#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1biq s TYR 2 N 0.00 3.84 0.01 0.00 5.04 -1.26 -5.04 117.35 119.95 1biq s TYR 2 Ca 0.00 1.48 0.02 0.00 -2.44 0.00 0.00 57.07 56.13 1biq s TYR 2 Cb 0.00 -2.68 -0.01 0.00 0.35 0.00 0.00 41.96 39.62 1biq s TYR 2 CO 0.00 0.50 -0.07 -0.08 -1.34 0.00 0.00 175.55 174.56 1biq s THR 3 N -0.94 0.50 -0.26 4.34 -1.32 -1.26 -5.01 115.64 111.70 1biq s THR 3 Ca 0.34 -0.58 0.28 0.00 -1.21 0.00 0.00 61.69 60.52 1biq s THR 3 Cb -0.21 -0.48 0.34 0.00 -1.51 0.00 0.00 72.50 70.63 1biq s THR 3 CO 0.23 -0.07 1.80 0.71 -2.21 0.00 0.00 174.62 175.08 1biq h THR 4 N 4.80 0.00 -1.74 5.08 1.35 -1.97 -3.39 112.91 117.04 1biq h THR 4 Ca -0.31 -0.61 -0.33 0.00 -0.55 0.00 0.00 66.41 64.60 1biq h THR 4 Cb 1.19 1.57 -0.28 0.00 -1.73 0.00 0.00 68.15 68.91 1biq h THR 4 CO 0.46 0.00 -0.67 0.12 -0.25 0.00 0.00 175.52 175.18 1biq s PHE 5 N -3.40 -0.46 0.02 4.73 2.19 -1.26 -4.87 117.98 114.92 1biq s PHE 5 Ca 0.05 -0.92 -0.32 0.00 0.33 0.00 0.00 56.93 56.07 1biq s PHE 5 Cb 0.08 -0.28 -0.10 0.00 -1.31 0.00 0.00 43.02 41.41 1biq s PHE 5 CO 0.57 -1.03 1.91 -1.13 1.83 0.00 0.00 175.22 177.37 1biq n SER 6 N 3.78 3.89 -0.04 6.13 3.41 -1.26 -4.88 113.62 124.65 1biq n SER 6 Ca 0.16 0.94 0.14 0.00 -0.26 0.00 0.00 58.87 59.85 1biq n SER 6 Cb 0.49 -1.48 0.82 0.00 -0.26 0.00 0.00 64.21 63.78 1biq n SER 6 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1biq n GLN 7 N 6.81 1.06 -2.99 4.33 -0.06 -1.26 -4.75 117.38 120.52 1biq n GLN 7 Ca 0.20 -0.09 -0.40 0.00 -2.00 0.00 0.00 57.00 54.72 1biq n GLN 7 Cb 0.36 -1.45 -0.05 0.00 -4.06 0.00 0.00 30.24 25.04 1biq n GLN 7 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 1biq s THR 8 N -2.00 4.64 -0.71 1.69 2.01 -1.26 -4.99 115.64 115.03 1biq s THR 8 Ca 0.42 1.64 -0.27 0.00 0.31 0.00 0.00 61.69 63.79 1biq s THR 8 Cb 0.20 -4.11 0.03 0.00 0.01 0.00 0.00 72.50 68.62 1biq s THR 8 CO 0.33 0.41 1.25 -0.75 -0.69 0.00 0.00 174.62 175.17 1biq s LYS 9 N -0.36 3.24 0.15 4.92 2.20 -1.26 -5.00 119.74 123.62 1biq s LYS 9 Ca 0.38 -0.18 0.06 0.00 -0.36 0.00 0.00 55.97 55.87 1biq s LYS 9 Cb -0.21 -4.15 -0.04 0.00 -1.51 0.00 0.00 37.83 31.92 1biq s LYS 9 CO 0.24 -2.05 0.01 0.54 -0.36 0.00 0.00 175.35 173.72 1biq s ASN 10 N 3.60 4.88 -0.57 1.43 4.22 -1.26 -5.07 114.94 122.17 1biq s ASN 10 Ca 0.36 -0.32 -0.23 0.00 -2.14 0.00 0.00 52.86 50.53 1biq s ASN 10 Cb -0.08 -1.09 0.05 0.00 1.28 0.00 0.00 41.25 41.41 1biq s ASN 10 CO 0.17 0.11 0.91 -0.62 -2.04 0.00 0.00 177.10 175.63 1biq s ASP 11 N -2.76 6.29 0.60 3.54 -1.08 -1.26 -4.83 116.67 117.16 1biq s ASP 11 Ca 0.27 -0.57 0.37 0.00 -0.52 0.00 0.00 52.55 52.11 1biq s ASP 11 Cb -0.10 -2.41 1.83 0.00 -1.46 0.00 0.00 42.92 40.78 1biq s ASP 11 CO 0.19 -1.24 2.16 1.56 0.52 0.00 0.00 175.17 178.36 1biq h GLN 12 N 9.33 0.00 0.00 4.34 4.20 -1.97 0.68 115.11 131.70 1biq h GLN 12 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1biq h GLN 12 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 1biq h GLN 12 CO 1.09 0.02 0.00 -0.07 -0.67 0.00 0.00 178.83 179.20 1biq h LEU 13 N 0.00 0.00 -2.90 1.46 3.38 -1.96 -3.04 115.31 112.25 1biq h LEU 13 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1biq h LEU 13 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1biq h LEU 13 CO 0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 1biq n LYS 14 N -2.62 2.90 -2.49 1.13 4.76 0.23 -4.78 118.16 117.30 1biq n LYS 14 Ca 0.01 -2.30 -0.29 0.00 -2.87 0.00 0.00 58.31 52.87 1biq n LYS 14 Cb 0.25 -1.42 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1biq n LYS 14 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1biq s GLU 15 N -1.19 3.61 0.99 1.97 0.41 -1.15 -5.05 118.70 118.30 1biq s GLU 15 Ca 0.32 0.40 -0.13 0.00 -0.41 0.00 0.00 54.97 55.15 1biq s GLU 15 Cb 0.18 -2.30 0.18 0.00 -1.78 0.00 0.00 34.13 30.41 1biq s GLU 15 CO 0.20 -0.26 1.12 -1.25 -0.49 0.00 0.00 175.26 174.58 1biq s PRO 16 N -4.66 0.48 0.20 0.39 0.04 -1.26 -4.91 135.00 125.28 1biq s PRO 16 Ca 0.50 0.30 -0.08 0.00 0.04 0.00 0.00 61.00 61.76 1biq s PRO 16 Cb -0.10 -1.76 0.13 0.00 0.04 0.00 0.00 34.50 32.81 1biq s PRO 16 CO 0.44 -2.65 1.75 0.52 0.04 0.00 0.00 177.00 177.10 1biq h MET 17 N -1.83 1.14 -5.11 4.56 2.86 -1.95 -3.38 114.93 111.22 1biq h MET 17 Ca -0.52 -0.24 -0.35 0.00 -2.06 0.00 0.00 59.70 56.53 1biq h MET 17 Cb 1.33 -0.17 -0.14 0.00 0.06 0.00 0.00 31.60 32.67 1biq h MET 17 CO 0.56 0.96 -0.69 -0.06 1.06 0.00 0.00 176.91 178.74 1biq s PHE 18 N -5.45 1.40 0.00 -0.22 0.40 -1.26 -1.18 117.98 111.67 1biq s PHE 18 Ca -0.12 -0.81 0.00 0.00 -0.60 0.00 0.00 56.93 55.40 1biq s PHE 18 Cb 0.15 -0.75 0.00 0.00 0.51 0.00 0.00 43.02 42.93 1biq s PHE 18 CO 0.84 0.06 0.00 1.19 0.70 0.00 0.00 175.22 178.01 1biq n PHE 19 N -0.29 0.00 -0.26 0.36 3.72 0.13 -4.83 117.46 116.29 1biq n PHE 19 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1biq n PHE 19 Cb 0.62 -1.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.07 1biq n PHE 19 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1biq n GLY 20 N -1.59 -0.06 3.74 1.37 0.00 -1.26 -4.98 105.19 102.40 1biq n GLY 20 Ca 0.00 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 1biq n GLY 20 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1biq s GLN 21 N 0.46 4.54 0.47 1.61 0.74 -1.26 -4.82 119.66 121.40 1biq s GLN 21 Ca 0.00 1.85 -0.23 0.00 0.05 0.00 0.00 55.36 57.03 1biq s GLN 21 Cb 0.00 -3.23 -0.09 0.00 1.10 0.00 0.00 33.01 30.80 1biq s GLN 21 CO 0.00 0.01 1.09 -2.30 -0.55 0.00 0.00 175.29 173.53 1biq n PRO 22 N 2.08 1.41 -1.95 1.67 -0.02 -1.26 -4.50 135.00 132.43 1biq n PRO 22 Ca 0.02 0.51 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 1biq n PRO 22 Cb 0.45 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1biq n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1biq s VAL 23 N -1.32 2.52 0.00 -1.45 1.01 -1.25 -4.63 120.40 115.28 1biq s VAL 23 Ca 0.66 0.43 0.00 0.00 0.00 0.00 0.00 61.98 63.07 1biq s VAL 23 Cb -0.50 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1biq s VAL 23 CO 0.54 0.07 0.00 -0.46 0.00 0.00 0.00 175.10 175.25 1biq n ASN 24 N 2.43 0.00 -4.69 3.32 0.23 -1.26 -4.48 115.26 110.81 1biq n ASN 24 Ca 0.08 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.70 1biq n ASN 24 Cb 0.39 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.07 1biq n ASN 24 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1biq s VAL 25 N 0.00 4.11 -0.62 3.53 1.01 -1.26 -4.93 120.40 122.24 1biq s VAL 25 Ca 0.00 1.45 -0.20 0.00 0.00 0.00 0.00 61.98 63.23 1biq s VAL 25 Cb 0.00 -3.93 0.10 0.00 0.00 0.00 0.00 36.38 32.55 1biq s VAL 25 CO 0.00 -0.01 0.79 0.00 0.00 0.00 0.00 175.10 175.88 1biq s ALA 26 N 2.35 3.34 0.13 5.51 0.00 -1.26 -4.84 121.76 126.99 1biq s ALA 26 Ca 0.58 -2.16 0.10 0.00 0.00 0.00 0.00 51.96 50.48 1biq s ALA 26 Cb -0.26 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1biq s ALA 26 CO 0.23 -2.48 -0.24 -0.98 0.00 0.00 0.00 175.76 172.29 1biq s ARG 27 N 3.02 1.30 -0.09 0.00 1.70 -1.26 -5.06 118.95 118.56 1biq s ARG 27 Ca 0.15 -1.31 0.14 0.00 -0.47 0.00 0.00 55.73 54.24 1biq s ARG 27 Cb -0.22 -1.65 0.29 0.00 -0.57 0.00 0.00 34.95 32.81 1biq s ARG 27 CO 0.07 0.38 1.14 0.66 -1.08 0.00 0.00 175.30 176.46 1biq n TYR 28 N 0.83 0.00 0.10 5.89 4.01 -1.26 -4.67 117.16 122.05 1biq n TYR 28 Ca -0.17 -0.77 0.04 0.00 -0.16 0.00 0.00 57.90 56.84 1biq n TYR 28 Cb 0.54 -0.15 -0.01 0.00 -0.31 0.00 0.00 39.34 39.41 1biq n TYR 28 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1biq h ASP 29 N 0.53 0.00 -5.24 7.72 2.03 -2.03 -3.46 116.42 115.96 1biq h ASP 29 Ca -0.06 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.12 1biq h ASP 29 Cb 1.33 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.68 1biq h ASP 29 CO 0.03 0.38 -0.66 0.00 -1.03 0.00 0.00 179.24 177.95 1biq s GLN 30 N -3.05 0.64 -0.01 4.15 -2.07 -1.26 -5.18 119.66 112.87 1biq s GLN 30 Ca 0.01 -1.22 -0.10 0.00 -1.82 0.00 0.00 55.36 52.23 1biq s GLN 30 Cb 0.08 0.22 0.01 0.00 -1.09 0.00 0.00 33.01 32.23 1biq s GLN 30 CO 0.77 -0.12 0.20 1.14 -1.32 0.00 0.00 175.29 175.96 1biq s GLN 31 N -3.92 0.53 0.01 9.60 0.00 -1.26 -4.91 119.66 119.71 1biq s GLN 31 Ca 0.08 -0.27 -0.18 0.00 -0.00 0.00 0.00 55.36 54.98 1biq s GLN 31 Cb 0.08 0.23 -0.29 0.00 0.00 0.00 0.00 33.01 33.02 1biq s GLN 31 CO -0.10 -0.13 1.03 -0.22 0.00 0.00 0.00 175.29 175.88 1biq h LYS 32 N 4.26 0.48 -4.00 9.60 3.64 -1.88 -3.42 116.57 125.26 1biq h LYS 32 Ca -0.30 -0.67 -0.60 0.00 -1.27 0.00 0.00 60.65 57.81 1biq h LYS 32 Cb 1.19 0.23 -0.39 0.00 -0.41 0.00 0.00 32.23 32.84 1biq h LYS 32 CO 0.40 1.29 -0.76 0.71 -2.27 0.00 0.00 179.45 178.82 1biq s TYR 33 N -2.85 2.24 -0.83 1.91 2.02 -1.26 -4.99 117.35 113.59 1biq s TYR 33 Ca -0.11 -1.90 0.15 0.00 -0.37 0.00 0.00 57.07 54.83 1biq s TYR 33 Cb 0.04 -1.85 0.64 0.00 -0.40 0.00 0.00 41.96 40.39 1biq s TYR 33 CO 0.88 -0.84 1.46 -0.40 -1.57 0.00 0.00 175.55 175.09 1biq n ASP 34 N 4.70 0.19 -0.28 2.29 5.75 -1.26 -2.38 116.55 125.56 1biq n ASP 34 Ca -0.04 0.56 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 1biq n ASP 34 Cb 0.43 -0.59 0.20 0.00 -1.03 0.00 0.00 41.12 40.13 1biq n ASP 34 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 1biq h ILE 35 N 0.00 1.20 -0.41 2.12 6.09 -1.99 -0.65 117.51 123.87 1biq h ILE 35 Ca 0.00 -0.39 -0.07 0.00 -1.37 0.00 0.00 64.86 63.03 1biq h ILE 35 Cb 0.22 -0.03 -0.02 0.00 0.47 0.00 0.00 36.82 37.46 1biq h ILE 35 CO 0.00 0.21 -0.05 -0.26 -3.07 0.00 0.00 178.15 174.98 1biq h PHE 36 N 1.13 0.72 -0.49 2.19 0.04 -1.83 -0.95 116.94 117.76 1biq h PHE 36 Ca 0.32 -0.10 -0.07 0.00 2.80 0.00 0.00 57.97 60.92 1biq h PHE 36 Cb -0.10 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 37.84 1biq h PHE 36 CO -0.00 0.71 0.03 1.49 -0.60 0.00 0.00 178.31 179.94 1biq h GLU 37 N 0.63 0.84 -0.69 1.51 4.57 -1.55 -0.92 114.58 118.96 1biq h GLU 37 Ca 0.12 -0.25 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1biq h GLU 37 Cb 0.46 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.94 1biq h GLU 37 CO 0.02 0.86 0.25 0.87 -1.18 0.00 0.00 179.01 179.84 1biq h LYS 38 N 0.70 1.04 -0.40 1.92 1.79 -0.83 0.71 116.57 121.51 1biq h LYS 38 Ca 0.14 -0.19 -0.12 0.00 -2.18 0.00 0.00 60.65 58.30 1biq h LYS 38 Cb 0.46 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1biq h LYS 38 CO 0.02 0.87 -0.22 -0.07 -1.08 0.00 0.00 179.45 178.96 1biq h LEU 39 N 1.01 0.80 0.03 2.94 3.38 -0.76 -1.14 115.31 121.58 1biq h LEU 39 Ca 0.23 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1biq h LEU 39 Cb 0.23 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1biq h LEU 39 CO -0.02 1.00 -0.02 0.40 0.09 0.00 0.00 178.44 179.90 1biq h ILE 40 N 0.69 0.99 -0.66 1.22 2.04 -0.43 0.03 117.51 121.39 1biq h ILE 40 Ca 0.09 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.92 1biq h ILE 40 Cb 0.74 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 1biq h ILE 40 CO 0.06 0.02 0.37 -0.33 0.00 0.00 0.00 178.15 178.27 1biq h GLU 41 N -0.08 0.67 -0.51 2.37 5.08 -0.68 -1.64 114.58 119.79 1biq h GLU 41 Ca -0.00 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 1biq h GLU 41 Cb 0.07 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1biq h GLU 41 CO 0.01 0.45 0.13 -0.22 -1.00 0.00 0.00 179.01 178.38 1biq h LYS 42 N 0.69 0.81 -0.17 2.33 3.64 -1.00 -0.63 116.57 122.23 1biq h LYS 42 Ca 0.29 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1biq h LYS 42 Cb 0.16 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1biq h LYS 42 CO -0.17 0.77 0.11 0.37 -2.27 0.00 0.00 179.45 178.26 1biq h GLN 43 N 0.70 0.23 -0.92 1.90 5.75 -0.71 -1.04 115.11 121.01 1biq h GLN 43 Ca 0.16 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.68 1biq h GLN 43 Cb 0.32 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.76 1biq h GLN 43 CO -0.00 0.18 0.60 -0.07 -2.65 0.00 0.00 178.83 176.89 1biq h LEU 44 N 0.22 1.01 -2.15 -2.39 3.38 -1.23 -0.27 115.31 113.87 1biq h LEU 44 Ca 0.06 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1biq h LEU 44 Cb 0.00 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1biq h LEU 44 CO -0.01 0.69 -0.07 0.77 0.09 0.00 0.00 178.44 179.92 1biq h SER 45 N 1.17 0.00 -0.13 -0.43 4.64 -0.59 -1.68 113.55 116.53 1biq h SER 45 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1biq h SER 45 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1biq h SER 45 CO -0.12 0.07 0.00 0.49 -0.87 0.00 0.00 176.83 176.40 1biq n PHE 46 N -3.52 0.16 -1.64 4.77 3.72 -0.14 -4.99 117.46 115.82 1biq n PHE 46 Ca -0.02 -0.08 -0.62 0.00 -0.05 0.00 0.00 57.45 56.68 1biq n PHE 46 Cb 0.19 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.64 1biq n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1biq n PHE 47 N 0.72 1.38 -4.03 1.38 -0.00 -0.63 -4.97 117.46 111.30 1biq n PHE 47 Ca 0.17 1.00 -0.08 0.00 -0.00 0.00 0.00 57.45 58.54 1biq n PHE 47 Cb 0.45 -2.22 -0.10 0.00 -0.00 0.00 0.00 39.48 37.61 1biq n PHE 47 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.76 178.43 1biq s TRP 48 N 1.79 0.42 -0.25 -5.13 1.48 -1.26 -5.12 118.94 110.86 1biq s TRP 48 Ca 0.97 -0.90 0.03 0.00 -1.06 0.00 0.00 56.10 55.14 1biq s TRP 48 Cb -1.32 -0.31 0.06 0.00 -1.16 0.00 0.00 33.47 30.74 1biq s TRP 48 CO 0.68 -0.38 -0.11 1.03 -4.06 0.00 0.00 176.95 174.11 1biq s ARG 49 N -3.54 2.25 0.17 3.25 1.81 -1.26 -5.04 118.95 116.59 1biq s ARG 49 Ca 0.03 -1.30 -0.21 0.00 -1.72 0.00 0.00 55.73 52.54 1biq s ARG 49 Cb 0.05 -2.86 0.09 0.00 -0.45 0.00 0.00 34.95 31.78 1biq s ARG 49 CO -0.09 -0.55 1.62 -1.35 -0.68 0.00 0.00 175.30 174.25 1biq h PRO 50 N 7.79 -0.18 0.00 3.54 0.11 -1.95 -1.52 132.00 139.80 1biq h PRO 50 Ca -0.21 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1biq h PRO 50 Cb 1.05 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1biq h PRO 50 CO 0.47 -0.12 0.28 0.93 -0.21 0.00 0.00 178.00 179.35 1biq h GLU 51 N -0.18 0.00 0.00 1.05 3.07 -1.95 0.62 114.58 117.19 1biq h GLU 51 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1biq h GLU 51 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1biq h GLU 51 CO -0.50 0.00 0.00 0.93 -1.40 0.00 0.00 179.01 178.04 1biq h GLU 52 N 0.00 0.00 -6.57 2.33 5.08 -1.71 -3.45 114.58 110.26 1biq h GLU 52 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1biq h GLU 52 Cb 0.56 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.82 1biq h GLU 52 CO 0.00 0.00 0.53 0.08 -1.00 0.00 0.00 179.01 178.62 1biq s VAL 53 N -3.17 3.91 -0.44 3.13 1.01 0.22 -4.98 120.40 120.08 1biq s VAL 53 Ca 0.09 1.49 -0.28 0.00 0.00 0.00 0.00 61.98 63.27 1biq s VAL 53 Cb 0.10 -3.95 0.03 0.00 0.00 0.00 0.00 36.38 32.55 1biq s VAL 53 CO 0.61 0.18 1.09 -0.62 0.00 0.00 0.00 175.10 176.36 1biq s ASP 54 N 0.54 6.68 -0.04 3.32 2.15 -1.26 -4.83 116.67 123.23 1biq s ASP 54 Ca 0.55 0.55 0.09 0.00 0.43 0.00 0.00 52.55 54.17 1biq s ASP 54 Cb -0.30 -2.53 0.26 0.00 -0.30 0.00 0.00 42.92 40.04 1biq s ASP 54 CO 0.32 -1.14 1.20 1.33 -0.17 0.00 0.00 175.17 176.71 1biq n VAL 55 N 6.57 1.31 0.02 1.11 0.24 -1.26 -4.37 118.33 121.95 1biq n VAL 55 Ca 0.11 -1.28 -0.13 0.00 -2.04 0.00 0.00 64.34 61.00 1biq n VAL 55 Cb 0.49 0.30 -0.07 0.00 -1.47 0.00 0.00 33.84 33.08 1biq n VAL 55 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1biq h SER 56 N 1.21 -1.41 -0.84 -1.34 4.64 -1.93 -2.78 113.55 111.09 1biq h SER 56 Ca 0.00 0.18 0.05 0.00 -0.47 0.00 0.00 61.79 61.54 1biq h SER 56 Cb 0.81 0.56 -0.05 0.00 -0.31 0.00 0.00 62.40 63.42 1biq h SER 56 CO 0.04 -0.45 0.55 -0.09 -0.87 0.00 0.00 176.83 176.01 1biq h ARG 57 N -0.54 0.97 -1.18 4.77 2.43 -1.97 -3.08 114.38 115.78 1biq h ARG 57 Ca 0.06 -0.06 0.34 0.00 -0.81 0.00 0.00 59.98 59.51 1biq h ARG 57 Cb 0.65 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 1biq h ARG 57 CO -0.39 0.64 1.10 -0.44 -1.51 0.00 0.00 179.97 179.38 1biq h ASP 58 N 1.00 0.00 -0.03 -3.80 5.19 -1.84 0.65 116.42 117.59 1biq h ASP 58 Ca 0.35 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 56.54 1biq h ASP 58 Cb 0.11 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.62 1biq h ASP 58 CO -0.11 0.00 -0.79 -0.09 -3.12 0.00 0.00 179.24 175.13 1biq h ARG 59 N 0.00 0.69 -0.02 3.56 2.43 -1.67 0.93 114.38 120.29 1biq h ARG 59 Ca 0.56 -0.58 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1biq h ARG 59 Cb 2.75 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 32.42 1biq h ARG 59 CO -0.01 1.19 -0.03 0.82 -1.51 0.00 0.00 179.97 180.44 1biq h ILE 60 N 0.46 1.40 -0.42 1.20 1.08 0.07 -1.87 117.51 119.43 1biq h ILE 60 Ca -0.05 -1.22 0.09 0.00 -0.39 0.00 0.00 64.86 63.29 1biq h ILE 60 Cb 1.41 2.17 -0.09 0.00 -3.07 0.00 0.00 36.82 37.24 1biq h ILE 60 CO 0.16 0.32 -0.20 0.44 -0.69 0.00 0.00 178.15 178.18 1biq h ASP 61 N -0.43 -0.69 -0.63 1.72 5.19 -1.43 0.10 116.42 120.25 1biq h ASP 61 Ca 0.00 0.16 0.02 0.00 -0.62 0.00 0.00 57.03 56.60 1biq h ASP 61 Cb 0.54 0.38 -0.04 0.00 0.18 0.00 0.00 39.33 40.39 1biq h ASP 61 CO 0.01 -0.23 0.40 0.22 -3.12 0.00 0.00 179.24 176.51 1biq h TYR 62 N -0.12 0.75 -0.44 4.55 3.20 -0.75 -1.83 116.97 122.33 1biq h TYR 62 Ca 0.20 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 1biq h TYR 62 Cb 0.44 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1biq h TYR 62 CO -0.45 0.44 0.09 -0.56 -1.64 0.00 0.00 178.16 176.04 1biq h GLN 63 N 0.79 0.66 0.00 1.82 3.07 -0.41 -2.19 115.11 118.84 1biq h GLN 63 Ca 0.25 -0.12 -0.03 0.00 0.09 0.00 0.00 58.65 58.83 1biq h GLN 63 Cb -0.01 -0.10 -0.00 0.00 0.08 0.00 0.00 27.48 27.44 1biq h GLN 63 CO -0.09 0.61 -0.15 0.00 0.09 0.00 0.00 178.83 179.28 1biq h ALA 64 N 1.47 1.06 -2.99 0.06 0.00 -0.04 -3.46 119.26 115.36 1biq h ALA 64 Ca 0.14 -0.14 -0.55 0.00 0.00 0.00 0.00 54.91 54.37 1biq h ALA 64 Cb 0.26 -0.02 0.13 0.00 0.00 0.00 0.00 17.79 18.16 1biq h ALA 64 CO -0.00 0.19 0.55 -0.51 0.00 0.00 0.00 179.25 179.48 1biq s LEU 65 N -6.71 3.75 0.22 0.00 1.43 -0.83 -4.97 118.68 111.57 1biq s LEU 65 Ca 0.00 2.63 -0.30 0.00 -1.03 0.00 0.00 54.13 55.43 1biq s LEU 65 Cb 0.10 -4.42 -0.08 0.00 0.03 0.00 0.00 46.19 41.82 1biq s LEU 65 CO 0.60 -1.65 1.13 -2.84 0.23 0.00 0.00 176.35 173.82 1biq s PRO 66 N -3.09 4.58 0.46 1.29 0.02 -1.26 -4.75 135.00 132.24 1biq s PRO 66 Ca 0.75 1.80 0.36 0.00 0.02 0.00 0.00 61.00 63.93 1biq s PRO 66 Cb -0.37 -3.23 1.51 0.00 0.02 0.00 0.00 34.50 32.43 1biq s PRO 66 CO 0.42 0.08 1.52 0.39 -0.33 0.00 0.00 177.00 179.08 1biq n GLU 67 N 1.94 -0.03 0.12 5.54 -0.58 -1.26 0.17 120.64 126.55 1biq n GLU 67 Ca 0.02 1.18 -0.01 0.00 -0.42 0.00 0.00 57.16 57.93 1biq n GLU 67 Cb 0.45 -2.42 0.08 0.00 -0.57 0.00 0.00 31.44 28.98 1biq n GLU 67 CO 0.00 0.00 0.00 1.12 -0.48 0.00 0.00 177.13 177.77 1biq h HIS 68 N 0.00 0.00 0.00 -0.32 2.07 -1.89 0.13 115.15 115.14 1biq h HIS 68 Ca 0.87 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 58.21 1biq h HIS 68 Cb 2.99 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 32.95 1biq h HIS 68 CO -0.00 0.68 -0.87 0.93 -3.07 0.00 0.00 177.93 175.59 1biq h GLU 69 N 0.00 0.01 0.32 5.12 5.08 0.14 -1.21 114.58 124.04 1biq h GLU 69 Ca -0.01 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1biq h GLU 69 Cb 1.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1biq h GLU 69 CO 0.09 0.87 -0.15 0.87 -1.00 0.00 0.00 179.01 179.68 1biq h LYS 70 N 0.00 -0.41 -0.97 2.33 1.57 -0.59 0.75 116.57 119.26 1biq h LYS 70 Ca -0.01 0.03 0.22 0.00 -1.87 0.00 0.00 60.65 59.02 1biq h LYS 70 Cb 1.53 0.09 -0.12 0.00 0.08 0.00 0.00 32.23 33.81 1biq h LYS 70 CO 0.11 -0.12 0.54 1.25 -0.57 0.00 0.00 179.45 180.67 1biq h HIS 71 N -0.71 0.93 -0.09 -1.35 2.76 -0.64 0.15 115.15 116.21 1biq h HIS 71 Ca -0.04 0.04 -0.05 0.00 -2.20 0.00 0.00 60.37 58.11 1biq h HIS 71 Cb 0.49 -0.26 -0.00 0.00 1.55 0.00 0.00 27.41 29.18 1biq h HIS 71 CO 0.01 0.08 -0.13 0.82 -1.30 0.00 0.00 177.93 177.41 1biq h ILE 72 N 0.58 1.39 0.06 6.26 2.04 -0.96 -2.22 117.51 124.67 1biq h ILE 72 Ca 0.60 -1.38 0.02 0.00 1.00 0.00 0.00 64.86 65.10 1biq h ILE 72 Cb 1.09 2.09 -0.03 0.00 -0.74 0.00 0.00 36.82 39.23 1biq h ILE 72 CO -0.46 0.39 -0.20 0.15 0.00 0.00 0.00 178.15 178.02 1biq h PHE 73 N -0.20 -0.54 -0.41 1.37 3.57 0.17 -2.28 116.94 118.62 1biq h PHE 73 Ca 0.01 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 1biq h PHE 73 Cb 0.69 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 1biq h PHE 73 CO 0.10 -0.29 -0.01 0.97 -2.23 0.00 0.00 178.31 176.85 1biq h ILE 74 N -0.36 1.26 -0.71 1.41 6.09 -1.11 -1.60 117.51 122.50 1biq h ILE 74 Ca 0.04 -1.04 0.05 0.00 -1.37 0.00 0.00 64.86 62.53 1biq h ILE 74 Cb 0.41 1.12 -0.05 0.00 0.47 0.00 0.00 36.82 38.76 1biq h ILE 74 CO -0.15 0.35 0.42 0.28 -3.07 0.00 0.00 178.15 175.99 1biq h SER 75 N 0.57 0.67 0.27 2.19 0.02 -1.34 0.10 113.55 116.03 1biq h SER 75 Ca 0.12 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1biq h SER 75 Cb 0.50 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1biq h SER 75 CO 0.02 0.44 -0.20 -1.13 -1.14 0.00 0.00 176.83 174.83 1biq h ASN 76 N 0.80 -0.52 -0.69 3.07 -1.24 -1.17 -2.46 115.58 113.37 1biq h ASN 76 Ca 0.30 0.04 0.11 0.00 0.71 0.00 0.00 56.30 57.46 1biq h ASN 76 Cb 0.11 0.16 -0.08 0.00 0.73 0.00 0.00 38.32 39.25 1biq h ASN 76 CO -0.15 -0.31 0.29 0.25 -1.29 0.00 0.00 177.43 176.22 1biq h LEU 77 N -0.48 0.32 -0.92 0.34 5.85 -0.51 -0.64 115.31 119.28 1biq h LEU 77 Ca -0.02 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1biq h LEU 77 Cb 0.41 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.42 1biq h LEU 77 CO -0.00 0.17 0.58 0.11 -0.34 0.00 0.00 178.44 178.95 1biq h LYS 78 N 0.48 1.00 -0.14 1.25 1.57 -0.61 0.51 116.57 120.63 1biq h LYS 78 Ca 0.36 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.91 1biq h LYS 78 Cb 0.46 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1biq h LYS 78 CO -0.33 0.66 -0.60 -0.92 -0.57 0.00 0.00 179.45 177.70 1biq h TYR 79 N 1.03 0.62 -0.16 -1.35 3.20 -0.69 -2.02 116.97 117.60 1biq h TYR 79 Ca 0.41 -0.23 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 1biq h TYR 79 Cb 0.21 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1biq h TYR 79 CO -0.02 0.96 0.09 1.96 -1.64 0.00 0.00 178.16 179.51 1biq h GLN 80 N 0.36 0.22 -0.63 1.82 4.20 -0.13 0.81 115.11 121.76 1biq h GLN 80 Ca -0.00 -0.02 0.09 0.00 0.06 0.00 0.00 58.65 58.77 1biq h GLN 80 Cb 1.15 -0.04 -0.07 0.00 0.30 0.00 0.00 27.48 28.81 1biq h GLN 80 CO 0.11 0.21 0.27 1.15 -0.67 0.00 0.00 178.83 179.90 1biq h THR 81 N 0.17 0.81 0.06 -0.54 2.02 0.10 -1.55 112.91 113.98 1biq h THR 81 Ca 0.06 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.07 1biq h THR 81 Cb 0.06 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1biq h THR 81 CO -0.01 0.09 -0.03 0.25 0.37 0.00 0.00 175.52 176.19 1biq h LEU 82 N 0.48 -0.07 -0.85 2.58 5.85 -0.64 0.37 115.31 123.02 1biq h LEU 82 Ca 0.31 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1biq h LEU 82 Cb 0.36 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1biq h LEU 82 CO -0.28 -0.03 0.54 -0.07 -0.34 0.00 0.00 178.44 178.26 1biq h LEU 83 N -0.11 1.00 -0.77 2.25 3.38 -0.26 -1.98 115.31 118.83 1biq h LEU 83 Ca -0.01 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1biq h LEU 83 Cb 0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1biq h LEU 83 CO 0.01 0.75 -0.41 0.44 0.09 0.00 0.00 178.44 179.32 1biq h ASP 84 N 1.16 0.00 -0.60 -0.43 3.32 -1.16 -0.95 116.42 117.77 1biq h ASP 84 Ca 0.31 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.34 1biq h ASP 84 Cb -0.09 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 1biq h ASP 84 CO -0.06 0.41 0.30 0.28 -1.72 0.00 0.00 179.24 178.45 1biq h SER 85 N 0.00 0.77 0.76 6.45 0.02 -0.20 0.08 113.55 121.43 1biq h SER 85 Ca -0.00 -0.12 -0.20 0.00 -0.84 0.00 0.00 61.79 60.63 1biq h SER 85 Cb 1.00 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.32 1biq h SER 85 CO 0.05 0.67 -0.92 0.40 -1.14 0.00 0.00 176.83 175.89 1biq h ILE 86 N 0.82 1.58 0.00 3.27 2.04 -1.23 -3.19 117.51 120.79 1biq h ILE 86 Ca 0.21 -2.90 -0.05 0.00 1.00 0.00 0.00 64.86 63.11 1biq h ILE 86 Cb 0.09 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.77 1biq h ILE 86 CO -0.03 0.84 -0.26 1.56 0.00 0.00 0.00 178.15 180.26 1biq h GLN 87 N 0.05 0.00 -0.02 2.37 1.08 -0.85 -1.17 115.11 116.56 1biq h GLN 87 Ca -0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1biq h GLN 87 Cb 1.59 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 29.02 1biq h GLN 87 CO 0.13 0.26 0.01 0.78 -0.95 0.00 0.00 178.83 179.06 1biq h GLY 88 N 2.84 0.04 0.72 3.46 0.00 -0.97 -3.36 103.07 105.80 1biq h GLY 88 Ca -0.00 -0.02 -0.34 0.00 0.00 0.00 0.00 47.33 46.97 1biq h GLY 88 CO 0.03 0.02 -1.91 -0.96 0.00 0.00 0.00 176.54 173.72 1biq n ARG 89 N -4.97 0.71 -0.03 4.80 1.85 -1.21 -4.69 116.66 113.12 1biq n ARG 89 Ca -0.07 0.27 -0.10 0.00 -1.00 0.00 0.00 57.85 56.95 1biq n ARG 89 Cb 0.12 -1.73 -0.03 0.00 -1.05 0.00 0.00 32.46 29.76 1biq n ARG 89 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 1biq h SER 90 N 0.04 -1.01 -0.51 2.89 0.02 -1.35 -1.70 113.55 111.95 1biq h SER 90 Ca -0.38 0.15 0.09 0.00 -0.84 0.00 0.00 61.79 60.81 1biq h SER 90 Cb 2.03 0.44 -0.03 0.00 0.14 0.00 0.00 62.40 64.98 1biq h SER 90 CO 0.08 -0.35 0.35 -0.65 -1.14 0.00 0.00 176.83 175.12 1biq h PRO 91 N -0.36 0.30 0.01 3.45 0.11 -1.81 0.35 132.00 134.06 1biq h PRO 91 Ca 0.11 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 1biq h PRO 91 Cb 0.54 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1biq h PRO 91 CO -0.39 0.20 -0.01 -0.91 -0.21 0.00 0.00 178.00 176.68 1biq h ASN 92 N 0.31 -0.01 0.10 -2.05 2.35 -1.69 -1.06 115.58 113.53 1biq h ASN 92 Ca 0.23 -0.70 -0.11 0.00 -0.55 0.00 0.00 56.30 55.17 1biq h ASN 92 Cb 0.51 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1biq h ASN 92 CO -0.05 0.71 -0.39 0.58 -1.65 0.00 0.00 177.43 176.62 1biq h VAL 93 N -0.75 1.30 0.09 2.81 2.07 -1.04 -2.95 116.25 117.78 1biq h VAL 93 Ca -0.00 -1.51 -0.36 0.00 0.82 0.00 0.00 66.70 65.64 1biq h VAL 93 Cb 0.71 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 1biq h VAL 93 CO 0.00 0.46 -2.04 0.00 0.02 0.00 0.00 177.57 176.01 1biq n ALA 94 N -2.48 0.98 -0.01 1.67 0.00 0.12 -4.69 120.51 116.10 1biq n ALA 94 Ca -0.01 -0.68 -0.22 0.00 0.00 0.00 0.00 53.44 52.53 1biq n ALA 94 Cb 0.48 -0.56 -0.14 0.00 0.00 0.00 0.00 19.45 19.24 1biq n ALA 94 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1biq h LEU 95 N -0.03 0.35 -0.80 0.00 3.38 -1.31 -3.41 115.31 113.49 1biq h LEU 95 Ca -0.45 -0.83 0.19 0.00 0.09 0.00 0.00 57.88 56.88 1biq h LEU 95 Cb 1.96 -0.11 -0.14 0.00 0.09 0.00 0.00 40.66 42.45 1biq h LEU 95 CO 0.03 1.68 0.04 -0.07 0.09 0.00 0.00 178.44 180.21 1biq h LEU 96 N -0.28 -0.32 0.00 1.67 3.38 -1.40 -0.25 115.31 118.12 1biq h LEU 96 Ca -0.35 0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1biq h LEU 96 Cb 1.79 0.35 0.00 0.00 0.09 0.00 0.00 40.66 42.89 1biq h LEU 96 CO 0.03 -0.19 0.00 -2.65 0.09 0.00 0.00 178.44 175.72 1biq n PRO 97 N -5.35 0.15 0.00 1.13 -0.02 -1.26 -2.72 135.00 126.94 1biq n PRO 97 Ca 0.16 0.19 0.02 0.00 -2.02 0.00 0.00 63.50 61.84 1biq n PRO 97 Cb 0.53 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.50 1biq n PRO 97 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1biq n LEU 98 N -1.29 0.40 -4.75 2.45 4.77 -0.12 -4.99 117.00 113.48 1biq n LEU 98 Ca 0.05 -0.60 -0.41 0.00 -0.03 0.00 0.00 56.01 55.03 1biq n LEU 98 Cb 0.09 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 1biq n LEU 98 CO 0.08 0.09 0.73 -0.63 -1.33 0.00 0.00 177.39 176.33 1biq s ILE 99 N -1.15 3.94 -0.03 -0.08 1.01 -1.10 0.18 121.20 123.96 1biq s ILE 99 Ca 0.02 1.81 0.04 0.00 0.00 0.00 0.00 60.65 62.52 1biq s ILE 99 Cb 0.03 -4.15 0.06 0.00 0.01 0.00 0.00 42.46 38.41 1biq s ILE 99 CO 0.13 0.37 0.94 -1.54 0.00 0.00 0.00 174.94 174.84 1biq n SER 100 N 1.88 1.55 -4.03 3.58 3.41 -0.33 -3.91 113.62 115.78 1biq n SER 100 Ca 0.00 -2.05 -0.20 0.00 -0.26 0.00 0.00 58.87 56.36 1biq n SER 100 Cb 0.47 -0.11 -0.15 0.00 -0.26 0.00 0.00 64.21 64.16 1biq n SER 100 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1biq s ILE 101 N -1.14 0.83 0.23 -1.33 -4.36 -1.26 -4.63 121.20 109.55 1biq s ILE 101 Ca 0.07 -0.41 -0.08 0.00 -0.26 0.00 0.00 60.65 59.97 1biq s ILE 101 Cb 0.06 -0.72 0.21 0.00 1.25 0.00 0.00 42.46 43.25 1biq s ILE 101 CO 0.01 0.25 1.88 1.55 0.24 0.00 0.00 174.94 178.86 1biq h PRO 102 N 6.19 1.20 -0.89 0.37 0.13 -1.89 -2.62 132.00 134.48 1biq h PRO 102 Ca -0.33 -0.11 0.01 0.00 -0.87 0.00 0.00 66.00 64.71 1biq h PRO 102 Cb 1.17 -0.25 -0.04 0.00 0.13 0.00 0.00 31.00 32.00 1biq h PRO 102 CO 0.49 0.84 0.59 1.05 -0.23 0.00 0.00 178.00 180.74 1biq h GLU 103 N 1.22 1.16 0.01 0.86 9.09 -1.91 -0.15 114.58 124.87 1biq h GLU 103 Ca 0.32 -0.07 -0.21 0.00 0.05 0.00 0.00 59.36 59.45 1biq h GLU 103 Cb -0.06 -0.26 -0.01 0.00 -1.65 0.00 0.00 28.75 26.78 1biq h GLU 103 CO -0.06 0.77 -0.92 1.25 0.05 0.00 0.00 179.01 180.10 1biq h LEU 104 N 1.20 0.36 0.15 3.06 5.85 -1.91 -0.02 115.31 124.01 1biq h LEU 104 Ca 0.33 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1biq h LEU 104 Cb -0.13 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.80 1biq h LEU 104 CO -0.07 1.10 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.97 1biq h GLU 105 N 0.15 -0.20 -0.17 1.25 4.81 -1.05 -0.06 114.58 119.31 1biq h GLU 105 Ca -0.06 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 1biq h GLU 105 Cb 1.55 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.97 1biq h GLU 105 CO 0.15 0.00 -0.26 1.15 -0.73 0.00 0.00 179.01 179.32 1biq h THR 106 N -0.37 1.25 -0.14 0.32 2.02 -1.02 -2.14 112.91 112.84 1biq h THR 106 Ca -0.02 -1.20 0.01 0.00 0.77 0.00 0.00 66.41 65.97 1biq h THR 106 Cb 0.29 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1biq h THR 106 CO 0.03 0.37 0.06 -0.25 0.37 0.00 0.00 175.52 176.10 1biq h TRP 107 N 0.28 0.10 -0.74 3.16 2.91 -0.74 0.22 115.95 121.14 1biq h TRP 107 Ca 0.04 0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.04 1biq h TRP 107 Cb 0.62 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 29.21 1biq h TRP 107 CO 0.01 0.06 0.35 0.28 -1.03 0.00 0.00 178.44 178.11 1biq h VAL 108 N 0.13 1.24 -0.29 2.65 2.07 -0.71 -0.23 116.25 121.11 1biq h VAL 108 Ca 0.06 -0.66 -0.13 0.00 0.82 0.00 0.00 66.70 66.78 1biq h VAL 108 Cb 0.02 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1biq h VAL 108 CO -0.05 0.28 -0.36 -0.33 0.02 0.00 0.00 177.57 177.13 1biq h GLU 109 N 1.05 0.65 -0.41 1.57 5.08 -0.92 -1.34 114.58 120.26 1biq h GLU 109 Ca 0.26 -0.32 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 1biq h GLU 109 Cb 0.11 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1biq h GLU 109 CO -0.03 0.91 -0.19 1.15 -1.00 0.00 0.00 179.01 179.85 1biq h THR 110 N 0.55 1.28 0.41 1.13 2.02 -0.08 -2.04 112.91 116.18 1biq h THR 110 Ca 0.05 -1.33 -0.02 0.00 0.77 0.00 0.00 66.41 65.89 1biq h THR 110 Cb 0.87 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 1biq h THR 110 CO 0.08 0.45 -0.22 -0.25 0.37 0.00 0.00 175.52 175.95 1biq h TRP 111 N 0.66 -0.56 -0.54 3.16 7.01 -0.97 -0.45 115.95 124.26 1biq h TRP 111 Ca 0.09 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.14 1biq h TRP 111 Cb 0.75 0.19 -0.05 0.00 -2.10 0.00 0.00 29.16 27.95 1biq h TRP 111 CO 0.06 -0.34 0.26 0.00 -2.79 0.00 0.00 178.44 175.62 1biq h ALA 112 N -0.00 0.70 -0.53 2.65 0.00 -1.28 -2.04 119.26 118.76 1biq h ALA 112 Ca -0.05 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1biq h ALA 112 Cb 0.46 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1biq h ALA 112 CO 0.08 -0.10 0.19 0.35 0.00 0.00 0.00 179.25 179.77 1biq h PHE 113 N 0.50 0.34 -0.03 0.00 3.57 -1.04 -0.45 116.94 119.83 1biq h PHE 113 Ca 0.25 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.78 1biq h PHE 113 Cb 0.19 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 1biq h PHE 113 CO -0.11 0.11 0.02 0.66 -2.23 0.00 0.00 178.31 176.76 1biq h SER 114 N 0.38 0.00 0.11 0.41 4.64 -0.41 -0.73 113.55 117.94 1biq h SER 114 Ca 0.25 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 1biq h SER 114 Cb 0.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1biq h SER 114 CO -0.25 0.00 -0.67 -0.33 -0.87 0.00 0.00 176.83 174.71 1biq h GLU 115 N 0.00 0.52 0.00 4.77 4.39 -0.49 -1.66 114.58 122.11 1biq h GLU 115 Ca 0.02 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.31 1biq h GLU 115 Cb 0.06 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1biq h GLU 115 CO -0.00 1.01 -0.08 1.79 -1.16 0.00 0.00 179.01 180.57 1biq h THR 116 N 0.38 0.29 -0.08 1.13 1.35 -0.48 0.27 112.91 115.77 1biq h THR 116 Ca -0.02 -0.53 -0.22 0.00 -0.55 0.00 0.00 66.41 65.09 1biq h THR 116 Cb 1.24 1.41 0.01 0.00 -1.73 0.00 0.00 68.15 69.07 1biq h THR 116 CO 0.12 0.08 -0.84 0.40 -0.25 0.00 0.00 175.52 175.03 1biq h ILE 117 N 0.00 1.33 -0.42 6.82 1.08 -0.77 -2.16 117.51 123.39 1biq h ILE 117 Ca -0.00 -2.16 0.05 0.00 -0.39 0.00 0.00 64.86 62.36 1biq h ILE 117 Cb 0.40 2.17 -0.05 0.00 -3.07 0.00 0.00 36.82 36.27 1biq h ILE 117 CO 0.01 0.66 0.14 0.45 -0.69 0.00 0.00 178.15 178.73 1biq h HIS 118 N 0.37 0.26 -0.49 1.37 3.86 -0.14 -0.14 115.15 120.23 1biq h HIS 118 Ca -0.06 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1biq h HIS 118 Cb 1.46 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 29.85 1biq h HIS 118 CO 0.07 0.09 0.26 0.77 0.86 0.00 0.00 177.93 179.98 1biq h SER 119 N 0.31 0.60 -0.70 2.45 0.02 -1.06 -1.18 113.55 113.99 1biq h SER 119 Ca 0.20 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 1biq h SER 119 Cb 0.19 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 1biq h SER 119 CO -0.21 0.49 0.20 0.03 -1.14 0.00 0.00 176.83 176.20 1biq h ARG 120 N 0.68 1.10 -0.20 3.45 3.08 -0.49 -2.36 114.38 119.64 1biq h ARG 120 Ca 0.17 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1biq h ARG 120 Cb 0.03 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1biq h ARG 120 CO -0.03 0.95 0.08 0.66 -1.07 0.00 0.00 179.97 180.57 1biq h SER 121 N 1.03 0.23 0.45 7.04 4.64 0.11 -1.15 113.55 125.92 1biq h SER 121 Ca 0.22 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.30 1biq h SER 121 Cb 0.33 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1biq h SER 121 CO -0.00 0.22 -0.96 -0.26 -0.87 0.00 0.00 176.83 174.95 1biq h PHE 122 N 0.27 0.50 -0.77 4.77 0.04 -0.87 -1.86 116.94 119.02 1biq h PHE 122 Ca 0.07 -0.28 -0.03 0.00 2.80 0.00 0.00 57.97 60.53 1biq h PHE 122 Cb 0.05 -0.05 -0.04 0.00 2.20 0.00 0.00 35.95 38.12 1biq h PHE 122 CO 0.00 1.12 0.36 1.15 -0.60 0.00 0.00 178.31 180.34 1biq h THR 123 N 0.17 1.25 -0.81 -1.55 2.02 -1.06 0.42 112.91 113.35 1biq h THR 123 Ca -0.08 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 1biq h THR 123 Cb 1.61 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 68.27 1biq h THR 123 CO 0.16 0.29 0.44 -0.74 0.37 0.00 0.00 175.52 176.04 1biq h HIS 124 N 1.08 1.12 0.03 3.16 -0.00 -1.08 -1.18 115.15 118.28 1biq h HIS 124 Ca 0.26 -0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.60 1biq h HIS 124 Cb 0.13 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 27.18 1biq h HIS 124 CO 0.01 0.79 -0.01 0.82 -0.00 0.00 0.00 177.93 179.54 1biq h ILE 125 N 1.13 1.39 -0.03 6.26 2.04 -0.91 -2.88 117.51 124.51 1biq h ILE 125 Ca 0.28 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 64.72 1biq h ILE 125 Cb 0.05 2.35 -0.04 0.00 -0.74 0.00 0.00 36.82 38.43 1biq h ILE 125 CO -0.04 0.36 -0.19 0.40 0.00 0.00 0.00 178.15 178.68 1biq h ILE 126 N -0.69 0.53 0.00 -0.67 2.04 -0.11 -1.65 117.51 116.96 1biq h ILE 126 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1biq h ILE 126 Cb 0.63 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1biq h ILE 126 CO 0.01 0.00 -0.00 0.08 0.00 0.00 0.00 178.15 178.23 1biq h ARG 127 N -0.29 0.00 -0.33 2.37 0.11 -1.31 -0.13 114.38 114.80 1biq h ARG 127 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 1biq h ARG 127 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1biq h ARG 127 CO -0.20 0.00 0.00 0.09 0.10 0.00 0.00 179.97 179.96 1biq n ASN 128 N -3.22 2.58 0.00 0.08 3.02 -0.65 -4.33 115.26 112.74 1biq n ASN 128 Ca -0.03 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.64 1biq n ASN 128 Cb 0.09 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1biq n ASN 128 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1biq n ILE 129 N 0.92 0.00 -4.35 2.41 -5.35 -0.11 -4.11 119.36 108.78 1biq n ILE 129 Ca 0.18 -0.18 -0.18 0.00 -0.27 0.00 0.00 62.75 62.29 1biq n ILE 129 Cb 0.46 1.09 -0.10 0.00 -1.74 0.00 0.00 39.64 39.34 1biq n ILE 129 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1biq s VAL 130 N -0.31 1.01 0.02 7.28 1.01 -0.93 -4.90 120.40 123.58 1biq s VAL 130 Ca 0.00 -2.03 -0.10 0.00 0.00 0.00 0.00 61.98 59.85 1biq s VAL 130 Cb 0.00 -2.44 -0.32 0.00 0.00 0.00 0.00 36.38 33.62 1biq s VAL 130 CO 0.00 -0.25 0.95 0.78 0.00 0.00 0.00 175.10 176.58 1biq h ASN 131 N 2.41 0.64 -3.04 3.32 2.35 -1.90 -3.44 115.58 115.91 1biq h ASN 131 Ca -0.39 -0.75 -0.55 0.00 -0.55 0.00 0.00 56.30 54.06 1biq h ASN 131 Cb 1.23 -0.21 -0.40 0.00 0.05 0.00 0.00 38.32 38.99 1biq h ASN 131 CO 0.65 1.60 -0.76 -0.62 -1.65 0.00 0.00 177.43 176.65 1biq s ASP 132 N -7.33 3.70 0.55 5.81 -1.08 -1.26 -4.95 116.67 112.10 1biq s ASP 132 Ca -0.09 -1.40 0.33 0.00 -0.52 0.00 0.00 52.55 50.87 1biq s ASP 132 Cb 0.05 -0.65 1.50 0.00 -1.46 0.00 0.00 42.92 42.36 1biq s ASP 132 CO 0.90 -0.41 1.85 -0.65 0.52 0.00 0.00 175.17 177.38 1biq h PRO 133 N 8.22 0.00 -0.05 4.34 0.11 -1.90 -0.63 132.00 142.10 1biq h PRO 133 Ca -0.16 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.96 1biq h PRO 133 Cb 1.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1biq h PRO 133 CO 0.44 0.00 0.14 0.77 -0.21 0.00 0.00 178.00 179.14 1biq h SER 134 N 0.00 0.00 0.00 -2.05 0.02 -1.97 0.49 113.55 110.04 1biq h SER 134 Ca 0.46 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.41 1biq h SER 134 Cb 1.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.43 1biq h SER 134 CO -0.00 0.00 -0.00 0.58 -1.14 0.00 0.00 176.83 176.26 1biq h VAL 135 N 0.00 1.73 0.60 2.27 2.07 -1.53 -0.31 116.25 121.09 1biq h VAL 135 Ca 0.02 -2.18 -0.02 0.00 0.82 0.00 0.00 66.70 65.34 1biq h VAL 135 Cb 0.31 3.21 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 1biq h VAL 135 CO -0.00 0.56 -0.49 0.58 0.02 0.00 0.00 177.57 178.24 1biq h VAL 136 N -0.93 0.00 -0.94 2.57 2.07 -1.51 0.47 116.25 117.99 1biq h VAL 136 Ca -0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1biq h VAL 136 Cb 0.92 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 1biq h VAL 136 CO 0.00 0.00 0.61 -0.26 0.02 0.00 0.00 177.57 177.94 1biq h PHE 137 N -1.06 1.11 -0.13 1.57 0.04 -1.04 0.11 116.94 117.53 1biq h PHE 137 Ca -0.08 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.57 1biq h PHE 137 Cb 0.89 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 1biq h PHE 137 CO -0.19 0.59 -0.54 -0.44 -0.60 0.00 0.00 178.31 177.13 1biq h ASP 138 N 1.10 0.43 0.11 2.17 3.32 -0.83 -2.83 116.42 119.89 1biq h ASP 138 Ca 0.40 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1biq h ASP 138 Cb 0.15 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1biq h ASP 138 CO -0.15 0.89 0.00 -0.67 -1.72 0.00 0.00 179.24 177.59 1biq n ASP 139 N -3.94 0.41 0.01 6.45 2.03 0.16 -2.98 116.55 118.69 1biq n ASP 139 Ca -0.03 0.68 -0.18 0.00 0.52 0.00 0.00 54.79 55.78 1biq n ASP 139 Cb 0.58 -0.74 -0.11 0.00 -0.72 0.00 0.00 41.12 40.14 1biq n ASP 139 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1biq h ILE 140 N 0.00 1.40 -0.19 5.18 2.04 -1.22 -2.18 117.51 122.54 1biq h ILE 140 Ca 0.00 -2.09 -0.00 0.00 1.00 0.00 0.00 64.86 63.77 1biq h ILE 140 Cb 0.05 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 1biq h ILE 140 CO 0.00 0.62 0.10 0.58 0.00 0.00 0.00 178.15 179.45 1biq h VAL 141 N -0.00 1.10 0.00 1.67 2.07 -1.69 -3.20 116.25 116.20 1biq h VAL 141 Ca -0.08 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1biq h VAL 141 Cb 1.36 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1biq h VAL 141 CO 0.13 0.09 -0.54 0.35 0.02 0.00 0.00 177.57 177.63 1biq n THR 142 N -4.91 0.15 -1.92 2.57 -2.24 -1.25 -4.83 114.28 101.85 1biq n THR 142 Ca -0.04 -0.12 -0.36 0.00 -2.27 0.00 0.00 64.05 61.26 1biq n THR 142 Cb 0.07 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 1biq n THR 142 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1biq s ASN 143 N -3.55 5.03 0.23 3.42 3.84 -0.82 -4.82 114.94 118.28 1biq s ASN 143 Ca 0.09 0.39 -0.07 0.00 0.21 0.00 0.00 52.86 53.48 1biq s ASN 143 Cb 0.16 -2.53 0.40 0.00 -0.55 0.00 0.00 41.25 38.73 1biq s ASN 143 CO 0.70 -2.57 1.70 -0.33 -2.79 0.00 0.00 177.10 173.81 1biq h GLU 144 N 15.53 0.28 -0.10 0.43 4.39 -1.89 1.19 114.58 134.41 1biq h GLU 144 Ca -0.21 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 1biq h GLU 144 Cb 1.16 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1biq h GLU 144 CO 1.20 0.19 0.06 0.37 -1.16 0.00 0.00 179.01 179.66 1biq h GLN 145 N 0.29 0.13 0.02 2.33 5.75 -1.98 2.34 115.11 123.99 1biq h GLN 145 Ca 0.38 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.88 1biq h GLN 145 Cb 0.61 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 1biq h GLN 145 CO -0.46 0.12 -0.11 0.82 -2.65 0.00 0.00 178.83 176.54 1biq h ILE 146 N 0.11 0.72 -0.71 2.39 1.08 -1.34 -0.17 117.51 119.58 1biq h ILE 146 Ca 0.04 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.51 1biq h ILE 146 Cb 0.02 0.72 -0.04 0.00 -3.07 0.00 0.00 36.82 34.45 1biq h ILE 146 CO -0.01 0.00 0.47 1.56 -0.69 0.00 0.00 178.15 179.48 1biq h GLN 147 N -0.20 0.93 -0.46 2.37 1.08 0.20 -1.87 115.11 117.16 1biq h GLN 147 Ca 0.04 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.11 1biq h GLN 147 Cb 0.25 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 1biq h GLN 147 CO -0.10 0.62 0.02 -0.22 -0.95 0.00 0.00 178.83 178.20 1biq h LYS 148 N 0.96 0.79 -0.54 1.46 3.64 0.50 -1.56 116.57 121.83 1biq h LYS 148 Ca 0.26 -0.24 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 1biq h LYS 148 Cb -0.11 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 1biq h LYS 148 CO -0.06 0.84 0.18 -0.09 -2.27 0.00 0.00 179.45 178.05 1biq h ARG 149 N 0.64 0.79 -0.01 1.90 2.43 -0.39 -2.46 114.38 117.29 1biq h ARG 149 Ca 0.13 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1biq h ARG 149 Cb 0.46 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1biq h ARG 149 CO 0.02 0.68 -0.08 0.00 -1.51 0.00 0.00 179.97 179.08 1biq n ALA 150 N -2.46 2.73 -1.61 2.80 0.00 -0.77 -4.81 120.51 116.39 1biq n ALA 150 Ca 0.04 -0.31 -0.53 0.00 0.00 0.00 0.00 53.44 52.64 1biq n ALA 150 Cb 0.18 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.26 1biq n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1biq n GLU 151 N -0.66 1.19 -0.27 0.00 2.13 -0.61 -1.99 120.64 120.42 1biq n GLU 151 Ca 0.17 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.42 1biq n GLU 151 Cb 0.27 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 29.90 1biq n GLU 151 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1biq n GLY 152 N 2.85 0.65 0.07 8.31 0.00 -1.26 -4.98 105.19 110.84 1biq n GLY 152 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 1biq n GLY 152 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1biq h ILE 153 N 0.00 0.31 -0.96 -0.61 2.04 -1.80 -2.99 117.51 113.49 1biq h ILE 153 Ca 0.00 -1.18 0.16 0.00 1.00 0.00 0.00 64.86 64.84 1biq h ILE 153 Cb 0.00 0.57 -0.08 0.00 -0.74 0.00 0.00 36.82 36.57 1biq h ILE 153 CO 0.00 0.10 0.61 0.77 0.00 0.00 0.00 178.15 179.63 1biq h SER 154 N -1.01 0.75 -0.63 1.72 4.64 -1.94 -2.11 113.55 114.97 1biq h SER 154 Ca -0.01 0.06 -0.05 0.00 -0.47 0.00 0.00 61.79 61.33 1biq h SER 154 Cb 0.21 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 1biq h SER 154 CO 0.01 0.34 0.21 0.28 -0.87 0.00 0.00 176.83 176.81 1biq h SER 155 N 0.77 0.91 -0.28 4.97 0.02 -1.95 0.25 113.55 118.24 1biq h SER 155 Ca 0.50 -0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 61.22 1biq h SER 155 Cb 0.75 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1biq h SER 155 CO -0.27 0.86 0.05 1.88 -1.14 0.00 0.00 176.83 178.21 1biq h TYR 156 N 0.90 0.50 0.56 3.45 0.05 -1.23 -1.43 116.97 119.78 1biq h TYR 156 Ca 0.21 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.89 1biq h TYR 156 Cb 0.27 -0.14 0.01 0.00 1.01 0.00 0.00 36.73 37.88 1biq h TYR 156 CO 0.02 0.57 -0.27 1.88 -1.05 0.00 0.00 178.16 179.30 1biq h TYR 157 N 0.29 -0.70 -0.64 4.88 0.05 -1.32 -1.67 116.97 117.86 1biq h TYR 157 Ca 0.09 -0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.95 1biq h TYR 157 Cb 0.34 0.23 -0.04 0.00 1.01 0.00 0.00 36.73 38.27 1biq h TYR 157 CO 0.02 -0.41 0.43 -0.44 -1.05 0.00 0.00 178.16 176.71 1biq h ASP 158 N -0.83 0.43 0.60 3.88 3.32 -0.48 -1.31 116.42 122.02 1biq h ASP 158 Ca -0.08 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.81 1biq h ASP 158 Cb 0.61 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1biq h ASP 158 CO 0.13 0.26 -0.77 -0.33 -1.72 0.00 0.00 179.24 176.80 1biq h GLU 159 N 0.48 0.13 -0.22 3.56 5.08 -0.96 -1.71 114.58 120.93 1biq h GLU 159 Ca 0.29 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 1biq h GLU 159 Cb 0.52 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1biq h GLU 159 CO -0.09 0.83 -0.28 1.25 -1.00 0.00 0.00 179.01 179.73 1biq h LEU 160 N 0.08 0.44 -0.25 1.33 5.85 -0.32 -2.28 115.31 120.16 1biq h LEU 160 Ca -0.02 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.47 1biq h LEU 160 Cb 1.35 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1biq h LEU 160 CO 0.11 0.71 -0.14 0.40 -0.34 0.00 0.00 178.44 179.18 1biq h ILE 161 N 0.38 1.30 -0.26 4.05 2.04 -1.10 -1.17 117.51 122.76 1biq h ILE 161 Ca 0.05 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 1biq h ILE 161 Cb 0.69 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1biq h ILE 161 CO 0.05 0.38 0.13 -0.08 0.00 0.00 0.00 178.15 178.63 1biq h GLU 162 N 0.24 0.37 -0.73 2.37 4.81 -1.20 -0.60 114.58 119.85 1biq h GLU 162 Ca 0.05 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1biq h GLU 162 Cb 0.65 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1biq h GLU 162 CO 0.04 0.36 0.37 0.52 -0.73 0.00 0.00 179.01 179.57 1biq h MET 163 N 0.29 1.02 -0.48 1.92 2.86 -1.40 -1.08 114.93 118.07 1biq h MET 163 Ca 0.09 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1biq h MET 163 Cb 0.11 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1biq h MET 163 CO -0.01 0.78 0.21 1.15 1.06 0.00 0.00 176.91 180.09 1biq h THR 164 N 1.02 1.20 -0.21 2.22 2.02 -0.91 0.12 112.91 118.37 1biq h THR 164 Ca 0.25 -0.61 0.01 0.00 0.77 0.00 0.00 66.41 66.83 1biq h THR 164 Cb 0.08 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 1biq h THR 164 CO -0.04 0.23 0.11 0.28 0.37 0.00 0.00 175.52 176.48 1biq h SER 165 N 0.64 0.17 -0.65 4.18 0.02 -0.54 0.20 113.55 117.56 1biq h SER 165 Ca 0.16 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 1biq h SER 165 Cb 0.17 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1biq h SER 165 CO -0.02 0.13 0.38 1.88 -1.14 0.00 0.00 176.83 178.06 1biq h TYR 166 N 0.23 0.71 -0.27 3.45 0.05 -0.96 0.81 116.97 120.99 1biq h TYR 166 Ca 0.09 0.02 0.02 0.00 0.05 0.00 0.00 58.73 58.91 1biq h TYR 166 Cb 0.02 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.51 1biq h TYR 166 CO -0.09 0.37 0.14 2.35 -1.05 0.00 0.00 178.16 179.88 1biq h TRP 167 N 0.73 0.26 -0.60 4.88 7.01 0.09 0.27 115.95 128.59 1biq h TRP 167 Ca 0.28 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.25 1biq h TRP 167 Cb 0.11 -0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.06 1biq h TRP 167 CO -0.06 0.15 0.24 0.45 -2.79 0.00 0.00 178.44 176.42 1biq h HIS 168 N 0.29 0.91 0.04 2.65 3.86 -0.27 0.98 115.15 123.62 1biq h HIS 168 Ca 0.11 -0.07 -0.20 0.00 -1.16 0.00 0.00 60.37 59.05 1biq h HIS 168 Cb 0.03 -0.27 0.02 0.00 1.06 0.00 0.00 27.41 28.24 1biq h HIS 168 CO -0.09 0.73 -0.82 -0.07 0.86 0.00 0.00 177.93 178.54 1biq h LEU 169 N 0.83 0.65 0.00 2.43 3.38 -0.48 -2.13 115.31 120.00 1biq h LEU 169 Ca 0.20 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1biq h LEU 169 Cb 0.20 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1biq h LEU 169 CO -0.02 1.37 -1.62 0.18 0.09 0.00 0.00 178.44 178.44 1biq n LEU 170 N -4.07 0.01 -0.19 1.67 4.77 0.90 -4.86 117.00 115.23 1biq n LEU 170 Ca -0.12 -0.01 0.02 0.00 -0.03 0.00 0.00 56.01 55.88 1biq n LEU 170 Cb 0.78 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.86 1biq n LEU 170 CO 0.50 0.00 -0.06 0.61 -1.33 0.00 0.00 177.39 177.11 1biq n GLY 171 N 1.70 -2.13 3.76 -0.72 0.00 0.34 -4.87 105.19 103.27 1biq n GLY 171 Ca -0.02 -1.44 -0.39 0.00 0.00 0.00 0.00 46.02 44.17 1biq n GLY 171 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1biq s GLU 172 N -2.31 3.59 0.00 1.61 2.12 -1.26 -4.72 118.70 117.73 1biq s GLU 172 Ca 0.00 2.12 0.00 0.00 0.36 0.00 0.00 54.97 57.45 1biq s GLU 172 Cb 0.00 -2.49 0.00 0.00 0.26 0.00 0.00 34.13 31.90 1biq s GLU 172 CO 0.00 -0.79 0.00 0.41 -0.54 0.00 0.00 175.26 174.34 1biq n GLY 173 N 0.62 0.97 3.27 -1.50 0.00 0.56 -4.96 105.19 104.15 1biq n GLY 173 Ca 0.07 -1.89 -0.33 0.00 0.00 0.00 0.00 46.02 43.88 1biq n GLY 173 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1biq s THR 174 N -2.58 2.49 0.36 2.61 -4.23 -1.26 0.55 115.64 113.58 1biq s THR 174 Ca 0.00 -0.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.69 1biq s THR 174 Cb 0.00 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 1biq s THR 174 CO 0.00 0.54 0.08 -1.00 -0.54 0.00 0.00 174.62 173.69 1biq s HIS 175 N 0.49 1.91 -0.25 3.99 3.76 0.31 -4.92 115.29 120.58 1biq s HIS 175 Ca -0.12 -1.06 0.02 0.00 -0.15 0.00 0.00 55.06 53.75 1biq s HIS 175 Cb -0.17 -1.27 0.05 0.00 1.11 0.00 0.00 32.58 32.30 1biq s HIS 175 CO 0.05 -0.07 -0.10 0.99 -0.85 0.00 0.00 174.74 174.76 1biq s THR 176 N -3.24 2.33 -0.20 1.30 2.01 -1.26 -0.08 115.64 116.51 1biq s THR 176 Ca 0.30 -1.45 0.01 0.00 0.31 0.00 0.00 61.69 60.86 1biq s THR 176 Cb 0.06 -2.30 0.02 0.00 0.01 0.00 0.00 72.50 70.30 1biq s THR 176 CO 0.14 0.06 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.28 1biq s VAL 177 N 1.17 2.27 -1.55 3.82 1.01 0.17 -4.68 120.40 122.61 1biq s VAL 177 Ca -0.06 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 60.79 1biq s VAL 177 Cb -0.19 -2.04 0.09 0.00 0.00 0.00 0.00 36.38 34.24 1biq s VAL 177 CO -0.06 0.41 0.75 0.59 0.00 0.00 0.00 175.10 176.80 1biq n ASN 178 N 4.61 -2.86 0.00 3.32 3.02 -1.26 -0.50 115.26 121.59 1biq n ASN 178 Ca -0.19 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.43 1biq n ASN 178 Cb 0.49 -3.28 0.00 0.00 -0.61 0.00 0.00 39.78 36.37 1biq n ASN 178 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1biq n GLY 179 N -1.65 0.52 3.46 7.41 0.00 -1.26 -5.02 105.19 108.66 1biq n GLY 179 Ca -0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1biq n GLY 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1biq s LYS 180 N -0.37 1.66 -0.01 1.61 1.02 0.34 -5.10 119.74 118.90 1biq s LYS 180 Ca 0.00 -1.35 -0.23 0.00 0.02 0.00 0.00 55.97 54.40 1biq s LYS 180 Cb 0.00 -1.98 -0.05 0.00 -0.52 0.00 0.00 37.83 35.28 1biq s LYS 180 CO 0.00 0.44 0.70 0.99 -0.92 0.00 0.00 175.35 176.56 1biq s THR 181 N -1.42 4.89 -0.06 2.17 2.01 -1.26 0.42 115.64 122.39 1biq s THR 181 Ca 0.19 1.47 0.03 0.00 0.31 0.00 0.00 61.69 63.69 1biq s THR 181 Cb -0.09 -4.04 0.01 0.00 0.01 0.00 0.00 72.50 68.38 1biq s THR 181 CO 0.10 0.34 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.53 1biq s VAL 182 N 0.21 1.30 -0.15 3.82 1.01 0.89 -4.91 120.40 122.57 1biq s VAL 182 Ca 0.36 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.70 1biq s VAL 182 Cb -0.19 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 1biq s VAL 182 CO 0.20 0.39 0.04 -0.89 0.00 0.00 0.00 175.10 174.84 1biq s THR 183 N 0.49 4.61 -0.30 3.92 2.01 -1.26 0.11 115.64 125.22 1biq s THR 183 Ca -0.13 -0.11 0.02 0.00 0.31 0.00 0.00 61.69 61.78 1biq s THR 183 Cb -0.15 -3.02 0.09 0.00 0.01 0.00 0.00 72.50 69.42 1biq s THR 183 CO 0.04 0.52 0.03 -0.69 -0.69 0.00 0.00 174.62 173.84 1biq s VAL 184 N -0.13 1.64 -0.13 3.82 1.01 0.19 -4.98 120.40 121.82 1biq s VAL 184 Ca 0.06 -1.73 -0.01 0.00 0.00 0.00 0.00 61.98 60.30 1biq s VAL 184 Cb -0.12 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 1biq s VAL 184 CO 0.01 -0.47 -0.09 -0.55 0.00 0.00 0.00 175.10 174.00 1biq s SER 185 N 1.26 4.34 0.21 3.32 0.15 -1.26 -0.32 113.70 121.40 1biq s SER 185 Ca 0.05 -0.23 -0.03 0.00 0.70 0.00 0.00 55.95 56.45 1biq s SER 185 Cb -0.18 -1.61 0.18 0.00 -1.71 0.00 0.00 66.02 62.69 1biq s SER 185 CO -0.13 0.19 1.58 0.25 1.20 0.00 0.00 173.24 176.33 1biq h LEU 186 N 6.55 0.66 -0.69 3.45 6.46 -1.97 -2.26 115.31 127.51 1biq h LEU 186 Ca -0.30 -0.29 0.04 0.00 -0.12 0.00 0.00 57.88 57.21 1biq h LEU 186 Cb 1.20 -0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 40.90 1biq h LEU 186 CO 0.58 0.98 0.42 -0.09 -0.62 0.00 0.00 178.44 179.71 1biq h ARG 187 N 0.52 0.79 -0.64 1.25 2.43 -1.98 0.30 114.38 117.05 1biq h ARG 187 Ca 0.05 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1biq h ARG 187 Cb 0.90 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 1biq h ARG 187 CO 0.08 0.52 0.27 0.93 -1.51 0.00 0.00 179.97 180.27 1biq h GLU 188 N 0.81 0.95 -0.53 0.20 4.39 -1.91 -0.73 114.58 117.75 1biq h GLU 188 Ca 0.28 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.70 1biq h GLU 188 Cb 0.06 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 1biq h GLU 188 CO -0.12 0.78 -0.14 1.25 -1.16 0.00 0.00 179.01 179.62 1biq h LEU 189 N 0.90 1.04 -1.41 1.33 5.85 -0.79 -0.97 115.31 121.25 1biq h LEU 189 Ca 0.22 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1biq h LEU 189 Cb 0.18 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1biq h LEU 189 CO -0.02 1.16 0.05 0.11 -0.34 0.00 0.00 178.44 179.40 1biq h LYS 190 N 0.91 0.44 -0.34 1.25 1.57 -0.11 0.19 116.57 120.47 1biq h LYS 190 Ca 0.13 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 1biq h LYS 190 Cb 0.71 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1biq h LYS 190 CO 0.05 0.43 -0.21 0.87 -0.57 0.00 0.00 179.45 180.03 1biq h LYS 191 N 0.43 0.75 -0.67 3.15 1.57 -0.30 -0.72 116.57 120.78 1biq h LYS 191 Ca 0.10 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.52 1biq h LYS 191 Cb 0.21 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 1biq h LYS 191 CO 0.00 0.96 0.35 0.87 -0.57 0.00 0.00 179.45 181.06 1biq h LYS 192 N 0.53 0.94 -0.07 3.15 1.79 -0.46 -1.87 116.57 120.58 1biq h LYS 192 Ca 0.07 -0.12 -0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1biq h LYS 192 Cb 0.76 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1biq h LYS 192 CO 0.06 0.73 0.05 1.25 -1.08 0.00 0.00 179.45 180.45 1biq h LEU 193 N 0.92 0.09 -0.89 2.94 5.85 -0.39 -1.66 115.31 122.17 1biq h LEU 193 Ca 0.23 -0.04 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1biq h LEU 193 Cb 0.07 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.00 1biq h LEU 193 CO -0.03 0.10 0.52 0.22 -0.34 0.00 0.00 178.44 178.90 1biq h TYR 194 N 0.07 0.93 -0.02 1.25 3.20 -0.87 -1.06 116.97 120.47 1biq h TYR 194 Ca 0.03 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.75 1biq h TYR 194 Cb 0.03 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 1biq h TYR 194 CO -0.06 0.35 -0.77 -0.07 -1.64 0.00 0.00 178.16 175.97 1biq h LEU 195 N 0.83 0.23 -0.02 2.82 3.38 -1.26 -0.89 115.31 120.40 1biq h LEU 195 Ca 0.44 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 58.26 1biq h LEU 195 Cb 0.46 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1biq h LEU 195 CO -0.27 0.91 -0.04 0.00 0.09 0.00 0.00 178.44 179.13 1biq h LEU 197 N -0.06 -0.12 -0.69 0.00 3.38 -1.11 0.32 115.31 117.03 1biq h LEU 197 Ca 0.02 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1biq h LEU 197 Cb 0.09 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 1biq h LEU 197 CO -0.06 -0.05 0.39 -0.03 0.09 0.00 0.00 178.44 178.79 1biq h MET 198 N -0.00 0.70 -0.29 1.13 4.05 -0.79 0.37 114.93 120.10 1biq h MET 198 Ca 0.06 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.38 1biq h MET 198 Cb 0.10 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 30.72 1biq h MET 198 CO -0.13 0.46 -0.07 0.77 0.23 0.00 0.00 176.91 178.18 1biq h SER 199 N 0.72 0.44 -0.14 1.39 0.02 0.79 -1.52 113.55 115.26 1biq h SER 199 Ca 0.31 -0.09 -0.17 0.00 -0.84 0.00 0.00 61.79 60.99 1biq h SER 199 Cb 0.18 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1biq h SER 199 CO -0.18 0.56 -0.52 0.58 -1.14 0.00 0.00 176.83 176.13 1biq h VAL 200 N 0.44 1.30 -0.69 2.27 2.07 0.16 0.02 116.25 121.81 1biq h VAL 200 Ca 0.09 -1.73 0.06 0.00 0.82 0.00 0.00 66.70 65.94 1biq h VAL 200 Cb 0.40 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 1biq h VAL 200 CO 0.02 0.55 0.39 -1.13 0.02 0.00 0.00 177.57 177.42 1biq h ASN 201 N 0.56 0.58 0.21 0.57 -1.24 0.20 0.18 115.58 116.64 1biq h ASN 201 Ca 0.02 0.03 -0.11 0.00 0.71 0.00 0.00 56.30 56.95 1biq h ASN 201 Cb 1.09 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 40.05 1biq h ASN 201 CO 0.11 0.37 -0.41 0.00 -1.29 0.00 0.00 177.43 176.20 1biq h ALA 202 N 1.36 1.09 -0.28 1.57 0.00 -0.86 0.11 119.26 122.24 1biq h ALA 202 Ca 0.31 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1biq h ALA 202 Cb 0.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1biq h ALA 202 CO -0.19 0.60 0.10 1.25 0.00 0.00 0.00 179.25 181.00 1biq h LEU 203 N 0.22 0.41 -0.19 0.00 6.46 0.19 -1.29 115.31 121.11 1biq h LEU 203 Ca 0.02 -0.19 -0.14 0.00 -0.12 0.00 0.00 57.88 57.44 1biq h LEU 203 Cb 0.82 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 1biq h LEU 203 CO 0.07 0.49 -0.44 -0.33 -0.62 0.00 0.00 178.44 177.61 1biq h GLU 204 N 0.30 0.63 0.00 1.25 4.39 -0.31 -3.11 114.58 117.73 1biq h GLU 204 Ca 0.09 -0.42 0.00 0.00 0.34 0.00 0.00 59.36 59.37 1biq h GLU 204 Cb 0.23 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1biq h GLU 204 CO -0.00 1.04 -0.56 0.00 -1.16 0.00 0.00 179.01 178.33 1biq h ALA 205 N 0.58 0.69 0.00 3.43 0.00 -0.82 -3.41 119.26 119.74 1biq h ALA 205 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1biq h ALA 205 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1biq h ALA 205 CO 0.10 0.00 0.00 -0.89 0.00 0.00 0.00 179.25 178.46 1biq n ILE 206 N -2.58 0.90 0.00 0.00 5.41 -0.55 -4.60 119.36 117.94 1biq n ILE 206 Ca 0.02 0.30 0.00 0.00 1.00 0.00 0.00 62.75 64.07 1biq n ILE 206 Cb 0.50 -1.31 0.00 0.00 -0.71 0.00 0.00 39.64 38.13 1biq n ILE 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1biq n ARG 207 N -3.45 0.00 0.00 0.38 1.74 -0.81 -2.63 116.66 111.90 1biq n ARG 207 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1biq n ARG 207 Cb 0.00 -0.83 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1biq n ARG 207 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1biq n TYR 209 N 0.32 0.00 -0.07 -1.55 4.02 -1.26 -3.09 117.16 115.53 1biq n TYR 209 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 1biq n TYR 209 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.27 1biq n TYR 209 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1biq h VAL 210 N 0.00 1.27 -0.40 -0.72 2.07 -1.86 -2.46 116.25 114.16 1biq h VAL 210 Ca 0.00 -1.77 -0.08 0.00 0.82 0.00 0.00 66.70 65.67 1biq h VAL 210 Cb 0.00 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 1biq h VAL 210 CO 0.00 0.57 -0.10 0.77 0.02 0.00 0.00 177.57 178.84 1biq h SER 211 N 0.63 0.67 -0.34 0.57 4.64 -1.82 -2.75 113.55 115.15 1biq h SER 211 Ca 0.00 -0.19 0.01 0.00 -0.47 0.00 0.00 61.79 61.14 1biq h SER 211 Cb 1.20 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 1biq h SER 211 CO 0.13 0.81 0.22 -0.26 -0.87 0.00 0.00 176.83 176.85 1biq h PHE 212 N 0.63 0.41 -0.19 4.77 0.04 -1.85 -1.27 116.94 119.48 1biq h PHE 212 Ca 0.11 0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.94 1biq h PHE 212 Cb 0.54 -0.14 -0.07 0.00 2.20 0.00 0.00 35.95 38.48 1biq h PHE 212 CO 0.02 0.25 -0.39 0.00 -0.60 0.00 0.00 178.31 177.60 1biq h ALA 213 N 1.14 -0.49 -0.54 2.45 0.00 -1.25 1.11 119.26 121.69 1biq h ALA 213 Ca 0.13 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1biq h ALA 213 Cb -0.03 0.75 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 1biq h ALA 213 CO -0.04 -0.87 0.28 0.00 0.00 0.00 0.00 179.25 178.62 1biq h SER 215 N 0.54 -0.68 0.69 0.00 0.02 0.00 -2.05 113.55 112.07 1biq h SER 215 Ca 0.24 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1biq h SER 215 Cb 0.14 0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1biq h SER 215 CO -0.16 -0.32 0.00 -0.26 -1.14 0.00 0.00 176.83 174.95 1biq h PHE 216 N -0.42 0.00 -0.96 3.45 0.04 0.14 -2.93 116.94 116.25 1biq h PHE 216 Ca 0.04 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.82 1biq h PHE 216 Cb 0.46 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.56 1biq h PHE 216 CO -0.24 0.00 0.64 0.00 -0.60 0.00 0.00 178.31 178.11 1biq h ALA 217 N 2.07 1.23 -0.37 2.45 0.00 -0.44 -2.08 119.26 122.12 1biq h ALA 217 Ca 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 1biq h ALA 217 Cb 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1biq h ALA 217 CO 0.00 0.59 -0.37 0.74 0.00 0.00 0.00 179.25 180.21 1biq h PHE 218 N 1.28 1.08 -0.23 0.00 0.04 -1.61 -2.93 116.94 114.57 1biq h PHE 218 Ca 0.36 -0.33 0.03 0.00 2.80 0.00 0.00 57.97 60.84 1biq h PHE 218 Cb -0.12 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 37.80 1biq h PHE 218 CO -0.00 1.14 0.16 0.00 -0.60 0.00 0.00 178.31 179.00 1biq h ALA 219 N 0.76 2.01 0.00 2.45 0.00 -1.27 -0.45 119.26 122.76 1biq h ALA 219 Ca 0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1biq h ALA 219 Cb 0.96 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1biq h ALA 219 CO 0.09 -0.05 -0.14 0.93 0.00 0.00 0.00 179.25 180.08 1biq h GLU 220 N 0.16 0.00 -0.65 0.00 4.39 -1.21 -1.41 114.58 115.86 1biq h GLU 220 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1biq h GLU 220 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1biq h GLU 220 CO -0.02 0.14 0.00 0.54 -1.16 0.00 0.00 179.01 178.51 1biq n ARG 221 N -3.28 3.91 -2.08 2.33 1.74 -0.32 -4.91 116.66 114.04 1biq n ARG 221 Ca 0.00 -2.84 -0.17 0.00 -0.77 0.00 0.00 57.85 54.08 1biq n ARG 221 Cb 0.39 -1.96 -0.03 0.00 -1.02 0.00 0.00 32.46 29.84 1biq n ARG 221 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1biq n GLU 222 N 0.99 -1.31 -4.15 5.56 4.71 -0.53 -5.03 120.64 120.88 1biq n GLU 222 Ca 0.25 0.91 -0.25 0.00 -0.01 0.00 0.00 57.16 58.06 1biq n GLU 222 Cb 0.94 -5.29 -0.06 0.00 -1.01 0.00 0.00 31.44 26.02 1biq n GLU 222 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1biq s LEU 223 N -4.60 3.58 -1.22 -4.62 1.43 -0.35 -4.73 118.68 108.16 1biq s LEU 223 Ca 0.00 -0.29 -0.33 0.00 -1.03 0.00 0.00 54.13 52.48 1biq s LEU 223 Cb 0.00 -2.18 0.04 0.00 0.03 0.00 0.00 46.19 44.08 1biq s LEU 223 CO 0.00 0.05 0.67 0.23 0.23 0.00 0.00 176.35 177.53 1biq n MET 224 N -0.44 -0.33 0.00 1.70 2.81 -1.26 -2.90 117.12 116.70 1biq n MET 224 Ca -0.09 0.10 0.14 0.00 -1.81 0.00 0.00 57.70 56.04 1biq n MET 224 Cb 0.56 -2.66 0.65 0.00 -0.71 0.00 0.00 33.22 31.06 1biq n MET 224 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1biq n GLU 225 N -5.00 0.27 -0.00 0.03 1.02 -1.26 -2.15 120.64 113.55 1biq n GLU 225 Ca -0.12 -0.03 -0.08 0.00 -0.02 0.00 0.00 57.16 56.91 1biq n GLU 225 Cb 0.57 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.43 1biq n GLU 225 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1biq h GLY 226 N 5.00 -0.12 0.45 0.62 0.00 -1.89 -2.78 103.07 104.35 1biq h GLY 226 Ca 0.00 0.04 0.12 0.00 0.00 0.00 0.00 47.33 47.50 1biq h GLY 226 CO 0.00 -0.04 0.63 -0.57 0.00 0.00 0.00 176.54 176.56 1biq h ASN 227 N -0.96 0.93 0.04 0.19 -1.24 -1.87 -1.57 115.58 111.09 1biq h ASN 227 Ca -0.01 0.05 -0.05 0.00 0.71 0.00 0.00 56.30 57.00 1biq h ASN 227 Cb 0.47 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.38 1biq h ASN 227 CO 0.02 0.48 -0.13 0.00 -1.29 0.00 0.00 177.43 176.52 1biq h ALA 228 N 1.54 1.55 -0.38 1.57 0.00 -1.43 0.04 119.26 122.16 1biq h ALA 228 Ca 0.50 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 1biq h ALA 228 Cb 0.51 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1biq h ALA 228 CO -0.27 0.32 0.02 0.87 0.00 0.00 0.00 179.25 180.20 1biq h LYS 229 N 0.19 0.65 0.13 0.00 1.57 -1.00 0.27 116.57 118.39 1biq h LYS 229 Ca 0.04 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1biq h LYS 229 Cb 0.35 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1biq h LYS 229 CO 0.02 0.74 -0.06 0.82 -0.57 0.00 0.00 179.45 180.39 1biq h ILE 230 N 0.48 0.93 -0.79 1.86 2.04 -1.25 -1.20 117.51 119.59 1biq h ILE 230 Ca 0.11 -0.25 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1biq h ILE 230 Cb 0.43 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1biq h ILE 230 CO 0.01 0.06 0.51 0.40 0.00 0.00 0.00 178.15 179.14 1biq h ILE 231 N -0.29 1.02 -0.53 -0.67 1.08 -0.90 0.42 117.51 117.63 1biq h ILE 231 Ca -0.02 -0.28 -0.07 0.00 -0.39 0.00 0.00 64.86 64.10 1biq h ILE 231 Cb 0.23 0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 1biq h ILE 231 CO 0.03 0.15 0.05 0.03 -0.69 0.00 0.00 178.15 177.72 1biq h ARG 232 N 0.83 0.87 -0.44 2.37 3.08 -0.46 0.28 114.38 120.91 1biq h ARG 232 Ca 0.34 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 60.09 1biq h ARG 232 Cb 0.27 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1biq h ARG 232 CO -0.12 0.84 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.54 1biq h LEU 233 N 0.82 0.78 -0.12 3.04 3.38 0.92 -1.79 115.31 122.34 1biq h LEU 233 Ca 0.16 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1biq h LEU 233 Cb 0.43 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1biq h LEU 233 CO 0.01 0.90 0.06 0.40 0.09 0.00 0.00 178.44 179.91 1biq h ILE 234 N 0.63 1.01 -0.85 1.22 2.04 -0.50 -2.13 117.51 118.94 1biq h ILE 234 Ca 0.12 -0.05 0.12 0.00 1.00 0.00 0.00 64.86 66.06 1biq h ILE 234 Cb 0.51 0.86 -0.08 0.00 -0.74 0.00 0.00 36.82 37.37 1biq h ILE 234 CO 0.02 0.02 0.47 0.00 0.00 0.00 0.00 178.15 178.67 1biq h ALA 235 N 1.05 1.26 -0.86 1.87 0.00 -0.29 0.28 119.26 122.57 1biq h ALA 235 Ca 0.04 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1biq h ALA 235 Cb -0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1biq h ALA 235 CO -0.02 0.01 0.56 -0.09 0.00 0.00 0.00 179.25 179.71 1biq h ARG 236 N 0.72 1.03 0.07 0.00 2.43 -0.68 -2.04 114.38 115.90 1biq h ARG 236 Ca 0.44 -0.06 -0.17 0.00 -0.81 0.00 0.00 59.98 59.38 1biq h ARG 236 Cb 0.52 -0.23 0.02 0.00 -0.42 0.00 0.00 29.97 29.86 1biq h ARG 236 CO -0.31 0.68 -0.70 -0.44 -1.51 0.00 0.00 179.97 177.69 1biq h ASP 237 N 1.06 0.50 -0.84 -3.80 3.32 -0.24 -3.28 116.42 113.14 1biq h ASP 237 Ca 0.34 -0.85 0.14 0.00 0.02 0.00 0.00 57.03 56.69 1biq h ASP 237 Cb 0.04 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.37 1biq h ASP 237 CO -0.10 1.30 0.55 0.00 -1.72 0.00 0.00 179.24 179.26 1biq h ALA 238 N 0.21 1.93 -0.75 3.45 0.00 -0.29 0.93 119.26 124.74 1biq h ALA 238 Ca -0.11 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1biq h ALA 238 Cb 1.47 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1biq h ALA 238 CO 0.13 -0.16 0.50 0.00 0.00 0.00 0.00 179.25 179.73 1biq h ALA 239 N 1.61 1.53 -0.25 0.00 0.00 -1.44 0.25 119.26 120.97 1biq h ALA 239 Ca 0.42 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 1biq h ALA 239 Cb 0.76 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1biq h ALA 239 CO -0.17 0.40 -0.31 -0.07 0.00 0.00 0.00 179.25 179.10 1biq h LEU 240 N 0.95 0.70 -0.40 0.00 3.38 -0.97 -1.63 115.31 117.35 1biq h LEU 240 Ca 0.29 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1biq h LEU 240 Cb 0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1biq h LEU 240 CO -0.08 1.06 0.26 0.45 0.09 0.00 0.00 178.44 180.22 1biq h HIS 241 N 0.36 0.51 -0.16 1.13 3.86 -0.09 -0.23 115.15 120.53 1biq h HIS 241 Ca 0.03 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.16 1biq h HIS 241 Cb 0.89 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 29.18 1biq h HIS 241 CO 0.08 0.33 -0.31 1.37 0.86 0.00 0.00 177.93 180.26 1biq h LEU 242 N 0.54 0.32 -1.05 2.43 8.10 -0.56 -1.07 115.31 124.01 1biq h LEU 242 Ca 0.15 -0.11 -0.09 0.00 0.11 0.00 0.00 57.88 57.94 1biq h LEU 242 Cb -0.05 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.07 1biq h LEU 242 CO -0.03 0.62 -0.26 0.74 -4.11 0.00 0.00 178.44 175.40 1biq h THR 243 N 0.28 1.26 -0.22 0.15 2.02 -0.84 -1.85 112.91 113.70 1biq h THR 243 Ca 0.04 -1.21 -0.08 0.00 0.77 0.00 0.00 66.41 65.93 1biq h THR 243 Cb 0.69 1.39 -0.00 0.00 -1.74 0.00 0.00 68.15 68.49 1biq h THR 243 CO 0.05 0.38 -0.16 1.23 0.37 0.00 0.00 175.52 177.39 1biq h GLY 244 N 1.01 0.55 1.02 2.16 0.00 0.17 -2.29 103.07 105.68 1biq h GLY 244 Ca 0.05 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 46.82 1biq h GLY 244 CO 0.05 0.47 0.32 -0.91 0.00 0.00 0.00 176.54 176.47 1biq h THR 245 N 0.20 1.24 -0.74 4.70 1.35 -1.15 -1.72 112.91 116.80 1biq h THR 245 Ca 0.04 -0.70 0.02 0.00 -0.55 0.00 0.00 66.41 65.22 1biq h THR 245 Cb 0.68 0.39 -0.04 0.00 -1.73 0.00 0.00 68.15 67.45 1biq h THR 245 CO 0.04 0.29 0.47 1.56 -0.25 0.00 0.00 175.52 177.63 1biq h GLN 246 N 0.99 0.91 -0.50 4.72 4.20 -1.33 0.34 115.11 124.44 1biq h GLN 246 Ca 0.24 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.78 1biq h GLN 246 Cb 0.16 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1biq h GLN 246 CO -0.03 0.60 -0.12 0.45 -0.67 0.00 0.00 178.83 179.06 1biq h HIS 247 N 0.94 1.09 -0.17 2.96 3.86 -1.24 0.26 115.15 122.85 1biq h HIS 247 Ca 0.29 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1biq h HIS 247 Cb -0.03 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.17 1biq h HIS 247 CO -0.03 1.04 0.11 0.52 0.86 0.00 0.00 177.93 180.43 1biq h MET 248 N 0.83 0.23 -0.23 2.45 2.86 -0.34 0.32 114.93 121.05 1biq h MET 248 Ca 0.13 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1biq h MET 248 Cb 0.69 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 1biq h MET 248 CO 0.05 0.17 0.12 -0.07 1.06 0.00 0.00 176.91 178.24 1biq h LEU 249 N 0.22 0.30 -1.16 1.22 3.38 -0.09 -1.16 115.31 118.01 1biq h LEU 249 Ca 0.06 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1biq h LEU 249 Cb -0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1biq h LEU 249 CO -0.01 0.33 -0.25 0.78 0.09 0.00 0.00 178.44 179.39 1biq h ASN 250 N 0.25 0.27 -0.37 -0.43 2.35 -0.26 -1.21 115.58 116.17 1biq h ASN 250 Ca 0.08 -0.08 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 1biq h ASN 250 Cb 0.11 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1biq h ASN 250 CO -0.01 0.52 -0.20 -0.07 -1.65 0.00 0.00 177.43 176.02 1biq h LEU 251 N 0.25 0.82 -0.50 1.61 3.38 -0.04 -0.45 115.31 120.39 1biq h LEU 251 Ca 0.04 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1biq h LEU 251 Cb 0.58 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1biq h LEU 251 CO 0.04 1.06 0.26 -0.07 0.09 0.00 0.00 178.44 179.82 1biq h LEU 252 N 0.59 0.64 -0.92 1.67 3.38 -0.91 -2.71 115.31 117.05 1biq h LEU 252 Ca 0.08 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1biq h LEU 252 Cb 0.76 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1biq h LEU 252 CO 0.06 0.56 -0.45 -0.09 0.09 0.00 0.00 178.44 178.62 1biq h ARG 253 N 0.66 0.00 0.00 1.13 2.43 -1.07 -2.72 114.38 114.81 1biq h ARG 253 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1biq h ARG 253 Cb 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1biq h ARG 253 CO -0.03 0.45 0.00 -1.13 -1.51 0.00 0.00 179.97 177.75 1biq n SER 254 N -3.66 0.00 0.00 -3.80 3.41 -0.19 -4.75 113.62 104.63 1biq n SER 254 Ca -0.01 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 1biq n SER 254 Cb 0.53 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1biq n SER 254 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1biq n GLY 255 N -0.97 0.67 0.09 5.00 0.00 -1.03 -4.84 105.19 104.11 1biq n GLY 255 Ca 0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1biq n GLY 255 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1biq n ALA 256 N 1.00 2.06 -2.15 4.61 0.00 -1.26 -4.50 120.51 120.27 1biq n ALA 256 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1biq n ALA 256 Cb 0.01 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1biq n ALA 256 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1biq n ASP 257 N -2.07 0.00 -4.65 0.00 2.03 -1.26 -4.97 116.55 105.63 1biq n ASP 257 Ca 0.05 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.93 1biq n ASP 257 Cb 0.34 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.71 1biq n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1biq s ASP 258 N -0.70 6.57 0.34 1.67 2.15 -1.26 -4.88 116.67 120.56 1biq s ASP 258 Ca 0.00 2.13 0.02 0.00 0.43 0.00 0.00 52.55 55.13 1biq s ASP 258 Cb 0.00 -2.53 0.61 0.00 -0.30 0.00 0.00 42.92 40.70 1biq s ASP 258 CO 0.00 -1.02 1.97 -0.65 -0.17 0.00 0.00 175.17 175.30 1biq h PRO 259 N 9.96 0.89 0.00 4.34 0.11 -1.93 0.21 132.00 145.58 1biq h PRO 259 Ca -0.39 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1biq h PRO 259 Cb 1.18 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1biq h PRO 259 CO 0.96 0.59 -0.18 1.49 -0.21 0.00 0.00 178.00 180.65 1biq h GLU 260 N 0.91 0.00 -0.23 1.05 4.81 -1.96 -1.58 114.58 117.58 1biq h GLU 260 Ca 0.29 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.38 1biq h GLU 260 Cb 0.04 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1biq h GLU 260 CO -0.08 0.18 -0.43 0.52 -0.73 0.00 0.00 179.01 178.46 1biq h MET 261 N 0.00 0.57 -0.09 1.92 2.86 -1.27 -2.13 114.93 116.79 1biq h MET 261 Ca -0.00 -0.30 -0.07 0.00 -2.06 0.00 0.00 59.70 57.26 1biq h MET 261 Cb 0.36 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1biq h MET 261 CO 0.02 0.90 -0.27 0.00 1.06 0.00 0.00 176.91 178.62 1biq h ALA 262 N 1.06 1.37 0.00 6.32 0.00 -1.10 -0.40 119.26 126.51 1biq h ALA 262 Ca 0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1biq h ALA 262 Cb 0.95 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1biq h ALA 262 CO 0.08 0.44 -0.15 0.93 0.00 0.00 0.00 179.25 180.56 1biq h GLU 263 N 0.15 0.00 0.13 0.00 5.08 -1.15 -2.59 114.58 116.20 1biq h GLU 263 Ca 0.02 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.10 1biq h GLU 263 Cb 0.57 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.83 1biq h GLU 263 CO 0.04 0.15 -1.23 0.82 -1.00 0.00 0.00 179.01 177.79 1biq h ILE 264 N 0.00 1.40 -0.73 3.13 2.04 -0.84 -0.53 117.51 121.98 1biq h ILE 264 Ca -0.00 -2.75 -0.04 0.00 1.00 0.00 0.00 64.86 63.07 1biq h ILE 264 Cb 1.07 2.81 -0.03 0.00 -0.74 0.00 0.00 36.82 39.93 1biq h ILE 264 CO 0.02 0.82 0.31 0.00 0.00 0.00 0.00 178.15 179.29 1biq h ALA 265 N 0.48 0.94 -0.13 1.87 0.00 -1.00 0.20 119.26 121.61 1biq h ALA 265 Ca -0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 1biq h ALA 265 Cb 1.92 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 1biq h ALA 265 CO 0.22 0.55 -0.02 1.49 0.00 0.00 0.00 179.25 181.49 1biq h GLU 266 N 1.04 0.24 0.00 0.00 4.57 -1.45 -2.45 114.58 116.53 1biq h GLU 266 Ca 0.24 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1biq h GLU 266 Cb 0.19 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1biq h GLU 266 CO -0.02 0.52 -0.02 0.93 -1.18 0.00 0.00 179.01 179.23 1biq h GLU 267 N -0.05 0.00 -0.01 1.92 5.08 -0.81 -3.03 114.58 117.68 1biq h GLU 267 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1biq h GLU 267 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1biq h GLU 267 CO 0.01 0.02 -0.48 0.00 -1.00 0.00 0.00 179.01 177.57 1biq h LYS 269 N 1.81 0.16 -0.21 0.00 3.64 -1.31 0.15 116.57 120.81 1biq h LYS 269 Ca 0.00 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 1biq h LYS 269 Cb 0.66 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1biq h LYS 269 CO 0.00 0.10 -0.22 0.37 -2.27 0.00 0.00 179.45 177.43 1biq h GLN 270 N 0.16 0.38 -0.21 1.90 5.75 -1.86 0.12 115.11 121.35 1biq h GLN 270 Ca 0.79 -0.13 -0.07 0.00 -0.15 0.00 0.00 58.65 59.09 1biq h GLN 270 Cb 2.15 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 30.66 1biq h GLN 270 CO -0.55 0.59 -0.15 0.93 -2.65 0.00 0.00 178.83 177.00 1biq h GLU 271 N 0.35 0.47 0.21 1.69 3.07 -1.08 0.20 114.58 119.49 1biq h GLU 271 Ca 0.06 -0.23 0.01 0.00 -0.50 0.00 0.00 59.36 58.70 1biq h GLU 271 Cb 0.58 -0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.47 1biq h GLU 271 CO 0.04 0.78 -0.29 0.00 -1.40 0.00 0.00 179.01 178.15 1biq h TYR 273 N -0.56 -0.94 -0.10 0.00 3.20 -0.61 -1.45 116.97 116.51 1biq h TYR 273 Ca 0.01 0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1biq h TYR 273 Cb 0.55 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 1biq h TYR 273 CO -0.22 -0.39 -0.09 -0.44 -1.64 0.00 0.00 178.16 175.39 1biq h ASP 274 N -0.22 0.14 0.26 -2.11 3.32 -0.27 -2.37 116.42 115.16 1biq h ASP 274 Ca 0.19 -0.02 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 1biq h ASP 274 Cb 0.55 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 1biq h ASP 274 CO -0.60 0.25 -0.50 0.17 -1.72 0.00 0.00 179.24 176.84 1biq h LEU 275 N 0.15 0.30 -0.40 1.55 8.10 -0.05 -0.85 115.31 124.12 1biq h LEU 275 Ca 0.03 -0.15 -0.06 0.00 0.11 0.00 0.00 57.88 57.81 1biq h LEU 275 Cb 0.26 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.38 1biq h LEU 275 CO 0.01 0.76 -0.00 -0.26 -4.11 0.00 0.00 178.44 174.84 1biq h PHE 276 N 0.22 0.77 -0.74 0.17 0.04 -1.34 0.17 116.94 116.23 1biq h PHE 276 Ca 0.01 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 60.60 1biq h PHE 276 Cb 0.96 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.88 1biq h PHE 276 CO 0.02 0.78 0.29 0.28 -0.60 0.00 0.00 178.31 179.08 1biq h VAL 277 N 0.53 1.25 -0.39 -0.55 2.07 -1.26 0.15 116.25 118.06 1biq h VAL 277 Ca 0.11 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 66.75 1biq h VAL 277 Cb 0.48 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1biq h VAL 277 CO 0.02 0.32 -0.09 1.56 0.02 0.00 0.00 177.57 179.41 1biq h GLN 278 N 1.07 0.75 -0.35 1.57 4.20 -0.76 -1.19 115.11 120.39 1biq h GLN 278 Ca 0.25 -0.28 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1biq h GLN 278 Cb 0.22 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1biq h GLN 278 CO -0.02 0.88 0.23 0.00 -0.67 0.00 0.00 178.83 179.25 1biq h ALA 279 N 0.84 0.44 -0.76 3.87 0.00 -0.69 0.27 119.26 123.24 1biq h ALA 279 Ca 0.10 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1biq h ALA 279 Cb 0.60 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 1biq h ALA 279 CO 0.04 -0.10 0.42 0.00 0.00 0.00 0.00 179.25 179.61 1biq h ALA 280 N 1.13 1.05 -0.05 0.00 0.00 -0.84 0.24 119.26 120.79 1biq h ALA 280 Ca 0.13 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1biq h ALA 280 Cb -0.05 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1biq h ALA 280 CO -0.03 0.06 -0.45 0.37 0.00 0.00 0.00 179.25 179.20 1biq h GLN 281 N 0.72 0.12 -0.47 0.00 5.75 -0.53 -1.55 115.11 119.16 1biq h GLN 281 Ca 0.36 -0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.72 1biq h GLN 281 Cb 0.31 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 1biq h GLN 281 CO -0.23 0.55 -0.02 1.96 -2.65 0.00 0.00 178.83 178.44 1biq h GLN 282 N 0.10 0.84 -0.55 1.69 4.20 0.50 0.39 115.11 122.27 1biq h GLN 282 Ca 0.01 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.37 1biq h GLN 282 Cb 0.84 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.52 1biq h GLN 282 CO 0.06 0.90 0.08 0.93 -0.67 0.00 0.00 178.83 180.13 1biq h GLU 283 N 0.69 0.88 0.09 1.46 4.39 -0.55 -2.36 114.58 119.18 1biq h GLU 283 Ca 0.13 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 1biq h GLU 283 Cb 0.53 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1biq h GLU 283 CO 0.03 0.83 -0.04 0.87 -1.16 0.00 0.00 179.01 179.53 1biq h LYS 284 N 0.83 -0.12 -0.90 2.33 1.57 -1.05 -3.01 116.57 116.22 1biq h LYS 284 Ca 0.17 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 59.14 1biq h LYS 284 Cb 0.38 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.65 1biq h LYS 284 CO 0.01 0.10 0.58 -0.44 -0.57 0.00 0.00 179.45 179.13 1biq h ASP 285 N -0.32 0.54 -0.98 0.86 3.32 -0.67 -1.19 116.42 117.99 1biq h ASP 285 Ca -0.01 0.05 0.19 0.00 0.02 0.00 0.00 57.03 57.28 1biq h ASP 285 Cb 0.27 -0.05 -0.11 0.00 0.22 0.00 0.00 39.33 39.66 1biq h ASP 285 CO 0.02 0.24 0.57 -0.25 -1.72 0.00 0.00 179.24 178.10 1biq h TRP 286 N 0.55 1.00 -0.96 4.55 2.91 -1.28 -1.11 115.95 121.61 1biq h TRP 286 Ca 0.47 0.03 0.24 0.00 1.13 0.00 0.00 58.89 60.76 1biq h TRP 286 Cb 0.96 -0.29 -0.13 0.00 -0.51 0.00 0.00 29.16 29.19 1biq h TRP 286 CO -0.00 0.20 0.51 0.00 -1.03 0.00 0.00 178.44 178.11 1biq h ALA 287 N 1.65 1.65 -0.04 2.65 0.00 -1.28 0.85 119.26 124.74 1biq h ALA 287 Ca 0.57 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.64 1biq h ALA 287 Cb 0.90 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1biq h ALA 287 CO -0.40 -0.32 0.07 -0.44 0.00 0.00 0.00 179.25 178.16 1biq h ASP 288 N 0.48 0.00 0.12 0.00 3.32 -1.34 -1.97 116.42 117.04 1biq h ASP 288 Ca 0.62 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 57.31 1biq h ASP 288 Cb 1.19 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.69 1biq h ASP 288 CO -0.51 0.00 -2.19 0.00 -1.72 0.00 0.00 179.24 174.82 1biq n TYR 289 N -3.53 0.51 -0.30 4.55 9.36 0.29 -3.99 117.16 124.04 1biq n TYR 289 Ca -0.02 0.13 -0.04 0.00 3.32 0.00 0.00 57.90 61.29 1biq n TYR 289 Cb 0.15 -1.08 0.07 0.00 -0.63 0.00 0.00 39.34 37.86 1biq n TYR 289 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1biq h LEU 290 N 0.02 1.00 -3.62 2.98 5.85 -0.78 -2.62 115.31 118.14 1biq h LEU 290 Ca -0.48 -0.08 -0.34 0.00 0.84 0.00 0.00 57.88 57.82 1biq h LEU 290 Cb 2.04 -0.25 -0.20 0.00 0.37 0.00 0.00 40.66 42.61 1biq h LEU 290 CO 0.02 0.79 0.43 0.49 -0.34 0.00 0.00 178.44 179.82 1biq n PHE 291 N -4.43 2.47 0.06 1.25 3.72 -0.78 -4.38 117.46 115.37 1biq n PHE 291 Ca 0.08 -1.41 -0.15 0.00 -0.05 0.00 0.00 57.45 55.92 1biq n PHE 291 Cb 0.07 -0.76 -0.08 0.00 -0.94 0.00 0.00 39.48 37.77 1biq n PHE 291 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1biq h ARG 292 N 1.56 -0.61 -0.70 -1.08 2.43 -1.60 -1.58 114.38 112.80 1biq h ARG 292 Ca 0.41 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 1biq h ARG 292 Cb 2.43 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 32.12 1biq h ARG 292 CO 0.83 -0.41 0.00 -0.25 -1.51 0.00 0.00 179.97 178.64 1biq n ASP 293 N -5.46 3.75 0.00 -3.80 8.00 -1.26 -5.00 116.55 112.78 1biq n ASP 293 Ca -0.07 -2.50 0.00 0.00 0.71 0.00 0.00 54.79 52.94 1biq n ASP 293 Cb 0.39 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 1biq n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1biq n GLY 294 N 0.52 3.00 0.00 0.44 0.00 -0.60 -4.80 105.19 103.76 1biq n GLY 294 Ca 0.17 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1biq n GLY 294 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1biq n SER 295 N 0.00 0.00 -4.08 1.61 3.41 -1.26 -4.47 113.62 108.83 1biq n SER 295 Ca 0.00 -0.76 -0.10 0.00 -0.26 0.00 0.00 58.87 57.75 1biq n SER 295 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1biq n SER 295 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1biq s MET 296 N -1.23 0.58 0.00 4.33 -1.94 -0.96 -4.91 119.30 115.17 1biq s MET 296 Ca 0.00 -0.98 -0.30 0.00 -1.71 0.00 0.00 55.69 52.70 1biq s MET 296 Cb 0.00 -0.07 -0.07 0.00 2.01 0.00 0.00 34.83 36.70 1biq s MET 296 CO 0.00 -0.03 1.80 0.42 -0.01 0.00 0.00 175.02 177.20 1biq s ILE 297 N -2.57 3.24 0.00 2.53 1.01 -1.26 -1.45 121.20 122.71 1biq s ILE 297 Ca -0.02 0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.99 1biq s ILE 297 Cb -0.02 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.22 1biq s ILE 297 CO -0.04 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.49 1biq n GLY 298 N 4.30 0.61 3.40 6.18 0.00 -1.26 -5.03 105.19 113.40 1biq n GLY 298 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 1biq n GLY 298 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1biq s LEU 299 N 0.00 -0.82 0.30 0.99 2.96 -0.53 -5.01 118.68 116.58 1biq s LEU 299 Ca 0.00 1.20 -0.12 0.00 -0.22 0.00 0.00 54.13 54.99 1biq s LEU 299 Cb 0.00 1.69 0.01 0.00 0.50 0.00 0.00 46.19 48.39 1biq s LEU 299 CO 0.00 -0.23 0.57 0.54 -1.32 0.00 0.00 176.35 175.91 1biq s ASN 300 N 2.71 0.17 0.38 3.68 2.20 -1.26 -2.25 114.94 120.56 1biq s ASN 300 Ca -0.03 -1.08 0.11 0.00 -0.94 0.00 0.00 52.86 50.92 1biq s ASN 300 Cb -0.12 0.68 0.90 0.00 -2.00 0.00 0.00 41.25 40.71 1biq s ASN 300 CO -0.15 -1.32 1.89 0.50 -2.94 0.00 0.00 177.10 175.08 1biq h LYS 301 N 2.13 0.57 0.41 3.55 1.63 -1.99 -0.82 116.57 122.06 1biq h LYS 301 Ca -0.27 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.48 1biq h LYS 301 Cb 1.25 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 1biq h LYS 301 CO 0.36 0.38 -0.20 -0.44 -3.45 0.00 0.00 179.45 176.10 1biq h ASP 302 N 0.59 -0.47 -0.55 4.20 5.19 -1.99 0.34 116.42 123.73 1biq h ASP 302 Ca 0.41 0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.77 1biq h ASP 302 Cb 0.75 0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.35 1biq h ASP 302 CO -0.17 -0.33 0.11 0.40 -3.12 0.00 0.00 179.24 176.13 1biq h ILE 303 N -0.55 1.25 0.64 0.35 2.04 -1.80 -2.66 117.51 116.78 1biq h ILE 303 Ca -0.06 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 64.84 1biq h ILE 303 Cb 0.42 0.68 0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1biq h ILE 303 CO 0.09 0.35 -0.31 0.25 0.00 0.00 0.00 178.15 178.53 1biq h LEU 304 N 0.89 -0.73 -0.73 1.44 7.12 -1.08 -0.99 115.31 121.23 1biq h LEU 304 Ca 0.19 0.02 0.15 0.00 0.13 0.00 0.00 57.88 58.36 1biq h LEU 304 Cb 0.37 0.19 -0.10 0.00 -0.53 0.00 0.00 40.66 40.59 1biq h LEU 304 CO 0.01 -0.50 0.23 0.00 -0.13 0.00 0.00 178.44 178.05 1biq h GLN 306 N 0.35 0.72 -0.52 0.00 4.20 -1.36 -2.13 115.11 116.38 1biq h GLN 306 Ca 0.41 -0.25 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 1biq h GLN 306 Cb 0.65 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 1biq h GLN 306 CO -0.45 0.84 0.03 -0.92 -0.67 0.00 0.00 178.83 177.66 1biq h TYR 307 N 0.65 0.97 -0.59 2.96 3.20 0.03 -0.12 116.97 124.07 1biq h TYR 307 Ca 0.10 -0.16 0.06 0.00 3.14 0.00 0.00 58.73 61.87 1biq h TYR 307 Cb 0.63 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 1biq h TYR 307 CO 0.03 0.89 0.30 0.28 -1.64 0.00 0.00 178.16 178.02 1biq h VAL 308 N 0.77 0.94 -0.28 1.81 2.07 -0.74 -0.54 116.25 120.28 1biq h VAL 308 Ca 0.15 -0.19 -0.15 0.00 0.82 0.00 0.00 66.70 67.32 1biq h VAL 308 Cb 0.49 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1biq h VAL 308 CO 0.02 0.10 -0.44 -0.33 0.02 0.00 0.00 177.57 176.95 1biq h GLU 309 N 0.56 0.71 0.40 1.57 5.08 -1.12 -1.53 114.58 120.27 1biq h GLU 309 Ca 0.26 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1biq h GLU 309 Cb 0.18 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1biq h GLU 309 CO -0.19 1.01 -0.33 -0.92 -1.00 0.00 0.00 179.01 177.58 1biq h TYR 310 N 0.57 -0.89 -0.10 4.33 3.20 -0.45 -2.46 116.97 121.18 1biq h TYR 310 Ca 0.04 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.76 1biq h TYR 310 Cb 0.99 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.58 1biq h TYR 310 CO 0.05 -0.48 -0.60 0.97 -1.64 0.00 0.00 178.16 176.46 1biq h ILE 311 N -0.74 1.37 -0.68 1.81 6.09 -1.10 -2.93 117.51 121.33 1biq h ILE 311 Ca -0.03 -1.94 0.04 0.00 -1.37 0.00 0.00 64.86 61.56 1biq h ILE 311 Cb 0.64 1.95 -0.05 0.00 0.47 0.00 0.00 36.82 39.83 1biq h ILE 311 CO -0.02 0.58 0.41 0.74 -3.07 0.00 0.00 178.15 176.79 1biq h THR 312 N 0.25 1.05 -0.60 2.19 2.02 -1.23 -0.68 112.91 115.90 1biq h THR 312 Ca -0.00 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 1biq h THR 312 Cb 1.11 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1biq h THR 312 CO 0.10 0.14 0.27 0.78 0.37 0.00 0.00 175.52 177.18 1biq h ASN 313 N 0.79 0.80 -0.28 4.18 4.21 -1.31 -0.20 115.58 123.76 1biq h ASN 313 Ca 0.28 -0.15 -0.01 0.00 1.21 0.00 0.00 56.30 57.64 1biq h ASN 313 Cb 0.08 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.06 1biq h ASN 313 CO -0.13 0.73 0.14 0.40 -1.29 0.00 0.00 177.43 177.28 1biq h ILE 314 N 0.82 1.14 -0.60 2.81 2.04 -1.24 -1.68 117.51 120.81 1biq h ILE 314 Ca 0.20 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 1biq h ILE 314 Cb 0.16 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1biq h ILE 314 CO -0.02 0.14 0.06 0.03 0.00 0.00 0.00 178.15 178.36 1biq h ARG 315 N 0.33 1.01 -0.54 2.37 2.47 -0.86 -2.04 114.38 117.12 1biq h ARG 315 Ca 0.10 -0.29 -0.08 0.00 -1.26 0.00 0.00 59.98 58.45 1biq h ARG 315 Cb 0.09 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.28 1biq h ARG 315 CO -0.01 0.97 0.03 0.52 0.56 0.00 0.00 179.97 182.03 1biq h MET 316 N 0.91 0.89 -0.35 0.04 2.86 -0.98 -2.00 114.93 116.31 1biq h MET 316 Ca 0.18 -0.24 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 1biq h MET 316 Cb 0.48 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 1biq h MET 316 CO 0.02 0.87 -0.12 0.37 1.06 0.00 0.00 176.91 179.12 1biq h GLN 317 N 0.83 0.60 0.00 1.72 4.15 -1.12 0.12 115.11 121.41 1biq h GLN 317 Ca 0.16 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 1biq h GLN 317 Cb 0.46 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.09 1biq h GLN 317 CO 0.02 0.70 -0.04 0.00 -1.93 0.00 0.00 178.83 177.58 1biq h ALA 318 N 1.33 1.36 -0.37 3.38 0.00 -0.62 -1.78 119.26 122.55 1biq h ALA 318 Ca 0.10 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1biq h ALA 318 Cb 0.52 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 1biq h ALA 318 CO 0.03 0.05 0.03 1.33 0.00 0.00 0.00 179.25 180.70 1biq n VAL 319 N -3.66 2.48 -1.20 0.00 0.24 -1.00 -4.97 118.33 110.21 1biq n VAL 319 Ca -0.03 -2.02 -0.07 0.00 -2.04 0.00 0.00 64.34 60.19 1biq n VAL 319 Cb 0.14 -0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 32.19 1biq n VAL 319 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1biq n GLY 320 N -0.56 0.92 3.95 7.63 0.00 -0.67 -4.98 105.19 111.48 1biq n GLY 320 Ca 0.28 -0.64 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 1biq n GLY 320 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1biq s LEU 321 N -1.60 3.90 0.41 0.99 1.43 0.40 -4.99 118.68 119.21 1biq s LEU 321 Ca 0.00 0.32 -0.25 0.00 -1.03 0.00 0.00 54.13 53.17 1biq s LEU 321 Cb 0.00 -3.19 -0.08 0.00 0.03 0.00 0.00 46.19 42.94 1biq s LEU 321 CO 0.00 -0.43 1.14 -1.81 0.23 0.00 0.00 176.35 175.48 1biq s ASP 322 N -4.11 6.53 -0.31 2.29 1.01 -1.26 -4.01 116.67 116.81 1biq s ASP 322 Ca 0.43 2.28 -0.27 0.00 0.71 0.00 0.00 52.55 55.70 1biq s ASP 322 Cb -0.10 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.24 1biq s ASP 322 CO 0.36 -0.67 0.98 -0.76 0.21 0.00 0.00 175.17 175.29 1biq s LEU 323 N -2.58 3.99 0.39 1.23 1.43 -1.26 -4.88 118.68 117.01 1biq s LEU 323 Ca 0.58 0.93 0.21 0.00 -1.03 0.00 0.00 54.13 54.82 1biq s LEU 323 Cb -0.29 -3.39 0.46 0.00 0.03 0.00 0.00 46.19 43.00 1biq s LEU 323 CO 0.36 -0.79 1.63 1.55 0.23 0.00 0.00 176.35 179.33 1biq h PRO 324 N 8.08 0.00 -6.21 1.29 0.13 -1.94 -3.47 132.00 129.88 1biq h PRO 324 Ca -0.22 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.42 1biq h PRO 324 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 1biq h PRO 324 CO 0.98 0.22 -0.44 -0.06 -0.23 0.00 0.00 178.00 178.47 1biq s PHE 325 N -3.26 2.95 0.36 1.56 0.08 -1.26 -5.08 117.98 113.34 1biq s PHE 325 Ca 0.04 -0.27 -0.27 0.00 0.12 0.00 0.00 56.93 56.55 1biq s PHE 325 Cb 0.07 -1.78 -0.09 0.00 -0.57 0.00 0.00 43.02 40.65 1biq s PHE 325 CO 0.68 0.19 1.24 -1.14 -0.10 0.00 0.00 175.22 176.09 1biq s GLN 326 N -4.00 4.22 0.69 0.44 2.00 -1.26 -4.99 119.66 116.75 1biq s GLN 326 Ca 0.41 2.05 -0.15 0.00 -2.00 0.00 0.00 55.36 55.67 1biq s GLN 326 Cb -0.06 -2.91 0.02 0.00 0.80 0.00 0.00 33.01 30.86 1biq s GLN 326 CO 0.27 -0.24 1.16 0.99 -0.50 0.00 0.00 175.29 176.96 1biq s THR 327 N -1.24 2.78 -0.05 -0.34 2.01 -1.26 -4.90 115.64 112.64 1biq s THR 327 Ca 0.52 0.38 -0.31 0.00 0.31 0.00 0.00 61.69 62.59 1biq s THR 327 Cb -0.36 -2.91 0.11 0.00 0.01 0.00 0.00 72.50 69.35 1biq s THR 327 CO 0.47 -0.22 1.06 0.00 -0.69 0.00 0.00 174.62 175.24 1biq s ARG 328 N -4.00 0.64 0.70 4.92 1.70 -1.26 -5.14 118.95 116.51 1biq s ARG 328 Ca 0.70 -0.27 -0.11 0.00 -0.47 0.00 0.00 55.73 55.58 1biq s ARG 328 Cb -0.25 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.41 1biq s ARG 328 CO 0.43 -0.29 1.06 0.45 -1.08 0.00 0.00 175.30 175.88 1biq s SER 329 N -2.50 5.42 0.07 -2.89 0.15 -1.26 -4.92 113.70 107.77 1biq s SER 329 Ca 0.09 1.47 -0.31 0.00 0.70 0.00 0.00 55.95 57.89 1biq s SER 329 Cb -0.00 -2.36 -0.10 0.00 -1.71 0.00 0.00 66.02 61.85 1biq s SER 329 CO -0.05 -1.40 1.88 -3.20 1.20 0.00 0.00 173.24 171.67 1biq n ASN 330 N -3.09 3.95 0.00 5.45 2.85 -1.26 -4.86 115.26 118.30 1biq n ASN 330 Ca 0.07 0.96 0.12 0.00 -0.11 0.00 0.00 54.58 55.63 1biq n ASN 330 Cb 0.54 -1.51 0.65 0.00 1.24 0.00 0.00 39.78 40.71 1biq n ASN 330 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1biq n PRO 331 N 6.30 0.40 -3.02 1.20 -0.04 -1.26 -4.01 135.00 134.58 1biq n PRO 331 Ca 0.19 0.04 -0.18 0.00 -0.04 0.00 0.00 63.50 63.52 1biq n PRO 331 Cb 0.37 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 1biq n PRO 331 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1biq n ILE 332 N -1.26 -0.42 0.31 0.52 -5.35 -1.26 -4.99 119.36 106.90 1biq n ILE 332 Ca 0.13 -3.02 0.17 0.00 -0.27 0.00 0.00 62.75 59.75 1biq n ILE 332 Cb 0.19 -0.58 0.98 0.00 -1.74 0.00 0.00 39.64 38.49 1biq n ILE 332 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1biq h PRO 333 N 3.99 0.00 0.00 6.28 0.13 -1.99 -1.96 132.00 138.45 1biq h PRO 333 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1biq h PRO 333 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1biq h PRO 333 CO 0.41 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.51 1biq n TRP 334 N -3.66 0.00 0.09 1.56 4.27 -1.26 -1.36 117.44 117.07 1biq n TRP 334 Ca -0.03 0.00 -0.05 0.00 -3.89 0.00 0.00 57.50 53.53 1biq n TRP 334 Cb 0.08 -0.48 -0.01 0.00 -1.36 0.00 0.00 31.31 29.54 1biq n TRP 334 CO 0.00 0.00 0.00 -0.84 -2.29 0.00 0.00 177.69 174.56 1biq h ILE 335 N 0.00 1.59 -0.37 -1.67 3.07 -1.79 -3.25 117.51 115.09 1biq h ILE 335 Ca 0.00 -2.94 0.11 0.00 1.55 0.00 0.00 64.86 63.58 1biq h ILE 335 Cb 0.01 2.59 -0.01 0.00 -0.27 0.00 0.00 36.82 39.14 1biq h ILE 335 CO 0.00 0.83 0.34 0.78 -1.05 0.00 0.00 178.15 179.05 1biq h ASN 336 N 0.00 0.00 0.33 2.16 2.35 -1.43 -1.97 115.58 117.02 1biq h ASN 336 Ca -0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1biq h ASN 336 Cb 1.53 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.88 1biq h ASN 336 CO 0.11 0.00 -0.28 0.74 -1.65 0.00 0.00 177.43 176.35 1biq h THR 337 N 0.00 0.42 0.00 2.81 2.02 -1.75 0.34 112.91 116.75 1biq h THR 337 Ca 0.18 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.35 1biq h THR 337 Cb 0.85 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1biq h THR 337 CO -0.00 0.00 -0.03 -0.50 0.37 0.00 0.00 175.52 175.36 1biq h TRP 338 N -0.62 0.00 0.16 3.16 4.06 -1.58 -3.16 115.95 117.96 1biq h TRP 338 Ca -0.02 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.58 1biq h TRP 338 Cb 0.55 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.71 1biq h TRP 338 CO -0.15 0.03 -1.75 -0.07 -3.56 0.00 0.00 178.44 172.94 1biq h LEU 339 N 0.00 0.52 0.00 -4.49 4.07 -1.06 -3.46 115.31 110.89 1biq h LEU 339 Ca -0.00 -0.82 0.00 0.00 0.08 0.00 0.00 57.88 57.14 1biq h LEU 339 Cb 0.59 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1biq h LEU 339 CO 0.00 1.70 0.00 0.55 -1.08 0.00 0.00 178.44 179.61