.78 0.00 0.00 34.13 28.56 1sx4 s GLU 191 CO 0.23 -0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.27 1sx4 n GLY 192 N 4.18 1.95 3.76 -1.39 0.00 -1.26 -4.82 105.19 107.61 1sx4 n GLY 192 Ca -0.08 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 1sx4 n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sx4 s MET 193 N 0.00 4.06 -0.27 1.61 -2.45 -1.24 -4.63 119.30 116.38 1sx4 s MET 193 Ca 0.00 -0.18 -0.25 0.00 -1.25 0.00 0.00 55.69 54.00 1sx4 s MET 193 Cb 0.00 -3.38 0.10 0.00 1.25 0.00 0.00 34.83 32.81 1sx4 s MET 193 CO 0.00 0.38 0.92 -1.14 1.05 0.00 0.00 175.02 176.24 1sx4 s GLN 194 N 0.11 0.62 0.35 4.11 0.74 -1.26 -2.14 119.66 122.19 1sx4 s GLN 194 Ca 0.10 0.71 0.05 0.00 0.05 0.00 0.00 55.36 56.27 1sx4 s GLN 194 Cb -0.11 0.30 -0.02 0.00 1.10 0.00 0.00 33.01 34.28 1sx4 s GLN 194 CO -0.01 -0.08 0.18 1.97 -0.55 0.00 0.00 175.29 176.80 1sx4 n PHE 195 N 2.31 -0.17 -1.15 1.67 -1.74 -0.28 -5.00 117.46 113.10 1sx4 n PHE 195 Ca -0.13 -2.47 -0.22 0.00 -0.56 0.00 0.00 57.45 54.07 1sx4 n PHE 195 Cb 0.56 0.09 0.00 0.00 1.52 0.00 0.00 39.48 41.65 1sx4 n PHE 195 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 1sx4 n ASP 196 N -1.65 6.54 -4.01 5.98 8.00 -1.26 -2.43 116.55 127.72 1sx4 n ASP 196 Ca -0.01 -3.16 -0.26 0.00 0.71 0.00 0.00 54.79 52.08 1sx4 n ASP 196 Cb 0.56 -1.12 -0.17 0.00 -0.02 0.00 0.00 41.12 40.37 1sx4 n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1sx4 s ARG 197 N -1.87 1.76 0.44 -1.24 1.81 -1.07 -4.63 118.95 114.14 1sx4 s ARG 197 Ca 0.44 -0.41 0.04 0.00 -1.72 0.00 0.00 55.73 54.08 1sx4 s ARG 197 Cb 0.31 -1.52 0.01 0.00 -0.45 0.00 0.00 34.95 33.29 1sx4 s ARG 197 CO -0.09 -0.04 0.62 0.20 -0.68 0.00 0.00 175.30 175.31 1sx4 s GLY 198 N 0.92 1.70 0.65 -3.53 0.00 -1.24 0.04 107.32 105.85 1sx4 s GLY 198 Ca -0.09 -1.34 -0.17 0.00 0.00 0.00 0.00 44.72 43.12 1sx4 s GLY 198 CO 0.01 -1.16 0.64 1.58 0.00 0.00 0.00 173.10 174.16 1sx4 n TYR 199 N -1.98 -0.36 0.30 1.90 0.18 -1.09 -4.25 117.16 111.86 1sx4 n TYR 199 Ca 0.04 0.40 0.12 0.00 1.88 0.00 0.00 57.90 60.33 1sx4 n TYR 199 Cb 0.58 -1.98 0.11 0.00 -0.38 0.00 0.00 39.34 37.67 1sx4 n TYR 199 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1sx4 h LEU 200 N 0.01 0.00 -7.52 -3.48 3.38 -1.53 -3.44 115.31 102.72 1sx4 h LEU 200 Ca -0.46 -0.06 -0.27 0.00 0.09 0.00 0.00 57.88 57.17 1sx4 h LEU 200 Cb 1.37 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 41.80 1sx4 h LEU 200 CO 0.46 0.03 -0.68 -0.94 0.09 0.00 0.00 178.44 177.40 1sx4 s SER 201 N -5.15 -0.00 0.00 -0.43 1.04 -1.26 -5.02 113.70 102.88 1sx4 s SER 201 Ca 0.04 0.12 0.02 0.00 0.48 0.00 0.00 55.95 56.61 1sx4 s SER 201 Cb 0.10 0.03 0.12 0.00 0.10 0.00 0.00 66.02 66.37 1sx4 s SER 201 CO 0.73 -0.12 0.64 -2.65 0.98 0.00 0.00 173.24 172.83 1sx4 n PRO 202 N 4.01 0.06 0.12 4.02 -0.02 -1.26 -2.30 135.00 139.63 1sx4 n PRO 202 Ca -0.25 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1sx4 n PRO 202 Cb 0.52 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.49 1sx4 n PRO 202 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 1sx4 h TYR 203 N 0.00 0.00 -0.04 6.00 0.05 -1.99 -3.23 116.97 117.76 1sx4 h TYR 203 Ca 0.00 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.79 1sx4 h TYR 203 Cb 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 1sx4 h TYR 203 CO 0.00 0.60 0.04 0.74 -1.05 0.00 0.00 178.16 178.49 1sx4 h PHE 204 N 0.00 0.00 -1.49 4.88 0.04 -1.80 -3.43 116.94 115.14 1sx4 h PHE 204 Ca -0.02 0.00 -0.61 0.00 2.80 0.00 0.00 57.97 60.14 1sx4 h PHE 204 Cb 1.47 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.61 1sx4 h PHE 204 CO 0.00 0.00 1.49 -0.89 -0.60 0.00 0.00 178.31 178.31 1sx4 n ILE 205 N -4.07 0.22 1.27 -0.55 5.41 -1.22 -4.84 119.36 115.57 1sx4 n ILE 205 Ca -0.02 -0.39 0.13 0.00 1.00 0.00 0.00 62.75 63.47 1sx4 n ILE 205 Cb 0.13 -2.12 0.33 0.00 -0.71 0.00 0.00 39.64 37.26 1sx4 n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1sx4 n ASN 206 N 11.29 2.05 -3.54 4.38 0.23 -1.26 -4.63 115.26 123.78 1sx4 n ASN 206 Ca 0.37 -1.64 -0.29 0.00 -0.53 0.00 0.00 54.58 52.49 1sx4 n ASN 206 Cb 0.35 0.04 -0.12 0.00 -2.08 0.00 0.00 39.78 37.97 1sx4 n ASN 206 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1sx4 s LYS 207 N -2.07 0.95 0.53 -3.83 1.02 -1.20 -4.99 119.74 110.15 1sx4 s LYS 207 Ca 0.32 -1.81 0.27 0.00 0.02 0.00 0.00 55.97 54.77 1sx4 s LYS 207 Cb 0.20 -1.74 1.47 0.00 -0.52 0.00 0.00 37.83 37.25 1sx4 s LYS 207 CO 0.35 -1.24 2.09 -1.00 -0.92 0.00 0.00 175.35 174.63 1sx4 h PRO 208 N 6.53 0.00 -0.78 -1.68 0.13 -1.82 -2.78 132.00 131.60 1sx4 h PRO 208 Ca 0.09 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.24 1sx4 h PRO 208 Cb 0.93 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.02 1sx4 h PRO 208 CO 0.37 0.11 0.52 0.93 -0.23 0.00 0.00 178.00 179.70 1sx4 h GLU 209 N 0.00 1.00 0.00 0.86 3.07 -1.95 -1.10 114.58 116.46 1sx4 h GLU 209 Ca -0.00 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 58.65 1sx4 h GLU 209 Cb 0.30 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.96 1sx4 h GLU 209 CO 0.01 0.66 -0.89 1.15 -1.40 0.00 0.00 179.01 178.54 1sx4 h THR 210 N 1.03 0.90 -0.40 1.13 2.02 -2.00 -3.47 112.91 112.11 1sx4 h THR 210 Ca 0.29 -2.37 -0.08 0.00 0.77 0.00 0.00 66.41 65.03 1sx4 h THR 210 Cb -0.07 2.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 1sx4 h THR 210 CO -0.07 0.51 -0.09 0.61 0.37 0.00 0.00 175.52 176.85 1sx4 n GLY 211 N 1.31 0.38 3.09 2.16 0.00 -0.42 -5.04 105.19 106.67 1sx4 n GLY 211 Ca -0.02 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 1sx4 n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sx4 s ALA 212 N -2.17 0.20 -0.01 4.61 0.00 -1.07 -4.47 121.76 118.86 1sx4 s ALA 212 Ca 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 1sx4 s ALA 212 Cb 0.00 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 23.34 1sx4 s ALA 212 CO 0.00 -0.34 0.32 0.08 0.00 0.00 0.00 175.76 175.82 1sx4 s VAL 213 N -3.17 5.20 -0.09 0.00 1.01 0.59 -3.22 120.40 120.72 1sx4 s VAL 213 Ca -0.00 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 62.43 1sx4 s VAL 213 Cb 0.02 -3.60 0.05 0.00 0.00 0.00 0.00 36.38 32.85 1sx4 s VAL 213 CO -0.07 0.48 0.18 -0.70 0.00 0.00 0.00 175.10 174.99 1sx4 s GLU 214 N -1.39 0.07 0.03 2.72 2.12 -1.26 -0.76 118.70 120.23 1sx4 s GLU 214 Ca 0.25 0.56 0.05 0.00 0.36 0.00 0.00 54.97 56.19 1sx4 s GLU 214 Cb -0.14 -0.21 -0.02 0.00 0.26 0.00 0.00 34.13 34.01 1sx4 s GLU 214 CO 0.13 -0.28 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.92 1sx4 s LEU 215 N 2.10 2.16 -0.04 2.70 1.43 -0.85 -4.93 118.68 121.25 1sx4 s LEU 215 Ca 0.00 -0.44 0.06 0.00 -1.03 0.00 0.00 54.13 52.73 1sx4 s LEU 215 Cb -0.12 -0.61 -0.02 0.00 0.03 0.00 0.00 46.19 45.47 1sx4 s LEU 215 CO -0.06 0.04 -0.23 -1.61 0.23 0.00 0.00 176.35 174.72 1sx4 s GLU 216 N -1.06 2.36 -1.57 1.70 2.02 -1.26 -0.47 118.70 120.41 1sx4 s GLU 216 Ca 0.02 -0.88 -0.13 0.00 0.02 0.00 0.00 54.97 54.00 1sx4 s GLU 216 Cb -0.08 -2.15 0.10 0.00 0.10 0.00 0.00 34.13 32.10 1sx4 s GLU 216 CO 0.01 0.50 0.85 0.43 0.02 0.00 0.00 175.26 177.07 1sx4 n SER 217 N 2.62 -3.65 -4.82 -0.19 7.64 -0.21 -4.60 113.62 110.41 1sx4 n SER 217 Ca -0.17 -0.88 -0.35 0.00 1.01 0.00 0.00 58.87 58.48 1sx4 n SER 217 Cb 0.52 -3.42 -0.06 0.00 -1.01 0.00 0.00 64.21 60.23 1sx4 n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1sx4 s PRO 218 N -6.69 4.25 0.57 1.43 0.04 -1.19 -4.59 135.00 128.83 1sx4 s PRO 218 Ca 0.59 0.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.39 1sx4 s PRO 218 Cb -0.31 -2.73 -0.05 0.00 0.04 0.00 0.00 34.50 31.45 1sx4 s PRO 218 CO 0.87 0.30 1.03 -0.06 0.04 0.00 0.00 177.00 179.18 1sx4 s PHE 219 N -1.67 3.19 -0.13 0.56 0.08 -0.38 -2.54 117.98 117.11 1sx4 s PHE 219 Ca 0.47 1.48 0.00 0.00 0.12 0.00 0.00 56.93 59.01 1sx4 s PHE 219 Cb -0.15 -2.91 0.02 0.00 -0.57 0.00 0.00 43.02 39.41 1sx4 s PHE 219 CO 0.20 -0.83 -0.12 0.42 -0.10 0.00 0.00 175.22 174.79 1sx4 s ILE 220 N -2.58 1.36 -0.35 0.64 1.01 0.11 -0.21 121.20 121.19 1sx4 s ILE 220 Ca 0.61 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 60.62 1sx4 s ILE 220 Cb -0.13 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 1sx4 s ILE 220 CO 0.37 0.42 0.25 -0.22 0.00 0.00 0.00 174.94 175.75 1sx4 s LEU 221 N 1.43 4.58 -0.41 2.97 2.96 0.20 -0.66 118.68 129.75 1sx4 s LEU 221 Ca 0.02 -0.48 -0.12 0.00 -0.22 0.00 0.00 54.13 53.33 1sx4 s LEU 221 Cb -0.13 -2.14 0.05 0.00 0.50 0.00 0.00 46.19 44.47 1sx4 s LEU 221 CO -0.08 -0.26 0.27 -0.76 -1.32 0.00 0.00 176.35 174.20 1sx4 s LEU 222 N 1.72 5.04 -0.24 -0.68 1.43 -1.26 -0.57 118.68 124.12 1sx4 s LEU 222 Ca 0.06 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.00 1sx4 s LEU 222 Cb -0.18 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.02 1sx4 s LEU 222 CO 0.10 -0.48 -0.10 0.00 0.23 0.00 0.00 176.35 176.10 1sx4 s ALA 223 N 1.56 2.59 -1.36 4.21 0.00 -0.43 -1.44 121.76 126.89 1sx4 s ALA 223 Ca 0.03 -1.50 -0.10 0.00 0.00 0.00 0.00 51.96 50.38 1sx4 s ALA 223 Cb -0.21 -1.56 0.11 0.00 0.00 0.00 0.00 23.12 21.46 1sx4 s ALA 223 CO 0.06 -0.84 2.08 -3.47 0.00 0.00 0.00 175.76 173.60 1sx4 n ASP 224 N 4.59 5.17 0.00 0.00 2.03 -0.89 -2.14 116.55 125.31 1sx4 n ASP 224 Ca -0.17 -3.01 0.00 0.00 0.52 0.00 0.00 54.79 52.14 1sx4 n ASP 224 Cb 0.46 -1.52 0.00 0.00 -0.72 0.00 0.00 41.12 39.34 1sx4 n ASP 224 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1sx4 n LYS 225 N 4.31 0.00 -1.80 -0.67 2.85 -1.26 -4.35 118.16 117.24 1sx4 n LYS 225 Ca 0.47 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 57.35 1sx4 n LYS 225 Cb 0.35 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.78 1sx4 n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1sx4 s LYS 226 N -2.00 3.02 -0.29 -1.58 1.02 -1.26 -3.08 119.74 115.57 1sx4 s LYS 226 Ca 0.00 2.17 0.03 0.00 0.02 0.00 0.00 55.97 58.19 1sx4 s LYS 226 Cb 0.00 -2.16 0.07 0.00 -0.52 0.00 0.00 37.83 35.22 1sx4 s LYS 226 CO 0.00 -1.26 -0.05 0.42 -0.92 0.00 0.00 175.35 173.54 1sx4 s ILE 227 N -1.34 2.17 -0.17 2.17 1.01 -0.26 -4.92 121.20 119.86 1sx4 s ILE 227 Ca 0.74 -1.87 -0.05 0.00 0.00 0.00 0.00 60.65 59.47 1sx4 s ILE 227 Cb -0.39 -2.40 -0.08 0.00 0.01 0.00 0.00 42.46 39.59 1sx4 s ILE 227 CO 0.45 -0.24 -0.19 -1.20 0.00 0.00 0.00 174.94 173.76 1sx4 n SER 228 N 4.38 1.77 -4.70 3.58 7.64 -1.26 -2.86 113.62 122.17 1sx4 n SER 228 Ca -0.07 0.10 -0.39 0.00 1.01 0.00 0.00 58.87 59.52 1sx4 n SER 228 Cb 0.42 -0.41 -0.06 0.00 -1.01 0.00 0.00 64.21 63.15 1sx4 n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1sx4 s ASN 229 N -6.18 6.74 0.44 6.43 0.01 -1.26 -0.47 114.94 120.66 1sx4 s ASN 229 Ca -0.23 0.89 0.23 0.00 -0.71 0.00 0.00 52.86 53.05 1sx4 s ASN 229 Cb 0.08 -2.33 0.97 0.00 0.41 0.00 0.00 41.25 40.38 1sx4 s ASN 229 CO 0.32 -0.11 1.85 -0.29 -1.51 0.00 0.00 177.10 177.37 1sx4 h ILE 230 N 4.88 0.63 -0.85 0.60 2.10 -1.90 -3.10 117.51 119.87 1sx4 h ILE 230 Ca -0.38 -1.09 0.21 0.00 1.08 0.00 0.00 64.86 64.68 1sx4 h ILE 230 Cb 1.17 1.72 -0.13 0.00 -1.09 0.00 0.00 36.82 38.49 1sx4 h ILE 230 CO 0.76 0.23 0.28 0.03 -1.08 0.00 0.00 178.15 178.37 1sx4 h ARG 231 N 0.00 0.29 0.00 2.19 3.08 -2.00 0.27 114.38 118.21 1sx4 h ARG 231 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1sx4 h ARG 231 Cb 0.70 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1sx4 h ARG 231 CO 0.03 0.19 0.02 0.93 -1.07 0.00 0.00 179.97 180.08 1sx4 h GLU 232 N 0.30 0.00 0.07 0.04 5.08 -1.97 -2.96 114.58 115.13 1sx4 h GLU 232 Ca 0.52 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.50 1sx4 h GLU 232 Cb 0.98 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 1sx4 h GLU 232 CO -0.57 0.00 -2.22 -1.33 -1.00 0.00 0.00 179.01 173.89 1sx4 n MET 233 N -2.80 0.71 -0.35 2.33 2.81 0.94 -2.81 117.12 117.94 1sx4 n MET 233 Ca -0.02 0.21 -0.02 0.00 -1.81 0.00 0.00 57.70 56.06 1sx4 n MET 233 Cb 0.08 -1.62 0.04 0.00 -0.71 0.00 0.00 33.22 31.01 1sx4 n MET 233 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1sx4 h LEU 234 N 0.01 -1.36 -1.84 4.03 3.38 -1.33 0.39 115.31 118.60 1sx4 h LEU 234 Ca -0.50 0.29 0.23 0.00 0.09 0.00 0.00 57.88 58.00 1sx4 h LEU 234 Cb 1.96 0.72 -0.05 0.00 0.09 0.00 0.00 40.66 43.38 1sx4 h LEU 234 CO -0.00 -0.29 0.61 1.55 0.09 0.00 0.00 178.44 180.39 1sx4 h PRO 235 N -0.03 0.13 0.00 1.13 0.13 -1.85 -2.71 132.00 128.80 1sx4 h PRO 235 Ca 0.33 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.45 1sx4 h PRO 235 Cb 0.59 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 1sx4 h PRO 235 CO -0.93 0.08 -0.27 0.28 -0.23 0.00 0.00 178.00 176.94 1sx4 h VAL 236 N 0.13 0.09 -0.83 1.56 2.07 -0.50 -3.17 116.25 115.61 1sx4 h VAL 236 Ca 0.43 -1.09 0.24 0.00 0.82 0.00 0.00 66.70 67.10 1sx4 h VAL 236 Cb 1.49 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1sx4 h VAL 236 CO -0.06 0.03 0.85 -0.07 0.02 0.00 0.00 177.57 178.33 1sx4 h LEU 237 N -1.00 0.00 0.01 2.57 3.38 -1.15 0.29 115.31 119.40 1sx4 h LEU 237 Ca -0.01 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 1sx4 h LEU 237 Cb 0.30 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1sx4 h LEU 237 CO -0.01 0.00 -1.94 -0.62 0.09 0.00 0.00 178.44 175.96 1sx4 n GLU 238 N -3.59 0.66 0.21 1.13 1.02 -1.04 -1.96 120.64 117.06 1sx4 n GLU 238 Ca 0.18 0.21 0.04 0.00 -0.02 0.00 0.00 57.16 57.56 1sx4 n GLU 238 Cb 1.12 -1.70 0.44 0.00 -0.02 0.00 0.00 31.44 31.28 1sx4 n GLU 238 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 239 N 0.90 1.57 0.10 0.62 0.00 -0.44 -2.73 119.26 119.28 1sx4 h ALA 239 Ca -0.38 -0.24 -0.28 0.00 0.00 0.00 0.00 54.91 54.02 1sx4 h ALA 239 Cb 2.08 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 19.84 1sx4 h ALA 239 CO 0.06 0.33 -1.18 0.28 0.00 0.00 0.00 179.25 178.73 1sx4 h VAL 240 N 0.01 1.38 0.00 0.00 2.07 -1.30 -3.15 116.25 115.26 1sx4 h VAL 240 Ca -0.00 -2.66 -0.02 0.00 0.82 0.00 0.00 66.70 64.85 1sx4 h VAL 240 Cb 0.46 2.72 -0.00 0.00 -1.52 0.00 0.00 31.29 32.95 1sx4 h VAL 240 CO 0.03 0.79 -0.08 0.00 0.02 0.00 0.00 177.57 178.34 1sx4 h ALA 241 N 0.49 1.64 0.05 1.67 0.00 -1.26 -1.82 119.26 120.03 1sx4 h ALA 241 Ca -0.15 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.46 1sx4 h ALA 241 Cb 1.86 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.63 1sx4 h ALA 241 CO 0.21 0.10 -1.04 0.87 0.00 0.00 0.00 179.25 179.39 1sx4 h LYS 242 N 0.00 0.19 0.00 0.00 1.57 -1.52 -3.22 116.57 113.58 1sx4 h LYS 242 Ca -0.00 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1sx4 h LYS 242 Cb 0.16 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1sx4 h LYS 242 CO 0.01 1.07 -0.17 0.00 -0.57 0.00 0.00 179.45 179.79 1sx4 n ALA 243 N -2.47 2.66 -1.62 3.86 0.00 -0.95 -4.95 120.51 117.05 1sx4 n ALA 243 Ca -0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.11 1sx4 n ALA 243 Cb 0.92 -1.36 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 1sx4 n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 244 N 1.46 0.87 3.64 0.00 0.00 -0.73 -5.02 105.19 105.42 1sx4 n GLY 244 Ca 0.06 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 1sx4 n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sx4 s LYS 245 N -3.50 2.33 0.95 1.61 1.02 -1.23 -5.07 119.74 115.85 1sx4 s LYS 245 Ca 0.00 -1.08 -0.12 0.00 0.02 0.00 0.00 55.97 54.79 1sx4 s LYS 245 Cb 0.00 -2.35 0.16 0.00 -0.52 0.00 0.00 37.83 35.12 1sx4 s LYS 245 CO 0.00 0.47 1.11 -1.25 -0.92 0.00 0.00 175.35 174.76 1sx4 s PRO 246 N -2.72 0.81 -0.02 -1.68 0.04 -1.26 -4.73 135.00 125.43 1sx4 s PRO 246 Ca 0.26 0.45 -0.00 0.00 0.04 0.00 0.00 61.00 61.75 1sx4 s PRO 246 Cb -0.10 -1.79 0.03 0.00 0.04 0.00 0.00 34.50 32.68 1sx4 s PRO 246 CO 0.17 -2.46 0.04 -1.17 0.04 0.00 0.00 177.00 173.62 1sx4 s LEU 247 N -6.26 1.18 -0.14 -3.56 2.96 0.15 -1.24 118.68 111.77 1sx4 s LEU 247 Ca 0.64 0.06 -0.07 0.00 -0.22 0.00 0.00 54.13 54.54 1sx4 s LEU 247 Cb -0.17 -0.01 -0.04 0.00 0.50 0.00 0.00 46.19 46.47 1sx4 s LEU 247 CO 0.56 -0.11 0.12 -0.22 -1.32 0.00 0.00 176.35 175.38 1sx4 s LEU 248 N 0.92 4.26 -0.30 -0.68 2.96 0.71 -1.59 118.68 124.95 1sx4 s LEU 248 Ca -0.08 0.37 -0.00 0.00 -0.22 0.00 0.00 54.13 54.20 1sx4 s LEU 248 Cb -0.11 -2.05 0.06 0.00 0.50 0.00 0.00 46.19 44.59 1sx4 s LEU 248 CO -0.03 0.34 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.70 1sx4 s ILE 249 N -0.64 2.74 -0.43 6.68 -1.09 0.03 0.60 121.20 129.10 1sx4 s ILE 249 Ca 0.13 -1.56 -0.06 0.00 -2.23 0.00 0.00 60.65 56.92 1sx4 s ILE 249 Cb -0.12 -2.64 0.11 0.00 -1.58 0.00 0.00 42.46 38.23 1sx4 s ILE 249 CO 0.02 -0.16 0.25 -0.63 -1.23 0.00 0.00 174.94 173.19 1sx4 s ILE 250 N 1.18 3.73 0.43 2.92 1.01 0.26 -2.07 121.20 128.67 1sx4 s ILE 250 Ca -0.04 -1.83 0.06 0.00 0.00 0.00 0.00 60.65 58.84 1sx4 s ILE 250 Cb -0.20 -3.46 -0.06 0.00 0.01 0.00 0.00 42.46 38.75 1sx4 s ILE 250 CO -0.03 -0.66 0.05 0.00 0.00 0.00 0.00 174.94 174.30 1sx4 s ALA 251 N 1.27 3.43 0.46 9.38 0.00 -1.24 -1.31 121.76 133.75 1sx4 s ALA 251 Ca 0.06 -1.94 0.21 0.00 0.00 0.00 0.00 51.96 50.29 1sx4 s ALA 251 Cb -0.24 0.02 1.20 0.00 0.00 0.00 0.00 23.12 24.10 1sx4 s ALA 251 CO -0.02 -0.12 1.90 1.49 0.00 0.00 0.00 175.76 179.01 1sx4 h GLU 252 N 1.61 0.27 -1.17 0.00 4.81 -1.36 0.50 114.58 119.24 1sx4 h GLU 252 Ca -0.44 -0.02 0.27 0.00 -0.13 0.00 0.00 59.36 59.05 1sx4 h GLU 252 Cb 1.26 -0.06 -0.23 0.00 0.63 0.00 0.00 28.75 30.35 1sx4 h GLU 252 CO 0.77 0.18 0.91 0.34 -0.73 0.00 0.00 179.01 180.48 1sx4 s ASP 253 N -5.81 -0.07 -0.25 1.04 2.15 -1.26 -4.20 116.67 108.28 1sx4 s ASP 253 Ca -0.07 0.03 0.01 0.00 0.43 0.00 0.00 52.55 52.95 1sx4 s ASP 253 Cb 0.22 0.06 0.06 0.00 -0.30 0.00 0.00 42.92 42.96 1sx4 s ASP 253 CO 0.77 -0.09 -0.05 -0.69 -0.17 0.00 0.00 175.17 174.94 1sx4 s VAL 254 N -1.69 1.61 0.27 1.11 1.01 -1.26 -1.11 120.40 120.34 1sx4 s VAL 254 Ca 0.10 -1.33 -0.00 0.00 0.00 0.00 0.00 61.98 60.74 1sx4 s VAL 254 Cb -0.01 -1.89 0.05 0.00 0.00 0.00 0.00 36.38 34.54 1sx4 s VAL 254 CO -0.05 -0.14 0.37 -0.62 0.00 0.00 0.00 175.10 174.65 1sx4 n GLU 255 N 4.63 0.30 0.00 2.72 1.02 -1.13 -4.75 120.64 123.43 1sx4 n GLU 255 Ca -0.11 -0.96 0.00 0.00 -0.02 0.00 0.00 57.16 56.07 1sx4 n GLU 255 Cb 0.44 -0.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.60 1sx4 n GLU 255 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sx4 n GLY 256 N 2.23 -1.86 0.41 0.62 0.00 -1.26 -1.35 105.19 103.97 1sx4 n GLY 256 Ca 0.06 0.40 -0.10 0.00 0.00 0.00 0.00 46.02 46.38 1sx4 n GLY 256 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1sx4 h GLU 257 N 0.00 -0.28 0.92 1.61 4.22 -1.92 0.22 114.58 119.35 1sx4 h GLU 257 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.41 1sx4 h GLU 257 Cb 0.00 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.32 1sx4 h GLU 257 CO 0.00 -0.19 -0.44 0.00 -2.18 0.00 0.00 179.01 176.20 1sx4 h ALA 258 N 0.41 -1.31 -0.21 2.92 0.00 -0.86 -3.04 119.26 117.17 1sx4 h ALA 258 Ca 0.14 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.81 1sx4 h ALA 258 Cb 0.57 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1sx4 h ALA 258 CO -0.64 -1.22 -0.45 1.25 0.00 0.00 0.00 179.25 178.19 1sx4 h LEU 259 N -1.25 -1.47 -0.95 0.00 5.85 -0.92 -0.56 115.31 116.01 1sx4 h LEU 259 Ca -0.13 0.18 0.13 0.00 0.84 0.00 0.00 57.88 58.91 1sx4 h LEU 259 Cb 0.94 0.59 -0.14 0.00 0.37 0.00 0.00 40.66 42.42 1sx4 h LEU 259 CO 0.21 -0.37 -0.42 0.00 -0.34 0.00 0.00 178.44 177.52 1sx4 n ALA 260 N -2.97 -0.25 -0.18 1.25 0.00 0.75 0.12 120.51 119.23 1sx4 n ALA 260 Ca -0.04 0.91 -0.07 0.00 0.00 0.00 0.00 53.44 54.23 1sx4 n ALA 260 Cb 0.30 -0.34 0.02 0.00 0.00 0.00 0.00 19.45 19.42 1sx4 n ALA 260 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1sx4 h THR 261 N 0.00 1.18 -0.59 0.00 2.02 -1.24 0.66 112.91 114.94 1sx4 h THR 261 Ca 0.28 -0.47 0.08 0.00 0.77 0.00 0.00 66.41 67.07 1sx4 h THR 261 Cb 0.52 0.53 -0.06 0.00 -1.74 0.00 0.00 68.15 67.40 1sx4 h THR 261 CO -0.93 0.20 0.25 -0.07 0.37 0.00 0.00 175.52 175.34 1sx4 h LEU 262 N 0.70 0.30 -0.55 2.58 3.38 0.75 0.17 115.31 122.64 1sx4 h LEU 262 Ca 0.18 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1sx4 h LEU 262 Cb 0.06 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1sx4 h LEU 262 CO -0.03 0.19 0.37 0.58 0.09 0.00 0.00 178.44 179.63 1sx4 h VAL 263 N 0.46 1.14 -0.39 1.22 2.07 0.44 -0.12 116.25 121.07 1sx4 h VAL 263 Ca 0.29 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1sx4 h VAL 263 Cb 0.30 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1sx4 h VAL 263 CO -0.26 0.14 0.01 0.58 0.02 0.00 0.00 177.57 178.06 1sx4 h VAL 264 N 0.75 1.21 -0.00 2.57 2.07 0.20 -2.24 116.25 120.80 1sx4 h VAL 264 Ca 0.20 -0.84 -0.25 0.00 0.82 0.00 0.00 66.70 66.63 1sx4 h VAL 264 Cb -0.09 0.90 0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1sx4 h VAL 264 CO -0.04 0.29 -0.99 0.78 0.02 0.00 0.00 177.57 177.63 1sx4 h ASN 265 N 0.59 0.87 -0.36 0.57 -0.26 -0.16 -3.08 115.58 113.75 1sx4 h ASN 265 Ca 0.12 -0.74 -0.14 0.00 -0.56 0.00 0.00 56.30 54.99 1sx4 h ASN 265 Cb 0.36 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 37.34 1sx4 h ASN 265 CO 0.01 1.50 -0.31 0.71 -1.06 0.00 0.00 177.43 178.28 1sx4 h THR 266 N 0.33 1.28 0.00 2.81 1.35 -1.06 -2.73 112.91 114.90 1sx4 h THR 266 Ca -0.12 -1.47 0.03 0.00 -0.55 0.00 0.00 66.41 64.29 1sx4 h THR 266 Cb 1.65 1.41 -0.06 0.00 -1.73 0.00 0.00 68.15 69.42 1sx4 h THR 266 CO 0.19 0.49 -0.47 -0.03 -0.25 0.00 0.00 175.52 175.46 1sx4 h MET 267 N 0.65 -0.60 0.00 4.72 -1.53 -1.47 -2.70 114.93 114.00 1sx4 h MET 267 Ca 0.06 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.37 1sx4 h MET 267 Cb 0.89 0.14 0.00 0.00 -0.55 0.00 0.00 31.60 32.07 1sx4 h MET 267 CO 0.08 -0.40 0.00 0.54 0.14 0.00 0.00 176.91 177.27 1sx4 n ARG 268 N -5.46 0.46 -2.04 0.39 1.74 -1.16 -4.78 116.66 105.81 1sx4 n ARG 268 Ca -0.06 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.94 1sx4 n ARG 268 Cb 0.38 -1.16 -0.01 0.00 -1.02 0.00 0.00 32.46 30.65 1sx4 n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sx4 n GLY 269 N -0.06 0.16 0.02 -0.13 0.00 -1.02 -4.98 105.19 99.18 1sx4 n GLY 269 Ca 0.04 -0.58 -0.01 0.00 0.00 0.00 0.00 46.02 45.47 1sx4 n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1sx4 h ILE 270 N 0.00 0.00 -3.57 -0.61 2.04 -1.66 -3.47 117.51 110.24 1sx4 h ILE 270 Ca -0.18 -0.09 -0.33 0.00 1.00 0.00 0.00 64.86 65.27 1sx4 h ILE 270 Cb 1.06 0.00 -0.33 0.00 -0.74 0.00 0.00 36.82 36.81 1sx4 h ILE 270 CO 0.22 0.00 -0.74 -0.69 0.00 0.00 0.00 178.15 176.93 1sx4 s VAL 271 N -1.57 0.16 -0.34 1.67 1.01 -1.24 -5.02 120.40 115.08 1sx4 s VAL 271 Ca -0.01 0.05 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 1sx4 s VAL 271 Cb 0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 36.38 36.14 1sx4 s VAL 271 CO 0.02 0.12 1.47 -0.54 0.00 0.00 0.00 175.10 176.16 1sx4 s LYS 272 N 0.78 3.67 0.04 2.72 3.01 -1.26 -4.00 119.74 124.70 1sx4 s LYS 272 Ca -0.08 1.21 -0.01 0.00 -1.01 0.00 0.00 55.97 56.08 1sx4 s LYS 272 Cb -0.11 -4.01 -0.03 0.00 -1.01 0.00 0.00 37.83 32.67 1sx4 s LYS 272 CO -0.01 -1.44 -0.03 0.08 0.51 0.00 0.00 175.35 174.46 1sx4 s VAL 273 N 5.30 0.19 0.07 3.17 1.01 -1.26 -0.67 120.40 128.21 1sx4 s VAL 273 Ca 0.64 -1.58 -0.10 0.00 0.00 0.00 0.00 61.98 60.94 1sx4 s VAL 273 Cb -0.18 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.00 1sx4 s VAL 273 CO 0.30 -0.87 0.21 0.00 0.00 0.00 0.00 175.10 174.74 1sx4 s ALA 274 N -3.31 -0.35 -0.02 5.51 0.00 -0.62 -4.88 121.76 118.09 1sx4 s ALA 274 Ca 0.01 -0.42 -0.09 0.00 0.00 0.00 0.00 51.96 51.47 1sx4 s ALA 274 Cb 0.04 0.41 0.01 0.00 0.00 0.00 0.00 23.12 23.58 1sx4 s ALA 274 CO -0.08 -0.46 0.19 0.00 0.00 0.00 0.00 175.76 175.42 1sx4 s ALA 275 N -3.30 -0.47 -0.25 0.00 0.00 -1.26 -0.79 121.76 115.69 1sx4 s ALA 275 Ca 0.01 0.14 -0.22 0.00 0.00 0.00 0.00 51.96 51.88 1sx4 s ALA 275 Cb 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 23.12 23.20 1sx4 s ALA 275 CO -0.08 -0.19 0.67 0.14 0.00 0.00 0.00 175.76 176.29 1sx4 s VAL 276 N -1.01 -0.00 0.96 0.00 -7.23 -0.88 -1.16 120.40 111.08 1sx4 s VAL 276 Ca -0.11 0.00 -0.12 0.00 -1.81 0.00 0.00 61.98 59.94 1sx4 s VAL 276 Cb -0.06 -0.93 0.10 0.00 0.56 0.00 0.00 36.38 36.05 1sx4 s VAL 276 CO 0.02 0.00 0.73 0.29 -0.31 0.00 0.00 175.10 175.83 1sx4 n LYS 277 N 2.98 -0.57 -1.88 4.82 5.02 -1.26 -3.69 118.16 123.58 1sx4 n LYS 277 Ca -0.15 -0.12 -0.32 0.00 -2.02 0.00 0.00 58.31 55.70 1sx4 n LYS 277 Cb 0.56 -2.08 0.03 0.00 -0.02 0.00 0.00 35.03 33.51 1sx4 n LYS 277 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sx4 s ALA 278 N -2.49 2.67 0.19 7.82 0.00 0.17 -4.75 121.76 125.37 1sx4 s ALA 278 Ca 0.62 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.63 1sx4 s ALA 278 Cb -0.22 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.59 1sx4 s ALA 278 CO 0.63 -1.00 1.12 -1.25 0.00 0.00 0.00 175.76 175.26 1sx4 s PRO 279 N -4.30 4.58 2.29 0.00 0.04 -1.26 -4.88 135.00 131.47 1sx4 s PRO 279 Ca 0.63 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1sx4 s PRO 279 Cb -0.16 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1sx4 s PRO 279 CO 0.42 0.06 0.00 0.41 0.04 0.00 0.00 177.00 177.92 1sx4 n GLY 280 N 1.96 -0.36 0.00 0.56 0.00 -1.26 -4.22 105.19 101.87 1sx4 n GLY 280 Ca 0.03 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1sx4 n GLY 280 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1sx4 n PHE 281 N -1.13 0.00 -0.40 1.61 -1.74 -1.26 -4.81 117.46 109.72 1sx4 n PHE 281 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1sx4 n PHE 281 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1sx4 n PHE 281 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1sx4 n GLY 282 N 1.07 3.37 0.13 4.97 0.00 -1.26 -3.11 105.19 110.35 1sx4 n GLY 282 Ca 0.00 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 1sx4 n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1sx4 h ASP 283 N 0.81 0.56 0.07 1.61 3.32 -2.00 -3.34 116.42 117.44 1sx4 h ASP 283 Ca 0.00 -0.73 -0.04 0.00 0.02 0.00 0.00 57.03 56.28 1sx4 h ASP 283 Cb 0.00 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1sx4 h ASP 283 CO 0.00 1.60 -0.14 0.08 -1.72 0.00 0.00 179.24 179.06 1sx4 h ARG 284 N 0.10 0.17 -0.50 3.56 0.11 -1.96 -3.11 114.38 112.75 1sx4 h ARG 284 Ca -0.27 -0.04 0.05 0.00 0.10 0.00 0.00 59.98 59.83 1sx4 h ARG 284 Cb 2.07 -0.02 -0.08 0.00 1.11 0.00 0.00 29.97 33.05 1sx4 h ARG 284 CO 0.20 0.31 -0.48 -0.09 0.10 0.00 0.00 179.97 180.00 1sx4 h ARG 285 N 0.16 -0.23 -0.44 0.08 2.43 -1.66 1.36 114.38 116.08 1sx4 h ARG 285 Ca 0.03 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1sx4 h ARG 285 Cb 0.35 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1sx4 h ARG 285 CO 0.02 -0.15 0.24 0.87 -1.51 0.00 0.00 179.97 179.44 1sx4 h LYS 286 N -0.24 0.48 -0.66 0.20 1.57 -1.76 1.18 116.57 117.33 1sx4 h LYS 286 Ca 0.08 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1sx4 h LYS 286 Cb 0.46 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1sx4 h LYS 286 CO -0.60 0.31 0.28 0.00 -0.57 0.00 0.00 179.45 178.88 1sx4 h ALA 287 N 1.21 0.86 -0.03 3.86 0.00 -1.34 -2.04 119.26 121.77 1sx4 h ALA 287 Ca 0.18 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1sx4 h ALA 287 Cb 0.05 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1sx4 h ALA 287 CO -0.10 0.46 -0.82 1.98 0.00 0.00 0.00 179.25 180.77 1sx4 h MET 288 N 0.93 0.35 -0.15 0.00 4.05 0.28 -2.33 114.93 118.06 1sx4 h MET 288 Ca 0.22 -0.33 -0.02 0.00 -0.28 0.00 0.00 59.70 59.29 1sx4 h MET 288 Cb 0.19 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 1sx4 h MET 288 CO -0.02 0.99 -0.01 1.25 0.23 0.00 0.00 176.91 179.35 1sx4 h LEU 289 N 0.22 0.19 -0.80 3.39 6.46 0.14 -1.97 115.31 122.94 1sx4 h LEU 289 Ca -0.05 -0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1sx4 h LEU 289 Cb 1.42 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 41.26 1sx4 h LEU 289 CO 0.14 0.25 0.38 -0.61 -0.62 0.00 0.00 178.44 177.97 1sx4 h GLN 290 N 0.21 1.17 -0.29 1.25 5.75 -0.85 -1.63 115.11 120.72 1sx4 h GLN 290 Ca 0.05 -0.18 0.07 0.00 -0.15 0.00 0.00 58.65 58.44 1sx4 h GLN 290 Cb 0.17 -0.21 -0.08 0.00 1.07 0.00 0.00 27.48 28.44 1sx4 h GLN 290 CO 0.00 0.91 -0.27 -0.44 -2.65 0.00 0.00 178.83 176.38 1sx4 h ASP 291 N 1.14 -0.88 -0.97 -0.69 3.32 -0.87 -0.72 116.42 116.75 1sx4 h ASP 291 Ca 0.27 0.16 0.05 0.00 0.02 0.00 0.00 57.03 57.53 1sx4 h ASP 291 Cb 0.13 0.41 -0.06 0.00 0.22 0.00 0.00 39.33 40.04 1sx4 h ASP 291 CO -0.03 -0.30 0.63 0.40 -1.72 0.00 0.00 179.24 178.22 1sx4 h ILE 292 N -0.26 1.12 0.34 0.35 2.04 -1.19 -0.70 117.51 119.21 1sx4 h ILE 292 Ca 0.15 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 1sx4 h ILE 292 Cb 0.49 -0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 1sx4 h ILE 292 CO -0.44 0.21 -0.52 0.00 0.00 0.00 0.00 178.15 177.41 1sx4 h ALA 293 N 1.42 -1.09 -0.38 1.87 0.00 -0.39 -2.55 119.26 118.15 1sx4 h ALA 293 Ca 0.40 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1sx4 h ALA 293 Cb 0.09 0.81 -0.08 0.00 0.00 0.00 0.00 17.79 18.61 1sx4 h ALA 293 CO -0.15 -1.17 -0.12 1.15 0.00 0.00 0.00 179.25 178.96 1sx4 h THR 294 N -0.91 0.56 -0.24 0.00 2.02 -0.36 0.29 112.91 114.28 1sx4 h THR 294 Ca -0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.16 1sx4 h THR 294 Cb 0.83 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1sx4 h THR 294 CO -0.16 0.00 0.16 0.25 0.37 0.00 0.00 175.52 176.14 1sx4 h LEU 295 N -0.04 0.22 -2.37 2.58 7.12 -1.02 -2.46 115.31 119.34 1sx4 h LEU 295 Ca 0.18 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.19 1sx4 h LEU 295 Cb 0.32 -0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.40 1sx4 h LEU 295 CO -0.41 0.15 0.00 0.35 -0.13 0.00 0.00 178.44 178.40 1sx4 n THR 296 N -4.50 0.66 -3.53 1.05 -2.24 -0.86 -2.29 114.28 102.56 1sx4 n THR 296 Ca 0.01 -0.83 -0.19 0.00 -2.27 0.00 0.00 64.05 60.77 1sx4 n THR 296 Cb 0.12 0.74 0.06 0.00 -2.10 0.00 0.00 70.33 69.16 1sx4 n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sx4 n GLY 297 N 0.41 -0.41 3.69 3.38 0.00 0.85 -0.53 105.19 112.58 1sx4 n GLY 297 Ca 0.08 0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1sx4 n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sx4 s GLY 298 N -4.27 2.65 -0.17 -0.02 0.00 -0.26 -4.43 107.32 100.82 1sx4 s GLY 298 Ca 0.05 -1.64 0.00 0.00 0.00 0.00 0.00 44.72 43.13 1sx4 s GLY 298 CO 0.77 -2.11 -0.16 -1.59 0.00 0.00 0.00 173.10 170.01 1sx4 s THR 299 N -2.75 2.45 0.27 0.90 2.01 0.30 -4.45 115.64 114.36 1sx4 s THR 299 Ca 0.26 -0.82 -0.30 0.00 0.31 0.00 0.00 61.69 61.14 1sx4 s THR 299 Cb 0.06 -2.04 -0.11 0.00 0.01 0.00 0.00 72.50 70.42 1sx4 s THR 299 CO 0.14 0.51 1.59 -0.69 -0.69 0.00 0.00 174.62 175.48 1sx4 s VAL 300 N 1.12 2.18 -0.57 3.82 1.01 -1.26 -4.71 120.40 121.99 1sx4 s VAL 300 Ca 0.01 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.11 1sx4 s VAL 300 Cb -0.14 -3.09 0.15 0.00 0.00 0.00 0.00 36.38 33.29 1sx4 s VAL 300 CO -0.06 0.02 0.37 -0.63 0.00 0.00 0.00 175.10 174.80 1sx4 s ILE 301 N 0.21 3.47 0.03 2.22 1.01 -0.52 -4.99 121.20 122.62 1sx4 s ILE 301 Ca 0.64 -2.84 0.07 0.00 0.00 0.00 0.00 60.65 58.52 1sx4 s ILE 301 Cb -0.47 -3.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1sx4 s ILE 301 CO 0.44 -0.83 -0.20 -0.94 0.00 0.00 0.00 174.94 173.42 1sx4 s SER 302 N 0.76 3.65 0.00 3.58 1.04 -1.26 -2.10 113.70 119.37 1sx4 s SER 302 Ca 0.15 -0.43 0.15 0.00 0.48 0.00 0.00 55.95 56.30 1sx4 s SER 302 Cb -0.21 -0.56 0.90 0.00 0.10 0.00 0.00 66.02 66.25 1sx4 s SER 302 CO -0.03 0.27 1.32 -0.62 0.98 0.00 0.00 173.24 175.16 1sx4 n GLU 303 N 1.74 0.52 0.05 4.02 1.02 -1.26 -2.95 120.64 123.79 1sx4 n GLU 303 Ca -0.16 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.77 1sx4 n GLU 303 Cb 0.52 -1.45 -0.13 0.00 -0.02 0.00 0.00 31.44 30.36 1sx4 n GLU 303 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1sx4 h GLU 304 N 0.00 0.46 -0.39 3.49 5.08 -1.90 -2.99 114.58 118.33 1sx4 h GLU 304 Ca 0.00 -0.62 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 1sx4 h GLU 304 Cb 0.00 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1sx4 h GLU 304 CO 0.00 1.26 0.00 -0.89 -1.00 0.00 0.00 179.01 178.38 1sx4 n ILE 305 N -4.02 0.24 -2.88 3.13 5.41 -1.15 -4.89 119.36 115.20 1sx4 n ILE 305 Ca -0.13 -0.17 -0.01 0.00 1.00 0.00 0.00 62.75 63.44 1sx4 n ILE 305 Cb 0.85 -0.11 0.00 0.00 -0.71 0.00 0.00 39.64 39.68 1sx4 n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1sx4 n GLY 306 N 0.49 -1.11 3.22 7.39 0.00 -1.13 -5.05 105.19 108.99 1sx4 n GLY 306 Ca 0.04 0.39 -0.18 0.00 0.00 0.00 0.00 46.02 46.28 1sx4 n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sx4 s MET 307 N -3.09 0.95 -0.01 1.61 -1.94 -1.19 -5.01 119.30 110.62 1sx4 s MET 307 Ca 0.03 -1.15 0.06 0.00 -1.71 0.00 0.00 55.69 52.92 1sx4 s MET 307 Cb -0.00 -0.85 -0.02 0.00 2.01 0.00 0.00 34.83 35.97 1sx4 s MET 307 CO 0.66 0.17 -0.19 -1.21 -0.01 0.00 0.00 175.02 174.43 1sx4 s GLU 308 N -2.41 1.54 0.19 2.03 2.02 -1.26 -4.20 118.70 116.61 1sx4 s GLU 308 Ca 0.05 -0.70 -0.13 0.00 0.02 0.00 0.00 54.97 54.22 1sx4 s GLU 308 Cb -0.06 -1.50 0.20 0.00 0.10 0.00 0.00 34.13 32.87 1sx4 s GLU 308 CO 0.02 0.41 1.71 -0.07 0.02 0.00 0.00 175.26 177.36 1sx4 h LEU 309 N 5.61 -0.03 -0.77 1.80 3.38 -1.92 -2.61 115.31 120.77 1sx4 h LEU 309 Ca -0.38 0.10 0.18 0.00 0.09 0.00 0.00 57.88 57.86 1sx4 h LEU 309 Cb 1.14 0.14 -0.12 0.00 0.09 0.00 0.00 40.66 41.92 1sx4 h LEU 309 CO 0.48 0.01 0.20 -0.33 0.09 0.00 0.00 178.44 178.88 1sx4 h GLU 310 N 0.22 0.26 -3.57 1.13 3.07 -1.86 -2.50 114.58 111.32 1sx4 h GLU 310 Ca 0.26 -0.02 -0.74 0.00 -0.50 0.00 0.00 59.36 58.36 1sx4 h GLU 310 Cb 0.36 -0.06 -0.12 0.00 -0.84 0.00 0.00 28.75 28.08 1sx4 h GLU 310 CO -0.35 0.17 2.33 1.63 -1.40 0.00 0.00 179.01 181.40 1sx4 n LYS 311 N -5.17 3.48 -3.52 2.33 5.02 -0.98 -4.73 118.16 114.59 1sx4 n LYS 311 Ca 0.16 -3.29 -0.18 0.00 -2.02 0.00 0.00 58.31 52.98 1sx4 n LYS 311 Cb 0.51 -3.00 -0.13 0.00 -0.02 0.00 0.00 35.03 32.39 1sx4 n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sx4 s ALA 312 N 1.00 -0.27 0.85 7.82 0.00 -0.95 -4.71 121.76 125.51 1sx4 s ALA 312 Ca 0.42 0.32 -0.13 0.00 0.00 0.00 0.00 51.96 52.58 1sx4 s ALA 312 Cb 0.11 -1.25 0.10 0.00 0.00 0.00 0.00 23.12 22.09 1sx4 s ALA 312 CO -0.02 -1.11 1.19 0.95 0.00 0.00 0.00 175.76 176.77 1sx4 s THR 313 N 2.33 2.00 0.39 0.00 -4.23 -1.26 -4.55 115.64 110.31 1sx4 s THR 313 Ca 0.06 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 60.77 1sx4 s THR 313 Cb -0.15 -2.96 0.40 0.00 1.34 0.00 0.00 72.50 71.13 1sx4 s THR 313 CO -0.11 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 175.61 1sx4 h LEU 314 N -1.21 0.43 -1.08 4.79 3.38 -1.93 -2.47 115.31 117.22 1sx4 h LEU 314 Ca -0.47 0.12 0.11 0.00 0.09 0.00 0.00 57.88 57.74 1sx4 h LEU 314 Cb 1.32 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 42.06 1sx4 h LEU 314 CO 0.62 -0.02 0.62 -0.08 0.09 0.00 0.00 178.44 179.67 1sx4 h GLU 315 N 0.32 0.94 0.00 1.13 4.81 -2.00 -1.15 114.58 118.62 1sx4 h GLU 315 Ca 0.68 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.83 1sx4 h GLU 315 Cb 1.78 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.95 1sx4 h GLU 315 CO -0.40 0.62 -0.10 -0.44 -0.73 0.00 0.00 179.01 177.97 1sx4 h ASP 316 N 0.97 0.00 -3.67 1.04 3.32 -1.81 -3.44 116.42 112.82 1sx4 h ASP 316 Ca 0.47 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.99 1sx4 h ASP 316 Cb 0.45 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.06 1sx4 h ASP 316 CO -0.23 0.10 0.67 -0.76 -1.72 0.00 0.00 179.24 177.30 1sx4 s LEU 317 N -8.63 4.41 1.07 1.55 1.02 -0.44 0.11 118.68 117.78 1sx4 s LEU 317 Ca -0.04 2.64 -0.15 0.00 0.02 0.00 0.00 54.13 56.60 1sx4 s LEU 317 Cb 0.16 -3.64 0.23 0.00 0.02 0.00 0.00 46.19 42.96 1sx4 s LEU 317 CO 0.67 -0.58 1.11 -0.83 0.02 0.00 0.00 176.35 176.74 1sx4 s GLY 318 N -0.13 1.58 -0.02 -3.19 0.00 0.16 -4.41 107.32 101.30 1sx4 s GLY 318 Ca 0.53 -0.63 -0.19 0.00 0.00 0.00 0.00 44.72 44.43 1sx4 s GLY 318 CO 0.48 0.09 0.41 1.62 0.00 0.00 0.00 173.10 175.70 1sx4 s GLN 319 N -5.18 0.78 0.34 2.90 0.74 0.31 0.09 119.66 119.65 1sx4 s GLN 319 Ca 0.68 -0.08 0.02 0.00 0.05 0.00 0.00 55.36 56.02 1sx4 s GLN 319 Cb -0.15 0.35 -0.01 0.00 1.10 0.00 0.00 33.01 34.30 1sx4 s GLN 319 CO 0.57 -0.23 0.39 0.00 -0.55 0.00 0.00 175.29 175.47 1sx4 s ALA 320 N -1.34 1.26 -0.17 1.58 0.00 -1.05 -1.95 121.76 120.09 1sx4 s ALA 320 Ca -0.13 -1.77 0.19 0.00 0.00 0.00 0.00 51.96 50.25 1sx4 s ALA 320 Cb -0.04 1.30 -0.05 0.00 0.00 0.00 0.00 23.12 24.33 1sx4 s ALA 320 CO 0.05 -0.73 1.00 0.87 0.00 0.00 0.00 175.76 176.95 1sx4 h LYS 321 N 2.12 0.00 -1.65 0.00 1.57 -1.26 -3.14 116.57 114.21 1sx4 h LYS 321 Ca -0.27 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.56 1sx4 h LYS 321 Cb 1.24 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.31 1sx4 h LYS 321 CO 0.38 0.22 0.45 1.03 -0.57 0.00 0.00 179.45 180.95 1sx4 s ARG 322 N -3.07 0.63 0.06 3.15 0.52 -1.20 -1.04 118.95 118.00 1sx4 s ARG 322 Ca -0.01 0.38 0.04 0.00 -0.52 0.00 0.00 55.73 55.62 1sx4 s ARG 322 Cb 0.09 0.30 -0.03 0.00 0.52 0.00 0.00 34.95 35.83 1sx4 s ARG 322 CO 0.79 -0.15 -0.12 0.14 0.02 0.00 0.00 175.30 175.98 1sx4 s VAL 323 N -0.53 0.94 -0.12 3.52 -7.23 0.38 -1.15 120.40 116.21 1sx4 s VAL 323 Ca -0.01 -1.25 -0.02 0.00 -1.81 0.00 0.00 61.98 58.89 1sx4 s VAL 323 Cb -0.02 -0.94 0.04 0.00 0.56 0.00 0.00 36.38 36.01 1sx4 s VAL 323 CO -0.00 -0.28 0.01 -0.69 -0.31 0.00 0.00 175.10 173.82 1sx4 s VAL 324 N -1.35 0.45 -0.06 1.32 1.01 -0.32 -2.00 120.40 119.45 1sx4 s VAL 324 Ca -0.04 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 61.83 1sx4 s VAL 324 Cb -0.10 -0.73 0.01 0.00 0.00 0.00 0.00 36.38 35.57 1sx4 s VAL 324 CO 0.02 0.10 -0.12 0.27 0.00 0.00 0.00 175.10 175.36 1sx4 s ILE 325 N 1.93 1.11 0.00 2.22 -4.36 0.06 -0.83 121.20 121.32 1sx4 s ILE 325 Ca 0.03 -0.48 0.00 0.00 -0.26 0.00 0.00 60.65 59.94 1sx4 s ILE 325 Cb -0.14 -1.01 0.00 0.00 1.25 0.00 0.00 42.46 42.56 1sx4 s ILE 325 CO -0.06 0.35 0.00 0.59 0.24 0.00 0.00 174.94 176.05 1sx4 n ASN 326 N 3.70 0.30 -0.05 4.36 3.02 0.22 -0.30 115.26 126.51 1sx4 n ASN 326 Ca -0.22 -0.48 0.09 0.00 -0.03 0.00 0.00 54.58 53.94 1sx4 n ASN 326 Cb 0.52 0.00 0.47 0.00 -0.61 0.00 0.00 39.78 40.16 1sx4 n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1sx4 h LYS 327 N 0.00 0.45 -0.08 3.52 3.64 -1.92 -2.88 116.57 119.30 1sx4 h LYS 327 Ca 0.00 -0.03 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 1sx4 h LYS 327 Cb 0.00 -0.10 -0.31 0.00 -0.41 0.00 0.00 32.23 31.41 1sx4 h LYS 327 CO 0.00 0.30 -0.81 -0.40 -2.27 0.00 0.00 179.45 176.27 1sx4 n ASP 328 N -4.47 0.41 -3.27 4.20 5.68 -1.26 -3.71 116.55 114.12 1sx4 n ASP 328 Ca 0.07 -2.02 -0.05 0.00 -0.50 0.00 0.00 54.79 52.29 1sx4 n ASP 328 Cb 0.26 -0.10 -0.05 0.00 -1.14 0.00 0.00 41.12 40.08 1sx4 n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1sx4 s THR 329 N -0.66 -0.73 0.15 2.12 2.01 -0.93 -2.61 115.64 114.99 1sx4 s THR 329 Ca 0.22 -0.13 -0.16 0.00 0.31 0.00 0.00 61.69 61.93 1sx4 s THR 329 Cb 0.29 -0.93 -0.07 0.00 0.01 0.00 0.00 72.50 71.79 1sx4 s THR 329 CO -0.10 -0.14 0.59 -0.89 -0.69 0.00 0.00 174.62 173.38 1sx4 s THR 330 N 2.64 4.78 -0.10 -0.82 2.01 0.11 -0.61 115.64 123.63 1sx4 s THR 330 Ca 0.13 0.99 -0.05 0.00 0.31 0.00 0.00 61.69 63.07 1sx4 s THR 330 Cb -0.14 -3.79 0.05 0.00 0.01 0.00 0.00 72.50 68.64 1sx4 s THR 330 CO -0.23 0.28 0.23 0.28 -0.69 0.00 0.00 174.62 174.49 1sx4 s THR 331 N -1.42 -0.15 -0.24 -0.82 -1.32 -0.01 -1.12 115.64 110.55 1sx4 s THR 331 Ca 0.38 0.20 -0.10 0.00 -1.21 0.00 0.00 61.69 60.95 1sx4 s THR 331 Cb -0.16 -0.37 -0.05 0.00 -1.51 0.00 0.00 72.50 70.41 1sx4 s THR 331 CO 0.19 0.08 0.15 -0.63 -2.21 0.00 0.00 174.62 172.21 1sx4 s ILE 332 N 1.61 5.31 -0.29 5.08 1.01 -0.91 -1.17 121.20 131.85 1sx4 s ILE 332 Ca -0.06 0.16 -0.10 0.00 0.00 0.00 0.00 60.65 60.66 1sx4 s ILE 332 Cb -0.11 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.86 1sx4 s ILE 332 CO -0.08 0.35 0.15 -0.63 0.00 0.00 0.00 174.94 174.73 1sx4 s ILE 333 N 1.05 4.84 -0.29 2.92 1.01 -0.30 -4.09 121.20 126.34 1sx4 s ILE 333 Ca 0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.58 1sx4 s ILE 333 Cb -0.14 -3.36 0.00 0.00 0.01 0.00 0.00 42.46 38.97 1sx4 s ILE 333 CO 0.04 0.19 0.01 -0.67 0.00 0.00 0.00 174.94 174.51 1sx4 n ASP 334 N 5.01 -7.72 -4.86 3.58 2.03 -1.26 -2.90 116.55 110.42 1sx4 n ASP 334 Ca -0.14 1.40 -0.31 0.00 0.52 0.00 0.00 54.79 56.26 1sx4 n ASP 334 Cb 0.51 -5.19 -0.04 0.00 -0.72 0.00 0.00 41.12 35.67 1sx4 n ASP 334 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1sx4 s GLY 335 N -1.57 2.07 0.52 0.27 0.00 -1.26 -1.97 107.32 105.38 1sx4 s GLY 335 Ca -0.01 -0.10 0.30 0.00 0.00 0.00 0.00 44.72 44.91 1sx4 s GLY 335 CO 0.75 0.10 1.96 -2.08 0.00 0.00 0.00 173.10 173.83 1sx4 h VAL 336 N 1.36 0.23 -1.63 1.40 2.07 -1.41 -3.46 116.25 114.81 1sx4 h VAL 336 Ca -0.47 -0.69 -0.70 0.00 0.82 0.00 0.00 66.70 65.65 1sx4 h VAL 336 Cb 1.18 1.56 0.04 0.00 -1.52 0.00 0.00 31.29 32.55 1sx4 h VAL 336 CO 0.64 0.08 0.68 0.61 0.02 0.00 0.00 177.57 179.60 1sx4 n GLY 337 N -0.04 0.68 3.77 2.17 0.00 -0.97 -4.84 105.19 105.96 1sx4 n GLY 337 Ca 0.00 0.81 -0.39 0.00 0.00 0.00 0.00 46.02 46.44 1sx4 n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sx4 s GLU 338 N 1.97 3.95 0.01 1.61 2.02 -1.26 -4.82 118.70 122.18 1sx4 s GLU 338 Ca 0.91 2.15 0.10 0.00 0.02 0.00 0.00 54.97 58.15 1sx4 s GLU 338 Cb -1.00 -2.74 0.45 0.00 0.10 0.00 0.00 34.13 30.94 1sx4 s GLU 338 CO 0.55 -0.51 1.33 0.39 0.02 0.00 0.00 175.26 177.05 1sx4 n GLU 339 N 0.09 0.01 0.20 1.61 1.02 -1.26 -1.43 120.64 120.87 1sx4 n GLU 339 Ca 0.04 0.34 -0.15 0.00 -0.02 0.00 0.00 57.16 57.37 1sx4 n GLU 339 Cb 0.44 -1.52 -0.08 0.00 -0.02 0.00 0.00 31.44 30.26 1sx4 n GLU 339 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 340 N 2.33 -0.43 -0.02 0.62 0.00 -1.99 -0.41 119.26 119.36 1sx4 h ALA 340 Ca 0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1sx4 h ALA 340 Cb 0.17 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1sx4 h ALA 340 CO 0.00 -0.74 -0.85 0.00 0.00 0.00 0.00 179.25 177.66 1sx4 h ALA 341 N 0.23 0.49 0.66 0.00 0.00 -1.62 -2.77 119.26 116.25 1sx4 h ALA 341 Ca -0.04 -0.68 -0.03 0.00 0.00 0.00 0.00 54.91 54.15 1sx4 h ALA 341 Cb 0.34 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1sx4 h ALA 341 CO 0.07 0.83 -0.32 0.82 0.00 0.00 0.00 179.25 180.65 1sx4 h ILE 342 N 0.21 0.34 -0.84 0.00 2.04 -1.34 -1.95 117.51 115.97 1sx4 h ILE 342 Ca -0.05 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.84 1sx4 h ILE 342 Cb 1.46 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 37.84 1sx4 h ILE 342 CO 0.14 0.01 0.55 -0.61 0.00 0.00 0.00 178.15 178.24 1sx4 h GLN 343 N -0.92 0.81 0.54 2.37 5.75 -1.16 -1.84 115.11 120.65 1sx4 h GLN 343 Ca -0.09 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.33 1sx4 h GLN 343 Cb 0.69 -0.18 0.01 0.00 1.07 0.00 0.00 27.48 29.06 1sx4 h GLN 343 CO 0.15 0.54 -0.26 0.78 -2.65 0.00 0.00 178.83 177.39 1sx4 h GLY 344 N 0.84 -0.75 1.37 2.39 0.00 -1.40 -0.72 103.07 104.79 1sx4 h GLY 344 Ca 0.38 0.28 0.09 0.00 0.00 0.00 0.00 47.33 48.08 1sx4 h GLY 344 CO -0.15 -0.27 0.23 -0.09 0.00 0.00 0.00 176.54 176.25 1sx4 h ARG 345 N -0.94 0.00 -0.15 4.80 9.65 -1.12 0.13 114.38 126.76 1sx4 h ARG 345 Ca -0.07 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.62 1sx4 h ARG 345 Cb 0.62 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.20 1sx4 h ARG 345 CO 0.12 0.00 -0.68 0.28 2.80 0.00 0.00 179.97 182.49 1sx4 h VAL 346 N 0.00 1.33 0.00 0.20 2.07 -1.23 -2.65 116.25 115.96 1sx4 h VAL 346 Ca 0.14 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.70 1sx4 h VAL 346 Cb 0.60 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 1sx4 h VAL 346 CO -0.00 0.61 0.00 0.00 0.02 0.00 0.00 177.57 178.20 1sx4 n ALA 347 N -2.55 1.71 -0.09 1.67 0.00 0.39 -1.37 120.51 120.28 1sx4 n ALA 347 Ca -0.05 0.03 -0.18 0.00 0.00 0.00 0.00 53.44 53.25 1sx4 n ALA 347 Cb 0.69 -1.35 -0.11 0.00 0.00 0.00 0.00 19.45 18.67 1sx4 n ALA 347 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1sx4 h GLN 348 N 0.00 0.00 0.00 0.00 4.20 -1.19 -3.35 115.11 114.77 1sx4 h GLN 348 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1sx4 h GLN 348 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1sx4 h GLN 348 CO 0.00 0.93 0.00 -0.89 -0.67 0.00 0.00 178.83 178.20 1sx4 n ILE 349 N -4.52 0.66 -0.08 2.54 5.41 -1.01 -2.03 119.36 120.34 1sx4 n ILE 349 Ca -0.22 0.17 -0.10 0.00 1.00 0.00 0.00 62.75 63.60 1sx4 n ILE 349 Cb 0.57 -0.90 -0.03 0.00 -0.71 0.00 0.00 39.64 38.57 1sx4 n ILE 349 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1sx4 h ARG 350 N 0.00 0.38 -0.01 0.38 9.65 -1.35 -3.25 114.38 120.18 1sx4 h ARG 350 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1sx4 h ARG 350 Cb 0.19 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.70 1sx4 h ARG 350 CO 0.00 0.36 -0.32 1.04 2.80 0.00 0.00 179.97 183.85 1sx4 n GLN 351 N -4.82 0.81 -0.30 0.20 6.02 -0.86 -3.79 117.38 114.63 1sx4 n GLN 351 Ca -0.02 -0.51 -0.05 0.00 -0.01 0.00 0.00 57.00 56.40 1sx4 n GLN 351 Cb 0.09 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 29.93 1sx4 n GLN 351 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1sx4 h GLN 352 N 1.25 1.21 -0.10 -1.09 1.08 -1.54 -2.68 115.11 113.24 1sx4 h GLN 352 Ca 0.00 -0.20 -0.19 0.00 -1.45 0.00 0.00 58.65 56.81 1sx4 h GLN 352 Cb 0.54 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1sx4 h GLN 352 CO 0.00 0.95 -0.73 0.82 -0.95 0.00 0.00 178.83 178.92 1sx4 h ILE 353 N 1.19 1.35 -0.88 2.54 2.04 -1.66 -1.02 117.51 121.06 1sx4 h ILE 353 Ca 0.28 -2.08 0.02 0.00 1.00 0.00 0.00 64.86 64.08 1sx4 h ILE 353 Cb 0.16 2.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 1sx4 h ILE 353 CO -0.03 0.63 0.57 -0.33 0.00 0.00 0.00 178.15 179.00 1sx4 h GLU 354 N 0.35 1.11 -0.50 2.37 4.39 -1.62 -2.90 114.58 117.78 1sx4 h GLU 354 Ca -0.03 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1sx4 h GLU 354 Cb 1.32 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1sx4 h GLU 354 CO 0.13 0.73 0.00 0.39 -1.16 0.00 0.00 179.01 179.11 1sx4 n GLU 355 N -4.51 3.21 -2.26 2.33 1.02 -1.03 -4.86 120.64 114.53 1sx4 n GLU 355 Ca 0.10 -2.59 -0.37 0.00 -0.02 0.00 0.00 57.16 54.28 1sx4 n GLU 355 Cb 0.06 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 29.79 1sx4 n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 s ALA 356 N -1.64 2.32 -2.00 0.62 0.00 -0.39 -4.83 121.76 115.85 1sx4 s ALA 356 Ca 0.41 -1.25 0.14 0.00 0.00 0.00 0.00 51.96 51.26 1sx4 s ALA 356 Cb 0.26 -4.37 0.83 0.00 0.00 0.00 0.00 23.12 19.84 1sx4 s ALA 356 CO 0.20 -3.85 1.37 0.25 0.00 0.00 0.00 175.76 173.74 1sx4 n THR 357 N 7.04 0.00 -4.60 0.00 -2.24 -1.26 -4.81 114.28 108.42 1sx4 n THR 357 Ca 0.21 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.68 1sx4 n THR 357 Cb 0.50 -0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 68.26 1sx4 n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1sx4 s SER 358 N -1.66 4.13 -0.20 3.42 0.15 -1.26 -5.09 113.70 113.19 1sx4 s SER 358 Ca 0.21 -1.50 0.02 0.00 0.70 0.00 0.00 55.95 55.38 1sx4 s SER 358 Cb 0.10 0.18 -0.21 0.00 -1.71 0.00 0.00 66.02 64.38 1sx4 s SER 358 CO 0.16 -0.74 0.01 0.47 1.20 0.00 0.00 173.24 174.34 1sx4 n ASP 359 N -1.22 1.76 0.08 5.45 8.00 -1.26 -4.34 116.55 125.02 1sx4 n ASP 359 Ca -0.12 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.26 1sx4 n ASP 359 Cb 0.67 -0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 41.35 1sx4 n ASP 359 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1sx4 h TYR 360 N 0.02 0.42 0.00 1.24 3.20 -1.98 -3.21 116.97 116.66 1sx4 h TYR 360 Ca -0.52 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.11 1sx4 h TYR 360 Cb 1.98 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 40.21 1sx4 h TYR 360 CO 0.04 1.07 0.00 -0.25 -1.64 0.00 0.00 178.16 177.38 1sx4 n ASP 361 N -3.67 0.00 -0.09 -2.11 9.92 -1.26 -3.21 116.55 116.13 1sx4 n ASP 361 Ca -0.05 -0.52 -0.12 0.00 -0.53 0.00 0.00 54.79 53.57 1sx4 n ASP 361 Cb 0.84 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 41.24 1sx4 n ASP 361 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1sx4 n ARG 362 N -0.98 0.49 0.22 -1.24 0.63 -1.21 -4.37 116.66 110.19 1sx4 n ARG 362 Ca 0.11 0.10 -0.15 0.00 -0.92 0.00 0.00 57.85 56.99 1sx4 n ARG 362 Cb 0.05 -1.36 -0.08 0.00 0.45 0.00 0.00 32.46 31.52 1sx4 n ARG 362 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1sx4 h GLU 363 N 0.00 -0.55 -0.61 -0.14 4.39 -1.56 -2.66 114.58 113.45 1sx4 h GLU 363 Ca -0.40 0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.37 1sx4 h GLU 363 Cb 1.63 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 30.36 1sx4 h GLU 363 CO -0.06 -0.37 0.36 0.87 -1.16 0.00 0.00 179.01 178.65 1sx4 h LYS 364 N -0.57 0.67 -0.25 2.33 1.79 -1.83 -1.78 116.57 116.93 1sx4 h LYS 364 Ca -0.04 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.39 1sx4 h LYS 364 Cb 0.48 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 1sx4 h LYS 364 CO 0.03 0.44 0.14 -0.07 -1.08 0.00 0.00 179.45 178.91 1sx4 h LEU 365 N 0.69 0.31 -1.43 2.94 3.38 -1.75 -0.82 115.31 118.63 1sx4 h LEU 365 Ca 0.26 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1sx4 h LEU 365 Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1sx4 h LEU 365 CO -0.13 0.31 0.29 1.56 0.09 0.00 0.00 178.44 180.56 1sx4 h GLN 366 N 0.29 0.67 0.87 1.13 4.20 -1.30 -0.06 115.11 120.92 1sx4 h GLN 366 Ca 0.09 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 1sx4 h GLN 366 Cb 0.07 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 27.71 1sx4 h GLN 366 CO -0.01 0.48 -0.42 0.93 -0.67 0.00 0.00 178.83 179.14 1sx4 h GLU 367 N 0.69 -1.13 -0.89 1.46 5.08 -0.67 -2.65 114.58 116.46 1sx4 h GLU 367 Ca 0.18 0.08 0.11 0.00 -1.00 0.00 0.00 59.36 58.73 1sx4 h GLU 367 Cb -0.01 0.26 -0.08 0.00 0.50 0.00 0.00 28.75 29.42 1sx4 h GLU 367 CO -0.03 -0.75 0.52 0.00 -1.00 0.00 0.00 179.01 177.75 1sx4 h ARG 368 N -1.18 0.81 -0.97 2.33 3.08 -0.69 0.77 114.38 118.53 1sx4 h ARG 368 Ca -0.12 -0.05 0.11 0.00 0.07 0.00 0.00 59.98 59.99 1sx4 h ARG 368 Cb 0.90 -0.18 -0.08 0.00 0.08 0.00 0.00 29.97 30.69 1sx4 h ARG 368 CO 0.20 0.53 0.62 -0.39 -1.07 0.00 0.00 179.97 179.86 1sx4 h VAL 369 N 0.83 0.94 -0.11 2.04 -1.51 -0.90 -1.21 116.25 116.34 1sx4 h VAL 369 Ca 0.44 -0.33 -0.21 0.00 -1.23 0.00 0.00 66.70 65.38 1sx4 h VAL 369 Cb 0.46 -0.10 0.00 0.00 -2.13 0.00 0.00 31.29 29.52 1sx4 h VAL 369 CO -0.27 0.17 -0.77 0.00 -1.23 0.00 0.00 177.57 175.47 1sx4 h ALA 370 N 1.54 0.45 0.00 5.19 0.00 -0.51 0.40 119.26 126.33 1sx4 h ALA 370 Ca 0.47 -0.61 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1sx4 h ALA 370 Cb 0.46 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1sx4 h ALA 370 CO -0.23 0.73 -0.01 0.87 0.00 0.00 0.00 179.25 180.61 1sx4 h LYS 371 N 0.39 0.00 0.00 0.00 1.57 -0.61 -2.85 116.57 115.07 1sx4 h LYS 371 Ca -0.04 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.44 1sx4 h LYS 371 Cb 1.37 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.62 1sx4 h LYS 371 CO 0.14 0.01 -2.21 1.28 -0.57 0.00 0.00 179.45 178.10 1sx4 n LEU 372 N -3.11 0.00 0.00 2.94 4.77 -0.54 -3.62 117.00 117.44 1sx4 n LEU 372 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1sx4 n LEU 372 Cb 0.33 0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 1sx4 n LEU 372 CO 0.28 0.40 0.00 0.00 -1.33 0.00 0.00 177.39 176.74 1sx4 n ALA 373 N -2.62 0.20 -1.21 -1.18 0.00 0.14 -5.02 120.51 110.82 1sx4 n ALA 373 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1sx4 n ALA 373 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.48 1sx4 n ALA 373 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sx4 n GLY 374 N 2.96 0.99 3.50 0.00 0.00 -1.09 -4.97 105.19 106.59 1sx4 n GLY 374 Ca 0.00 -0.90 -0.24 0.00 0.00 0.00 0.00 46.02 44.88 1sx4 n GLY 374 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sx4 s GLY 375 N 0.00 2.25 -0.12 -0.02 0.00 -1.13 -4.18 107.32 104.12 1sx4 s GLY 375 Ca 0.00 -1.93 -0.01 0.00 0.00 0.00 0.00 44.72 42.77 1sx4 s GLY 375 CO 0.00 -1.89 -0.07 0.14 0.00 0.00 0.00 173.10 171.29 1sx4 s VAL 376 N -3.17 3.65 0.05 1.40 1.01 -1.18 -3.68 120.40 118.47 1sx4 s VAL 376 Ca 0.33 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.93 1sx4 s VAL 376 Cb 0.08 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1sx4 s VAL 376 CO 0.15 0.54 -0.24 0.00 0.00 0.00 0.00 175.10 175.55 1sx4 s ALA 377 N -0.07 2.03 -0.09 5.51 0.00 -0.52 -0.78 121.76 127.84 1sx4 s ALA 377 Ca 0.01 -1.18 0.04 0.00 0.00 0.00 0.00 51.96 50.83 1sx4 s ALA 377 Cb -0.13 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.58 1sx4 s ALA 377 CO 0.03 0.47 -0.21 0.08 0.00 0.00 0.00 175.76 176.13 1sx4 s VAL 378 N -0.81 1.85 -0.14 0.00 1.01 0.15 -2.23 120.40 120.24 1sx4 s VAL 378 Ca 0.10 -0.90 -0.10 0.00 0.00 0.00 0.00 61.98 61.08 1sx4 s VAL 378 Cb -0.09 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 1sx4 s VAL 378 CO 0.02 0.51 0.19 -0.63 0.00 0.00 0.00 175.10 175.19 1sx4 s ILE 379 N 0.37 5.40 -0.28 2.22 1.01 0.30 -0.80 121.20 129.43 1sx4 s ILE 379 Ca -0.17 0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.75 1sx4 s ILE 379 Cb -0.17 -3.49 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1sx4 s ILE 379 CO 0.07 0.52 0.05 -0.54 0.00 0.00 0.00 174.94 175.04 1sx4 s LYS 380 N -0.37 3.12 0.04 2.79 1.02 0.58 -1.44 119.74 125.48 1sx4 s LYS 380 Ca 0.14 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 55.00 1sx4 s LYS 380 Cb -0.12 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1sx4 s LYS 380 CO 0.03 -0.39 1.10 0.08 -0.92 0.00 0.00 175.35 175.25 1sx4 s VAL 381 N 1.48 4.41 0.03 3.17 1.01 -1.16 -0.91 120.40 128.42 1sx4 s VAL 381 Ca 0.03 1.73 -0.05 0.00 0.00 0.00 0.00 61.98 63.69 1sx4 s VAL 381 Cb -0.17 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1sx4 s VAL 381 CO 0.01 0.14 0.26 -0.83 0.00 0.00 0.00 175.10 174.67 1sx4 s GLY 382 N 1.02 2.23 -0.12 4.51 0.00 -1.26 -1.60 107.32 112.10 1sx4 s GLY 382 Ca 0.56 -0.65 -0.29 0.00 0.00 0.00 0.00 44.72 44.34 1sx4 s GLY 382 CO 0.29 -0.51 0.72 0.00 0.00 0.00 0.00 173.10 173.60 1sx4 s ALA 383 N -1.38 -1.79 0.09 3.20 0.00 -1.21 -4.81 121.76 115.86 1sx4 s ALA 383 Ca 0.30 1.52 -0.19 0.00 0.00 0.00 0.00 51.96 53.60 1sx4 s ALA 383 Cb -0.13 -0.37 -0.08 0.00 0.00 0.00 0.00 23.12 22.54 1sx4 s ALA 383 CO 0.19 -0.36 1.53 0.00 0.00 0.00 0.00 175.76 177.13 1sx4 h ALA 384 N 3.49 0.33 -5.13 0.00 0.00 -1.87 -3.42 119.26 112.66 1sx4 h ALA 384 Ca -0.27 -0.21 -0.44 0.00 0.00 0.00 0.00 54.91 53.98 1sx4 h ALA 384 Cb 1.15 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1sx4 h ALA 384 CO 0.30 0.06 -0.26 0.25 0.00 0.00 0.00 179.25 179.60 1sx4 n THR 385 N -4.64 0.00 -0.01 0.00 -2.24 -1.26 -5.06 114.28 101.07 1sx4 n THR 385 Ca -0.03 -1.65 -0.17 0.00 -2.27 0.00 0.00 64.05 59.92 1sx4 n THR 385 Cb 0.23 0.04 -0.14 0.00 -2.10 0.00 0.00 70.33 68.36 1sx4 n THR 385 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1sx4 n GLU 386 N -1.24 0.72 -0.06 -0.78 2.13 -1.26 -2.94 120.64 117.20 1sx4 n GLU 386 Ca -0.07 0.26 0.23 0.00 0.66 0.00 0.00 57.16 58.24 1sx4 n GLU 386 Cb 0.46 -1.72 0.70 0.00 0.27 0.00 0.00 31.44 31.15 1sx4 n GLU 386 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1sx4 h VAL 387 N 0.05 0.67 0.09 6.31 -1.51 -1.98 -2.34 116.25 117.55 1sx4 h VAL 387 Ca -0.39 -0.00 -0.26 0.00 -1.23 0.00 0.00 66.70 64.81 1sx4 h VAL 387 Cb 2.03 0.67 -0.01 0.00 -2.13 0.00 0.00 31.29 31.84 1sx4 h VAL 387 CO 0.08 0.00 -1.37 -0.08 -1.23 0.00 0.00 177.57 174.97 1sx4 h GLU 388 N 0.01 0.19 -0.02 5.19 4.81 -1.96 -3.31 114.58 119.48 1sx4 h GLU 388 Ca 0.31 -0.33 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1sx4 h GLU 388 Cb 1.24 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.74 1sx4 h GLU 388 CO -0.01 1.16 -0.04 1.98 -0.73 0.00 0.00 179.01 181.37 1sx4 h MET 389 N -0.42 -0.05 -0.31 1.92 4.05 -1.40 -0.62 114.93 118.10 1sx4 h MET 389 Ca -0.31 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.18 1sx4 h MET 389 Cb 1.67 0.01 -0.08 0.00 -0.80 0.00 0.00 31.60 32.40 1sx4 h MET 389 CO 0.01 -0.04 -0.41 0.87 0.23 0.00 0.00 176.91 177.57 1sx4 h LYS 390 N -0.06 -0.36 -0.11 0.39 1.57 -1.60 0.21 116.57 116.62 1sx4 h LYS 390 Ca 0.03 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1sx4 h LYS 390 Cb 0.09 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1sx4 h LYS 390 CO -0.06 -0.24 -0.04 1.49 -0.57 0.00 0.00 179.45 180.03 1sx4 h GLU 391 N -0.38 0.22 -0.02 3.15 4.57 -1.61 -2.31 114.58 118.20 1sx4 h GLU 391 Ca 0.12 -0.09 0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1sx4 h GLU 391 Cb 0.59 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 1sx4 h GLU 391 CO -0.51 0.55 -0.05 -0.22 -1.18 0.00 0.00 179.01 177.60 1sx4 h LYS 392 N -0.12 -0.08 -0.32 1.92 1.63 -1.05 -1.47 116.57 117.09 1sx4 h LYS 392 Ca 0.03 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.87 1sx4 h LYS 392 Cb 0.47 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 1sx4 h LYS 392 CO 0.01 -0.05 0.08 -0.22 -3.45 0.00 0.00 179.45 175.82 1sx4 h LYS 393 N -0.08 0.19 -0.50 1.90 3.64 -0.57 0.48 116.57 121.64 1sx4 h LYS 393 Ca 0.03 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1sx4 h LYS 393 Cb 0.12 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.82 1sx4 h LYS 393 CO -0.07 0.13 0.02 0.00 -2.27 0.00 0.00 179.45 177.26 1sx4 h ALA 394 N 1.23 0.50 0.47 5.00 0.00 -1.27 -0.96 119.26 124.22 1sx4 h ALA 394 Ca 0.15 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1sx4 h ALA 394 Cb 0.15 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1sx4 h ALA 394 CO -0.18 -0.37 -0.23 0.00 0.00 0.00 0.00 179.25 178.47 1sx4 h ARG 395 N 0.14 -0.61 -0.81 0.00 3.08 0.17 0.13 114.38 116.48 1sx4 h ARG 395 Ca 0.25 0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.53 1sx4 h ARG 395 Cb 0.37 0.14 -0.14 0.00 0.08 0.00 0.00 29.97 30.42 1sx4 h ARG 395 CO -0.40 -0.41 -0.03 0.28 -1.07 0.00 0.00 179.97 178.35 1sx4 h VAL 396 N -0.64 0.26 -0.19 2.04 2.07 -0.93 0.28 116.25 119.14 1sx4 h VAL 396 Ca -0.06 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.49 1sx4 h VAL 396 Cb 0.49 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.38 1sx4 h VAL 396 CO 0.11 0.01 -0.26 -0.33 0.02 0.00 0.00 177.57 177.12 1sx4 h GLU 397 N 0.07 -0.28 -0.48 1.57 4.39 -0.81 0.24 114.58 119.28 1sx4 h GLU 397 Ca 0.44 0.02 0.10 0.00 0.34 0.00 0.00 59.36 60.25 1sx4 h GLU 397 Cb 0.78 0.06 -0.09 0.00 -0.10 0.00 0.00 28.75 29.41 1sx4 h GLU 397 CO -0.74 -0.19 -0.11 0.22 -1.16 0.00 0.00 179.01 177.03 1sx4 h ASP 398 N -0.29 -0.43 0.45 1.42 3.58 0.22 -2.23 116.42 119.13 1sx4 h ASP 398 Ca 0.12 0.14 -0.25 0.00 0.42 0.00 0.00 57.03 57.46 1sx4 h ASP 398 Cb 0.48 0.29 0.01 0.00 1.72 0.00 0.00 39.33 41.82 1sx4 h ASP 398 CO -0.36 -0.15 -1.10 0.00 -2.88 0.00 0.00 179.24 174.75 1sx4 h ALA 399 N 1.48 0.22 -0.95 -0.78 0.00 -0.22 -2.44 119.26 116.58 1sx4 h ALA 399 Ca 0.23 -0.79 0.26 0.00 0.00 0.00 0.00 54.91 54.61 1sx4 h ALA 399 Cb 0.35 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.01 1sx4 h ALA 399 CO -0.49 0.87 0.45 1.25 0.00 0.00 0.00 179.25 181.33 1sx4 h LEU 400 N 0.16 0.38 -0.07 0.00 7.12 -0.05 -0.94 115.31 121.91 1sx4 h LEU 400 Ca -0.11 0.17 -0.03 0.00 0.13 0.00 0.00 57.88 58.04 1sx4 h LEU 400 Cb 1.78 0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 42.05 1sx4 h LEU 400 CO 0.19 -0.06 -0.07 0.45 -0.13 0.00 0.00 178.44 178.82 1sx4 h HIS 401 N 0.37 0.20 -0.35 1.25 3.86 -1.04 -2.76 115.15 116.67 1sx4 h HIS 401 Ca 0.63 -0.06 -0.00 0.00 -1.16 0.00 0.00 60.37 59.78 1sx4 h HIS 401 Cb 1.30 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.71 1sx4 h HIS 401 CO -0.10 0.61 0.21 0.00 0.86 0.00 0.00 177.93 179.51 1sx4 h ALA 402 N 0.56 0.44 0.01 2.45 0.00 -0.84 -1.61 119.26 120.28 1sx4 h ALA 402 Ca 0.01 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1sx4 h ALA 402 Cb 0.58 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1sx4 h ALA 402 CO 0.02 -0.06 -0.25 1.79 0.00 0.00 0.00 179.25 180.75 1sx4 h THR 403 N 0.45 0.43 -0.65 0.00 1.35 -1.26 0.37 112.91 113.59 1sx4 h THR 403 Ca 0.12 0.00 0.19 0.00 -0.55 0.00 0.00 66.41 66.17 1sx4 h THR 403 Cb 0.01 0.43 -0.03 0.00 -1.73 0.00 0.00 68.15 66.83 1sx4 h THR 403 CO -0.02 0.00 0.72 0.03 -0.25 0.00 0.00 175.52 176.00 1sx4 h ARG 404 N -0.40 0.00 0.15 4.72 2.47 -1.18 -0.91 114.38 119.24 1sx4 h ARG 404 Ca 0.06 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.44 1sx4 h ARG 404 Cb 0.48 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1sx4 h ARG 404 CO -0.22 0.00 -1.74 0.00 0.56 0.00 0.00 179.97 178.58 1sx4 h ALA 405 N 1.17 0.24 -0.79 0.04 0.00 0.13 -3.17 119.26 116.89 1sx4 h ALA 405 Ca 0.31 -1.20 0.13 0.00 0.00 0.00 0.00 54.91 54.15 1sx4 h ALA 405 Cb 1.74 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 19.98 1sx4 h ALA 405 CO -0.00 1.05 0.38 0.00 0.00 0.00 0.00 179.25 180.68 1sx4 h ALA 406 N 0.05 1.15 -0.12 0.00 0.00 0.93 0.14 119.26 121.40 1sx4 h ALA 406 Ca -0.36 0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 1sx4 h ALA 406 Cb 1.99 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1sx4 h ALA 406 CO 0.12 -0.12 -0.55 0.28 0.00 0.00 0.00 179.25 178.97 1sx4 h VAL 407 N 0.56 1.35 0.00 0.00 2.07 -1.40 0.33 116.25 119.16 1sx4 h VAL 407 Ca 0.43 -1.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 1sx4 h VAL 407 Cb 0.59 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1sx4 h VAL 407 CO -0.36 0.55 -1.25 -1.84 0.02 0.00 0.00 177.57 174.69 1sx4 n GLU 408 N -3.93 0.62 0.00 1.57 0.28 -1.05 -4.66 120.64 113.47 1sx4 n GLU 408 Ca -0.03 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.02 1sx4 n GLU 408 Cb 0.59 -1.75 0.00 0.00 1.43 0.00 0.00 31.44 31.71 1sx4 n GLU 408 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1sx4 n GLU 409 N -2.59 1.11 0.00 3.44 2.13 0.01 -5.08 120.64 119.66 1sx4 n GLU 409 Ca -0.01 -0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.67 1sx4 n GLU 409 Cb 0.56 -0.52 0.00 0.00 0.27 0.00 0.00 31.44 31.75 1sx4 n GLU 409 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1sx4 n GLY 410 N 0.20 -3.10 3.21 8.31 0.00 0.11 -4.49 105.19 109.44 1sx4 n GLY 410 Ca 0.00 -1.86 -0.16 0.00 0.00 0.00 0.00 46.02 44.00 1sx4 n GLY 410 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sx4 s VAL 411 N -0.74 1.15 0.27 1.61 -7.23 -0.40 0.20 120.40 115.26 1sx4 s VAL 411 Ca 0.00 -1.71 0.02 0.00 -1.81 0.00 0.00 61.98 58.48 1sx4 s VAL 411 Cb 0.00 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 1sx4 s VAL 411 CO 0.00 -0.51 0.13 0.68 -0.31 0.00 0.00 175.10 175.09 1sx4 s VAL 412 N -2.37 0.39 -0.01 1.32 -7.23 -0.56 -2.70 120.40 109.24 1sx4 s VAL 412 Ca 0.08 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.95 1sx4 s VAL 412 Cb -0.03 -2.57 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 1sx4 s VAL 412 CO 0.02 0.00 1.40 0.00 -0.31 0.00 0.00 175.10 176.21 1sx4 s ALA 413 N -3.76 3.58 1.03 1.32 0.00 -1.26 -1.99 121.76 120.69 1sx4 s ALA 413 Ca 0.37 0.86 -0.04 0.00 0.00 0.00 0.00 51.96 53.15 1sx4 s ALA 413 Cb 0.07 -3.60 0.06 0.00 0.00 0.00 0.00 23.12 19.64 1sx4 s ALA 413 CO 0.15 -0.94 0.27 0.41 0.00 0.00 0.00 175.76 175.65 1sx4 n GLY 414 N 3.66 -1.85 2.19 0.00 0.00 -0.51 -1.35 105.19 107.33 1sx4 n GLY 414 Ca 0.13 -1.57 -0.06 0.00 0.00 0.00 0.00 46.02 44.52 1sx4 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 415 N 1.98 0.85 2.20 -0.02 0.00 -1.26 -1.72 105.19 107.21 1sx4 n GLY 415 Ca 0.04 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.30 1sx4 n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 416 N -2.18 0.66 0.08 -0.02 0.00 -1.26 -4.22 105.19 98.25 1sx4 n GLY 416 Ca -0.06 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1sx4 n GLY 416 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1sx4 h VAL 417 N 0.00 1.35 -0.98 1.61 3.04 -1.25 -2.45 116.25 117.57 1sx4 h VAL 417 Ca -0.08 -1.58 0.23 0.00 -1.01 0.00 0.00 66.70 64.26 1sx4 h VAL 417 Cb 0.33 2.36 -0.18 0.00 -2.01 0.00 0.00 31.29 31.79 1sx4 h VAL 417 CO 0.11 0.38 -0.14 0.00 -1.01 0.00 0.00 177.57 176.92 1sx4 h ALA 418 N 0.06 0.85 -0.31 3.17 0.00 -1.46 0.25 119.26 121.82 1sx4 h ALA 418 Ca -0.01 0.37 -0.15 0.00 0.00 0.00 0.00 54.91 55.12 1sx4 h ALA 418 Cb 0.67 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 1sx4 h ALA 418 CO 0.01 -0.46 -0.41 -0.07 0.00 0.00 0.00 179.25 178.32 1sx4 h LEU 419 N 0.00 0.83 -0.93 0.00 4.07 -1.84 0.18 115.31 117.62 1sx4 h LEU 419 Ca 0.52 -0.39 -0.08 0.00 0.08 0.00 0.00 57.88 58.02 1sx4 h LEU 419 Cb 0.92 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 42.41 1sx4 h LEU 419 CO -0.97 1.13 -0.09 -0.29 -1.08 0.00 0.00 178.44 177.14 1sx4 h ILE 420 N 0.63 1.24 -0.14 1.22 2.10 -0.10 -1.77 117.51 120.70 1sx4 h ILE 420 Ca 0.05 -1.08 -0.03 0.00 1.08 0.00 0.00 64.86 64.89 1sx4 h ILE 420 Cb 0.97 1.04 -0.00 0.00 -1.09 0.00 0.00 36.82 37.73 1sx4 h ILE 420 CO 0.09 0.37 -0.02 0.03 -1.08 0.00 0.00 178.15 177.54 1sx4 h ARG 421 N 0.63 0.25 -0.52 2.19 2.47 -0.51 -2.87 114.38 116.02 1sx4 h ARG 421 Ca 0.11 -0.09 0.01 0.00 -1.26 0.00 0.00 59.98 58.76 1sx4 h ARG 421 Cb 0.52 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.80 1sx4 h ARG 421 CO 0.03 0.52 0.35 -0.39 0.56 0.00 0.00 179.97 181.03 1sx4 h VAL 422 N -0.04 1.12 -0.98 2.04 -1.51 -0.44 -1.40 116.25 115.05 1sx4 h VAL 422 Ca 0.04 -0.24 0.15 0.00 -1.23 0.00 0.00 66.70 65.42 1sx4 h VAL 422 Cb 0.41 0.37 -0.09 0.00 -2.13 0.00 0.00 31.29 29.85 1sx4 h VAL 422 CO 0.01 0.13 0.60 0.00 -1.23 0.00 0.00 177.57 177.08 1sx4 h ALA 423 N 1.68 1.53 0.00 5.19 0.00 -1.27 -1.08 119.26 125.31 1sx4 h ALA 423 Ca 0.19 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1sx4 h ALA 423 Cb -0.05 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1sx4 h ALA 423 CO -0.04 0.10 -0.11 0.66 0.00 0.00 0.00 179.25 179.85 1sx4 h SER 424 N 0.87 0.00 0.64 0.00 4.64 -1.05 -3.00 113.55 115.65 1sx4 h SER 424 Ca 0.52 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.78 1sx4 h SER 424 Cb 0.64 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1sx4 h SER 424 CO -0.31 0.11 -0.29 0.11 -0.87 0.00 0.00 176.83 175.58 1sx4 h LYS 425 N 0.00 0.00 -0.69 4.77 1.57 -0.64 -2.91 116.57 118.68 1sx4 h LYS 425 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1sx4 h LYS 425 Cb 0.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.25 1sx4 h LYS 425 CO 0.01 0.29 0.00 1.28 -0.57 0.00 0.00 179.45 180.47 1sx4 n LEU 426 N -3.65 4.26 -0.34 2.94 4.77 -0.86 -4.43 117.00 119.69 1sx4 n LEU 426 Ca -0.01 -2.19 0.36 0.00 -0.03 0.00 0.00 56.01 54.14 1sx4 n LEU 426 Cb 0.41 -0.52 0.75 0.00 -2.33 0.00 0.00 43.42 41.73 1sx4 n LEU 426 CO 0.35 0.91 1.33 0.00 -1.33 0.00 0.00 177.39 178.65 1sx4 h ALA 427 N 4.12 3.14 -0.27 -1.18 0.00 -1.48 0.15 119.26 123.75 1sx4 h ALA 427 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sx4 h ALA 427 Cb 1.17 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1sx4 h ALA 427 CO 0.09 -1.49 0.00 -0.25 0.00 0.00 0.00 179.25 177.60 1sx4 n ASP 428 N -4.18 3.04 -4.77 0.00 8.00 -1.26 -4.98 116.55 112.41 1sx4 n ASP 428 Ca 0.26 -1.94 -0.38 0.00 0.71 0.00 0.00 54.79 53.44 1sx4 n ASP 428 Cb 1.27 -0.17 -0.00 0.00 -0.02 0.00 0.00 41.12 42.20 1sx4 n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1sx4 s LEU 429 N -1.62 4.11 0.13 0.64 2.96 0.52 -5.02 118.68 120.40 1sx4 s LEU 429 Ca 0.36 2.50 -0.03 0.00 -0.22 0.00 0.00 54.13 56.74 1sx4 s LEU 429 Cb 0.21 -4.06 -0.03 0.00 0.50 0.00 0.00 46.19 42.81 1sx4 s LEU 429 CO 0.31 -0.91 0.09 -0.13 -1.32 0.00 0.00 176.35 174.39 1sx4 s ARG 430 N -2.45 0.94 0.14 1.98 0.52 -1.26 -5.02 118.95 113.81 1sx4 s ARG 430 Ca 0.60 -1.37 0.01 0.00 -0.52 0.00 0.00 55.73 54.45 1sx4 s ARG 430 Cb -0.34 0.27 0.01 0.00 0.52 0.00 0.00 34.95 35.40 1sx4 s ARG 430 CO 0.43 -0.28 0.04 0.41 0.02 0.00 0.00 175.30 175.92 1sx4 n GLY 431 N -0.10 3.62 0.13 -3.53 0.00 -1.26 -5.02 105.19 99.04 1sx4 n GLY 431 Ca -0.07 -2.24 0.10 0.00 0.00 0.00 0.00 46.02 43.82 1sx4 n GLY 431 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1sx4 n GLN 432 N -0.54 0.13 -3.76 1.61 6.02 -1.26 -4.83 117.38 114.75 1sx4 n GLN 432 Ca -0.04 0.57 -0.05 0.00 -0.01 0.00 0.00 57.00 57.47 1sx4 n GLN 432 Cb 0.17 -1.88 -0.02 0.00 1.02 0.00 0.00 30.24 29.54 1sx4 n GLN 432 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1sx4 s ASN 433 N -3.94 -0.22 0.18 1.08 4.22 -1.26 -5.05 114.94 109.96 1sx4 s ASN 433 Ca -0.00 -0.43 -0.11 0.00 -2.14 0.00 0.00 52.86 50.18 1sx4 s ASN 433 Cb 0.06 0.55 0.10 0.00 1.28 0.00 0.00 41.25 43.25 1sx4 s ASN 433 CO 0.22 -1.01 1.78 -0.08 -2.04 0.00 0.00 177.10 175.97 1sx4 h GLU 434 N 2.00 0.92 -0.74 3.55 4.57 -2.00 -1.24 114.58 121.65 1sx4 h GLU 434 Ca -0.23 -0.13 0.09 0.00 -1.18 0.00 0.00 59.36 57.91 1sx4 h GLU 434 Cb 1.24 -0.17 -0.07 0.00 -0.16 0.00 0.00 28.75 29.59 1sx4 h GLU 434 CO 0.25 0.73 0.39 -0.44 -1.18 0.00 0.00 179.01 178.77 1sx4 h ASP 435 N 0.89 0.54 -0.20 1.04 3.32 -1.96 0.85 116.42 120.91 1sx4 h ASP 435 Ca 0.22 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1sx4 h ASP 435 Cb 0.10 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1sx4 h ASP 435 CO -0.03 0.32 0.12 1.56 -1.72 0.00 0.00 179.24 179.49 1sx4 h GLN 436 N 0.68 0.29 -0.53 3.56 4.20 -1.41 -1.02 115.11 120.88 1sx4 h GLN 436 Ca 0.36 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 59.00 1sx4 h GLN 436 Cb 0.34 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1sx4 h GLN 436 CO -0.25 0.21 0.14 -0.91 -0.67 0.00 0.00 178.83 177.36 1sx4 h ASN 437 N 0.30 0.80 -0.16 1.46 2.35 -0.41 0.52 115.58 120.43 1sx4 h ASN 437 Ca 0.08 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.60 1sx4 h ASN 437 Cb 0.01 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1sx4 h ASN 437 CO -0.01 0.81 0.09 0.58 -1.65 0.00 0.00 177.43 177.25 1sx4 h VAL 438 N 0.74 1.09 -0.76 2.81 2.07 -0.72 -2.00 116.25 119.49 1sx4 h VAL 438 Ca 0.17 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.57 1sx4 h VAL 438 Cb 0.32 0.96 -0.09 0.00 -1.52 0.00 0.00 31.29 30.96 1sx4 h VAL 438 CO -0.00 0.09 0.35 1.23 0.02 0.00 0.00 177.57 179.25 1sx4 h GLY 439 N 0.17 1.16 0.58 2.17 0.00 -0.82 2.12 103.07 108.45 1sx4 h GLY 439 Ca 0.06 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.24 1sx4 h GLY 439 CO -0.01 -0.03 -0.05 -2.22 0.00 0.00 0.00 176.54 174.23 1sx4 h ILE 440 N 0.53 0.79 -0.36 2.60 2.04 0.19 -2.78 117.51 120.52 1sx4 h ILE 440 Ca 0.40 -0.00 -0.12 0.00 1.00 0.00 0.00 64.86 66.14 1sx4 h ILE 440 Cb 0.54 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1sx4 h ILE 440 CO -0.35 0.00 -0.27 0.50 0.00 0.00 0.00 178.15 178.03 1sx4 h LYS 441 N 0.00 0.75 -0.32 2.37 1.63 -0.09 0.46 116.57 121.38 1sx4 h LYS 441 Ca 0.10 -0.32 0.07 0.00 -0.85 0.00 0.00 60.65 59.65 1sx4 h LYS 441 Cb 0.15 -0.02 -0.08 0.00 -0.60 0.00 0.00 32.23 31.68 1sx4 h LYS 441 CO -0.22 0.93 -0.25 0.28 -3.45 0.00 0.00 179.45 176.74 1sx4 h VAL 442 N 0.64 0.35 -0.46 2.00 2.07 0.35 -1.85 116.25 119.36 1sx4 h VAL 442 Ca 0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.55 1sx4 h VAL 442 Cb 0.78 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1sx4 h VAL 442 CO 0.06 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.73 1sx4 h ALA 443 N 0.87 0.61 -0.69 1.67 0.00 -0.69 -2.54 119.26 118.48 1sx4 h ALA 443 Ca 0.16 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1sx4 h ALA 443 Cb 0.48 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 1sx4 h ALA 443 CO -0.45 0.33 0.38 -0.07 0.00 0.00 0.00 179.25 179.44 1sx4 h LEU 444 N 0.62 0.55 -0.69 0.00 3.38 -1.08 0.19 115.31 118.28 1sx4 h LEU 444 Ca 0.14 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.20 1sx4 h LEU 444 Cb 0.38 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1sx4 h LEU 444 CO 0.01 0.34 0.40 -0.09 0.09 0.00 0.00 178.44 179.19 1sx4 h ARG 445 N 0.68 0.73 -0.40 1.13 2.43 -1.21 -2.05 114.38 115.68 1sx4 h ARG 445 Ca 0.32 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.39 1sx4 h ARG 445 Cb 0.24 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1sx4 h ARG 445 CO -0.20 0.48 0.04 0.00 -1.51 0.00 0.00 179.97 178.77 1sx4 h ALA 446 N 1.34 1.32 0.00 2.80 0.00 -0.61 -1.94 119.26 122.16 1sx4 h ALA 446 Ca 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1sx4 h ALA 446 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1sx4 h ALA 446 CO -0.16 0.47 0.47 0.52 0.00 0.00 0.00 179.25 180.55 1sx4 h MET 447 N 0.60 0.00 0.00 0.00 2.86 0.04 0.66 114.93 119.09 1sx4 h MET 447 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1sx4 h MET 447 Cb 0.32 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1sx4 h MET 447 CO 0.01 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.37 1sx4 n GLU 448 N -2.60 0.63 0.03 1.72 1.02 -0.73 -4.16 120.64 116.56 1sx4 n GLU 448 Ca -0.01 0.01 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 1sx4 n GLU 448 Cb 0.50 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.33 1sx4 n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sx4 h ALA 449 N 3.57 -0.10 -0.93 0.62 0.00 0.16 0.10 119.26 122.67 1sx4 h ALA 449 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1sx4 h ALA 449 Cb 0.15 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 1sx4 h ALA 449 CO 0.00 -0.34 0.62 -1.35 0.00 0.00 0.00 179.25 178.17 1sx4 h PRO 450 N -0.53 1.21 -0.35 0.00 0.11 -1.79 0.33 132.00 130.98 1sx4 h PRO 450 Ca -0.01 -0.07 -0.14 0.00 0.11 0.00 0.00 66.00 65.88 1sx4 h PRO 450 Cb 0.45 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1sx4 h PRO 450 CO 0.02 0.80 -0.34 1.25 -0.21 0.00 0.00 178.00 179.52 1sx4 h LEU 451 N 1.25 0.91 -1.57 2.35 6.46 -1.71 -0.97 115.31 122.02 1sx4 h LEU 451 Ca 0.35 -0.47 -0.01 0.00 -0.12 0.00 0.00 57.88 57.64 1sx4 h LEU 451 Cb -0.12 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.54 1sx4 h LEU 451 CO -0.08 1.19 0.19 0.03 -0.62 0.00 0.00 178.44 179.15 1sx4 h ARG 452 N 0.64 0.48 0.06 1.25 3.08 0.22 -2.65 114.38 117.46 1sx4 h ARG 452 Ca 0.06 -0.04 -0.29 0.00 0.07 0.00 0.00 59.98 59.78 1sx4 h ARG 452 Cb 0.93 -0.10 0.03 0.00 0.08 0.00 0.00 29.97 30.90 1sx4 h ARG 452 CO 0.09 0.35 -1.15 1.96 -1.07 0.00 0.00 179.97 180.15 1sx4 h GLN 453 N 0.49 0.67 -0.76 0.04 1.08 -0.44 -2.68 115.11 113.51 1sx4 h GLN 453 Ca 0.13 -0.80 0.17 0.00 -1.45 0.00 0.00 58.65 56.69 1sx4 h GLN 453 Cb 0.02 0.25 -0.11 0.00 -0.05 0.00 0.00 27.48 27.58 1sx4 h GLN 453 CO -0.02 1.36 0.19 0.82 -0.95 0.00 0.00 178.83 180.23 1sx4 h ILE 454 N 0.34 0.50 -0.29 2.54 2.04 -0.89 0.17 117.51 121.91 1sx4 h ILE 454 Ca -0.16 -0.09 -0.19 0.00 1.00 0.00 0.00 64.86 65.42 1sx4 h ILE 454 Cb 1.81 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 1sx4 h ILE 454 CO 0.22 0.05 -0.54 0.58 0.00 0.00 0.00 178.15 178.46 1sx4 h VAL 455 N 0.28 1.27 -0.08 1.67 2.07 -1.49 -3.03 116.25 116.94 1sx4 h VAL 455 Ca 0.43 -1.72 -0.13 0.00 0.82 0.00 0.00 66.70 66.10 1sx4 h VAL 455 Cb 0.75 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1sx4 h VAL 455 CO -0.52 0.56 -0.53 0.25 0.02 0.00 0.00 177.57 177.35 1sx4 h LEU 456 N 0.68 0.23 -2.08 2.57 5.85 -0.93 -1.38 115.31 120.25 1sx4 h LEU 456 Ca 0.02 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1sx4 h LEU 456 Cb 1.15 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1sx4 h LEU 456 CO 0.12 0.72 -0.03 0.78 -0.34 0.00 0.00 178.44 179.69 1sx4 h ASN 457 N 0.17 0.00 -0.03 1.25 -0.26 -0.90 -1.04 115.58 114.77 1sx4 h ASN 457 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1sx4 h ASN 457 Cb 0.99 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.25 1sx4 h ASN 457 CO 0.08 0.03 0.00 0.00 -1.06 0.00 0.00 177.43 176.48 1sx4 n GLY 459 N 1.12 0.95 1.66 0.00 0.00 -0.40 -5.01 105.19 103.50 1sx4 n GLY 459 Ca 0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 1sx4 n GLY 459 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sx4 n GLU 460 N -2.61 1.12 -3.34 1.61 1.02 -1.14 -5.03 120.64 112.27 1sx4 n GLU 460 Ca -0.22 -1.49 -0.43 0.00 -0.02 0.00 0.00 57.16 55.00 1sx4 n GLU 460 Cb 0.67 0.15 -0.08 0.00 -0.02 0.00 0.00 31.44 32.16 1sx4 n GLU 460 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1sx4 s GLU 461 N -2.99 3.04 0.43 3.49 2.02 -1.26 -4.01 118.70 119.43 1sx4 s GLU 461 Ca 0.14 -0.99 0.20 0.00 0.02 0.00 0.00 54.97 54.34 1sx4 s GLU 461 Cb -0.01 -4.03 1.15 0.00 0.10 0.00 0.00 34.13 31.33 1sx4 s GLU 461 CO 0.09 -0.93 1.85 -1.35 0.02 0.00 0.00 175.26 174.94 1sx4 h PRO 462 N 8.75 0.33 0.00 0.39 0.11 -1.88 -1.24 132.00 138.48 1sx4 h PRO 462 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1sx4 h PRO 462 Cb 1.11 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1sx4 h PRO 462 CO 0.83 0.22 -0.78 -1.13 -0.21 0.00 0.00 178.00 176.93 1sx4 n SER 463 N -4.49 0.65 -0.01 -2.05 3.41 -1.26 -0.14 113.62 109.74 1sx4 n SER 463 Ca 0.20 -0.37 -0.17 0.00 -0.26 0.00 0.00 58.87 58.28 1sx4 n SER 463 Cb 0.76 0.57 -0.12 0.00 -0.26 0.00 0.00 64.21 65.17 1sx4 n SER 463 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1sx4 h VAL 464 N 0.00 1.50 0.85 -3.33 2.07 -1.66 -2.79 116.25 112.89 1sx4 h VAL 464 Ca 0.00 -2.07 -0.04 0.00 0.82 0.00 0.00 66.70 65.40 1sx4 h VAL 464 Cb 0.59 2.76 0.01 0.00 -1.52 0.00 0.00 31.29 33.13 1sx4 h VAL 464 CO 0.00 0.58 -0.41 0.58 0.02 0.00 0.00 177.57 178.35 1sx4 h VAL 465 N -0.34 0.14 -0.59 2.57 2.07 -1.39 -1.98 116.25 116.74 1sx4 h VAL 465 Ca -0.06 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.50 1sx4 h VAL 465 Cb 1.20 0.14 -0.07 0.00 -1.52 0.00 0.00 31.29 31.04 1sx4 h VAL 465 CO 0.09 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.89 1sx4 h ALA 466 N -1.05 0.75 -0.61 1.67 0.00 -0.69 -0.69 119.26 118.63 1sx4 h ALA 466 Ca -0.12 0.08 0.12 0.00 0.00 0.00 0.00 54.91 54.99 1sx4 h ALA 466 Cb 0.88 0.06 -0.12 0.00 0.00 0.00 0.00 17.79 18.61 1sx4 h ALA 466 CO 0.19 -0.20 -0.27 -0.91 0.00 0.00 0.00 179.25 178.06 1sx4 h ASN 467 N 0.39 -0.95 -0.22 0.00 2.35 -1.34 0.42 115.58 116.24 1sx4 h ASN 467 Ca 0.29 0.22 -0.10 0.00 -0.55 0.00 0.00 56.30 56.16 1sx4 h ASN 467 Cb 0.35 0.51 -0.02 0.00 0.05 0.00 0.00 38.32 39.22 1sx4 h ASN 467 CO -0.30 -0.28 -0.20 0.71 -1.65 0.00 0.00 177.43 175.72 1sx4 h THR 468 N -0.11 1.26 -0.23 2.81 1.35 -0.50 0.94 112.91 118.44 1sx4 h THR 468 Ca 0.27 -1.25 -0.11 0.00 -0.55 0.00 0.00 66.41 64.77 1sx4 h THR 468 Cb 0.53 1.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 1sx4 h THR 468 CO -0.68 0.41 -0.31 0.58 -0.25 0.00 0.00 175.52 175.27 1sx4 h VAL 469 N 0.59 1.28 -0.36 6.82 2.07 -0.28 -2.16 116.25 124.21 1sx4 h VAL 469 Ca 0.09 -1.38 -0.16 0.00 0.82 0.00 0.00 66.70 66.06 1sx4 h VAL 469 Cb 0.66 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 1sx4 h VAL 469 CO 0.05 0.43 -0.41 0.11 0.02 0.00 0.00 177.57 177.77 1sx4 h LYS 470 N 0.41 0.91 0.00 1.57 1.57 0.50 -2.49 116.57 119.04 1sx4 h LYS 470 Ca 0.05 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1sx4 h LYS 470 Cb 0.75 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1sx4 h LYS 470 CO 0.06 1.14 0.14 0.41 -0.57 0.00 0.00 179.45 180.63 1sx4 n GLY 471 N 0.16 -0.74 0.00 3.86 0.00 0.26 -4.72 105.19 104.01 1sx4 n GLY 471 Ca -0.02 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1sx4 n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sx4 n GLY 472 N -1.29 1.55 3.24 -0.02 0.00 -0.94 -5.09 105.19 102.63 1sx4 n GLY 472 Ca -0.01 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 1sx4 n GLY 472 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sx4 s ASP 473 N -1.00 -0.01 0.35 1.61 -0.00 -1.26 -5.03 116.67 111.33 1sx4 s ASP 473 Ca 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 52.55 52.09 1sx4 s ASP 473 Cb 0.00 0.37 0.00 0.00 -0.00 0.00 0.00 42.92 43.29 1sx4 s ASP 473 CO 0.00 -0.72 0.00 0.61 -0.00 0.00 0.00 175.17 175.06 1sx4 n GLY 474 N 0.10 2.04 1.11 0.21 0.00 -1.26 -1.20 105.19 106.20 1sx4 n GLY 474 Ca -0.16 0.47 0.05 0.00 0.00 0.00 0.00 46.02 46.37 1sx4 n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sx4 n ASN 475 N 4.57 3.90 -4.73 1.61 5.03 -1.26 -4.93 115.26 119.46 1sx4 n ASN 475 Ca 0.00 -3.15 -0.42 0.00 0.87 0.00 0.00 54.58 51.89 1sx4 n ASN 475 Cb 0.00 -0.59 -0.03 0.00 -1.02 0.00 0.00 39.78 38.14 1sx4 n ASN 475 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1sx4 s TYR 476 N -2.91 3.16 0.19 3.10 5.04 -0.34 -0.58 117.35 125.01 1sx4 s TYR 476 Ca 0.45 1.00 -0.08 0.00 -2.44 0.00 0.00 57.07 56.00 1sx4 s TYR 476 Cb 0.37 -3.74 0.03 0.00 0.35 0.00 0.00 41.96 38.97 1sx4 s TYR 476 CO 0.08 -2.48 0.43 0.41 -1.34 0.00 0.00 175.55 172.66 1sx4 n GLY 477 N 2.84 1.39 3.42 8.97 0.00 0.72 -4.78 105.19 117.75 1sx4 n GLY 477 Ca 0.09 -1.13 -0.35 0.00 0.00 0.00 0.00 46.02 44.63 1sx4 n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1sx4 s TYR 478 N -5.24 3.02 -0.65 1.61 5.04 -1.26 -1.52 117.35 118.35 1sx4 s TYR 478 Ca 0.09 -0.55 -0.26 0.00 -2.44 0.00 0.00 57.07 53.91 1sx4 s TYR 478 Cb -0.02 -2.10 0.04 0.00 0.35 0.00 0.00 41.96 40.23 1sx4 s TYR 478 CO 0.06 -0.32 1.13 1.21 -1.34 0.00 0.00 175.55 176.29 1sx4 s ASN 479 N 1.16 6.26 0.35 4.32 3.84 0.15 -4.89 114.94 126.12 1sx4 s ASN 479 Ca 0.03 -0.44 0.03 0.00 0.21 0.00 0.00 52.86 52.69 1sx4 s ASN 479 Cb -0.14 -2.50 0.64 0.00 -0.55 0.00 0.00 41.25 38.69 1sx4 s ASN 479 CO 0.01 -1.56 1.97 0.00 -2.79 0.00 0.00 177.10 174.73 1sx4 h ALA 480 N 9.69 1.50 -0.36 1.71 0.00 -1.95 -0.51 119.26 129.33 1sx4 h ALA 480 Ca -0.27 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.40 1sx4 h ALA 480 Cb 1.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1sx4 h ALA 480 CO 1.20 0.41 -0.38 0.00 0.00 0.00 0.00 179.25 180.49 1sx4 h ALA 481 N 1.57 0.65 -0.49 0.00 0.00 -1.95 -3.08 119.26 115.96 1sx4 h ALA 481 Ca 0.19 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1sx4 h ALA 481 Cb 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1sx4 h ALA 481 CO -0.03 0.67 0.00 0.25 0.00 0.00 0.00 179.25 180.14 1sx4 n THR 482 N -4.05 0.80 -3.78 0.00 -2.24 -1.13 -4.91 114.28 98.97 1sx4 n THR 482 Ca -0.02 -0.90 -0.30 0.00 -2.27 0.00 0.00 64.05 60.56 1sx4 n THR 482 Cb 0.53 0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 69.38 1sx4 n THR 482 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1sx4 n GLU 483 N 1.23 -0.82 -4.12 -0.78 0.28 -0.23 -4.97 120.64 111.23 1sx4 n GLU 483 Ca 0.18 0.10 -0.12 0.00 -0.16 0.00 0.00 57.16 57.16 1sx4 n GLU 483 Cb 0.54 -3.33 -0.11 0.00 1.43 0.00 0.00 31.44 29.98 1sx4 n GLU 483 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 1sx4 s GLU 484 N -5.76 0.70 0.60 3.44 -1.05 -1.03 -4.95 118.70 110.66 1sx4 s GLU 484 Ca 0.50 -1.08 -0.12 0.00 -0.15 0.00 0.00 54.97 54.12 1sx4 s GLU 484 Cb -0.29 -0.25 -0.04 0.00 -0.44 0.00 0.00 34.13 33.10 1sx4 s GLU 484 CO 0.76 0.01 1.02 0.71 0.95 0.00 0.00 175.26 178.72 1sx4 s TYR 485 N -2.62 3.57 -2.51 4.83 1.51 -1.26 -0.68 117.35 120.19 1sx4 s TYR 485 Ca 0.02 1.33 0.00 0.00 -1.01 0.00 0.00 57.07 57.41 1sx4 s TYR 485 Cb -0.02 -2.74 0.00 0.00 -0.11 0.00 0.00 41.96 39.09 1sx4 s TYR 485 CO -0.02 -0.66 0.00 0.41 -1.11 0.00 0.00 175.55 174.17 1sx4 n GLY 486 N -2.48 -1.71 3.66 0.71 0.00 -0.57 -4.86 105.19 99.92 1sx4 n GLY 486 Ca 0.06 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 1sx4 n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1sx4 s ASN 487 N -1.74 6.90 0.35 1.61 3.84 -1.26 -0.20 114.94 124.43 1sx4 s ASN 487 Ca 0.00 1.74 0.16 0.00 0.21 0.00 0.00 52.86 54.97 1sx4 s ASN 487 Cb 0.00 -2.54 0.62 0.00 -0.55 0.00 0.00 41.25 38.78 1sx4 s ASN 487 CO 0.00 -0.80 1.72 0.24 -2.79 0.00 0.00 177.10 175.47 1sx4 h MET 488 N 8.43 0.00 -0.35 0.43 2.86 -1.17 -2.25 114.93 122.88 1sx4 h MET 488 Ca -0.28 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.20 1sx4 h MET 488 Cb 1.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 1sx4 h MET 488 CO 0.97 0.44 -0.41 0.82 1.06 0.00 0.00 176.91 179.79 1sx4 h ILE 489 N 0.00 1.28 0.00 -1.22 1.08 -1.83 -1.64 117.51 115.17 1sx4 h ILE 489 Ca -0.00 -1.58 -0.05 0.00 -0.39 0.00 0.00 64.86 62.83 1sx4 h ILE 489 Cb 0.91 1.44 -0.01 0.00 -3.07 0.00 0.00 36.82 36.09 1sx4 h ILE 489 CO 0.06 0.52 -0.25 0.44 -0.69 0.00 0.00 178.15 178.23 1sx4 h ASP 490 N 0.70 0.00 -0.28 1.72 3.32 -1.88 -2.09 116.42 117.92 1sx4 h ASP 490 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1sx4 h ASP 490 Cb 0.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1sx4 h ASP 490 CO 0.10 0.25 0.00 0.23 -1.72 0.00 0.00 179.24 178.09 1sx4 n MET 491 N -3.59 1.99 -1.77 3.56 2.81 -0.87 -4.93 117.12 114.30 1sx4 n MET 491 Ca -0.01 -1.50 -0.12 0.00 -1.81 0.00 0.00 57.70 54.27 1sx4 n MET 491 Cb 0.38 -1.42 -0.03 0.00 -0.71 0.00 0.00 33.22 31.45 1sx4 n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1sx4 n GLY 492 N 1.24 0.61 3.13 3.03 0.00 -0.79 -4.93 105.19 107.48 1sx4 n GLY 492 Ca 0.17 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 1sx4 n GLY 492 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1sx4 n ILE 493 N -3.31 4.84 -3.64 -0.61 5.41 -0.66 -4.79 119.36 116.60 1sx4 n ILE 493 Ca -0.13 -5.66 -0.36 0.00 1.00 0.00 0.00 62.75 57.60 1sx4 n ILE 493 Cb 0.50 -2.30 -0.08 0.00 -0.71 0.00 0.00 39.64 37.05 1sx4 n ILE 493 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1sx4 s LEU 494 N -2.12 4.18 -0.10 1.39 1.43 -1.26 -1.43 118.68 120.76 1sx4 s LEU 494 Ca 0.31 0.26 -0.04 0.00 -1.03 0.00 0.00 54.13 53.63 1sx4 s LEU 494 Cb -0.01 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 1sx4 s LEU 494 CO 0.02 0.10 0.07 -1.81 0.23 0.00 0.00 176.35 174.96 1sx4 s ASP 495 N 0.67 5.80 0.16 2.29 1.01 -0.84 -4.65 116.67 121.12 1sx4 s ASP 495 Ca 0.10 0.30 -0.30 0.00 0.71 0.00 0.00 52.55 53.36 1sx4 s ASP 495 Cb -0.12 -1.77 -0.07 0.00 1.01 0.00 0.00 42.92 41.96 1sx4 s ASP 495 CO 0.02 0.39 1.19 -2.84 0.21 0.00 0.00 175.17 174.15 1sx4 s PRO 496 N -0.95 4.49 0.09 8.23 0.02 -1.26 -1.50 135.00 144.12 1sx4 s PRO 496 Ca 0.14 1.84 -0.31 0.00 0.02 0.00 0.00 61.00 62.70 1sx4 s PRO 496 Cb -0.12 -3.27 -0.14 0.00 0.02 0.00 0.00 34.50 31.00 1sx4 s PRO 496 CO 0.03 -0.11 1.63 1.15 -0.33 0.00 0.00 177.00 179.37 1sx4 h THR 497 N 3.91 0.35 -1.10 0.99 2.02 0.21 -1.23 112.91 118.06 1sx4 h THR 497 Ca -0.44 0.00 0.39 0.00 0.77 0.00 0.00 66.41 67.13 1sx4 h THR 497 Cb 1.21 0.35 -0.11 0.00 -1.74 0.00 0.00 68.15 67.86 1sx4 h THR 497 CO 0.76 0.00 0.70 1.17 0.37 0.00 0.00 175.52 178.52 1sx4 n LYS 498 N -5.43 -0.03 0.02 6.66 4.81 -1.26 -0.11 118.16 122.82 1sx4 n LYS 498 Ca -0.10 1.02 -0.18 0.00 -0.87 0.00 0.00 58.31 58.18 1sx4 n LYS 498 Cb 0.34 -2.01 -0.13 0.00 0.02 0.00 0.00 35.03 33.25 1sx4 n LYS 498 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 1sx4 h VAL 499 N 0.00 1.51 -0.03 3.15 -1.51 -1.59 -2.12 116.25 115.67 1sx4 h VAL 499 Ca 0.71 -2.32 0.01 0.00 -1.23 0.00 0.00 66.70 63.87 1sx4 h VAL 499 Cb 2.28 2.99 -0.00 0.00 -2.13 0.00 0.00 31.29 34.42 1sx4 h VAL 499 CO -0.39 0.66 0.03 0.74 -1.23 0.00 0.00 177.57 177.37 1sx4 h THR 500 N -0.34 0.54 0.01 7.19 2.02 -0.54 -0.56 112.91 121.23 1sx4 h THR 500 Ca -0.10 0.00 -0.29 0.00 0.77 0.00 0.00 66.41 66.79 1sx4 h THR 500 Cb 1.43 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 68.77 1sx4 h THR 500 CO 0.12 0.00 -1.70 -0.09 0.37 0.00 0.00 175.52 174.23 1sx4 h ARG 501 N 0.00 0.01 -0.10 6.66 1.12 -0.53 -3.11 114.38 118.44 1sx4 h ARG 501 Ca 0.01 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.79 1sx4 h ARG 501 Cb 0.07 0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 1sx4 h ARG 501 CO -0.00 0.55 -0.21 0.77 -3.11 0.00 0.00 179.97 177.97 1sx4 h SER 502 N 0.00 0.35 -0.82 -3.80 0.02 -0.56 -0.05 113.55 108.69 1sx4 h SER 502 Ca -0.28 -0.57 0.10 0.00 -0.84 0.00 0.00 61.79 60.20 1sx4 h SER 502 Cb 2.01 -0.10 -0.12 0.00 0.14 0.00 0.00 62.40 64.33 1sx4 h SER 502 CO 0.08 0.86 -0.40 0.00 -1.14 0.00 0.00 176.83 176.23 1sx4 n ALA 503 N -2.46 -0.31 0.02 3.77 0.00 -0.32 -1.37 120.51 119.84 1sx4 n ALA 503 Ca -0.07 0.76 -0.12 0.00 0.00 0.00 0.00 53.44 54.01 1sx4 n ALA 503 Cb 0.42 -0.24 -0.07 0.00 0.00 0.00 0.00 19.45 19.56 1sx4 n ALA 503 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1sx4 h LEU 504 N 0.00 0.03 0.08 0.00 6.46 -1.44 -2.25 115.31 118.19 1sx4 h LEU 504 Ca 0.21 -0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1sx4 h LEU 504 Cb 0.42 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.33 1sx4 h LEU 504 CO -0.79 0.09 -0.08 1.56 -0.62 0.00 0.00 178.44 178.60 1sx4 h GLN 505 N -0.03 -0.15 -0.88 1.25 4.20 -0.16 -0.89 115.11 118.45 1sx4 h GLN 505 Ca 0.01 0.01 0.16 0.00 0.06 0.00 0.00 58.65 58.89 1sx4 h GLN 505 Cb 0.06 0.03 -0.10 0.00 0.30 0.00 0.00 27.48 27.78 1sx4 h GLN 505 CO -0.00 -0.10 0.46 1.88 -0.67 0.00 0.00 178.83 180.39 1sx4 h TYR 506 N -0.16 0.80 -0.17 2.96 0.05 -1.33 0.34 116.97 119.46 1sx4 h TYR 506 Ca -0.01 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 1sx4 h TYR 506 Cb 0.14 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.65 1sx4 h TYR 506 CO -0.11 0.17 -0.06 0.00 -1.05 0.00 0.00 178.16 177.11 1sx4 h ALA 507 N 1.59 0.24 -0.59 3.88 0.00 -1.28 -2.42 119.26 120.68 1sx4 h ALA 507 Ca 0.49 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1sx4 h ALA 507 Cb 0.73 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1sx4 h ALA 507 CO -0.38 0.03 0.04 0.00 0.00 0.00 0.00 179.25 178.93 1sx4 h ALA 508 N 0.71 0.94 0.07 0.00 0.00 -0.12 -0.16 119.26 120.69 1sx4 h ALA 508 Ca 0.04 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.69 1sx4 h ALA 508 Cb 0.51 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1sx4 h ALA 508 CO 0.02 0.64 -0.35 1.03 0.00 0.00 0.00 179.25 180.59 1sx4 h SER 509 N 0.93 -1.05 -0.12 0.00 0.87 -0.11 0.62 113.55 114.70 1sx4 h SER 509 Ca 0.18 0.12 -0.11 0.00 -1.23 0.00 0.00 61.79 60.75 1sx4 h SER 509 Cb 0.49 0.40 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1sx4 h SER 509 CO 0.02 -0.43 -0.36 1.62 -0.53 0.00 0.00 176.83 177.16 1sx4 h VAL 510 N -0.55 1.38 -1.00 2.23 3.04 -1.49 -3.30 116.25 116.56 1sx4 h VAL 510 Ca 0.04 -1.67 0.24 0.00 -1.01 0.00 0.00 66.70 64.30 1sx4 h VAL 510 Cb 0.61 2.13 -0.08 0.00 -2.01 0.00 0.00 31.29 31.93 1sx4 h VAL 510 CO -0.24 0.50 0.65 0.00 -1.01 0.00 0.00 177.57 177.47 1sx4 h ALA 511 N 0.50 2.23 0.84 3.17 0.00 -0.86 -1.01 119.26 124.14 1sx4 h ALA 511 Ca -0.01 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1sx4 h ALA 511 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1sx4 h ALA 511 CO 0.08 -0.59 -0.48 0.78 0.00 0.00 0.00 179.25 179.04 1sx4 h GLY 512 N 0.41 -1.34 0.06 0.00 0.00 0.16 -2.40 103.07 99.96 1sx4 h GLY 512 Ca 0.55 0.53 0.11 0.00 0.00 0.00 0.00 47.33 48.52 1sx4 h GLY 512 CO -0.25 -0.46 0.00 1.41 0.00 0.00 0.00 176.54 177.24 1sx4 h LEU 513 N -1.22 -0.23 -2.37 3.11 3.38 -1.42 -2.47 115.31 114.08 1sx4 h LEU 513 Ca -0.11 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1sx4 h LEU 513 Cb 0.97 0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 1sx4 h LEU 513 CO 0.14 -0.09 0.05 0.24 0.09 0.00 0.00 178.44 178.87 1sx4 h MET 514 N 0.12 0.00 -0.08 1.13 2.86 -0.83 0.29 114.93 118.42 1sx4 h MET 514 Ca 0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.93 1sx4 h MET 514 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1sx4 h MET 514 CO -0.47 0.00 0.00 0.44 1.06 0.00 0.00 176.91 177.94 1sx4 n ILE 515 N -3.91 0.10 -0.58 -1.22 -5.35 -0.93 -2.94 119.36 104.52 1sx4 n ILE 515 Ca -0.02 -0.25 0.09 0.00 -0.27 0.00 0.00 62.75 62.30 1sx4 n ILE 515 Cb 0.14 0.29 0.32 0.00 -1.74 0.00 0.00 39.64 38.64 1sx4 n ILE 515 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1sx4 n THR 516 N 0.06 1.70 -1.72 7.28 -2.24 0.10 -4.83 114.28 114.63 1sx4 n THR 516 Ca 0.18 -1.23 -0.42 0.00 -2.27 0.00 0.00 64.05 60.31 1sx4 n THR 516 Cb 0.30 0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.67 1sx4 n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1sx4 s THR 517 N -1.76 2.25 0.00 4.28 2.01 -1.15 -4.89 115.64 116.38 1sx4 s THR 517 Ca 0.46 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.48 1sx4 s THR 517 Cb 0.30 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.79 1sx4 s THR 517 CO 0.23 0.00 0.00 1.21 -0.69 0.00 0.00 174.62 175.37 1sx4 n GLU 518 N 4.81 2.90 -4.37 4.92 4.07 -1.26 -4.88 120.64 126.83 1sx4 n GLU 518 Ca 0.17 0.00 -0.23 0.00 -0.06 0.00 0.00 57.16 57.04 1sx4 n GLU 518 Cb 0.37 -0.87 -0.11 0.00 -0.06 0.00 0.00 31.44 30.77 1sx4 n GLU 518 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1sx4 s MET 520 N -2.84 0.14 -0.04 0.00 -1.94 0.09 -4.97 119.30 109.74 1sx4 s MET 520 Ca 0.18 0.51 0.06 0.00 -1.71 0.00 0.00 55.69 54.73 1sx4 s MET 520 Cb -0.06 -0.15 -0.02 0.00 2.01 0.00 0.00 34.83 36.61 1sx4 s MET 520 CO 0.08 -0.20 -0.22 0.08 -0.01 0.00 0.00 175.02 174.76 1sx4 s VAL 521 N 1.49 2.40 0.00 -6.03 1.01 -1.26 0.35 120.40 118.35 1sx4 s VAL 521 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.95 1sx4 s VAL 521 Cb -0.11 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1sx4 s VAL 521 CO -0.07 0.58 0.00 1.07 0.00 0.00 0.00 175.10 176.67 1sx4 n THR 522 N 2.57 0.00 -3.23 3.92 5.66 -1.04 -4.99 114.28 117.18 1sx4 n THR 522 Ca -0.17 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.59 1sx4 n THR 522 Cb 0.52 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.29 1sx4 n THR 522 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1sx4 s ASP 523 N -0.52 6.19 0.42 1.09 1.11 -1.26 -0.32 116.67 123.38 1sx4 s ASP 523 Ca 0.00 0.45 -0.26 0.00 0.18 0.00 0.00 52.55 52.92 1sx4 s ASP 523 Cb 0.00 -1.93 -0.08 0.00 1.07 0.00 0.00 42.92 41.97 1sx4 s ASP 523 CO 0.00 -0.41 1.31 -0.76 1.18 0.00 0.00 175.17 176.49 1sx4 s LEU 524 N -4.41 4.17 0.00 1.23 1.43 -1.15 -4.32 118.68 115.64 1sx4 s LEU 524 Ca 0.42 2.67 0.00 0.00 -1.03 0.00 0.00 54.13 56.20 1sx4 s LEU 524 Cb -0.10 -3.95 0.00 0.00 0.03 0.00 0.00 46.19 42.18 1sx4 s LEU 524 CO 0.37 -0.93 0.33 -0.81 0.23 0.00 0.00 176.35 175.54