#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i0w n ASP 2 N 0.00 5.99 -3.70 3.17 8.00 -0.33 -4.84 116.55 124.84 3i0w n ASP 2 Ca 0.00 -3.21 -0.07 0.00 0.71 0.00 0.00 54.79 52.22 3i0w n ASP 2 Cb 0.00 -0.95 -0.02 0.00 -0.02 0.00 0.00 41.12 40.13 3i0w n ASP 2 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3i0w s PHE 3 N -2.33 -0.25 0.00 1.24 -0.12 -1.25 -1.65 117.98 113.62 3i0w s PHE 3 Ca 0.40 -0.07 0.00 0.00 -0.05 0.00 0.00 56.93 57.21 3i0w s PHE 3 Cb 0.32 0.64 0.00 0.00 -0.63 0.00 0.00 43.02 43.34 3i0w s PHE 3 CO 0.01 -0.93 0.00 -3.47 -0.05 0.00 0.00 175.22 170.78 3i0w n ASP 4 N -0.42 4.32 -3.94 1.98 -0.08 -0.85 -4.98 116.55 112.59 3i0w n ASP 4 Ca -0.08 0.00 -0.09 0.00 -1.51 0.00 0.00 54.79 53.12 3i0w n ASP 4 Cb 0.61 0.23 -0.05 0.00 2.34 0.00 0.00 41.12 44.26 3i0w n ASP 4 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 3i0w s MET 5 N -1.96 1.53 0.10 -0.67 -1.94 -1.25 -5.04 119.30 110.07 3i0w s MET 5 Ca 0.00 -1.15 0.02 0.00 -1.71 0.00 0.00 55.69 52.85 3i0w s MET 5 Cb 0.00 0.49 -0.04 0.00 2.01 0.00 0.00 34.83 37.29 3i0w s MET 5 CO 0.00 -0.65 -0.07 0.96 -0.01 0.00 0.00 175.02 175.25 3i0w s ILE 6 N -3.98 0.77 -0.14 2.53 -0.00 -1.26 -0.27 121.20 118.86 3i0w s ILE 6 Ca 0.19 -1.91 -0.01 0.00 -0.00 0.00 0.00 60.65 58.92 3i0w s ILE 6 Cb -0.01 -1.65 0.04 0.00 -0.00 0.00 0.00 42.46 40.84 3i0w s ILE 6 CO 0.06 -0.82 -0.02 -1.61 -0.00 0.00 0.00 174.94 172.55 3i0w s GLU 7 N -3.68 1.02 -0.28 0.37 2.02 0.56 -4.96 118.70 113.75 3i0w s GLU 7 Ca 0.11 -0.26 -0.27 0.00 0.02 0.00 0.00 54.97 54.57 3i0w s GLU 7 Cb 0.04 -1.65 0.01 0.00 0.10 0.00 0.00 34.13 32.63 3i0w s GLU 7 CO -0.04 -0.41 0.97 -2.00 0.02 0.00 0.00 175.26 173.80 3i0w s GLU 8 N 1.80 4.11 0.48 1.61 2.12 -1.26 -0.51 118.70 127.05 3i0w s GLU 8 Ca 0.02 1.03 0.07 0.00 0.36 0.00 0.00 54.97 56.46 3i0w s GLU 8 Cb -0.14 -3.69 0.07 0.00 0.26 0.00 0.00 34.13 30.62 3i0w s GLU 8 CO -0.07 -0.73 0.60 1.63 -0.54 0.00 0.00 175.26 176.15 3i0w n LYS 9 N 6.45 0.70 -0.18 4.30 5.02 0.86 -5.00 118.16 130.31 3i0w n LYS 9 Ca 0.09 -2.65 -0.09 0.00 -2.02 0.00 0.00 58.31 53.65 3i0w n LYS 9 Cb 0.47 -0.09 0.01 0.00 -0.02 0.00 0.00 35.03 35.40 3i0w n LYS 9 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 3i0w h LYS 10 N 0.00 0.84 -0.16 1.97 2.10 -1.96 -3.30 116.57 116.06 3i0w h LYS 10 Ca -0.24 -0.20 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 3i0w h LYS 10 Cb 1.04 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 3i0w h LYS 10 CO 0.35 0.80 0.00 -0.40 -2.00 0.00 0.00 179.45 178.20 3i0w n ASP 11 N -4.43 2.30 -0.95 7.07 5.75 -1.26 -5.04 116.55 119.99 3i0w n ASP 11 Ca 0.02 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.10 3i0w n ASP 11 Cb 0.23 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 3i0w n ASP 11 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3i0w n SER 12 N 0.45 0.00 -3.88 -1.12 3.41 -1.24 -1.19 113.62 110.06 3i0w n SER 12 Ca 0.08 -0.95 -0.18 0.00 -0.26 0.00 0.00 58.87 57.56 3i0w n SER 12 Cb 0.32 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.11 3i0w n SER 12 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3i0w s VAL 13 N -2.59 0.36 -0.23 -3.33 1.01 -0.67 -0.10 120.40 114.86 3i0w s VAL 13 Ca 0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.84 3i0w s VAL 13 Cb 0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 3i0w s VAL 13 CO 0.00 0.17 0.10 -0.63 0.00 0.00 0.00 175.10 174.73 3i0w s ILE 14 N 0.73 4.80 -0.30 2.22 1.01 0.33 -0.85 121.20 129.14 3i0w s ILE 14 Ca -0.08 -0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.43 3i0w s ILE 14 Cb -0.12 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 3i0w s ILE 14 CO -0.01 0.37 0.21 -0.69 0.00 0.00 0.00 174.94 174.83 3i0w s VAL 15 N 1.08 5.30 0.29 2.92 1.01 0.13 -0.33 120.40 130.79 3i0w s VAL 15 Ca 0.05 0.08 -0.03 0.00 0.00 0.00 0.00 61.98 62.08 3i0w s VAL 15 Cb -0.14 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 3i0w s VAL 15 CO 0.04 0.17 0.53 -0.13 0.00 0.00 0.00 175.10 175.71 3i0w s ARG 16 N 1.77 3.59 -1.44 2.72 1.81 0.63 -1.26 118.95 126.77 3i0w s ARG 16 Ca 0.07 -0.10 -0.09 0.00 -1.72 0.00 0.00 55.73 53.90 3i0w s ARG 16 Cb -0.16 -2.67 0.05 0.00 -0.45 0.00 0.00 34.95 31.71 3i0w s ARG 16 CO 0.11 0.22 0.90 0.09 -0.68 0.00 0.00 175.30 175.94 3i0w n ASN 17 N -1.05 -3.63 -4.75 0.23 5.03 -1.18 -2.00 115.26 107.91 3i0w n ASN 17 Ca -0.03 -0.77 -0.40 0.00 0.87 0.00 0.00 54.58 54.25 3i0w n ASN 17 Cb 0.54 -4.04 -0.06 0.00 -1.02 0.00 0.00 39.78 35.21 3i0w n ASN 17 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3i0w s VAL 18 N -3.43 4.07 0.11 2.41 1.01 -0.30 -3.91 120.40 120.36 3i0w s VAL 18 Ca 0.42 2.02 0.07 0.00 0.00 0.00 0.00 61.98 64.49 3i0w s VAL 18 Cb -0.21 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.85 3i0w s VAL 18 CO 0.82 0.45 -0.16 -1.61 0.00 0.00 0.00 175.10 174.59 3i0w s GLU 19 N -1.00 1.05 -1.19 2.72 2.02 -0.66 -4.84 118.70 116.81 3i0w s GLU 19 Ca 0.42 -1.19 -0.11 0.00 0.02 0.00 0.00 54.97 54.11 3i0w s GLU 19 Cb -0.26 -1.08 -0.02 0.00 0.10 0.00 0.00 34.13 32.87 3i0w s GLU 19 CO 0.33 0.23 0.76 0.09 0.02 0.00 0.00 175.26 176.68 3i0w n ASN 20 N 0.77 -4.03 -3.33 -0.19 3.02 -1.26 -4.88 115.26 105.36 3i0w n ASN 20 Ca -0.17 -0.91 -0.11 0.00 -0.03 0.00 0.00 54.58 53.36 3i0w n ASN 20 Cb 0.56 -3.85 -0.07 0.00 -0.61 0.00 0.00 39.78 35.81 3i0w n ASN 20 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3i0w s PHE 21 N -3.55 -0.86 -0.06 3.10 5.99 -1.26 -4.61 117.98 116.74 3i0w s PHE 21 Ca 0.31 0.31 0.03 0.00 0.00 0.00 0.00 56.93 57.58 3i0w s PHE 21 Cb -0.09 -0.19 0.01 0.00 0.00 0.00 0.00 43.02 42.75 3i0w s PHE 21 CO 0.83 -0.92 -0.12 -1.21 -0.00 0.00 0.00 175.22 173.79 3i0w s GLU 22 N 2.51 1.60 0.13 10.12 0.41 -0.97 -4.97 118.70 127.52 3i0w s GLU 22 Ca 0.10 -0.42 -0.20 0.00 -0.41 0.00 0.00 54.97 54.04 3i0w s GLU 22 Cb -0.13 -1.35 -0.02 0.00 -1.78 0.00 0.00 34.13 30.85 3i0w s GLU 22 CO -0.28 0.07 1.70 -0.07 -0.49 0.00 0.00 175.26 176.19 3i0w h LEU 23 N 6.78 -0.20 -0.59 1.80 3.38 -1.96 -1.57 115.31 122.95 3i0w h LEU 23 Ca -0.32 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 3i0w h LEU 23 Cb 1.18 0.14 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 3i0w h LEU 23 CO 0.48 -0.07 0.32 0.50 0.09 0.00 0.00 178.44 179.75 3i0w h LYS 24 N 0.00 0.82 -0.53 1.13 3.64 -1.95 -0.56 116.57 119.12 3i0w h LYS 24 Ca 0.11 -0.10 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 3i0w h LYS 24 Cb 0.16 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 3i0w h LYS 24 CO -0.23 0.63 0.31 -0.44 -2.27 0.00 0.00 179.45 177.46 3i0w h ASP 25 N 0.79 0.51 0.13 4.20 5.19 -1.80 0.34 116.42 125.78 3i0w h ASP 25 Ca 0.21 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.62 3i0w h ASP 25 Cb 0.05 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.46 3i0w h ASP 25 CO -0.03 0.36 -0.06 0.40 -3.12 0.00 0.00 179.24 176.78 3i0w h ILE 26 N 0.62 1.05 0.00 0.35 2.04 -1.02 -3.13 117.51 117.41 3i0w h ILE 26 Ca 0.21 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.05 3i0w h ILE 26 Cb 0.02 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.76 3i0w h ILE 26 CO -0.10 0.23 -0.18 -0.26 0.00 0.00 0.00 178.15 177.85 3i0w h PHE 27 N -0.68 0.00 -0.31 1.37 0.04 -1.10 -3.34 116.94 112.91 3i0w h PHE 27 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 3i0w h PHE 27 Cb 0.51 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.66 3i0w h PHE 27 CO 0.08 0.00 0.00 -0.25 -0.60 0.00 0.00 178.31 177.54 3i0w n ASP 28 N -3.00 2.88 -0.04 2.17 8.00 0.11 -4.57 116.55 122.10 3i0w n ASP 28 Ca 0.03 -2.04 0.10 0.00 0.71 0.00 0.00 54.79 53.59 3i0w n ASP 28 Cb 0.53 -0.22 0.59 0.00 -0.02 0.00 0.00 41.12 42.00 3i0w n ASP 28 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3i0w n GLY 30 N 0.84 2.14 0.24 0.00 0.00 -1.26 -4.47 105.19 102.67 3i0w n GLY 30 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 3i0w n GLY 30 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3i0w h GLN 31 N 2.98 0.00 -5.02 1.61 3.07 -1.88 -3.46 115.11 112.42 3i0w h GLN 31 Ca 0.00 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.42 3i0w h GLN 31 Cb 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 27.48 27.40 3i0w h GLN 31 CO 0.00 0.09 -0.72 0.00 0.09 0.00 0.00 178.83 178.29 3i0w n PHE 33 N 0.19 0.00 -1.32 0.00 3.72 -1.26 -4.79 117.46 114.00 3i0w n PHE 33 Ca -0.13 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.26 3i0w n PHE 33 Cb 0.59 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 39.34 3i0w n PHE 33 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3i0w n ARG 34 N -0.56 2.08 -4.72 -1.08 1.74 -1.26 -4.74 116.66 108.12 3i0w n ARG 34 Ca 0.00 -3.07 -0.33 0.00 -0.77 0.00 0.00 57.85 53.68 3i0w n ARG 34 Cb 0.02 -1.81 -0.14 0.00 -1.02 0.00 0.00 32.46 29.51 3i0w n ARG 34 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3i0w s TRP 35 N -3.13 2.84 -0.11 -1.55 0.52 -1.26 -2.47 118.94 113.78 3i0w s TRP 35 Ca 0.43 -0.54 0.03 0.00 0.02 0.00 0.00 56.10 56.04 3i0w s TRP 35 Cb 0.39 -1.85 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 3i0w s TRP 35 CO 0.02 -0.15 -0.21 -1.01 0.02 0.00 0.00 176.95 175.62 3i0w s HIS 36 N 0.27 2.44 0.21 -1.98 3.76 0.47 -4.93 115.29 115.52 3i0w s HIS 36 Ca -0.08 -1.11 -0.30 0.00 -0.15 0.00 0.00 55.06 53.42 3i0w s HIS 36 Cb -0.15 -1.67 -0.09 0.00 1.11 0.00 0.00 32.58 31.79 3i0w s HIS 36 CO 0.05 -0.49 1.25 0.50 -0.85 0.00 0.00 174.74 175.20 3i0w s ARG 37 N 0.63 4.44 0.32 1.40 3.52 -1.26 -1.17 118.95 126.83 3i0w s ARG 37 Ca -0.13 1.98 0.03 0.00 -0.13 0.00 0.00 55.73 57.48 3i0w s ARG 37 Cb -0.17 -3.20 -0.03 0.00 -1.56 0.00 0.00 34.95 29.99 3i0w s ARG 37 CO 0.03 -0.15 0.48 -0.65 -0.81 0.00 0.00 175.30 174.20 3i0w s GLN 38 N -0.36 3.38 0.32 5.12 -1.52 0.25 -4.94 119.66 121.90 3i0w s GLN 38 Ca 0.54 -0.59 0.08 0.00 -1.95 0.00 0.00 55.36 53.44 3i0w s GLN 38 Cb -0.35 -2.76 0.83 0.00 -0.22 0.00 0.00 33.01 30.51 3i0w s GLN 38 CO 0.39 0.20 1.76 0.93 -0.25 0.00 0.00 175.29 178.32 3i0w h GLU 39 N 0.89 0.64 -0.05 2.91 3.07 -1.96 0.26 114.58 120.35 3i0w h GLU 39 Ca -0.50 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.32 3i0w h GLU 39 Cb 1.23 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.00 3i0w h GLU 39 CO 0.60 0.43 0.00 0.27 -1.40 0.00 0.00 179.01 178.90 3i0w n ASN 40 N -4.81 0.43 0.00 1.42 0.23 -1.26 -4.89 115.26 106.38 3i0w n ASN 40 Ca 0.25 -1.54 0.00 0.00 -0.53 0.00 0.00 54.58 52.76 3i0w n ASN 40 Cb 0.67 -0.03 0.00 0.00 -2.08 0.00 0.00 39.78 38.34 3i0w n ASN 40 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3i0w n GLY 41 N 0.85 1.41 3.76 4.83 0.00 0.08 -5.06 105.19 111.06 3i0w n GLY 41 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 3i0w n GLY 41 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3i0w s ASN 42 N -1.82 3.33 -0.03 1.61 0.01 -1.26 -4.69 114.94 112.09 3i0w s ASN 42 Ca 0.00 1.04 0.03 0.00 -0.71 0.00 0.00 52.86 53.22 3i0w s ASN 42 Cb 0.00 -1.65 0.00 0.00 0.41 0.00 0.00 41.25 40.01 3i0w s ASN 42 CO 0.00 -2.67 -0.11 -0.31 -1.51 0.00 0.00 177.10 172.50 3i0w s TYR 43 N -3.19 1.07 -0.11 2.20 1.51 -0.91 0.85 117.35 118.77 3i0w s TYR 43 Ca 0.64 -0.27 0.01 0.00 -1.01 0.00 0.00 57.07 56.44 3i0w s TYR 43 Cb -0.16 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 40.93 3i0w s TYR 43 CO 0.54 -0.10 -0.14 0.42 -1.11 0.00 0.00 175.55 175.17 3i0w s ILE 44 N 0.10 3.03 0.13 2.71 1.01 -0.31 -0.92 121.20 126.95 3i0w s ILE 44 Ca -0.02 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 3i0w s ILE 44 Cb -0.08 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 3i0w s ILE 44 CO 0.01 0.54 0.03 -0.83 0.00 0.00 0.00 174.94 174.68 3i0w s GLY 45 N 0.12 0.99 -0.18 6.18 0.00 0.32 -0.40 107.32 114.35 3i0w s GLY 45 Ca -0.06 -1.47 0.01 0.00 0.00 0.00 0.00 44.72 43.19 3i0w s GLY 45 CO 0.05 -1.41 -0.12 -0.42 0.00 0.00 0.00 173.10 171.20 3i0w s ILE 46 N -3.91 1.62 -0.06 0.90 1.01 -1.03 -1.07 121.20 118.66 3i0w s ILE 46 Ca 0.22 -0.89 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 3i0w s ILE 46 Cb 0.07 -1.64 0.04 0.00 0.01 0.00 0.00 42.46 40.94 3i0w s ILE 46 CO 0.01 0.26 0.45 0.00 0.00 0.00 0.00 174.94 175.66 3i0w s ALA 47 N 1.42 -1.13 -1.46 9.38 0.00 -0.73 -4.84 121.76 124.39 3i0w s ALA 47 Ca 0.01 0.82 -0.04 0.00 0.00 0.00 0.00 51.96 52.75 3i0w s ALA 47 Cb -0.15 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 22.86 3i0w s ALA 47 CO -0.09 -0.28 0.50 1.19 0.00 0.00 0.00 175.76 177.08 3i0w n PHE 48 N 1.54 -1.69 -2.92 0.00 3.72 -1.26 -1.45 117.46 115.40 3i0w n PHE 48 Ca -0.19 0.76 -0.20 0.00 -0.05 0.00 0.00 57.45 57.77 3i0w n PHE 48 Cb 0.56 -3.62 0.01 0.00 -0.94 0.00 0.00 39.48 35.50 3i0w n PHE 48 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3i0w n GLU 49 N -4.41 -3.46 -3.97 -1.08 1.02 -1.26 -4.98 120.64 102.50 3i0w n GLU 49 Ca -0.23 0.73 -0.09 0.00 -0.02 0.00 0.00 57.16 57.54 3i0w n GLU 49 Cb 0.65 -5.46 -0.11 0.00 -0.02 0.00 0.00 31.44 26.50 3i0w n GLU 49 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3i0w s LYS 50 N -5.57 0.40 -0.19 3.49 1.02 -0.53 -5.00 119.74 113.36 3i0w s LYS 50 Ca 0.23 -0.65 -0.07 0.00 0.02 0.00 0.00 55.97 55.49 3i0w s LYS 50 Cb -0.11 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.31 3i0w s LYS 50 CO 0.28 -0.08 0.06 0.08 -0.92 0.00 0.00 175.35 174.78 3i0w s VAL 51 N -1.82 4.74 0.01 3.17 1.01 -1.26 -1.78 120.40 124.47 3i0w s VAL 51 Ca -0.12 -0.05 0.04 0.00 0.00 0.00 0.00 61.98 61.85 3i0w s VAL 51 Cb -0.07 -3.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 3i0w s VAL 51 CO -0.02 0.45 -0.11 -0.69 0.00 0.00 0.00 175.10 174.73 3i0w s VAL 52 N 0.51 0.87 -0.08 2.92 1.01 -0.23 -4.78 120.40 120.61 3i0w s VAL 52 Ca 0.03 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.39 3i0w s VAL 52 Cb -0.13 -0.76 -0.00 0.00 0.00 0.00 0.00 36.38 35.49 3i0w s VAL 52 CO 0.01 0.10 -0.23 -0.70 0.00 0.00 0.00 175.10 174.28 3i0w s GLU 53 N -0.65 2.65 -0.06 2.72 2.12 -1.19 -0.52 118.70 123.78 3i0w s GLU 53 Ca 0.02 -0.82 0.06 0.00 0.36 0.00 0.00 54.97 54.59 3i0w s GLU 53 Cb -0.06 -2.10 -0.01 0.00 0.26 0.00 0.00 34.13 32.22 3i0w s GLU 53 CO 0.00 0.24 -0.25 0.08 -0.54 0.00 0.00 175.26 174.79 3i0w s VAL 54 N 0.18 2.01 -0.01 3.70 1.01 -0.10 -0.22 120.40 126.98 3i0w s VAL 54 Ca -0.12 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.84 3i0w s VAL 54 Cb -0.16 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 3i0w s VAL 54 CO 0.06 0.56 -0.09 -1.58 0.00 0.00 0.00 175.10 174.05 3i0w s GLN 55 N -0.16 0.77 -0.18 2.72 0.74 -0.38 -2.15 119.66 121.02 3i0w s GLN 55 Ca -0.03 -0.33 -0.02 0.00 0.05 0.00 0.00 55.36 55.03 3i0w s GLN 55 Cb -0.13 -0.74 -0.01 0.00 1.10 0.00 0.00 33.01 33.22 3i0w s GLN 55 CO 0.03 0.19 -0.10 0.21 -0.55 0.00 0.00 175.29 175.08 3i0w s LYS 56 N -0.18 3.34 -0.28 1.67 2.47 -1.26 -0.20 119.74 125.30 3i0w s LYS 56 Ca 0.03 -0.67 -0.01 0.00 -1.56 0.00 0.00 55.97 53.76 3i0w s LYS 56 Cb -0.04 -2.81 0.09 0.00 -1.46 0.00 0.00 37.83 33.61 3i0w s LYS 56 CO -0.00 -0.04 0.06 0.42 0.16 0.00 0.00 175.35 175.95 3i0w s ILE 57 N 1.01 0.94 0.00 5.43 1.01 0.07 -5.02 121.20 124.65 3i0w s ILE 57 Ca -0.01 -1.24 0.00 0.00 0.00 0.00 0.00 60.65 59.41 3i0w s ILE 57 Cb -0.15 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.73 3i0w s ILE 57 CO -0.01 -0.50 0.00 0.61 0.00 0.00 0.00 174.94 175.04 3i0w n GLY 58 N 4.84 2.96 0.93 6.18 0.00 -1.26 -1.74 105.19 117.11 3i0w n GLY 58 Ca -0.05 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.87 3i0w n GLY 58 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i0w n GLU 59 N 13.39 2.19 -4.45 1.61 1.02 -1.26 -4.91 120.64 128.23 3i0w n GLU 59 Ca 0.00 -1.82 -0.31 0.00 -0.02 0.00 0.00 57.16 55.00 3i0w n GLU 59 Cb 0.00 -1.43 -0.11 0.00 -0.02 0.00 0.00 31.44 29.89 3i0w n GLU 59 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3i0w s ASP 60 N -1.21 4.47 -0.13 1.62 1.01 -0.71 -1.15 116.67 120.58 3i0w s ASP 60 Ca 0.36 -0.23 0.02 0.00 0.71 0.00 0.00 52.55 53.41 3i0w s ASP 60 Cb 0.19 -0.97 -0.00 0.00 1.01 0.00 0.00 42.92 43.15 3i0w s ASP 60 CO 0.26 0.26 -0.19 -0.69 0.21 0.00 0.00 175.17 175.02 3i0w s VAL 61 N -1.03 2.49 -0.21 -1.27 1.01 -0.39 -0.75 120.40 120.26 3i0w s VAL 61 Ca 0.18 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 3i0w s VAL 61 Cb -0.11 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 3i0w s VAL 61 CO 0.09 0.54 0.01 -0.69 0.00 0.00 0.00 175.10 175.04 3i0w s VAL 62 N 0.51 4.00 -0.38 2.92 1.01 0.71 0.17 120.40 129.35 3i0w s VAL 62 Ca -0.12 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 3i0w s VAL 62 Cb -0.16 -2.82 0.08 0.00 0.00 0.00 0.00 36.38 33.47 3i0w s VAL 62 CO 0.05 0.41 0.16 -0.63 0.00 0.00 0.00 175.10 175.09 3i0w s ILE 63 N 1.12 3.56 0.46 2.22 1.01 -0.03 -1.25 121.20 128.28 3i0w s ILE 63 Ca 0.03 -1.59 -0.20 0.00 0.00 0.00 0.00 60.65 58.89 3i0w s ILE 63 Cb -0.14 -3.22 -0.10 0.00 0.01 0.00 0.00 42.46 39.01 3i0w s ILE 63 CO 0.02 -0.44 0.98 -0.31 0.00 0.00 0.00 174.94 175.19 3i0w s TYR 64 N 1.28 3.26 -0.67 3.97 2.02 0.70 -1.67 117.35 126.25 3i0w s TYR 64 Ca 0.02 1.57 0.00 0.00 -0.37 0.00 0.00 57.07 58.30 3i0w s TYR 64 Cb -0.22 -2.89 0.00 0.00 -0.40 0.00 0.00 41.96 38.45 3i0w s TYR 64 CO -0.01 -0.33 0.00 -1.71 -1.57 0.00 0.00 175.55 171.93 3i0w n ASN 65 N -0.92 -3.25 -4.04 2.29 5.15 -0.33 -3.14 115.26 111.02 3i0w n ASN 65 Ca 0.07 0.08 -0.08 0.00 -0.60 0.00 0.00 54.58 54.06 3i0w n ASN 65 Cb 0.54 -1.97 -0.09 0.00 -0.53 0.00 0.00 39.78 37.72 3i0w n ASN 65 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3i0w s ILE 66 N -2.30 0.19 0.43 -1.44 -4.36 -1.26 -4.94 121.20 107.51 3i0w s ILE 66 Ca 0.00 -1.66 0.02 0.00 -0.26 0.00 0.00 60.65 58.75 3i0w s ILE 66 Cb 0.00 -1.53 0.02 0.00 1.25 0.00 0.00 42.46 42.19 3i0w s ILE 66 CO 0.00 -0.85 0.13 -0.46 0.24 0.00 0.00 174.94 174.01 3i0w n ASN 67 N 0.04 2.86 -0.19 4.36 0.23 -1.26 -3.88 115.26 117.43 3i0w n ASN 67 Ca -0.13 -2.71 -0.04 0.00 -0.53 0.00 0.00 54.58 51.17 3i0w n ASN 67 Cb 0.62 0.16 0.14 0.00 -2.08 0.00 0.00 39.78 38.62 3i0w n ASN 67 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3i0w h GLU 68 N 0.00 0.97 -0.79 -3.83 4.81 -1.94 -1.61 114.58 112.19 3i0w h GLU 68 Ca -0.32 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 3i0w h GLU 68 Cb 1.04 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.24 3i0w h GLU 68 CO 0.52 0.84 0.44 1.49 -0.73 0.00 0.00 179.01 181.56 3i0w h GLU 69 N 0.94 1.10 -0.20 1.92 4.22 -1.99 -1.27 114.58 119.29 3i0w h GLU 69 Ca 0.21 -0.13 -0.13 0.00 0.08 0.00 0.00 59.36 59.39 3i0w h GLU 69 Cb 0.28 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3i0w h GLU 69 CO -0.01 0.81 -0.43 0.93 -2.18 0.00 0.00 179.01 178.13 3i0w h GLU 70 N 1.10 0.50 -0.26 1.92 5.08 -1.89 -1.88 114.58 119.15 3i0w h GLU 70 Ca 0.28 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3i0w h GLU 70 Cb 0.03 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3i0w h GLU 70 CO -0.05 0.84 0.07 0.35 -1.00 0.00 0.00 179.01 179.22 3i0w h PHE 71 N 0.41 0.42 -0.30 4.33 3.57 -0.89 0.70 116.94 125.18 3i0w h PHE 71 Ca 0.03 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3i0w h PHE 71 Cb 0.92 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 3i0w h PHE 71 CO 0.03 0.48 0.13 0.87 -2.23 0.00 0.00 178.31 177.59 3i0w h LYS 72 N 0.25 0.44 0.00 1.11 1.57 -1.13 0.15 116.57 118.96 3i0w h LYS 72 Ca 0.08 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3i0w h LYS 72 Cb 0.26 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3i0w h LYS 72 CO -0.00 0.45 -0.79 -0.91 -0.57 0.00 0.00 179.45 177.63 3i0w h ASN 73 N 0.34 0.00 0.00 0.86 2.35 -1.34 -3.44 115.58 114.35 3i0w h ASN 73 Ca 0.10 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 3i0w h ASN 73 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3i0w h ASN 73 CO -0.01 0.08 0.00 0.52 -1.65 0.00 0.00 177.43 176.37 3i0w n VAL 74 N -2.28 0.44 0.18 2.81 0.31 0.18 -4.93 118.33 115.05 3i0w n VAL 74 Ca 0.02 0.15 0.04 0.00 -0.01 0.00 0.00 64.34 64.54 3i0w n VAL 74 Cb 0.47 -0.88 0.33 0.00 -0.91 0.00 0.00 33.84 32.85 3i0w n VAL 74 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3i0w h TRP 75 N 0.00 0.00 -0.51 3.52 4.06 -1.36 -1.45 115.95 120.21 3i0w h TRP 75 Ca 0.00 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.92 3i0w h TRP 75 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 3i0w h TRP 75 CO 0.00 0.41 0.19 0.66 -3.56 0.00 0.00 178.44 176.14 3i0w h SER 76 N 0.00 0.73 0.61 -3.49 4.64 -0.95 -2.14 113.55 112.94 3i0w h SER 76 Ca -0.00 -0.18 -0.19 0.00 -0.47 0.00 0.00 61.79 60.94 3i0w h SER 76 Cb 0.87 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 3i0w h SER 76 CO 0.05 0.71 -0.86 -0.33 -0.87 0.00 0.00 176.83 175.53 3i0w h GLU 77 N 0.69 0.17 -0.70 4.77 4.39 -1.78 -1.03 114.58 121.10 3i0w h GLU 77 Ca 0.17 -0.19 0.08 0.00 0.34 0.00 0.00 59.36 59.76 3i0w h GLU 77 Cb 0.23 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.87 3i0w h GLU 77 CO -0.01 0.93 0.36 -0.92 -1.16 0.00 0.00 179.01 178.22 3i0w h TYR 78 N 0.10 0.65 -0.35 4.33 3.20 -0.93 0.72 116.97 124.68 3i0w h TYR 78 Ca -0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3i0w h TYR 78 Cb 1.49 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.57 3i0w h TYR 78 CO 0.03 0.26 0.00 1.19 -1.64 0.00 0.00 178.16 177.99 3i0w n PHE 79 N -4.84 0.64 -4.14 -3.82 3.72 -0.83 -0.90 117.46 107.28 3i0w n PHE 79 Ca 0.10 -0.28 -0.35 0.00 -0.05 0.00 0.00 57.45 56.88 3i0w n PHE 79 Cb 0.25 -0.08 -0.01 0.00 -0.94 0.00 0.00 39.48 38.69 3i0w n PHE 79 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3i0w n ASP 80 N 0.52 -3.59 0.03 4.37 2.03 0.24 -4.83 116.55 115.32 3i0w n ASP 80 Ca 0.13 -0.96 0.07 0.00 0.52 0.00 0.00 54.79 54.55 3i0w n ASP 80 Cb 0.42 -3.04 0.31 0.00 -0.72 0.00 0.00 41.12 38.10 3i0w n ASP 80 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3i0w n LEU 81 N -4.46 0.12 0.01 -2.67 4.77 -0.40 -2.55 117.00 111.82 3i0w n LEU 81 Ca 0.06 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 3i0w n LEU 81 Cb 0.50 -0.52 0.31 0.00 -2.33 0.00 0.00 43.42 41.38 3i0w n LEU 81 CO 0.83 -0.34 0.54 -1.22 -1.33 0.00 0.00 177.39 175.87 3i0w n TYR 82 N -1.64 0.09 -3.37 -1.77 4.02 -1.26 -1.18 117.16 112.05 3i0w n TYR 82 Ca 0.03 0.03 -0.38 0.00 -0.01 0.00 0.00 57.90 57.56 3i0w n TYR 82 Cb 0.16 -0.36 -0.06 0.00 -0.02 0.00 0.00 39.34 39.06 3i0w n TYR 82 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 3i0w s ARG 83 N -3.02 4.08 -0.71 -0.72 3.52 -1.06 -3.79 118.95 117.24 3i0w s ARG 83 Ca 0.11 0.60 -0.20 0.00 -0.13 0.00 0.00 55.73 56.11 3i0w s ARG 83 Cb 0.17 -3.22 0.11 0.00 -1.56 0.00 0.00 34.95 30.45 3i0w s ARG 83 CO 0.67 0.65 0.90 -0.51 -0.81 0.00 0.00 175.30 176.21 3i0w s ASP 84 N -1.13 6.33 0.25 -2.12 -0.00 -1.26 -4.00 116.67 114.74 3i0w s ASP 84 Ca 0.27 -1.52 0.23 0.00 -0.00 0.00 0.00 52.55 51.54 3i0w s ASP 84 Cb -0.18 -2.36 0.97 0.00 -0.00 0.00 0.00 42.92 41.35 3i0w s ASP 84 CO 0.17 -1.18 1.70 -1.22 -0.00 0.00 0.00 175.17 174.64 3i0w n TYR 85 N 6.70 0.79 -0.23 4.23 4.02 -1.26 -2.54 117.16 128.86 3i0w n TYR 85 Ca 0.02 0.31 -0.07 0.00 -0.01 0.00 0.00 57.90 58.16 3i0w n TYR 85 Cb 0.45 -1.00 0.07 0.00 -0.02 0.00 0.00 39.34 38.84 3i0w n TYR 85 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3i0w h GLY 86 N 2.22 1.17 1.25 2.72 0.00 -1.95 -1.06 103.07 107.42 3i0w h GLY 86 Ca 0.00 -0.73 -0.15 0.00 0.00 0.00 0.00 47.33 46.45 3i0w h GLY 86 CO 0.00 0.68 -0.37 -2.09 0.00 0.00 0.00 176.54 174.76 3i0w h GLU 87 N 1.03 0.83 -0.05 4.80 4.57 -1.92 -1.07 114.58 122.76 3i0w h GLU 87 Ca 0.21 -0.42 -0.00 0.00 -1.18 0.00 0.00 59.36 57.97 3i0w h GLU 87 Cb 0.37 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.97 3i0w h GLU 87 CO 0.00 1.06 0.03 0.82 -1.18 0.00 0.00 179.01 179.74 3i0w h ILE 88 N 0.68 1.04 -0.27 2.32 2.04 -1.48 -1.68 117.51 120.17 3i0w h ILE 88 Ca 0.06 -0.11 -0.07 0.00 1.00 0.00 0.00 64.86 65.74 3i0w h ILE 88 Cb 0.93 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 3i0w h ILE 88 CO 0.09 0.04 -0.15 0.11 0.00 0.00 0.00 178.15 178.23 3i0w h LYS 89 N 0.04 0.46 -0.29 2.37 1.57 -1.14 -1.60 116.57 117.98 3i0w h LYS 89 Ca 0.02 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 3i0w h LYS 89 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3i0w h LYS 89 CO -0.00 0.60 0.08 -0.22 -0.57 0.00 0.00 179.45 179.34 3i0w h LYS 90 N 0.42 0.45 -0.00 3.15 3.64 -0.94 -0.19 116.57 123.09 3i0w h LYS 90 Ca 0.08 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3i0w h LYS 90 Cb 0.51 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.27 3i0w h LYS 90 CO 0.03 0.52 0.00 0.93 -2.27 0.00 0.00 179.45 178.66 3i0w h GLU 91 N 0.30 0.00 -0.58 1.90 5.08 -1.10 -3.13 114.58 117.05 3i0w h GLU 91 Ca 0.09 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3i0w h GLU 91 Cb 0.26 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3i0w h GLU 91 CO -0.00 0.22 0.18 -0.07 -1.00 0.00 0.00 179.01 178.34 3i0w h LEU 92 N -0.22 0.80 0.00 1.33 3.38 -1.27 -2.57 115.31 116.76 3i0w h LEU 92 Ca 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3i0w h LEU 92 Cb 0.22 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3i0w h LEU 92 CO -0.00 0.76 0.00 -1.20 0.09 0.00 0.00 178.44 178.09 3i0w n SER 93 N -4.29 0.00 0.29 -0.43 7.64 -0.09 -1.72 113.62 115.02 3i0w n SER 93 Ca 0.05 0.23 0.18 0.00 1.01 0.00 0.00 58.87 60.34 3i0w n SER 93 Cb 0.20 -0.35 0.79 0.00 -1.01 0.00 0.00 64.21 63.84 3i0w n SER 93 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3i0w h ARG 94 N 0.00 0.00 -5.04 1.43 3.08 -1.43 -3.37 114.38 109.04 3i0w h ARG 94 Ca 0.00 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.37 3i0w h ARG 94 Cb 0.15 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.02 3i0w h ARG 94 CO 0.00 0.03 -0.04 0.34 -1.07 0.00 0.00 179.97 179.23 3i0w s ASP 95 N -5.65 6.24 0.56 7.04 -1.08 -0.70 -4.94 116.67 118.14 3i0w s ASP 95 Ca -0.01 -0.66 0.26 0.00 -0.52 0.00 0.00 52.55 51.63 3i0w s ASP 95 Cb 0.10 -2.27 1.49 0.00 -1.46 0.00 0.00 42.92 40.79 3i0w s ASP 95 CO 0.52 -0.73 2.03 -0.65 0.52 0.00 0.00 175.17 176.86 3i0w h PRO 96 N 8.85 0.00 0.00 4.34 0.11 -1.86 -0.58 132.00 142.86 3i0w h PRO 96 Ca -0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 3i0w h PRO 96 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3i0w h PRO 96 CO 0.88 0.00 -0.16 -0.07 -0.21 0.00 0.00 178.00 178.43 3i0w h LEU 97 N 0.00 0.00 0.00 2.35 3.38 -1.92 -3.03 115.31 116.08 3i0w h LEU 97 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3i0w h LEU 97 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3i0w h LEU 97 CO -0.00 0.16 -1.21 0.18 0.09 0.00 0.00 178.44 177.66 3i0w n LEU 98 N -3.30 0.59 -0.20 1.67 4.77 -0.25 -4.57 117.00 115.72 3i0w n LEU 98 Ca 0.00 0.16 -0.09 0.00 -0.03 0.00 0.00 56.01 56.05 3i0w n LEU 98 Cb 0.41 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.40 3i0w n LEU 98 CO 0.32 -0.08 0.56 0.50 -1.33 0.00 0.00 177.39 177.37 3i0w h LYS 99 N 0.00 -0.23 -0.89 3.23 1.63 -1.38 -1.09 116.57 117.85 3i0w h LYS 99 Ca 0.00 0.02 0.07 0.00 -0.85 0.00 0.00 60.65 59.89 3i0w h LYS 99 Cb 0.91 0.05 -0.07 0.00 -0.60 0.00 0.00 32.23 32.53 3i0w h LYS 99 CO 0.00 -0.15 0.55 0.87 -3.45 0.00 0.00 179.45 177.27 3i0w h LYS 100 N -0.24 0.95 -0.35 1.90 1.57 -1.80 0.85 116.57 119.45 3i0w h LYS 100 Ca 0.17 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.81 3i0w h LYS 100 Cb 0.56 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3i0w h LYS 100 CO -0.69 0.63 -0.10 0.77 -0.57 0.00 0.00 179.45 179.49 3i0w h SER 101 N 0.98 0.70 -0.35 0.86 0.02 -1.68 -1.83 113.55 112.25 3i0w h SER 101 Ca 0.40 -0.37 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 3i0w h SER 101 Cb 0.23 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3i0w h SER 101 CO -0.19 0.92 0.15 0.58 -1.14 0.00 0.00 176.83 177.14 3i0w h VAL 102 N 0.48 1.18 -0.70 2.27 2.07 -0.74 -2.21 116.25 118.61 3i0w h VAL 102 Ca 0.09 -0.53 0.04 0.00 0.82 0.00 0.00 66.70 67.12 3i0w h VAL 102 Cb 0.62 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3i0w h VAL 102 CO 0.04 0.19 0.46 0.44 0.02 0.00 0.00 177.57 178.72 3i0w h ASP 103 N 0.42 0.70 0.36 0.57 3.32 -0.75 -1.94 116.42 119.10 3i0w h ASP 103 Ca 0.12 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.02 3i0w h ASP 103 Cb 0.16 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3i0w h ASP 103 CO -0.01 0.47 -0.59 0.15 -1.72 0.00 0.00 179.24 177.54 3i0w h PHE 104 N 0.80 0.29 -0.97 4.55 3.57 -0.99 -3.31 116.94 120.89 3i0w h PHE 104 Ca 0.29 -0.11 -0.57 0.00 3.53 0.00 0.00 57.97 61.11 3i0w h PHE 104 Cb 0.13 -0.05 -0.42 0.00 2.79 0.00 0.00 35.95 38.39 3i0w h PHE 104 CO -0.00 0.76 -0.70 0.41 -2.23 0.00 0.00 178.31 176.56 3i0w n GLY 105 N 0.23 6.28 0.44 2.40 0.00 -0.86 -4.85 105.19 108.83 3i0w n GLY 105 Ca -0.02 -2.68 0.25 0.00 0.00 0.00 0.00 46.02 43.57 3i0w n GLY 105 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3i0w h GLU 106 N 2.28 0.24 -0.51 1.61 4.39 -1.46 -1.74 114.58 119.39 3i0w h GLU 106 Ca 0.37 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.05 3i0w h GLU 106 Cb 1.33 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 3i0w h GLU 106 CO 0.83 0.16 0.00 0.41 -1.16 0.00 0.00 179.01 179.25 3i0w n GLY 107 N -1.59 1.35 3.76 -3.84 0.00 -1.26 -4.65 105.19 98.96 3i0w n GLY 107 Ca 0.23 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 3i0w n GLY 107 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i0w s ILE 108 N -1.55 3.26 0.00 -0.61 1.01 -0.66 -2.29 121.20 120.37 3i0w s ILE 108 Ca 0.30 1.21 0.00 0.00 0.00 0.00 0.00 60.65 62.17 3i0w s ILE 108 Cb 0.17 -3.75 -0.00 0.00 0.01 0.00 0.00 42.46 38.89 3i0w s ILE 108 CO 0.18 0.25 -0.02 -0.13 0.00 0.00 0.00 174.94 175.22 3i0w s ARG 109 N -1.73 0.13 -0.43 2.79 0.52 -1.26 -4.89 118.95 114.08 3i0w s ARG 109 Ca 0.48 -0.15 -0.22 0.00 -0.52 0.00 0.00 55.73 55.32 3i0w s ARG 109 Cb -0.33 -0.05 0.02 0.00 0.52 0.00 0.00 34.95 35.11 3i0w s ARG 109 CO 0.43 0.01 0.73 0.42 0.02 0.00 0.00 175.30 176.91 3i0w s ILE 110 N -0.30 4.73 0.61 1.52 -1.09 -1.26 -4.84 121.20 120.56 3i0w s ILE 110 Ca -0.03 0.37 -0.19 0.00 -2.23 0.00 0.00 60.65 58.58 3i0w s ILE 110 Cb -0.02 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 3i0w s ILE 110 CO -0.00 -0.64 1.23 -0.76 -1.23 0.00 0.00 174.94 173.54 3i0w s LEU 111 N 3.09 3.64 -0.79 2.97 1.43 -1.26 -4.45 118.68 123.31 3i0w s LEU 111 Ca 0.27 2.44 -0.13 0.00 -1.03 0.00 0.00 54.13 55.68 3i0w s LEU 111 Cb -0.13 -4.60 0.21 0.00 0.03 0.00 0.00 46.19 41.70 3i0w s LEU 111 CO 0.21 -1.69 0.72 -0.13 0.23 0.00 0.00 176.35 175.69 3i0w s ARG 112 N -3.35 3.45 0.55 1.70 0.52 -0.08 -4.68 118.95 117.06 3i0w s ARG 112 Ca 0.78 -2.44 0.01 0.00 -0.52 0.00 0.00 55.73 53.56 3i0w s ARG 112 Cb -0.32 -4.34 0.03 0.00 0.52 0.00 0.00 34.95 30.85 3i0w s ARG 112 CO 0.34 -1.28 0.78 -0.65 0.02 0.00 0.00 175.30 174.51 3i0w s GLN 113 N 0.19 2.59 0.07 3.54 -0.21 -0.43 -4.56 119.66 120.85 3i0w s GLN 113 Ca 0.17 -0.72 -0.31 0.00 0.02 0.00 0.00 55.36 54.53 3i0w s GLN 113 Cb -0.12 -2.48 -0.06 0.00 1.00 0.00 0.00 33.01 31.35 3i0w s GLN 113 CO -0.08 -0.69 1.27 0.34 -2.12 0.00 0.00 175.29 174.01 3i0w s ASP 114 N -4.41 6.99 0.16 5.90 2.15 -1.26 -4.33 116.67 121.88 3i0w s ASP 114 Ca 0.56 2.10 -0.16 0.00 0.43 0.00 0.00 52.55 55.49 3i0w s ASP 114 Cb -0.10 -2.58 0.10 0.00 -0.30 0.00 0.00 42.92 40.04 3i0w s ASP 114 CO 0.39 -0.54 1.71 -0.65 -0.17 0.00 0.00 175.17 175.91 3i0w h PRO 115 N 6.88 0.15 -0.11 4.34 0.11 -1.94 -1.04 132.00 140.39 3i0w h PRO 115 Ca -0.41 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 3i0w h PRO 115 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3i0w h PRO 115 CO 0.83 0.10 0.06 0.35 -0.21 0.00 0.00 178.00 179.13 3i0w h PHE 116 N 0.16 0.16 -0.64 0.65 3.57 -1.97 0.23 116.94 119.10 3i0w h PHE 116 Ca 0.19 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 3i0w h PHE 116 Cb 0.25 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 3i0w h PHE 116 CO -0.23 0.21 0.33 1.49 -2.23 0.00 0.00 178.31 177.89 3i0w h GLU 117 N 0.07 0.90 -0.46 1.11 4.81 -1.93 -2.57 114.58 116.50 3i0w h GLU 117 Ca 0.04 -0.11 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 3i0w h GLU 117 Cb 0.11 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 3i0w h GLU 117 CO -0.01 0.69 -0.15 0.82 -0.73 0.00 0.00 179.01 179.64 3i0w h ILE 118 N 0.87 1.27 0.02 2.32 1.08 -0.97 0.48 117.51 122.57 3i0w h ILE 118 Ca 0.22 -1.27 0.02 0.00 -0.39 0.00 0.00 64.86 63.44 3i0w h ILE 118 Cb 0.07 1.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.86 3i0w h ILE 118 CO -0.03 0.44 -0.12 0.25 -0.69 0.00 0.00 178.15 177.99 3i0w h LEU 119 N 0.78 -0.35 -0.44 1.44 5.85 -0.32 -0.71 115.31 121.56 3i0w h LEU 119 Ca 0.12 0.05 -0.16 0.00 0.84 0.00 0.00 57.88 58.73 3i0w h LEU 119 Cb 0.68 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 3i0w h LEU 119 CO 0.05 -0.18 -0.44 -0.07 -0.34 0.00 0.00 178.44 177.47 3i0w h LEU 120 N -0.22 0.88 -0.74 2.25 3.38 -1.37 -2.73 115.31 116.76 3i0w h LEU 120 Ca 0.04 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.60 3i0w h LEU 120 Cb 0.26 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 3i0w h LEU 120 CO -0.11 1.19 0.48 0.28 0.09 0.00 0.00 178.44 180.37 3i0w h SER 121 N 0.66 0.82 1.42 -0.43 0.02 -0.64 -2.20 113.55 113.19 3i0w h SER 121 Ca 0.04 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3i0w h SER 121 Cb 1.01 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.36 3i0w h SER 121 CO 0.10 0.58 -0.19 -0.26 -1.14 0.00 0.00 176.83 175.92 3i0w h PHE 122 N 0.97 0.00 -0.43 3.45 -1.00 -1.14 -2.18 116.94 116.60 3i0w h PHE 122 Ca 0.28 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.92 3i0w h PHE 122 Cb -0.06 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.49 3i0w h PHE 122 CO -0.03 0.00 -0.29 0.82 -1.61 0.00 0.00 178.31 177.20 3i0w h ILE 123 N 0.00 1.27 -0.02 -0.55 2.04 -1.15 -2.51 117.51 116.60 3i0w h ILE 123 Ca 0.00 -1.46 -0.06 0.00 1.00 0.00 0.00 64.86 64.35 3i0w h ILE 123 Cb 0.81 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 3i0w h ILE 123 CO 0.00 0.50 -0.25 0.40 0.00 0.00 0.00 178.15 178.79 3i0w h ILE 124 N 0.80 1.19 0.00 -0.67 2.04 -1.20 -3.05 117.51 116.62 3i0w h ILE 124 Ca 0.09 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 3i0w h ILE 124 Cb 0.87 1.46 -0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3i0w h ILE 124 CO 0.08 0.26 -0.10 0.77 0.00 0.00 0.00 178.15 179.17 3i0w h SER 125 N 0.03 0.00 -2.25 1.72 4.64 -0.93 -3.43 113.55 113.33 3i0w h SER 125 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3i0w h SER 125 Cb 0.47 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.60 3i0w h SER 125 CO 0.03 0.10 0.95 0.00 -0.87 0.00 0.00 176.83 177.04 3i0w n ALA 126 N -2.18 1.40 -4.02 5.18 0.00 -1.16 -2.36 120.51 117.38 3i0w n ALA 126 Ca -0.01 0.37 -0.27 0.00 0.00 0.00 0.00 53.44 53.54 3i0w n ALA 126 Cb 0.30 -2.44 -0.03 0.00 0.00 0.00 0.00 19.45 17.27 3i0w n ALA 126 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3i0w n ASN 127 N 4.77 -0.27 -4.12 0.00 4.05 -1.26 -4.94 115.26 113.48 3i0w n ASN 127 Ca 0.19 -1.04 -0.10 0.00 0.45 0.00 0.00 54.58 54.07 3i0w n ASN 127 Cb 0.31 -2.84 -0.09 0.00 1.23 0.00 0.00 39.78 38.38 3i0w n ASN 127 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 3i0w s ASN 128 N -4.32 0.21 -0.11 1.20 3.84 -0.99 -5.16 114.94 109.60 3i0w s ASN 128 Ca 0.04 -1.18 -0.04 0.00 0.21 0.00 0.00 52.86 51.89 3i0w s ASN 128 Cb -0.02 0.35 -0.04 0.00 -0.55 0.00 0.00 41.25 41.00 3i0w s ASN 128 CO 0.91 -0.80 0.04 -0.13 -2.79 0.00 0.00 177.10 174.33 3i0w s ARG 129 N -4.06 3.22 0.28 0.43 0.52 -1.26 -5.01 118.95 113.07 3i0w s ARG 129 Ca 0.26 -0.33 0.02 0.00 -0.52 0.00 0.00 55.73 55.17 3i0w s ARG 129 Cb 0.06 -2.95 0.67 0.00 0.52 0.00 0.00 34.95 33.26 3i0w s ARG 129 CO 0.04 0.67 1.68 0.82 0.02 0.00 0.00 175.30 178.54 3i0w h ILE 130 N 4.20 0.45 -0.92 1.52 2.04 -1.99 -0.09 117.51 122.72 3i0w h ILE 130 Ca -0.50 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.28 3i0w h ILE 130 Cb 1.20 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 3i0w h ILE 130 CO 0.57 0.06 0.60 -0.65 0.00 0.00 0.00 178.15 178.74 3i0w h PRO 131 N 0.34 1.10 -0.22 2.37 0.11 -2.00 0.08 132.00 133.79 3i0w h PRO 131 Ca 0.53 -0.07 -0.16 0.00 0.11 0.00 0.00 66.00 66.42 3i0w h PRO 131 Cb 1.00 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 3i0w h PRO 131 CO -0.55 0.73 -0.51 0.52 -0.21 0.00 0.00 178.00 177.98 3i0w h MET 132 N 1.13 0.61 -0.40 1.05 2.86 -1.47 -2.31 114.93 116.40 3i0w h MET 132 Ca 0.37 -0.36 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 3i0w h MET 132 Cb 0.05 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 3i0w h MET 132 CO -0.12 0.97 0.16 0.82 1.06 0.00 0.00 176.91 179.80 3i0w h ILE 133 N 0.48 1.20 -0.55 -1.22 2.04 -0.47 -1.52 117.51 117.46 3i0w h ILE 133 Ca 0.02 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.28 3i0w h ILE 133 Cb 1.05 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 3i0w h ILE 133 CO 0.10 0.22 0.37 0.11 0.00 0.00 0.00 178.15 178.94 3i0w h LYS 134 N 0.50 0.73 -0.40 2.37 1.57 -0.92 -1.81 116.57 118.60 3i0w h LYS 134 Ca 0.13 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3i0w h LYS 134 Cb 0.19 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 3i0w h LYS 134 CO -0.01 0.48 0.24 0.87 -0.57 0.00 0.00 179.45 180.46 3i0w h LYS 135 N 0.75 0.55 -0.61 3.15 1.57 -1.16 -1.41 116.57 119.41 3i0w h LYS 135 Ca 0.20 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 3i0w h LYS 135 Cb -0.09 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 3i0w h LYS 135 CO -0.04 0.42 0.34 0.00 -0.57 0.00 0.00 179.45 179.60 3i0w h ILE 137 N 0.83 1.25 -0.26 0.00 2.04 -1.16 -0.91 117.51 119.31 3i0w h ILE 137 Ca 0.22 -0.88 -0.13 0.00 1.00 0.00 0.00 64.86 65.07 3i0w h ILE 137 Cb 0.03 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3i0w h ILE 137 CO -0.04 0.33 -0.36 -1.13 0.00 0.00 0.00 178.15 176.95 3i0w h ASN 138 N 0.82 0.60 -0.53 1.72 -1.24 -0.96 -2.10 115.58 113.90 3i0w h ASN 138 Ca 0.18 -0.25 -0.05 0.00 0.71 0.00 0.00 56.30 56.89 3i0w h ASN 138 Cb 0.34 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 3i0w h ASN 138 CO 0.00 0.91 0.13 0.78 -1.29 0.00 0.00 177.43 177.96 3i0w h ASN 139 N 0.48 0.81 -0.69 1.15 2.35 -0.60 0.74 115.58 119.82 3i0w h ASN 139 Ca 0.05 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 3i0w h ASN 139 Cb 0.85 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.97 3i0w h ASN 139 CO 0.07 0.83 0.45 0.40 -1.65 0.00 0.00 177.43 177.53 3i0w h ILE 140 N 0.75 1.18 -0.44 2.81 2.04 -1.01 -0.79 117.51 122.05 3i0w h ILE 140 Ca 0.17 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 3i0w h ILE 140 Cb 0.34 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 3i0w h ILE 140 CO 0.00 0.18 0.03 0.28 0.00 0.00 0.00 178.15 178.64 3i0w h SER 141 N 0.93 0.73 -0.61 1.72 0.02 -0.99 -2.66 113.55 112.69 3i0w h SER 141 Ca 0.25 -0.29 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 3i0w h SER 141 Cb -0.09 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 3i0w h SER 141 CO -0.05 0.84 0.23 -0.33 -1.14 0.00 0.00 176.83 176.38 3i0w h GLU 142 N 0.60 0.95 -0.36 3.45 5.08 -0.57 0.77 114.58 124.51 3i0w h GLU 142 Ca 0.13 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 3i0w h GLU 142 Cb 0.44 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3i0w h GLU 142 CO 0.02 0.80 -0.21 -0.22 -1.00 0.00 0.00 179.01 178.39 3i0w h LYS 143 N 0.93 0.70 0.00 2.33 3.64 -0.95 -3.39 116.57 119.83 3i0w h LYS 143 Ca 0.21 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3i0w h LYS 143 Cb 0.22 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3i0w h LYS 143 CO -0.01 0.85 -0.14 0.00 -2.27 0.00 0.00 179.45 177.88 3i0w n ALA 144 N -2.49 1.31 -2.35 5.00 0.00 -1.02 -5.11 120.51 115.84 3i0w n ALA 144 Ca 0.00 -0.59 -0.25 0.00 0.00 0.00 0.00 53.44 52.60 3i0w n ALA 144 Cb 0.41 -0.14 0.01 0.00 0.00 0.00 0.00 19.45 19.73 3i0w n ALA 144 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3i0w s GLY 145 N -0.28 1.51 0.36 0.00 0.00 0.27 -4.61 107.32 104.56 3i0w s GLY 145 Ca 0.00 -0.85 -0.26 0.00 0.00 0.00 0.00 44.72 43.61 3i0w s GLY 145 CO 0.00 -0.69 1.13 1.25 0.00 0.00 0.00 173.10 174.79 3i0w s LYS 146 N -4.61 4.28 0.14 2.90 2.20 -1.25 -4.67 119.74 118.73 3i0w s LYS 146 Ca 0.47 1.78 -0.30 0.00 -0.36 0.00 0.00 55.97 57.56 3i0w s LYS 146 Cb -0.10 -2.83 -0.07 0.00 -1.51 0.00 0.00 37.83 33.32 3i0w s LYS 146 CO 0.40 -0.11 1.13 0.15 -0.36 0.00 0.00 175.35 176.56 3i0w s LYS 147 N -2.05 4.54 -0.02 4.03 1.02 -1.26 -1.16 119.74 124.84 3i0w s LYS 147 Ca 0.53 1.73 0.04 0.00 0.02 0.00 0.00 55.97 58.29 3i0w s LYS 147 Cb -0.30 -3.30 -0.01 0.00 -0.52 0.00 0.00 37.83 33.71 3i0w s LYS 147 CO 0.38 -0.03 -0.15 -0.51 -0.92 0.00 0.00 175.35 174.13 3i0w s LEU 148 N 0.05 1.97 -0.11 3.17 1.43 0.87 -4.94 118.68 121.12 3i0w s LEU 148 Ca 0.52 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 3i0w s LEU 148 Cb -0.29 -0.78 -0.02 0.00 0.03 0.00 0.00 46.19 45.13 3i0w s LEU 148 CO 0.33 0.16 -0.10 -0.70 0.23 0.00 0.00 176.35 176.27 3i0w s GLU 149 N -0.19 3.14 -0.23 1.70 2.12 -1.26 0.56 118.70 124.54 3i0w s GLU 149 Ca 0.02 -0.63 -0.07 0.00 0.36 0.00 0.00 54.97 54.66 3i0w s GLU 149 Cb -0.07 -2.62 0.11 0.00 0.26 0.00 0.00 34.13 31.80 3i0w s GLU 149 CO 0.00 0.39 0.48 -0.47 -0.54 0.00 0.00 175.26 175.12 3i0w s TYR 150 N -0.09 -0.97 -1.39 5.30 5.04 -0.73 -4.96 117.35 119.54 3i0w s TYR 150 Ca -0.01 1.64 -0.01 0.00 -2.44 0.00 0.00 57.07 56.25 3i0w s TYR 150 Cb -0.14 0.40 0.01 0.00 0.35 0.00 0.00 41.96 42.58 3i0w s TYR 150 CO 0.03 -0.58 0.51 1.63 -1.34 0.00 0.00 175.55 175.81 3i0w n LYS 151 N 5.40 -3.74 -0.08 4.97 5.02 -1.26 -2.23 118.16 126.24 3i0w n LYS 151 Ca -0.08 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 3i0w n LYS 151 Cb 0.49 -4.73 0.00 0.00 -0.02 0.00 0.00 35.03 30.78 3i0w n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3i0w n GLY 152 N -1.86 2.59 3.57 0.72 0.00 -1.26 -5.02 105.19 103.94 3i0w n GLY 152 Ca -0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 3i0w n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i0w s LYS 153 N -0.09 2.26 -0.26 1.61 1.02 -0.95 -5.10 119.74 118.23 3i0w s LYS 153 Ca 0.00 -0.93 -0.13 0.00 0.02 0.00 0.00 55.97 54.93 3i0w s LYS 153 Cb 0.00 -2.36 -0.04 0.00 -0.52 0.00 0.00 37.83 34.91 3i0w s LYS 153 CO 0.00 0.54 0.27 0.42 -0.92 0.00 0.00 175.35 175.66 3i0w s ILE 154 N -1.13 5.26 0.26 2.17 1.01 -1.26 -1.78 121.20 125.73 3i0w s ILE 154 Ca 0.20 0.37 0.07 0.00 0.00 0.00 0.00 60.65 61.29 3i0w s ILE 154 Cb -0.11 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 3i0w s ILE 154 CO 0.11 0.23 0.17 -0.31 0.00 0.00 0.00 174.94 175.15 3i0w s TYR 155 N 1.70 3.03 -0.13 3.97 2.02 0.19 -4.91 117.35 123.22 3i0w s TYR 155 Ca 0.11 -0.14 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 3i0w s TYR 155 Cb -0.15 -1.40 0.01 0.00 -0.40 0.00 0.00 41.96 40.02 3i0w s TYR 155 CO 0.09 0.51 -0.22 0.71 -1.57 0.00 0.00 175.55 175.08 3i0w s TYR 156 N -2.18 2.60 0.77 2.71 2.02 -1.26 -0.09 117.35 121.93 3i0w s TYR 156 Ca 0.33 -1.29 -0.11 0.00 -0.37 0.00 0.00 57.07 55.64 3i0w s TYR 156 Cb -0.07 -1.77 0.06 0.00 -0.40 0.00 0.00 41.96 39.77 3i0w s TYR 156 CO 0.24 -0.59 1.09 0.00 -1.57 0.00 0.00 175.55 174.73 3i0w s ALA 157 N 0.79 2.25 0.40 3.71 0.00 -0.31 -4.78 121.76 123.82 3i0w s ALA 157 Ca -0.08 0.25 -0.25 0.00 0.00 0.00 0.00 51.96 51.87 3i0w s ALA 157 Cb -0.16 -3.27 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 3i0w s ALA 157 CO -0.01 -1.77 1.22 0.12 0.00 0.00 0.00 175.76 175.32 3i0w s PHE 158 N -2.91 2.96 0.68 0.00 5.36 -1.26 -3.97 117.98 118.84 3i0w s PHE 158 Ca 0.61 1.50 -0.16 0.00 -0.96 0.00 0.00 56.93 57.92 3i0w s PHE 158 Cb -0.17 -3.50 0.01 0.00 -0.34 0.00 0.00 43.02 39.02 3i0w s PHE 158 CO 0.56 -1.63 1.20 -2.14 -1.46 0.00 0.00 175.22 171.76 3i0w s PRO 159 N -2.28 2.49 0.82 10.12 0.02 -1.26 -4.68 135.00 140.22 3i0w s PRO 159 Ca 0.57 1.76 -0.12 0.00 0.02 0.00 0.00 61.00 63.24 3i0w s PRO 159 Cb -0.34 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.39 3i0w s PRO 159 CO 0.42 -1.56 1.12 0.95 -0.33 0.00 0.00 177.00 177.60 3i0w s THR 160 N -1.86 2.70 0.18 0.99 -4.23 -1.26 -4.83 115.64 107.32 3i0w s THR 160 Ca 0.75 0.23 -0.13 0.00 -1.18 0.00 0.00 61.69 61.35 3i0w s THR 160 Cb -0.29 -3.03 0.08 0.00 1.34 0.00 0.00 72.50 70.59 3i0w s THR 160 CO 0.41 -0.30 1.82 0.58 -0.54 0.00 0.00 174.62 176.59 3i0w h VAL 161 N -1.15 1.17 -0.71 2.29 2.07 -1.98 -1.27 116.25 116.67 3i0w h VAL 161 Ca -0.48 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 66.70 3i0w h VAL 161 Cb 1.29 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 3i0w h VAL 161 CO 0.61 0.17 0.45 0.44 0.02 0.00 0.00 177.57 179.26 3i0w h ASP 162 N 0.77 0.75 -0.41 0.57 3.45 -1.99 -0.41 116.42 119.15 3i0w h ASP 162 Ca 0.21 -0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.52 3i0w h ASP 162 Cb -0.03 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.57 3i0w h ASP 162 CO -0.04 0.52 -0.30 0.11 -1.57 0.00 0.00 179.24 177.96 3i0w h LYS 163 N 0.89 0.95 0.00 3.56 1.79 -1.86 -2.97 116.57 118.92 3i0w h LYS 163 Ca 0.28 -0.45 -0.03 0.00 -2.18 0.00 0.00 60.65 58.27 3i0w h LYS 163 Cb -0.00 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.63 3i0w h LYS 163 CO -0.10 1.11 -0.15 -0.07 -1.08 0.00 0.00 179.45 179.16 3i0w h LEU 164 N 0.80 0.00 -0.75 2.94 3.38 -0.89 -2.23 115.31 118.56 3i0w h LEU 164 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3i0w h LEU 164 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3i0w h LEU 164 CO 0.08 0.15 0.00 -0.74 0.09 0.00 0.00 178.44 178.02 3i0w h HIS 165 N 0.00 0.00 0.00 1.13 2.76 -0.91 -2.32 115.15 115.81 3i0w h HIS 165 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3i0w h HIS 165 Cb 0.69 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.65 3i0w h HIS 165 CO 0.00 0.00 0.00 0.93 -1.30 0.00 0.00 177.93 177.56 3i0w h GLU 166 N 0.00 0.00 -6.85 5.26 5.08 -1.42 -3.46 114.58 113.19 3i0w h GLU 166 Ca 0.00 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.84 3i0w h GLU 166 Cb 0.45 0.00 0.05 0.00 0.50 0.00 0.00 28.75 29.75 3i0w h GLU 166 CO 0.00 0.00 0.60 -0.06 -1.00 0.00 0.00 179.01 178.55 3i0w s PHE 167 N -3.14 3.18 0.41 4.33 0.40 -0.87 -5.05 117.98 117.25 3i0w s PHE 167 Ca 0.10 1.47 0.08 0.00 -0.60 0.00 0.00 56.93 57.98 3i0w s PHE 167 Cb 0.11 -3.59 0.01 0.00 0.51 0.00 0.00 43.02 40.07 3i0w s PHE 167 CO 0.58 -1.56 0.56 0.95 0.70 0.00 0.00 175.22 176.45 3i0w s THR 168 N -1.09 3.06 0.31 0.64 -4.23 -1.26 -4.96 115.64 108.11 3i0w s THR 168 Ca 0.48 -1.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.98 3i0w s THR 168 Cb -0.38 -3.02 0.27 0.00 1.34 0.00 0.00 72.50 70.71 3i0w s THR 168 CO 0.50 -0.01 1.96 -0.08 -0.54 0.00 0.00 174.62 176.44 3i0w h GLU 169 N 0.66 1.03 -0.88 3.99 4.81 -1.97 -1.47 114.58 120.76 3i0w h GLU 169 Ca -0.40 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 3i0w h GLU 169 Cb 1.28 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 3i0w h GLU 169 CO 0.46 0.68 0.51 -0.22 -0.73 0.00 0.00 179.01 179.71 3i0w h LYS 170 N 1.07 1.21 -0.79 1.92 3.64 -1.95 -1.67 116.57 120.00 3i0w h LYS 170 Ca 0.32 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.61 3i0w h LYS 170 Cb -0.02 -0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 31.50 3i0w h LYS 170 CO -0.09 0.86 0.50 -0.44 -2.27 0.00 0.00 179.45 178.02 3i0w h ASP 171 N 1.22 0.84 -0.41 4.20 3.32 -1.64 -0.05 116.42 123.89 3i0w h ASP 171 Ca 0.31 -0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.26 3i0w h ASP 171 Cb -0.02 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 3i0w h ASP 171 CO -0.06 0.58 -0.11 -0.26 -1.72 0.00 0.00 179.24 177.67 3i0w h PHE 172 N 0.98 0.96 -0.64 4.55 0.04 -1.19 -2.44 116.94 119.20 3i0w h PHE 172 Ca 0.32 -0.19 -0.04 0.00 2.80 0.00 0.00 57.97 60.86 3i0w h PHE 172 Cb 0.01 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 37.89 3i0w h PHE 172 CO -0.03 0.93 0.26 0.93 -0.60 0.00 0.00 178.31 179.80 3i0w h GLU 173 N 0.78 0.94 -0.05 1.51 5.08 -0.47 -1.98 114.58 120.39 3i0w h GLU 173 Ca 0.13 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 3i0w h GLU 173 Cb 0.62 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 3i0w h GLU 173 CO 0.04 0.77 -0.34 0.93 -1.00 0.00 0.00 179.01 179.41 3i0w h GLU 174 N 0.93 0.09 0.00 2.33 5.08 -0.69 -0.41 114.58 121.91 3i0w h GLU 174 Ca 0.22 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3i0w h GLU 174 Cb 0.18 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3i0w h GLU 174 CO -0.02 0.43 0.00 0.00 -1.00 0.00 0.00 179.01 178.42 3i0w n THR 176 N -0.98 -5.09 1.04 0.00 5.66 -0.16 -4.21 114.28 110.53 3i0w n THR 176 Ca 0.23 -0.63 0.12 0.00 -3.05 0.00 0.00 64.05 60.72 3i0w n THR 176 Cb 0.11 -4.72 0.22 0.00 -1.55 0.00 0.00 70.33 64.39 3i0w n THR 176 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3i0w n ALA 177 N -2.63 3.61 -0.90 1.79 0.00 -0.88 -4.76 120.51 116.74 3i0w n ALA 177 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.96 3i0w n ALA 177 Cb 0.58 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.96 3i0w n ALA 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i0w n GLY 178 N 1.47 2.20 0.09 0.00 0.00 -1.26 -2.15 105.19 105.54 3i0w n GLY 178 Ca 0.07 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.68 3i0w n GLY 178 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3i0w n PHE 179 N 9.68 0.48 1.21 1.61 1.16 -1.26 -1.97 117.46 128.37 3i0w n PHE 179 Ca 0.00 0.22 0.14 0.00 -1.87 0.00 0.00 57.45 55.94 3i0w n PHE 179 Cb 0.00 -0.86 0.68 0.00 -1.61 0.00 0.00 39.48 37.69 3i0w n PHE 179 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3i0w n ARG 180 N -1.97 0.24 -0.22 3.97 1.74 -0.91 -3.87 116.66 115.63 3i0w n ARG 180 Ca 0.01 0.01 0.02 0.00 -0.77 0.00 0.00 57.85 57.12 3i0w n ARG 180 Cb 0.10 -1.50 0.14 0.00 -1.02 0.00 0.00 32.46 30.17 3i0w n ARG 180 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3i0w h ALA 181 N 3.21 0.88 -0.41 7.54 0.00 -1.52 -0.78 119.26 128.19 3i0w h ALA 181 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3i0w h ALA 181 Cb 0.36 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3i0w h ALA 181 CO 0.00 -0.19 0.07 1.57 0.00 0.00 0.00 179.25 180.70 3i0w h LYS 182 N 0.43 0.62 -0.44 0.00 2.10 -1.84 -1.50 116.57 115.94 3i0w h LYS 182 Ca 0.35 -0.12 -0.11 0.00 -2.00 0.00 0.00 60.65 58.76 3i0w h LYS 182 Cb 0.46 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 31.68 3i0w h LYS 182 CO -0.34 0.59 -0.17 1.88 -2.00 0.00 0.00 179.45 179.40 3i0w h TYR 183 N 0.60 1.02 -0.40 0.07 0.05 -1.42 -1.65 116.97 115.23 3i0w h TYR 183 Ca 0.13 -0.24 -0.04 0.00 0.05 0.00 0.00 58.73 58.64 3i0w h TYR 183 Cb 0.27 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3i0w h TYR 183 CO 0.01 1.02 0.11 -0.07 -1.05 0.00 0.00 178.16 178.18 3i0w h LEU 184 N 0.72 0.59 -0.28 3.88 3.38 -0.93 -0.55 115.31 122.13 3i0w h LEU 184 Ca 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3i0w h LEU 184 Cb 0.73 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3i0w h LEU 184 CO 0.06 0.66 0.15 0.50 0.09 0.00 0.00 178.44 179.90 3i0w h LYS 185 N 0.50 0.39 -0.68 1.13 1.63 -1.22 -0.50 116.57 117.81 3i0w h LYS 185 Ca 0.13 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.85 3i0w h LYS 185 Cb 0.29 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.81 3i0w h LYS 185 CO -0.00 0.34 0.30 0.22 -3.45 0.00 0.00 179.45 176.86 3i0w h ASP 186 N 0.33 0.91 -0.31 4.20 3.58 -1.20 -1.76 116.42 122.16 3i0w h ASP 186 Ca 0.10 -0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.37 3i0w h ASP 186 Cb 0.07 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.87 3i0w h ASP 186 CO -0.02 0.81 0.09 0.74 -2.88 0.00 0.00 179.24 177.99 3i0w h THR 187 N 0.95 1.21 -0.43 2.25 2.02 -0.86 -2.01 112.91 116.05 3i0w h THR 187 Ca 0.23 -0.69 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 3i0w h THR 187 Cb 0.16 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3i0w h THR 187 CO -0.02 0.23 0.07 0.58 0.37 0.00 0.00 175.52 176.75 3i0w h VAL 188 N 0.35 1.20 -0.48 3.16 2.07 -0.97 -1.96 116.25 119.62 3i0w h VAL 188 Ca 0.10 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 3i0w h VAL 188 Cb 0.27 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3i0w h VAL 188 CO -0.00 0.27 0.29 0.44 0.02 0.00 0.00 177.57 178.59 3i0w h ASP 189 N 0.63 0.58 0.63 0.57 3.32 -0.98 0.61 116.42 121.78 3i0w h ASP 189 Ca 0.14 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 3i0w h ASP 189 Cb 0.29 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3i0w h ASP 189 CO 0.00 0.47 -0.32 0.03 -1.72 0.00 0.00 179.24 177.70 3i0w h ARG 190 N 0.65 0.00 0.01 3.56 3.08 -0.99 -1.22 114.38 119.46 3i0w h ARG 190 Ca 0.17 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.13 3i0w h ARG 190 Cb -0.00 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.05 3i0w h ARG 190 CO -0.03 0.32 -0.36 0.82 -1.07 0.00 0.00 179.97 179.65 3i0w h ILE 191 N 0.00 1.53 -0.17 2.04 1.08 -1.00 -1.12 117.51 119.87 3i0w h ILE 191 Ca -0.00 -2.03 0.03 0.00 -0.39 0.00 0.00 64.86 62.46 3i0w h ILE 191 Cb 0.73 2.78 -0.03 0.00 -3.07 0.00 0.00 36.82 37.23 3i0w h ILE 191 CO 0.04 0.56 -0.00 0.22 -0.69 0.00 0.00 178.15 178.28 3i0w h TYR 192 N -0.42 -0.02 -0.00 1.37 3.20 -0.65 -2.37 116.97 118.08 3i0w h TYR 192 Ca -0.05 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.84 3i0w h TYR 192 Cb 1.12 0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.42 3i0w h TYR 192 CO 0.18 -0.03 0.00 0.27 -1.64 0.00 0.00 178.16 176.94 3i0w n ASN 193 N -5.13 0.21 -0.03 -2.11 0.23 -0.48 -4.92 115.26 103.02 3i0w n ASN 193 Ca -0.03 -1.09 -0.00 0.00 -0.53 0.00 0.00 54.58 52.92 3i0w n ASN 193 Cb 0.10 -0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.79 3i0w n ASN 193 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3i0w n GLY 194 N 1.01 0.47 0.37 4.83 0.00 -0.89 -4.93 105.19 106.06 3i0w n GLY 194 Ca 0.23 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.89 3i0w n GLY 194 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3i0w h GLU 195 N 0.63 1.29 -5.04 1.61 4.81 -1.47 -3.40 114.58 113.01 3i0w h GLU 195 Ca -0.01 -0.12 -0.57 0.00 -0.13 0.00 0.00 59.36 58.53 3i0w h GLU 195 Cb 0.07 -0.27 -0.32 0.00 0.63 0.00 0.00 28.75 28.86 3i0w h GLU 195 CO 0.01 0.91 -0.84 -0.51 -0.73 0.00 0.00 179.01 177.85 3i0w s LEU 196 N -10.00 1.86 -0.25 1.64 1.43 -1.08 -5.07 118.68 107.21 3i0w s LEU 196 Ca -0.13 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.57 3i0w s LEU 196 Cb 0.17 -1.03 0.03 0.00 0.03 0.00 0.00 46.19 45.40 3i0w s LEU 196 CO 0.83 0.11 -0.05 0.21 0.23 0.00 0.00 176.35 177.67 3i0w s ASN 197 N 0.34 4.39 0.25 2.29 3.84 -1.26 -4.43 114.94 120.35 3i0w s ASN 197 Ca -0.11 -0.92 -0.05 0.00 0.21 0.00 0.00 52.86 51.98 3i0w s ASN 197 Cb -0.15 -1.67 0.28 0.00 -0.55 0.00 0.00 41.25 39.17 3i0w s ASN 197 CO 0.04 -0.14 1.84 -0.07 -2.79 0.00 0.00 177.10 175.98 3i0w h LEU 198 N 8.01 1.00 -0.76 3.21 3.38 -1.98 -1.00 115.31 127.16 3i0w h LEU 198 Ca -0.31 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.49 3i0w h LEU 198 Cb 1.10 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 3i0w h LEU 198 CO 0.57 0.86 0.31 -0.08 0.09 0.00 0.00 178.44 180.18 3i0w h GLU 199 N 1.09 1.14 -0.16 1.13 4.81 -1.99 0.30 114.58 120.90 3i0w h GLU 199 Ca 0.26 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 3i0w h GLU 199 Cb 0.14 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3i0w h GLU 199 CO -0.03 0.92 -0.00 -0.92 -0.73 0.00 0.00 179.01 178.25 3i0w h TYR 200 N 1.10 0.30 -0.97 0.92 3.20 -1.91 -2.85 116.97 116.76 3i0w h TYR 200 Ca 0.25 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 62.09 3i0w h TYR 200 Cb 0.21 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 3i0w h TYR 200 CO 0.02 0.50 0.64 0.82 -1.64 0.00 0.00 178.16 178.50 3i0w h ILE 201 N 0.02 1.24 0.00 1.81 2.04 -0.95 -1.78 117.51 119.89 3i0w h ILE 201 Ca 0.04 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 3i0w h ILE 201 Cb 0.38 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.27 3i0w h ILE 201 CO 0.01 0.24 -0.08 0.50 0.00 0.00 0.00 178.15 178.82 3i0w h LYS 202 N 1.30 0.00 0.00 2.37 3.64 -0.84 -2.43 116.57 120.62 3i0w h LYS 202 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 3i0w h LYS 202 Cb -0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3i0w h LYS 202 CO -0.08 0.08 -0.10 0.66 -2.27 0.00 0.00 179.45 177.74 3i0w h SER 203 N 0.00 0.00 -4.28 4.20 4.64 -1.09 -3.47 113.55 113.55 3i0w h SER 203 Ca -0.00 -0.03 -0.51 0.00 -0.47 0.00 0.00 61.79 60.78 3i0w h SER 203 Cb 0.28 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.47 3i0w h SER 203 CO 0.01 0.01 0.35 -0.76 -0.87 0.00 0.00 176.83 175.57 3i0w s LEU 204 N -4.80 3.19 0.90 5.97 1.43 -0.91 -5.03 118.68 119.44 3i0w s LEU 204 Ca 0.09 1.80 -0.11 0.00 -1.03 0.00 0.00 54.13 54.88 3i0w s LEU 204 Cb 0.11 -4.52 0.13 0.00 0.03 0.00 0.00 46.19 41.94 3i0w s LEU 204 CO 0.63 -1.67 1.09 0.54 0.23 0.00 0.00 176.35 177.17 3i0w s ASN 205 N -3.26 3.37 0.20 2.29 2.20 -1.26 -4.60 114.94 113.88 3i0w s ASN 205 Ca 0.62 1.57 -0.21 0.00 -0.94 0.00 0.00 52.86 53.90 3i0w s ASN 205 Cb -0.17 -2.24 0.14 0.00 -2.00 0.00 0.00 41.25 36.98 3i0w s ASN 205 CO 0.50 -2.72 1.57 0.44 -2.94 0.00 0.00 177.10 173.96 3i0w h ASP 206 N -1.60 -1.33 -0.50 3.54 5.19 -1.96 0.16 116.42 119.92 3i0w h ASP 206 Ca -0.49 0.26 -0.08 0.00 -0.62 0.00 0.00 57.03 56.09 3i0w h ASP 206 Cb 1.28 0.66 -0.02 0.00 0.18 0.00 0.00 39.33 41.43 3i0w h ASP 206 CO 0.53 -0.30 -0.00 0.78 -3.12 0.00 0.00 179.24 177.12 3i0w h ASN 207 N -0.12 0.87 0.07 6.45 2.35 -2.00 -1.86 115.58 121.35 3i0w h ASN 207 Ca 0.25 -0.31 -0.13 0.00 -0.55 0.00 0.00 56.30 55.56 3i0w h ASN 207 Cb 0.56 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 3i0w h ASN 207 CO -0.78 0.97 -0.45 -0.33 -1.65 0.00 0.00 177.43 175.20 3i0w h GLU 208 N 0.75 0.46 -0.24 0.81 5.08 -1.82 -2.28 114.58 117.33 3i0w h GLU 208 Ca 0.14 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3i0w h GLU 208 Cb 0.53 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3i0w h GLU 208 CO 0.03 0.82 0.13 0.00 -1.00 0.00 0.00 179.01 178.99 3i0w h HIS 210 N 0.28 0.20 -0.78 0.00 -0.00 -1.18 -1.51 115.15 112.16 3i0w h HIS 210 Ca 0.09 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.45 3i0w h HIS 210 Cb 0.07 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 27.40 3i0w h HIS 210 CO -0.03 0.08 0.41 0.93 -0.00 0.00 0.00 177.93 179.32 3i0w h GLU 211 N 0.25 1.10 -0.56 5.26 4.39 -1.21 -2.42 114.58 121.40 3i0w h GLU 211 Ca 0.16 -0.14 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 3i0w h GLU 211 Cb 0.14 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 3i0w h GLU 211 CO -0.17 0.83 -0.00 0.93 -1.16 0.00 0.00 179.01 179.43 3i0w h GLU 212 N 1.09 0.99 -0.36 2.33 4.39 -1.00 -2.89 114.58 119.13 3i0w h GLU 212 Ca 0.27 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 3i0w h GLU 212 Cb 0.06 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3i0w h GLU 212 CO -0.04 0.99 0.16 -0.07 -1.16 0.00 0.00 179.01 178.89 3i0w h LEU 213 N 0.88 0.45 0.00 1.33 3.38 -1.03 -1.49 115.31 118.83 3i0w h LEU 213 Ca 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3i0w h LEU 213 Cb 0.54 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3i0w h LEU 213 CO 0.03 0.40 0.00 0.29 0.09 0.00 0.00 178.44 179.25 3i0w n LYS 214 N -4.41 0.05 0.22 1.13 5.02 -0.93 -2.18 118.16 117.06 3i0w n LYS 214 Ca 0.02 0.25 0.10 0.00 -2.02 0.00 0.00 58.31 56.66 3i0w n LYS 214 Cb 0.13 -1.50 0.47 0.00 -0.02 0.00 0.00 35.03 34.11 3i0w n LYS 214 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3i0w h LYS 215 N 0.00 0.00 -6.69 1.97 1.57 -1.32 -3.44 116.57 108.66 3i0w h LYS 215 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3i0w h LYS 215 Cb 0.19 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.52 3i0w h LYS 215 CO 0.00 0.23 0.57 -0.06 -0.57 0.00 0.00 179.45 179.61 3i0w s PHE 216 N -3.69 3.40 0.16 -1.35 0.08 -0.93 -4.98 117.98 110.67 3i0w s PHE 216 Ca 0.00 1.42 -0.31 0.00 0.12 0.00 0.00 56.93 58.17 3i0w s PHE 216 Cb 0.11 -3.45 -0.09 0.00 -0.57 0.00 0.00 43.02 39.01 3i0w s PHE 216 CO 0.64 -1.26 1.40 -1.64 -0.10 0.00 0.00 175.22 174.25 3i0w s MET 217 N -0.44 4.32 0.00 0.44 -1.94 -1.26 -2.11 119.30 118.30 3i0w s MET 217 Ca 0.52 2.14 0.00 0.00 -1.71 0.00 0.00 55.69 56.64 3i0w s MET 217 Cb -0.33 -3.20 0.00 0.00 2.01 0.00 0.00 34.83 33.30 3i0w s MET 217 CO 0.38 -0.41 0.00 0.41 -0.01 0.00 0.00 175.02 175.40 3i0w n GLY 218 N 3.03 0.33 3.32 -0.03 0.00 -1.26 -4.71 105.19 105.88 3i0w n GLY 218 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 3i0w n GLY 218 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i0w s VAL 219 N -2.10 3.69 0.00 1.61 1.01 -0.90 -4.73 120.40 118.98 3i0w s VAL 219 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3i0w s VAL 219 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.54 3i0w s VAL 219 CO 0.00 0.19 0.00 0.61 0.00 0.00 0.00 175.10 175.90 3i0w n GLY 220 N 4.82 5.54 0.37 4.51 0.00 -1.26 -4.59 105.19 114.57 3i0w n GLY 220 Ca -0.16 -2.04 -0.01 0.00 0.00 0.00 0.00 46.02 43.81 3i0w n GLY 220 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3i0w h PRO 221 N 0.00 1.22 -0.01 1.61 0.11 -1.98 -0.88 132.00 132.07 3i0w h PRO 221 Ca 0.00 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 3i0w h PRO 221 Cb 0.00 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 30.84 3i0w h PRO 221 CO 0.00 0.81 -0.03 0.37 -0.21 0.00 0.00 178.00 178.94 3i0w h GLN 222 N 1.25 0.04 -0.58 1.05 -0.00 -1.94 -2.40 115.11 112.53 3i0w h GLN 222 Ca 0.34 -0.03 -0.07 0.00 -0.00 0.00 0.00 58.65 58.89 3i0w h GLN 222 Cb -0.13 0.01 -0.02 0.00 0.00 0.00 0.00 27.48 27.33 3i0w h GLN 222 CO -0.07 0.69 0.08 0.28 0.00 0.00 0.00 178.83 179.81 3i0w h VAL 223 N -0.61 1.25 -0.52 2.39 2.07 -1.90 -1.71 116.25 117.22 3i0w h VAL 223 Ca -0.00 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 3i0w h VAL 223 Cb 0.70 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 3i0w h VAL 223 CO 0.01 0.36 0.27 0.00 0.02 0.00 0.00 177.57 178.23 3i0w h ALA 224 N 1.19 0.67 -0.74 1.67 0.00 -1.22 -0.35 119.26 120.48 3i0w h ALA 224 Ca 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3i0w h ALA 224 Cb 0.42 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3i0w h ALA 224 CO 0.01 0.21 0.32 -0.44 0.00 0.00 0.00 179.25 179.35 3i0w h ASP 225 N 0.70 1.01 -0.31 0.00 3.32 -1.13 -1.08 116.42 118.93 3i0w h ASP 225 Ca 0.18 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3i0w h ASP 225 Cb 0.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 3i0w h ASP 225 CO -0.03 0.89 0.16 0.00 -1.72 0.00 0.00 179.24 178.55 3i0w h ILE 227 N 0.37 1.02 0.00 0.00 2.04 -0.78 0.07 117.51 120.23 3i0w h ILE 227 Ca 0.11 -0.06 -0.09 0.00 1.00 0.00 0.00 64.86 65.82 3i0w h ILE 227 Cb 0.08 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 3i0w h ILE 227 CO -0.02 0.02 -0.42 0.00 0.00 0.00 0.00 178.15 177.73 3i0w h MET 228 N -0.00 0.00 0.11 2.37 -0.00 -1.13 -1.26 114.93 115.02 3i0w h MET 228 Ca 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.70 3i0w h MET 228 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.62 3i0w h MET 228 CO -0.00 0.42 -0.05 1.25 -0.00 0.00 0.00 176.91 178.53 3i0w h LEU 229 N 0.00 -0.12 -0.64 -0.10 5.85 -0.95 -1.09 115.31 118.27 3i0w h LEU 229 Ca -0.00 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 3i0w h LEU 229 Cb 0.81 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 3i0w h LEU 229 CO 0.06 0.47 -0.02 -0.26 -0.34 0.00 0.00 178.44 178.34 3i0w h PHE 230 N -0.81 0.00 0.00 1.25 0.04 -0.98 -3.20 116.94 113.24 3i0w h PHE 230 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3i0w h PHE 230 Cb 0.57 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.72 3i0w h PHE 230 CO 0.11 0.02 0.00 -1.13 -0.60 0.00 0.00 178.31 176.71 3i0w n SER 231 N -3.11 0.21 0.00 2.17 3.41 -0.48 -1.31 113.62 114.51 3i0w n SER 231 Ca 0.02 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.08 3i0w n SER 231 Cb 0.44 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 3i0w n SER 231 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3i0w n MET 232 N -0.33 0.64 -4.00 4.33 2.81 -0.70 -4.48 117.12 115.40 3i0w n MET 232 Ca 0.00 -0.70 -0.31 0.00 -1.81 0.00 0.00 57.70 54.87 3i0w n MET 232 Cb 0.05 -0.79 0.01 0.00 -0.71 0.00 0.00 33.22 31.77 3i0w n MET 232 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3i0w n GLN 233 N -0.15 -4.66 -3.23 0.03 3.00 -0.51 -4.91 117.38 106.95 3i0w n GLN 233 Ca 0.00 0.52 -0.46 0.00 -0.01 0.00 0.00 57.00 57.05 3i0w n GLN 233 Cb 0.24 -5.29 -0.02 0.00 0.00 0.00 0.00 30.24 25.16 3i0w n GLN 233 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 3i0w s LYS 234 N -6.67 3.68 0.00 -1.09 -0.14 -0.65 -4.91 119.74 109.96 3i0w s LYS 234 Ca 0.60 -2.40 0.16 0.00 -1.36 0.00 0.00 55.97 52.97 3i0w s LYS 234 Cb -0.31 -4.57 0.86 0.00 -1.68 0.00 0.00 37.83 32.13 3i0w s LYS 234 CO 0.86 -1.40 1.41 0.66 -0.76 0.00 0.00 175.35 176.12 3i0w n TYR 235 N 4.44 0.00 1.59 3.18 4.01 -1.26 -2.33 117.16 126.79 3i0w n TYR 235 Ca 0.18 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 58.05 3i0w n TYR 235 Cb 0.47 -0.17 0.60 0.00 -0.31 0.00 0.00 39.34 39.92 3i0w n TYR 235 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3i0w n SER 236 N -1.17 1.12 -4.76 7.72 3.41 -1.26 -0.44 113.62 118.24 3i0w n SER 236 Ca 0.09 -1.42 -0.37 0.00 -0.26 0.00 0.00 58.87 56.91 3i0w n SER 236 Cb 0.09 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.06 3i0w n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i0w s ALA 237 N -1.97 2.77 -0.43 7.33 0.00 -0.98 -4.66 121.76 123.82 3i0w s ALA 237 Ca 0.39 1.14 0.05 0.00 0.00 0.00 0.00 51.96 53.54 3i0w s ALA 237 Cb 0.20 -3.49 0.19 0.00 0.00 0.00 0.00 23.12 20.02 3i0w s ALA 237 CO 0.32 -1.14 0.46 0.34 0.00 0.00 0.00 175.76 175.75 3i0w n PHE 238 N -1.06 -1.56 -1.96 0.00 7.35 -1.26 -1.44 117.46 117.54 3i0w n PHE 238 Ca 0.11 -2.88 -0.43 0.00 -0.76 0.00 0.00 57.45 53.49 3i0w n PHE 238 Cb 0.47 0.49 -0.03 0.00 0.35 0.00 0.00 39.48 40.76 3i0w n PHE 238 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3i0w s PRO 239 N 0.09 3.78 -0.61 -7.13 0.04 -1.26 -4.81 135.00 125.10 3i0w s PRO 239 Ca 0.33 1.90 -0.15 0.00 0.04 0.00 0.00 61.00 63.11 3i0w s PRO 239 Cb 0.06 -4.10 0.15 0.00 0.04 0.00 0.00 34.50 30.65 3i0w s PRO 239 CO -0.16 -1.33 0.56 0.08 0.04 0.00 0.00 177.00 176.19 3i0w s VAL 240 N 5.47 5.27 0.00 -0.36 1.01 -1.26 -4.83 120.40 125.70 3i0w s VAL 240 Ca 0.78 -1.78 0.00 0.00 0.00 0.00 0.00 61.98 60.99 3i0w s VAL 240 Cb -0.29 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.74 3i0w s VAL 240 CO 0.32 -0.91 0.00 -0.90 0.00 0.00 0.00 175.10 173.61 3i0w n ASP 241 N 4.89 0.15 -0.35 3.32 3.85 -1.26 -4.83 116.55 122.32 3i0w n ASP 241 Ca -0.06 -0.82 -0.02 0.00 -0.71 0.00 0.00 54.79 53.18 3i0w n ASP 241 Cb 0.42 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.30 3i0w n ASP 241 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3i0w h THR 242 N 0.06 1.21 -0.24 2.12 1.03 -1.99 -1.25 112.91 113.84 3i0w h THR 242 Ca 0.00 -0.43 -0.10 0.00 -0.01 0.00 0.00 66.41 65.87 3i0w h THR 242 Cb 0.00 -0.15 -0.00 0.00 -1.07 0.00 0.00 68.15 66.93 3i0w h THR 242 CO 0.00 0.23 -0.25 -0.50 -0.01 0.00 0.00 175.52 174.98 3i0w h TRP 243 N 1.25 0.73 -0.36 0.00 4.06 -1.95 -2.02 115.95 117.65 3i0w h TRP 243 Ca 0.36 -0.22 -0.09 0.00 2.06 0.00 0.00 58.89 61.00 3i0w h TRP 243 Cb -0.08 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 27.91 3i0w h TRP 243 CO -0.01 0.93 -0.16 0.28 -3.56 0.00 0.00 178.44 175.92 3i0w h VAL 244 N 0.31 1.26 -0.20 1.49 2.07 -1.86 -1.00 116.25 118.33 3i0w h VAL 244 Ca 0.04 -1.20 0.02 0.00 0.82 0.00 0.00 66.70 66.38 3i0w h VAL 244 Cb 0.81 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 3i0w h VAL 244 CO 0.06 0.40 0.07 0.50 0.02 0.00 0.00 177.57 178.62 3i0w h LYS 245 N 0.60 0.16 -0.71 1.57 3.64 -1.14 0.28 116.57 120.97 3i0w h LYS 245 Ca 0.10 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3i0w h LYS 245 Cb 0.62 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 3i0w h LYS 245 CO 0.04 0.11 0.44 0.87 -2.27 0.00 0.00 179.45 178.64 3i0w h LYS 246 N 0.17 0.95 -0.61 1.90 1.57 -0.98 -0.80 116.57 118.76 3i0w h LYS 246 Ca 0.08 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3i0w h LYS 246 Cb 0.05 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 3i0w h LYS 246 CO -0.08 0.67 0.29 0.00 -0.57 0.00 0.00 179.45 179.75 3i0w h ALA 247 N 1.23 0.79 -0.11 3.86 0.00 -0.74 -1.92 119.26 122.38 3i0w h ALA 247 Ca 0.26 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3i0w h ALA 247 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3i0w h ALA 247 CO -0.05 0.36 -0.45 0.52 0.00 0.00 0.00 179.25 179.63 3i0w h MET 248 N 0.84 0.26 0.00 0.00 2.86 -0.60 -2.50 114.93 115.79 3i0w h MET 248 Ca 0.21 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 3i0w h MET 248 Cb 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 3i0w h MET 248 CO -0.03 0.66 -0.03 0.52 1.06 0.00 0.00 176.91 179.10 3i0w h MET 249 N 0.22 0.00 0.00 1.72 2.07 -0.88 0.24 114.93 118.29 3i0w h MET 249 Ca 0.02 0.00 -0.22 0.00 -2.07 0.00 0.00 59.70 57.42 3i0w h MET 249 Cb 0.88 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 30.57 3i0w h MET 249 CO 0.07 0.03 -1.14 1.03 1.07 0.00 0.00 176.91 177.98 3i0w h SER 250 N 0.00 0.00 0.00 1.22 0.87 -1.03 -3.41 113.55 111.20 3i0w h SER 250 Ca -0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.38 3i0w h SER 250 Cb 0.78 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 3i0w h SER 250 CO 0.00 0.99 -1.67 0.18 -0.53 0.00 0.00 176.83 175.81 3i0w n LEU 251 N -3.28 2.43 -0.01 2.23 4.77 -0.97 -4.97 117.00 117.20 3i0w n LEU 251 Ca -0.03 -0.01 -0.01 0.00 -0.03 0.00 0.00 56.01 55.93 3i0w n LEU 251 Cb 0.96 -0.39 -0.02 0.00 -2.33 0.00 0.00 43.42 41.64 3i0w n LEU 251 CO 0.46 0.58 -0.57 -1.22 -1.33 0.00 0.00 177.39 175.31 3i0w n TYR 252 N -3.03 0.00 -4.40 -1.77 4.02 0.64 -5.09 117.16 107.53 3i0w n TYR 252 Ca -0.21 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.48 3i0w n TYR 252 Cb 0.71 -0.10 -0.10 0.00 -0.02 0.00 0.00 39.34 39.82 3i0w n TYR 252 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 3i0w s VAL 253 N -2.05 1.59 0.69 -0.72 -7.23 -0.06 -5.02 120.40 107.61 3i0w s VAL 253 Ca -0.01 -2.13 -0.11 0.00 -1.81 0.00 0.00 61.98 57.91 3i0w s VAL 253 Cb 0.01 -2.34 0.01 0.00 0.56 0.00 0.00 36.38 34.62 3i0w s VAL 253 CO 0.08 -0.38 1.06 0.00 -0.31 0.00 0.00 175.10 175.56 3i0w s ALA 254 N -3.05 2.66 -0.71 1.32 0.00 -1.26 -4.29 121.76 116.43 3i0w s ALA 254 Ca 0.28 0.11 0.14 0.00 0.00 0.00 0.00 51.96 52.49 3i0w s ALA 254 Cb 0.03 -3.18 0.64 0.00 0.00 0.00 0.00 23.12 20.61 3i0w s ALA 254 CO 0.10 -1.23 1.43 -0.35 0.00 0.00 0.00 175.76 175.71 3i0w n PRO 255 N -3.09 0.07 -0.33 0.00 -0.04 -1.26 -2.85 135.00 127.51 3i0w n PRO 255 Ca 0.08 0.44 0.07 0.00 -0.04 0.00 0.00 63.50 64.05 3i0w n PRO 255 Cb 0.53 -1.68 0.22 0.00 -0.04 0.00 0.00 33.50 32.54 3i0w n PRO 255 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3i0w n ASP 256 N -1.83 3.53 -4.74 3.54 5.75 -1.26 -4.99 116.55 116.56 3i0w n ASP 256 Ca 0.01 -2.34 -0.40 0.00 -0.01 0.00 0.00 54.79 52.05 3i0w n ASP 256 Cb 0.11 -0.38 -0.05 0.00 -1.03 0.00 0.00 41.12 39.76 3i0w n ASP 256 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3i0w s VAL 257 N -1.62 4.50 0.79 2.12 1.01 -1.13 -5.04 120.40 121.05 3i0w s VAL 257 Ca 0.34 1.91 -0.10 0.00 0.00 0.00 0.00 61.98 64.12 3i0w s VAL 257 Cb 0.22 -4.25 0.07 0.00 0.00 0.00 0.00 36.38 32.42 3i0w s VAL 257 CO 0.16 0.37 1.10 -0.94 0.00 0.00 0.00 175.10 175.80 3i0w s SER 258 N -0.27 4.26 0.35 3.32 1.04 -1.26 -4.84 113.70 116.30 3i0w s SER 258 Ca 0.43 1.87 0.04 0.00 0.48 0.00 0.00 55.95 58.77 3i0w s SER 258 Cb -0.23 -2.52 0.65 0.00 0.10 0.00 0.00 66.02 64.01 3i0w s SER 258 CO 0.28 -2.20 1.93 -0.07 0.98 0.00 0.00 173.24 174.16 3i0w h LEU 259 N -1.24 0.55 -0.53 2.42 3.38 -1.97 -1.26 115.31 116.66 3i0w h LEU 259 Ca -0.43 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.40 3i0w h LEU 259 Cb 1.24 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 3i0w h LEU 259 CO 0.50 0.53 0.08 0.50 0.09 0.00 0.00 178.44 180.14 3i0w h LYS 260 N 0.60 0.88 -0.25 1.13 3.64 -1.98 -0.24 116.57 120.34 3i0w h LYS 260 Ca 0.14 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.21 3i0w h LYS 260 Cb 0.17 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3i0w h LYS 260 CO -0.01 0.86 -0.19 0.87 -2.27 0.00 0.00 179.45 178.71 3i0w h LYS 261 N 0.76 0.45 -0.35 1.90 1.57 -1.78 -0.69 116.57 118.43 3i0w h LYS 261 Ca 0.16 -0.15 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 3i0w h LYS 261 Cb 0.41 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 3i0w h LYS 261 CO 0.01 0.62 -0.25 0.82 -0.57 0.00 0.00 179.45 180.09 3i0w h ILE 262 N 0.41 1.29 -0.14 1.86 2.04 -0.89 -0.82 117.51 121.25 3i0w h ILE 262 Ca 0.07 -1.40 -0.00 0.00 1.00 0.00 0.00 64.86 64.53 3i0w h ILE 262 Cb 0.57 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 3i0w h ILE 262 CO 0.04 0.46 0.07 -0.09 0.00 0.00 0.00 178.15 178.63 3i0w h ARG 263 N 0.56 0.20 -0.67 2.37 2.43 -0.72 -0.91 114.38 117.64 3i0w h ARG 263 Ca 0.07 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 3i0w h ARG 263 Cb 0.81 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.29 3i0w h ARG 263 CO 0.07 0.24 0.30 -0.44 -1.51 0.00 0.00 179.97 178.62 3i0w h ASP 264 N 0.11 0.88 -0.22 -3.80 3.32 -1.07 -1.06 116.42 114.57 3i0w h ASP 264 Ca 0.05 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3i0w h ASP 264 Cb 0.11 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3i0w h ASP 264 CO -0.01 0.77 0.08 0.15 -1.72 0.00 0.00 179.24 178.50 3i0w h PHE 265 N 0.96 0.35 -0.31 4.55 3.57 -0.92 -1.47 116.94 123.66 3i0w h PHE 265 Ca 0.23 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3i0w h PHE 265 Cb 0.14 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 3i0w h PHE 265 CO 0.01 0.40 0.13 0.78 -2.23 0.00 0.00 178.31 177.41 3i0w h GLY 266 N 0.19 0.48 1.45 2.40 0.00 -0.80 -1.62 103.07 105.18 3i0w h GLY 266 Ca 0.07 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 3i0w h GLY 266 CO -0.00 0.24 0.01 3.21 0.00 0.00 0.00 176.54 179.99 3i0w h ARG 267 N 0.35 0.68 -0.38 4.80 3.08 -1.17 0.44 114.38 122.18 3i0w h ARG 267 Ca 0.10 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 59.90 3i0w h ARG 267 Cb 0.15 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3i0w h ARG 267 CO -0.01 0.69 -0.13 1.49 -1.07 0.00 0.00 179.97 180.94 3i0w h GLU 268 N 0.64 0.76 -0.05 0.04 4.22 -1.11 -0.75 114.58 118.33 3i0w h GLU 268 Ca 0.13 -0.31 -0.12 0.00 0.08 0.00 0.00 59.36 59.14 3i0w h GLU 268 Cb 0.39 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.61 3i0w h GLU 268 CO 0.01 0.92 -0.45 -0.22 -2.18 0.00 0.00 179.01 177.09 3i0w h LYS 269 N 0.56 0.39 0.00 1.92 3.64 -1.03 -3.35 116.57 118.70 3i0w h LYS 269 Ca 0.09 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 3i0w h LYS 269 Cb 0.66 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3i0w h LYS 269 CO 0.04 1.01 -0.82 1.19 -2.27 0.00 0.00 179.45 178.60 3i0w n PHE 270 N -4.32 0.16 0.00 1.91 3.72 0.12 -5.03 117.46 114.02 3i0w n PHE 270 Ca -0.09 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 3i0w n PHE 270 Cb 0.58 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 3i0w n PHE 270 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3i0w n GLY 271 N 1.43 3.18 0.00 1.37 0.00 -0.29 -1.46 105.19 109.42 3i0w n GLY 271 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.10 3i0w n GLY 271 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i0w n SER 272 N 3.55 0.00 -0.83 1.61 3.41 -1.26 -1.80 113.62 118.30 3i0w n SER 272 Ca 0.00 0.18 0.08 0.00 -0.26 0.00 0.00 58.87 58.86 3i0w n SER 272 Cb 0.00 -0.32 0.19 0.00 -0.26 0.00 0.00 64.21 63.82 3i0w n SER 272 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3i0w n LEU 273 N -1.32 3.11 -0.25 1.04 4.77 -0.54 -4.30 117.00 119.52 3i0w n LEU 273 Ca 0.05 -1.86 0.04 0.00 -0.03 0.00 0.00 56.01 54.22 3i0w n LEU 273 Cb 0.10 -0.27 0.17 0.00 -2.33 0.00 0.00 43.42 41.09 3i0w n LEU 273 CO 0.09 0.75 1.00 0.28 -1.33 0.00 0.00 177.39 178.18 3i0w h SER 274 N 2.77 0.22 -0.97 -1.43 0.02 -1.15 -1.12 113.55 111.89 3i0w h SER 274 Ca 0.00 0.11 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 3i0w h SER 274 Cb 0.79 0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.38 3i0w h SER 274 CO 0.00 0.08 0.63 1.23 -1.14 0.00 0.00 176.83 177.64 3i0w h GLY 275 N 0.41 1.38 0.69 -3.77 0.00 0.43 0.23 103.07 102.43 3i0w h GLY 275 Ca 0.40 -0.53 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 3i0w h GLY 275 CO -0.40 0.52 -0.16 0.74 0.00 0.00 0.00 176.54 177.23 3i0w h PHE 276 N 1.32 0.37 -0.73 5.60 0.04 -1.62 -2.41 116.94 119.51 3i0w h PHE 276 Ca 0.35 -0.12 0.09 0.00 2.80 0.00 0.00 57.97 61.09 3i0w h PHE 276 Cb -0.13 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 37.87 3i0w h PHE 276 CO 0.00 0.76 0.38 0.00 -0.60 0.00 0.00 178.31 178.85 3i0w h ALA 277 N 0.54 1.01 -0.89 2.45 0.00 -0.93 -1.34 119.26 120.11 3i0w h ALA 277 Ca 0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3i0w h ALA 277 Cb 0.72 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3i0w h ALA 277 CO 0.04 -0.02 0.57 0.37 0.00 0.00 0.00 179.25 180.21 3i0w h GLN 278 N 0.64 1.19 -0.46 0.00 -0.00 -0.87 -1.57 115.11 114.04 3i0w h GLN 278 Ca 0.36 -0.08 -0.09 0.00 -0.00 0.00 0.00 58.65 58.84 3i0w h GLN 278 Cb 0.36 -0.26 -0.02 0.00 0.00 0.00 0.00 27.48 27.57 3i0w h GLN 278 CO -0.26 0.80 -0.05 0.37 0.00 0.00 0.00 178.83 179.68 3i0w h GLN 279 N 1.21 0.86 -0.55 1.69 5.75 -0.75 0.14 115.11 123.47 3i0w h GLN 279 Ca 0.32 -0.30 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 3i0w h GLN 279 Cb -0.11 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.35 3i0w h GLN 279 CO -0.07 0.93 0.18 1.88 -2.65 0.00 0.00 178.83 179.10 3i0w h TYR 280 N 0.70 0.88 -0.17 3.99 0.05 -1.21 -1.56 116.97 119.65 3i0w h TYR 280 Ca 0.12 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3i0w h TYR 280 Cb 0.58 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 3i0w h TYR 280 CO 0.04 0.74 0.09 -0.07 -1.05 0.00 0.00 178.16 177.92 3i0w h LEU 281 N 0.76 0.22 0.09 3.88 3.38 -1.02 -2.24 115.31 120.39 3i0w h LEU 281 Ca 0.18 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3i0w h LEU 281 Cb 0.27 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3i0w h LEU 281 CO -0.01 0.27 -0.18 0.15 0.09 0.00 0.00 178.44 178.76 3i0w h PHE 282 N 0.16 -0.48 -0.46 1.13 3.57 -0.57 -1.35 116.94 118.95 3i0w h PHE 282 Ca 0.06 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.60 3i0w h PHE 282 Cb 0.10 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.00 3i0w h PHE 282 CO -0.03 -0.27 0.24 -0.92 -2.23 0.00 0.00 178.31 175.10 3i0w h TYR 283 N -0.35 0.44 -0.24 0.41 3.20 -1.26 -0.63 116.97 118.53 3i0w h TYR 283 Ca 0.03 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 3i0w h TYR 283 Cb 0.37 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 3i0w h TYR 283 CO -0.19 0.23 0.07 -0.92 -1.64 0.00 0.00 178.16 175.71 3i0w h TYR 284 N 0.47 0.40 -0.14 -3.82 3.20 -1.30 -1.86 116.97 113.93 3i0w h TYR 284 Ca 0.20 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 3i0w h TYR 284 Cb 0.09 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 3i0w h TYR 284 CO -0.10 0.46 0.08 0.00 -1.64 0.00 0.00 178.16 176.97 3i0w h ALA 285 N 0.89 0.18 -0.21 1.82 0.00 -0.98 -2.23 119.26 118.74 3i0w h ALA 285 Ca 0.08 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3i0w h ALA 285 Cb 0.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3i0w h ALA 285 CO -0.00 -0.31 -0.16 -0.09 0.00 0.00 0.00 179.25 178.69 3i0w h ARG 286 N 0.15 0.48 -0.17 0.00 2.43 -1.13 -1.47 114.38 114.67 3i0w h ARG 286 Ca 0.05 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 58.91 3i0w h ARG 286 Cb 0.04 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3i0w h ARG 286 CO -0.01 0.80 -0.21 0.93 -1.51 0.00 0.00 179.97 179.97 3i0w h GLU 287 N 0.16 0.29 -0.64 0.20 4.39 -1.37 -2.48 114.58 115.13 3i0w h GLU 287 Ca 0.04 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3i0w h GLU 287 Cb 0.69 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3i0w h GLU 287 CO 0.04 0.49 0.00 0.09 -1.16 0.00 0.00 179.01 178.47 3i0w n ASN 288 N -4.19 3.61 -4.08 1.42 3.02 -0.84 -4.98 115.26 109.23 3i0w n ASN 288 Ca -0.01 -1.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.13 3i0w n ASN 288 Cb 0.34 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 3i0w n ASN 288 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3i0w n ASN 289 N 1.49 -3.15 0.00 6.41 4.05 -0.62 -5.03 115.26 118.42 3i0w n ASN 289 Ca 0.22 -1.20 0.10 0.00 0.45 0.00 0.00 54.58 54.15 3i0w n ASN 289 Cb 0.58 -1.44 0.58 0.00 1.23 0.00 0.00 39.78 40.73 3i0w n ASN 289 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51