#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wbw s ARG 5 N 0.00 4.36 0.95 5.31 3.52 -1.26 -5.03 118.95 126.80 1wbw s ARG 5 Ca 0.00 1.71 -0.12 0.00 -0.13 0.00 0.00 55.73 57.18 1wbw s ARG 5 Cb 0.00 -3.53 0.16 0.00 -1.56 0.00 0.00 34.95 30.02 1wbw s ARG 5 CO 0.00 -0.43 1.12 -1.25 -0.81 0.00 0.00 175.30 173.93 1wbw s PRO 6 N 2.08 0.79 0.12 5.12 0.04 -1.26 -5.02 135.00 136.88 1wbw s PRO 6 Ca 0.57 0.36 -0.21 0.00 0.04 0.00 0.00 61.00 61.76 1wbw s PRO 6 Cb -0.26 -1.79 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 1wbw s PRO 6 CO 0.23 -2.45 0.65 0.99 0.04 0.00 0.00 177.00 176.46 1wbw s THR 7 N -3.16 4.62 0.12 1.26 2.01 -1.26 -5.01 115.64 114.23 1wbw s THR 7 Ca 0.65 1.34 0.05 0.00 0.31 0.00 0.00 61.69 64.04 1wbw s THR 7 Cb -0.16 -3.95 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1wbw s THR 7 CO 0.55 0.48 0.02 -0.36 -0.69 0.00 0.00 174.62 174.63 1wbw s PHE 8 N -1.20 2.98 0.16 4.92 0.40 -1.26 -1.82 117.98 122.17 1wbw s PHE 8 Ca 0.33 -0.05 0.07 0.00 -0.60 0.00 0.00 56.93 56.69 1wbw s PHE 8 Cb -0.20 -1.49 -0.04 0.00 0.51 0.00 0.00 43.02 41.79 1wbw s PHE 8 CO 0.21 0.50 -0.16 1.52 0.70 0.00 0.00 175.22 177.99 1wbw s TYR 9 N -1.49 1.65 -0.06 0.36 1.13 -0.56 -4.89 117.35 113.50 1wbw s TYR 9 Ca 0.27 -0.53 0.04 0.00 -1.41 0.00 0.00 57.07 55.44 1wbw s TYR 9 Cb -0.11 -0.82 -0.02 0.00 -1.10 0.00 0.00 41.96 39.91 1wbw s TYR 9 CO 0.19 0.28 -0.18 0.50 -2.51 0.00 0.00 175.55 173.84 1wbw s ARG 10 N -3.06 2.55 -0.12 -3.49 3.52 -1.26 -2.11 118.95 114.99 1wbw s ARG 10 Ca 0.16 -0.76 -0.23 0.00 -0.13 0.00 0.00 55.73 54.77 1wbw s ARG 10 Cb -0.04 -2.32 0.05 0.00 -1.56 0.00 0.00 34.95 31.09 1wbw s ARG 10 CO 0.05 0.53 0.55 1.14 -0.81 0.00 0.00 175.30 176.77 1wbw s GLN 11 N -0.49 0.80 -0.21 5.12 -2.07 -0.26 -4.98 119.66 117.57 1wbw s GLN 11 Ca 0.06 0.41 -0.24 0.00 -1.82 0.00 0.00 55.36 53.77 1wbw s GLN 11 Cb -0.12 0.38 -0.01 0.00 -1.09 0.00 0.00 33.01 32.17 1wbw s GLN 11 CO 0.01 -0.19 0.81 -2.00 -1.32 0.00 0.00 175.29 172.61 1wbw s GLU 12 N -0.54 4.24 -0.36 9.60 2.12 -1.26 0.25 118.70 132.74 1wbw s GLU 12 Ca -0.07 0.94 0.00 0.00 0.36 0.00 0.00 54.97 56.21 1wbw s GLU 12 Cb -0.03 -3.61 0.12 0.00 0.26 0.00 0.00 34.13 30.87 1wbw s GLU 12 CO 0.05 -0.40 0.15 -0.51 -0.54 0.00 0.00 175.26 174.01 1wbw s LEU 13 N 2.44 2.35 -0.45 2.70 1.02 0.94 -4.89 118.68 122.79 1wbw s LEU 13 Ca 0.36 -2.04 -0.24 0.00 0.02 0.00 0.00 54.13 52.23 1wbw s LEU 13 Cb -0.16 -0.90 0.03 0.00 0.02 0.00 0.00 46.19 45.18 1wbw s LEU 13 CO 0.10 -0.35 0.63 0.59 0.02 0.00 0.00 176.35 177.33 1wbw n ASN 14 N 4.32 -6.99 0.00 2.29 4.13 -1.26 -3.65 115.26 114.10 1wbw n ASN 14 Ca 0.03 0.24 0.00 0.00 1.68 0.00 0.00 54.58 56.53 1wbw n ASN 14 Cb 0.39 -3.93 0.00 0.00 -1.54 0.00 0.00 39.78 34.70 1wbw n ASN 14 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1wbw n LYS 15 N -0.32 0.00 -4.63 3.52 5.02 -1.26 -4.91 118.16 115.58 1wbw n LYS 15 Ca 0.03 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.05 1wbw n LYS 15 Cb 0.55 -2.68 -0.14 0.00 -0.02 0.00 0.00 35.03 32.74 1wbw n LYS 15 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1wbw s THR 16 N -1.61 1.87 -0.42 -0.18 -1.32 -1.24 -5.11 115.64 107.62 1wbw s THR 16 Ca 0.00 -1.37 -0.23 0.00 -1.21 0.00 0.00 61.69 58.89 1wbw s THR 16 Cb 0.00 -1.63 0.02 0.00 -1.51 0.00 0.00 72.50 69.38 1wbw s THR 16 CO 0.00 0.20 0.75 0.27 -2.21 0.00 0.00 174.62 173.63 1wbw s ILE 17 N -0.88 4.71 -0.20 5.08 -0.00 -1.26 -0.04 121.20 128.60 1wbw s ILE 17 Ca 0.09 0.49 -0.17 0.00 -0.00 0.00 0.00 60.65 61.06 1wbw s ILE 17 Cb -0.09 -4.26 -0.03 0.00 -0.00 0.00 0.00 42.46 38.07 1wbw s ILE 17 CO 0.03 -0.61 0.47 0.26 -0.00 0.00 0.00 174.94 175.08 1wbw s TRP 18 N 3.14 3.37 -0.32 1.37 0.52 0.14 -4.90 118.94 122.27 1wbw s TRP 18 Ca 0.29 0.70 -0.01 0.00 0.02 0.00 0.00 56.10 57.10 1wbw s TRP 18 Cb -0.13 -2.61 0.06 0.00 -1.15 0.00 0.00 33.47 29.64 1wbw s TRP 18 CO 0.20 -0.07 0.02 -2.00 0.02 0.00 0.00 176.95 175.13 1wbw s GLU 19 N 1.52 2.29 0.07 4.98 2.12 -1.26 -1.10 118.70 127.32 1wbw s GLU 19 Ca 0.22 -1.39 0.02 0.00 0.36 0.00 0.00 54.97 54.18 1wbw s GLU 19 Cb -0.15 -3.22 -0.03 0.00 0.26 0.00 0.00 34.13 30.99 1wbw s GLU 19 CO 0.09 -0.70 -0.08 0.14 -0.54 0.00 0.00 175.26 174.17 1wbw s VAL 20 N 1.20 0.69 0.45 3.70 -7.23 -0.89 -4.60 120.40 113.72 1wbw s VAL 20 Ca -0.02 -1.50 -0.25 0.00 -1.81 0.00 0.00 61.98 58.39 1wbw s VAL 20 Cb -0.20 -1.16 -0.08 0.00 0.56 0.00 0.00 36.38 35.50 1wbw s VAL 20 CO -0.02 -0.59 1.36 -2.84 -0.31 0.00 0.00 175.10 172.70 1wbw s PRO 21 N -2.64 3.69 0.49 4.82 0.02 -1.26 -1.49 135.00 138.62 1wbw s PRO 21 Ca 0.01 2.26 0.28 0.00 0.02 0.00 0.00 61.00 63.58 1wbw s PRO 21 Cb -0.03 -2.60 1.36 0.00 0.02 0.00 0.00 34.50 33.24 1wbw s PRO 21 CO -0.02 -0.76 1.82 0.93 -0.33 0.00 0.00 177.00 178.64 1wbw h GLU 22 N 2.27 0.15 -1.07 5.54 5.08 -1.70 -0.85 114.58 124.00 1wbw h GLU 22 Ca -0.50 -0.01 0.29 0.00 -1.00 0.00 0.00 59.36 58.13 1wbw h GLU 22 Cb 1.26 -0.03 -0.10 0.00 0.50 0.00 0.00 28.75 30.38 1wbw h GLU 22 CO 0.61 0.10 0.69 0.07 -1.00 0.00 0.00 179.01 179.48 1wbw h ARG 23 N 0.16 0.35 -5.65 2.33 0.11 -1.90 -3.38 114.38 106.39 1wbw h ARG 23 Ca 0.53 -0.02 -0.62 0.00 0.10 0.00 0.00 59.98 59.97 1wbw h ARG 23 Cb 1.79 -0.08 -0.12 0.00 1.11 0.00 0.00 29.97 32.67 1wbw h ARG 23 CO -0.11 0.23 0.28 0.71 0.10 0.00 0.00 179.97 181.18 1wbw s TYR 24 N -5.47 3.16 0.29 4.08 2.02 -0.32 -1.33 117.35 119.78 1wbw s TYR 24 Ca -0.09 0.57 0.10 0.00 -0.37 0.00 0.00 57.07 57.28 1wbw s TYR 24 Cb 0.26 -3.21 -0.06 0.00 -0.40 0.00 0.00 41.96 38.55 1wbw s TYR 24 CO 0.80 -0.61 -0.13 -0.65 -1.57 0.00 0.00 175.55 173.39 1wbw s GLN 25 N 2.87 1.66 -1.09 -0.62 -1.52 0.20 -4.86 119.66 116.30 1wbw s GLN 25 Ca 0.29 -1.81 -0.03 0.00 -1.95 0.00 0.00 55.36 51.85 1wbw s GLN 25 Cb -0.14 -1.55 0.00 0.00 -0.22 0.00 0.00 33.01 31.10 1wbw s GLN 25 CO 0.14 0.19 0.93 0.09 -0.25 0.00 0.00 175.29 176.39 1wbw n ASN 26 N -0.65 -3.63 -4.72 5.90 3.02 -1.26 0.64 115.26 114.57 1wbw n ASN 26 Ca -0.05 -0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 53.57 1wbw n ASN 26 Cb 0.62 -4.44 -0.03 0.00 -0.61 0.00 0.00 39.78 35.31 1wbw n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wbw s LEU 27 N -6.04 4.38 -0.06 3.41 1.02 -1.25 -4.31 118.68 115.83 1wbw s LEU 27 Ca 0.21 2.22 -0.05 0.00 0.02 0.00 0.00 54.13 56.54 1wbw s LEU 27 Cb -0.09 -3.59 0.02 0.00 0.02 0.00 0.00 46.19 42.55 1wbw s LEU 27 CO 0.63 -0.56 0.15 -0.94 0.02 0.00 0.00 176.35 175.65 1wbw s SER 28 N 0.95 -0.15 0.19 2.29 1.04 -1.02 -4.99 113.70 112.01 1wbw s SER 28 Ca 0.61 0.30 -0.30 0.00 0.48 0.00 0.00 55.95 57.04 1wbw s SER 28 Cb -0.34 0.28 -0.17 0.00 0.10 0.00 0.00 66.02 65.90 1wbw s SER 28 CO 0.31 -0.07 0.76 -2.65 0.98 0.00 0.00 173.24 172.57 1wbw n PRO 29 N 3.19 0.38 -4.31 4.02 -0.02 -1.26 -1.82 135.00 135.18 1wbw n PRO 29 Ca -0.15 0.13 -0.16 0.00 -2.02 0.00 0.00 63.50 61.30 1wbw n PRO 29 Cb 0.58 -1.32 -0.10 0.00 -0.02 0.00 0.00 33.50 32.63 1wbw n PRO 29 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1wbw s VAL 30 N -0.78 0.51 0.00 -1.45 0.11 -0.17 -4.75 120.40 113.87 1wbw s VAL 30 Ca 0.68 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 57.73 1wbw s VAL 30 Cb -0.93 -2.62 0.00 0.00 -1.53 0.00 0.00 36.38 31.30 1wbw s VAL 30 CO 0.56 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.94 1wbw n GLY 31 N -0.46 1.20 0.00 6.54 0.00 -1.26 -3.97 105.19 107.24 1wbw n GLY 31 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1wbw n GLY 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wbw n SER 32 N 8.18 0.00 0.00 1.61 3.41 -1.26 -4.85 113.62 120.71 1wbw n SER 32 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1wbw n SER 32 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1wbw n SER 32 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wbw n GLY 33 N 0.00 0.76 0.11 5.00 0.00 -1.25 -4.95 105.19 104.85 1wbw n GLY 33 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1wbw n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbw h ALA 34 N 0.00 0.59 -0.47 4.61 0.00 -1.89 -3.24 119.26 118.86 1wbw h ALA 34 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1wbw h ALA 34 Cb 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1wbw h ALA 34 CO 0.00 0.89 0.00 0.66 0.00 0.00 0.00 179.25 180.80 1wbw n TYR 35 N -3.35 0.62 0.00 0.00 4.01 -1.26 -5.08 117.16 112.09 1wbw n TYR 35 Ca 0.01 -0.35 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 1wbw n TYR 35 Cb 0.79 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.82 1wbw n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wbw n GLY 36 N 1.36 -1.50 3.56 2.72 0.00 -1.22 -4.72 105.19 105.39 1wbw n GLY 36 Ca 0.19 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 1wbw n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wbw s SER 37 N -4.00 5.77 -0.11 1.61 0.01 -1.26 -4.39 113.70 111.33 1wbw s SER 37 Ca 0.00 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.27 1wbw s SER 37 Cb 0.00 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.65 1wbw s SER 37 CO 0.00 -2.17 -0.17 -0.69 0.41 0.00 0.00 173.24 170.61 1wbw s VAL 38 N 7.72 2.67 -0.03 3.43 1.01 -1.26 -1.44 120.40 132.50 1wbw s VAL 38 Ca 0.59 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.80 1wbw s VAL 38 Cb -0.04 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1wbw s VAL 38 CO -0.05 0.54 -0.13 0.00 0.00 0.00 0.00 175.10 175.47 1wbw s ALA 40 N -0.80 3.01 0.17 0.00 0.00 -0.75 0.06 121.76 123.44 1wbw s ALA 40 Ca 0.13 0.20 -0.23 0.00 0.00 0.00 0.00 51.96 52.05 1wbw s ALA 40 Cb -0.11 -3.14 0.06 0.00 0.00 0.00 0.00 23.12 19.94 1wbw s ALA 40 CO 0.02 -0.37 0.70 0.00 0.00 0.00 0.00 175.76 176.11 1wbw s ALA 41 N -2.63 -1.54 -0.23 0.00 0.00 -0.26 -2.42 121.76 114.68 1wbw s ALA 41 Ca 0.59 0.33 -0.07 0.00 0.00 0.00 0.00 51.96 52.81 1wbw s ALA 41 Cb -0.11 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 1wbw s ALA 41 CO 0.34 -0.85 0.06 0.12 0.00 0.00 0.00 175.76 175.43 1wbw s PHE 42 N -3.68 3.10 -0.56 0.00 5.36 0.21 -1.89 117.98 120.53 1wbw s PHE 42 Ca 0.05 -0.33 -0.19 0.00 -0.96 0.00 0.00 56.93 55.50 1wbw s PHE 42 Cb -0.02 -2.19 0.09 0.00 -0.34 0.00 0.00 43.02 40.56 1wbw s PHE 42 CO -0.06 -0.24 0.67 0.34 -1.46 0.00 0.00 175.22 174.47 1wbw s ASP 43 N 1.29 6.20 0.47 6.13 2.15 -0.41 -0.62 116.67 131.87 1wbw s ASP 43 Ca 0.05 -1.26 0.26 0.00 0.43 0.00 0.00 52.55 52.03 1wbw s ASP 43 Cb -0.15 -2.30 1.09 0.00 -0.30 0.00 0.00 42.92 41.27 1wbw s ASP 43 CO 0.03 -1.04 1.89 0.71 -0.17 0.00 0.00 175.17 176.60 1wbw h THR 44 N 5.90 0.46 -0.12 1.71 1.35 -1.51 0.54 112.91 121.24 1wbw h THR 44 Ca -0.29 -0.93 -0.18 0.00 -0.55 0.00 0.00 66.41 64.47 1wbw h THR 44 Cb 1.09 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1wbw h THR 44 CO 1.05 0.17 -0.66 0.50 -0.25 0.00 0.00 175.52 176.33 1wbw h LYS 45 N 0.00 0.49 0.00 4.72 3.64 -1.92 -3.35 116.57 120.15 1wbw h LYS 45 Ca -0.00 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1wbw h LYS 45 Cb 0.64 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1wbw h LYS 45 CO 0.02 0.98 -1.10 0.25 -2.27 0.00 0.00 179.45 177.33 1wbw n THR 46 N -3.89 0.00 -0.98 1.00 -2.24 -0.96 -5.00 114.28 102.21 1wbw n THR 46 Ca -0.04 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1wbw n THR 46 Cb 0.67 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1wbw n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbw n GLY 47 N 1.54 0.48 3.88 3.38 0.00 0.18 -5.02 105.19 109.62 1wbw n GLY 47 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1wbw n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wbw s LEU 48 N 0.00 4.28 -0.13 0.99 1.43 -1.19 -4.89 118.68 119.17 1wbw s LEU 48 Ca 0.00 0.79 -0.17 0.00 -1.03 0.00 0.00 54.13 53.71 1wbw s LEU 48 Cb 0.00 -3.28 -0.04 0.00 0.03 0.00 0.00 46.19 42.89 1wbw s LEU 48 CO 0.00 0.07 0.45 -0.13 0.23 0.00 0.00 176.35 176.97 1wbw s ARG 49 N -2.37 4.32 0.09 1.70 0.52 -1.26 -1.29 118.95 120.66 1wbw s ARG 49 Ca 0.39 0.39 0.03 0.00 -0.52 0.00 0.00 55.73 56.03 1wbw s ARG 49 Cb -0.13 -3.44 -0.04 0.00 0.52 0.00 0.00 34.95 31.87 1wbw s ARG 49 CO 0.21 0.16 -0.10 0.14 0.02 0.00 0.00 175.30 175.73 1wbw s VAL 50 N 0.64 0.88 -0.14 3.52 -7.23 -0.79 -1.49 120.40 115.78 1wbw s VAL 50 Ca 0.24 -1.61 -0.06 0.00 -1.81 0.00 0.00 61.98 58.75 1wbw s VAL 50 Cb -0.15 -1.31 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 1wbw s VAL 50 CO 0.09 -0.56 0.06 0.00 -0.31 0.00 0.00 175.10 174.38 1wbw s ALA 51 N -2.43 3.48 -0.25 1.32 0.00 0.61 -1.11 121.76 123.39 1wbw s ALA 51 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.27 1wbw s ALA 51 Cb -0.03 -1.81 0.04 0.00 0.00 0.00 0.00 23.12 21.31 1wbw s ALA 51 CO -0.00 0.39 -0.09 0.08 0.00 0.00 0.00 175.76 176.14 1wbw s VAL 52 N -0.29 2.55 -0.24 0.00 1.01 0.11 -1.35 120.40 122.20 1wbw s VAL 52 Ca 0.08 -1.23 -0.11 0.00 0.00 0.00 0.00 61.98 60.73 1wbw s VAL 52 Cb -0.12 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.87 1wbw s VAL 52 CO 0.02 0.16 0.19 -0.75 0.00 0.00 0.00 175.10 174.71 1wbw s LYS 53 N 1.25 4.08 -0.29 2.72 2.20 0.65 -0.79 119.74 129.56 1wbw s LYS 53 Ca -0.02 -0.21 -0.14 0.00 -0.36 0.00 0.00 55.97 55.24 1wbw s LYS 53 Cb -0.17 -3.54 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 1wbw s LYS 53 CO -0.06 0.04 0.31 0.21 -0.36 0.00 0.00 175.35 175.49 1wbw s LYS 54 N 1.11 3.89 0.07 4.03 2.20 -0.52 -0.18 119.74 130.33 1wbw s LYS 54 Ca 0.09 -0.19 -0.31 0.00 -0.36 0.00 0.00 55.97 55.20 1wbw s LYS 54 Cb -0.14 -3.69 -0.07 0.00 -1.51 0.00 0.00 37.83 32.42 1wbw s LYS 54 CO 0.05 -0.30 1.38 -0.51 -0.36 0.00 0.00 175.35 175.61 1wbw s LEU 55 N 1.95 4.35 -0.26 5.43 1.43 -0.46 -4.26 118.68 126.86 1wbw s LEU 55 Ca 0.11 2.23 -0.29 0.00 -1.03 0.00 0.00 54.13 55.16 1wbw s LEU 55 Cb -0.16 -3.58 0.01 0.00 0.03 0.00 0.00 46.19 42.49 1wbw s LEU 55 CO 0.11 -0.66 1.14 -0.94 0.23 0.00 0.00 176.35 176.22 1wbw s SER 56 N 1.39 6.93 -0.82 2.29 1.04 -1.26 -4.36 113.70 118.92 1wbw s SER 56 Ca 0.64 1.28 -0.01 0.00 0.48 0.00 0.00 55.95 58.34 1wbw s SER 56 Cb -0.34 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.23 1wbw s SER 56 CO 0.29 -0.84 0.64 -1.14 0.98 0.00 0.00 173.24 173.17 1wbw n ARG 57 N 6.75 -1.44 0.22 4.02 3.00 -1.26 -4.84 116.66 123.10 1wbw n ARG 57 Ca 0.13 0.97 0.12 0.00 -0.00 0.00 0.00 57.85 59.07 1wbw n ARG 57 Cb 0.46 -3.45 0.18 0.00 0.00 0.00 0.00 32.46 29.65 1wbw n ARG 57 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1wbw h PRO 58 N -0.13 0.00 -0.16 -0.14 0.13 -1.80 -3.29 132.00 126.60 1wbw h PRO 58 Ca -0.44 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.55 1wbw h PRO 58 Cb 1.27 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.25 1wbw h PRO 58 CO 0.35 0.03 -0.66 1.19 -0.23 0.00 0.00 178.00 178.69 1wbw n PHE 59 N -3.11 0.58 0.20 1.56 3.72 -1.26 -2.54 117.46 116.62 1wbw n PHE 59 Ca 0.04 -1.54 0.07 0.00 -0.05 0.00 0.00 57.45 55.97 1wbw n PHE 59 Cb 0.53 -0.25 0.39 0.00 -0.94 0.00 0.00 39.48 39.21 1wbw n PHE 59 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1wbw h GLN 60 N 1.29 0.00 -4.19 -1.08 3.07 -1.92 -3.46 115.11 108.82 1wbw h GLN 60 Ca 0.04 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.56 1wbw h GLN 60 Cb 1.23 0.00 -0.11 0.00 0.08 0.00 0.00 27.48 28.68 1wbw h GLN 60 CO 0.17 0.33 -0.33 -1.54 0.09 0.00 0.00 178.83 177.55 1wbw s SER 61 N -6.42 0.45 0.21 0.06 1.04 -1.26 -5.01 113.70 102.77 1wbw s SER 61 Ca -0.00 -1.32 -0.06 0.00 0.48 0.00 0.00 55.95 55.05 1wbw s SER 61 Cb 0.11 0.55 0.17 0.00 0.10 0.00 0.00 66.02 66.95 1wbw s SER 61 CO 0.67 -1.09 1.66 0.40 0.98 0.00 0.00 173.24 175.87 1wbw h ILE 62 N 2.31 1.26 -0.35 -1.02 2.04 -1.94 0.13 117.51 119.94 1wbw h ILE 62 Ca -0.30 -1.18 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 1wbw h ILE 62 Cb 1.25 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1wbw h ILE 62 CO 0.42 0.41 0.21 0.40 0.00 0.00 0.00 178.15 179.59 1wbw h ILE 63 N 0.83 1.12 -0.29 -0.67 5.03 -1.96 -0.91 117.51 120.66 1wbw h ILE 63 Ca 0.14 -0.28 -0.15 0.00 -0.12 0.00 0.00 64.86 64.45 1wbw h ILE 63 Cb 0.59 0.67 -0.00 0.00 -3.03 0.00 0.00 36.82 35.05 1wbw h ILE 63 CO 0.04 0.12 -0.40 0.45 -0.68 0.00 0.00 178.15 177.68 1wbw h HIS 64 N 0.46 0.96 -0.45 1.37 3.86 -1.78 -1.74 115.15 117.83 1wbw h HIS 64 Ca 0.13 -0.32 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 1wbw h HIS 64 Cb 0.01 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.27 1wbw h HIS 64 CO -0.04 1.11 0.28 0.00 0.86 0.00 0.00 177.93 180.14 1wbw h ALA 65 N 0.69 0.57 -0.66 2.45 0.00 -0.45 -0.63 119.26 121.22 1wbw h ALA 65 Ca 0.03 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1wbw h ALA 65 Cb 0.99 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1wbw h ALA 65 CO 0.09 0.04 0.08 -0.22 0.00 0.00 0.00 179.25 179.24 1wbw h LYS 66 N 0.60 1.11 -0.51 0.00 3.64 -1.13 -1.48 116.57 118.80 1wbw h LYS 66 Ca 0.16 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1wbw h LYS 66 Cb -0.03 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 1wbw h LYS 66 CO -0.03 1.03 0.29 -0.09 -2.27 0.00 0.00 179.45 178.38 1wbw h ARG 67 N 1.03 0.71 -0.31 1.90 2.43 -1.07 0.35 114.38 119.42 1wbw h ARG 67 Ca 0.20 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1wbw h ARG 67 Cb 0.48 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 1wbw h ARG 67 CO 0.02 0.54 0.08 1.15 -1.51 0.00 0.00 179.97 180.25 1wbw h THR 68 N 0.68 0.87 -0.08 0.20 2.02 -1.01 -0.78 112.91 114.80 1wbw h THR 68 Ca 0.18 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.29 1wbw h THR 68 Cb 0.04 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1wbw h THR 68 CO -0.03 0.04 0.05 0.22 0.37 0.00 0.00 175.52 176.17 1wbw h TYR 69 N 0.19 0.11 -0.56 3.16 3.20 -0.93 -2.50 116.97 119.64 1wbw h TYR 69 Ca 0.14 0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.13 1wbw h TYR 69 Cb 0.14 -0.04 -0.10 0.00 1.54 0.00 0.00 36.73 38.28 1wbw h TYR 69 CO -0.16 0.08 -0.02 -0.09 -1.64 0.00 0.00 178.16 176.33 1wbw h ARG 70 N 0.10 0.09 -0.18 1.82 2.43 -0.09 -0.89 114.38 117.66 1wbw h ARG 70 Ca 0.03 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 1wbw h ARG 70 Cb 0.00 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1wbw h ARG 70 CO -0.01 0.06 -0.15 1.49 -1.51 0.00 0.00 179.97 179.86 1wbw h GLU 71 N 0.10 0.42 -0.37 0.20 4.81 -1.04 -1.44 114.58 117.26 1wbw h GLU 71 Ca 0.29 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1wbw h GLU 71 Cb 0.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 1wbw h GLU 71 CO -0.49 0.77 0.25 1.25 -0.73 0.00 0.00 179.01 180.05 1wbw h LEU 72 N 0.09 0.43 -0.03 1.64 5.85 -1.38 -1.06 115.31 120.84 1wbw h LEU 72 Ca 0.03 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1wbw h LEU 72 Cb 0.68 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1wbw h LEU 72 CO 0.04 0.31 -0.16 0.03 -0.34 0.00 0.00 178.44 178.32 1wbw h ARG 73 N 0.50 -0.24 -0.14 1.25 2.47 -1.06 -0.54 114.38 116.63 1wbw h ARG 73 Ca 0.14 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.88 1wbw h ARG 73 Cb -0.06 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 1wbw h ARG 73 CO -0.03 -0.16 0.07 1.25 0.56 0.00 0.00 179.97 181.66 1wbw h LEU 74 N -0.25 0.11 -0.90 3.04 5.85 -1.08 -2.37 115.31 119.71 1wbw h LEU 74 Ca 0.06 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1wbw h LEU 74 Cb 0.33 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1wbw h LEU 74 CO -0.18 0.08 0.02 -0.07 -0.34 0.00 0.00 178.44 177.96 1wbw h LEU 75 N 0.15 0.79 -1.69 2.25 4.07 -1.07 -2.42 115.31 117.39 1wbw h LEU 75 Ca 0.05 -0.19 -0.00 0.00 0.08 0.00 0.00 57.88 57.82 1wbw h LEU 75 Cb 0.00 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.52 1wbw h LEU 75 CO -0.03 0.84 0.15 0.11 -1.08 0.00 0.00 178.44 178.43 1wbw h LYS 76 N 0.77 0.35 -0.03 1.13 1.57 -0.89 -3.15 116.57 116.32 1wbw h LYS 76 Ca 0.15 -0.03 -0.22 0.00 -1.87 0.00 0.00 60.65 58.68 1wbw h LYS 76 Cb 0.44 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1wbw h LYS 76 CO 0.02 0.26 -0.89 1.25 -0.57 0.00 0.00 179.45 179.51 1wbw h HIS 77 N 0.36 0.68 -3.11 -1.35 2.76 -0.94 -3.45 115.15 110.10 1wbw h HIS 77 Ca 0.10 -0.35 -0.56 0.00 -2.20 0.00 0.00 60.37 57.35 1wbw h HIS 77 Cb -0.00 -0.09 -0.05 0.00 1.55 0.00 0.00 27.41 28.82 1wbw h HIS 77 CO 0.00 1.16 1.10 -1.64 -1.30 0.00 0.00 177.93 177.25 1wbw s MET 78 N -3.39 3.47 -0.60 5.26 -1.94 -1.06 -4.92 119.30 116.12 1wbw s MET 78 Ca -0.07 0.88 0.05 0.00 -1.71 0.00 0.00 55.69 54.84 1wbw s MET 78 Cb 0.09 -4.07 0.17 0.00 2.01 0.00 0.00 34.83 33.03 1wbw s MET 78 CO 0.87 -1.70 0.44 0.15 -0.01 0.00 0.00 175.02 174.77 1wbw s LYS 79 N 5.18 1.91 -0.06 2.03 1.02 -1.26 -4.45 119.74 124.10 1wbw s LYS 79 Ca 0.61 -2.91 -0.13 0.00 0.02 0.00 0.00 55.97 53.57 1wbw s LYS 79 Cb -0.14 -2.70 0.03 0.00 -0.52 0.00 0.00 37.83 34.50 1wbw s LYS 79 CO 0.31 -1.32 0.32 -1.58 -0.92 0.00 0.00 175.35 172.15 1wbw s HIS 80 N -0.92 -0.26 0.44 3.18 2.46 -1.26 -5.05 115.29 113.88 1wbw s HIS 80 Ca 0.28 0.54 0.12 0.00 0.47 0.00 0.00 55.06 56.46 1wbw s HIS 80 Cb -0.01 0.11 1.01 0.00 -0.13 0.00 0.00 32.58 33.55 1wbw s HIS 80 CO -0.18 -0.29 2.03 0.93 -2.47 0.00 0.00 174.74 174.76 1wbw h GLU 81 N 4.67 0.39 -0.71 2.88 5.08 -1.98 -2.62 114.58 122.29 1wbw h GLU 81 Ca -0.28 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 57.79 1wbw h GLU 81 Cb 1.18 -0.09 -0.16 0.00 0.50 0.00 0.00 28.75 30.19 1wbw h GLU 81 CO 0.35 0.26 0.29 0.09 -1.00 0.00 0.00 179.01 179.00 1wbw n ASN 82 N -4.48 4.18 -3.89 1.42 4.13 -1.26 -4.70 115.26 110.67 1wbw n ASN 82 Ca 0.06 -3.38 -0.11 0.00 1.68 0.00 0.00 54.58 52.82 1wbw n ASN 82 Cb 0.22 -0.74 -0.12 0.00 -1.54 0.00 0.00 39.78 37.60 1wbw n ASN 82 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1wbw s VAL 83 N -3.09 0.04 0.15 2.41 1.01 -0.99 -0.50 120.40 119.43 1wbw s VAL 83 Ca 0.53 -0.34 -0.34 0.00 0.00 0.00 0.00 61.98 61.83 1wbw s VAL 83 Cb 0.44 -0.19 -0.16 0.00 0.00 0.00 0.00 36.38 36.47 1wbw s VAL 83 CO 0.11 -0.19 1.12 0.00 0.00 0.00 0.00 175.10 176.14 1wbw n ILE 84 N 2.42 0.79 -4.32 2.22 3.06 -0.27 -4.53 119.36 118.74 1wbw n ILE 84 Ca -0.17 -0.20 -0.28 0.00 -2.50 0.00 0.00 62.75 59.60 1wbw n ILE 84 Cb 0.58 -0.69 -0.11 0.00 0.54 0.00 0.00 39.64 39.96 1wbw n ILE 84 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 1wbw s GLY 85 N -0.03 1.71 -0.38 4.50 0.00 -1.26 -4.74 107.32 107.12 1wbw s GLY 85 Ca 0.75 -1.44 -0.20 0.00 0.00 0.00 0.00 44.72 43.84 1wbw s GLY 85 CO 0.53 -1.44 0.60 -2.27 0.00 0.00 0.00 173.10 170.52 1wbw s LEU 86 N -2.45 4.35 0.09 0.66 0.20 -1.25 -4.58 118.68 115.70 1wbw s LEU 86 Ca 0.21 -0.03 -0.13 0.00 0.69 0.00 0.00 54.13 54.86 1wbw s LEU 86 Cb -0.10 -2.72 -0.20 0.00 -0.43 0.00 0.00 46.19 42.75 1wbw s LEU 86 CO 0.12 -0.61 1.24 -0.07 -0.29 0.00 0.00 176.35 176.74 1wbw h LEU 87 N 9.38 0.93 -7.00 -0.68 3.38 -0.91 -3.42 115.31 117.00 1wbw h LEU 87 Ca -0.26 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 56.99 1wbw h LEU 87 Cb 1.11 -0.28 -0.16 0.00 0.09 0.00 0.00 40.66 41.42 1wbw h LEU 87 CO 0.83 1.49 0.22 -0.62 0.09 0.00 0.00 178.44 180.45 1wbw s ASP 88 N -7.22 -0.60 -0.01 -0.43 2.15 -1.13 -4.47 116.67 104.96 1wbw s ASP 88 Ca -0.10 0.37 -0.01 0.00 0.43 0.00 0.00 52.55 53.24 1wbw s ASP 88 Cb 0.08 0.55 0.00 0.00 -0.30 0.00 0.00 42.92 43.25 1wbw s ASP 88 CO 0.92 -0.76 0.03 0.54 -0.17 0.00 0.00 175.17 175.72 1wbw s VAL 89 N -2.38 -0.00 0.16 1.11 0.11 -1.26 -0.92 120.40 117.22 1wbw s VAL 89 Ca -0.05 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 58.83 1wbw s VAL 89 Cb -0.00 -0.05 0.03 0.00 -1.53 0.00 0.00 36.38 34.83 1wbw s VAL 89 CO -0.01 0.00 0.47 0.72 -3.33 0.00 0.00 175.10 172.95 1wbw s PHE 90 N 0.03 -0.18 0.01 1.54 -0.12 -0.77 -4.99 117.98 113.50 1wbw s PHE 90 Ca -0.00 -0.14 0.01 0.00 -0.05 0.00 0.00 56.93 56.74 1wbw s PHE 90 Cb -0.00 0.34 -0.01 0.00 -0.63 0.00 0.00 43.02 42.71 1wbw s PHE 90 CO -0.00 -0.81 -0.03 -0.08 -0.05 0.00 0.00 175.22 174.25 1wbw s THR 91 N -3.84 0.21 -1.59 -4.49 -1.32 -1.26 -2.35 115.64 101.00 1wbw s THR 91 Ca 0.06 -0.36 0.05 0.00 -1.21 0.00 0.00 61.69 60.24 1wbw s THR 91 Cb 0.00 -0.23 0.11 0.00 -1.51 0.00 0.00 72.50 70.88 1wbw s THR 91 CO -0.08 -0.10 0.94 -2.65 -2.21 0.00 0.00 174.62 170.53 1wbw n PRO 92 N 2.59 0.10 -3.17 7.08 -0.02 -1.26 -4.82 135.00 135.50 1wbw n PRO 92 Ca -0.16 0.17 -0.39 0.00 -2.02 0.00 0.00 63.50 61.10 1wbw n PRO 92 Cb 0.58 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.50 1wbw n PRO 92 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wbw s ALA 93 N -2.41 3.46 -2.19 3.55 0.00 -1.26 -4.96 121.76 117.95 1wbw s ALA 93 Ca 0.06 0.06 0.26 0.00 0.00 0.00 0.00 51.96 52.34 1wbw s ALA 93 Cb 0.04 -2.79 0.69 0.00 0.00 0.00 0.00 23.12 21.06 1wbw s ALA 93 CO 0.07 0.13 1.53 0.54 0.00 0.00 0.00 175.76 178.03 1wbw n ARG 94 N 2.84 1.34 -3.60 0.00 1.74 -1.26 -4.93 116.66 112.79 1wbw n ARG 94 Ca -0.06 -0.89 -0.11 0.00 -0.77 0.00 0.00 57.85 56.03 1wbw n ARG 94 Cb 0.51 -1.48 -0.04 0.00 -1.02 0.00 0.00 32.46 30.43 1wbw n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wbw s SER 95 N -2.27 -0.30 0.36 0.55 1.04 -1.26 -5.05 113.70 106.78 1wbw s SER 95 Ca 0.29 -0.27 0.07 0.00 0.48 0.00 0.00 55.95 56.52 1wbw s SER 95 Cb 0.20 0.50 0.77 0.00 0.10 0.00 0.00 66.02 67.59 1wbw s SER 95 CO 0.44 -0.89 1.94 0.25 0.98 0.00 0.00 173.24 175.96 1wbw h LEU 96 N 2.29 0.64 -1.16 2.42 5.85 -1.95 -1.02 115.31 122.38 1wbw h LEU 96 Ca -0.34 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.34 1wbw h LEU 96 Cb 1.27 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 1wbw h LEU 96 CO 0.45 0.40 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.62 1wbw h GLU 97 N 0.72 0.58 0.00 1.25 3.07 -2.01 -2.69 114.58 115.51 1wbw h GLU 97 Ca 0.34 -0.13 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1wbw h GLU 97 Cb 0.37 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1wbw h GLU 97 CO -0.12 0.60 -0.84 -0.85 -1.40 0.00 0.00 179.01 176.41 1wbw n GLU 98 N -4.26 0.19 -1.67 2.33 0.28 -1.00 -4.96 120.64 111.56 1wbw n GLU 98 Ca 0.02 0.01 -0.48 0.00 -0.16 0.00 0.00 57.16 56.55 1wbw n GLU 98 Cb 0.26 -1.58 -0.05 0.00 1.43 0.00 0.00 31.44 31.50 1wbw n GLU 98 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1wbw n PHE 99 N -1.83 2.19 -0.65 -1.84 7.35 -0.42 -4.80 117.46 117.45 1wbw n PHE 99 Ca 0.03 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.97 1wbw n PHE 99 Cb 0.40 -2.55 0.00 0.00 0.35 0.00 0.00 39.48 37.68 1wbw n PHE 99 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1wbw n ASN 100 N 4.33 0.00 -3.94 -2.13 4.13 -1.26 -5.02 115.26 111.36 1wbw n ASN 100 Ca 0.19 0.00 -0.17 0.00 1.68 0.00 0.00 54.58 56.28 1wbw n ASN 100 Cb 0.27 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.36 1wbw n ASN 100 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1wbw s ASP 101 N 0.00 0.72 0.04 6.41 1.01 -1.26 -4.54 116.67 119.05 1wbw s ASP 101 Ca 0.00 -0.11 0.09 0.00 0.71 0.00 0.00 52.55 53.24 1wbw s ASP 101 Cb 0.00 -0.16 -0.03 0.00 1.01 0.00 0.00 42.92 43.74 1wbw s ASP 101 CO 0.00 0.04 -0.26 -0.69 0.21 0.00 0.00 175.17 174.47 1wbw s VAL 102 N 0.15 2.09 -0.03 -1.27 1.01 -1.26 -4.53 120.40 116.55 1wbw s VAL 102 Ca -0.01 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.64 1wbw s VAL 102 Cb -0.06 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.56 1wbw s VAL 102 CO -0.00 0.38 -0.05 -0.31 0.00 0.00 0.00 175.10 175.11 1wbw s TYR 103 N -0.78 0.72 0.07 5.22 1.51 -0.99 -1.35 117.35 121.75 1wbw s TYR 103 Ca 0.11 -0.18 0.08 0.00 -1.01 0.00 0.00 57.07 56.07 1wbw s TYR 103 Cb -0.10 -0.60 -0.03 0.00 -0.11 0.00 0.00 41.96 41.12 1wbw s TYR 103 CO 0.02 -0.14 -0.22 -0.51 -1.11 0.00 0.00 175.55 173.58 1wbw s LEU 104 N 0.62 2.22 -0.06 -1.29 1.43 0.75 -1.85 118.68 120.49 1wbw s LEU 104 Ca -0.08 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.43 1wbw s LEU 104 Cb -0.12 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.11 1wbw s LEU 104 CO 0.00 0.15 -0.08 -0.69 0.23 0.00 0.00 176.35 175.96 1wbw s VAL 105 N -0.93 0.83 0.31 -1.59 1.01 -0.10 -0.25 120.40 119.69 1wbw s VAL 105 Ca 0.08 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.84 1wbw s VAL 105 Cb -0.09 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 1wbw s VAL 105 CO 0.03 0.30 0.23 0.28 0.00 0.00 0.00 175.10 175.94 1wbw s THR 106 N 0.99 0.07 0.39 3.92 -1.32 -0.46 -0.14 115.64 119.09 1wbw s THR 106 Ca -0.09 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.11 1wbw s THR 106 Cb -0.15 -2.49 -0.11 0.00 -1.51 0.00 0.00 72.50 68.25 1wbw s THR 106 CO 0.00 0.00 1.49 1.41 -2.21 0.00 0.00 174.62 175.31 1wbw n HIS 107 N -0.59 2.98 -2.19 9.09 8.25 -1.26 -0.29 115.22 131.22 1wbw n HIS 107 Ca 0.05 0.44 -0.42 0.00 -0.26 0.00 0.00 57.72 57.53 1wbw n HIS 107 Cb 0.63 -2.53 -0.03 0.00 1.12 0.00 0.00 29.99 29.19 1wbw n HIS 107 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1wbw s LEU 108 N -2.17 4.31 -0.03 2.41 2.96 -0.56 -4.24 118.68 121.36 1wbw s LEU 108 Ca 0.54 2.12 -0.16 0.00 -0.22 0.00 0.00 54.13 56.40 1wbw s LEU 108 Cb -0.47 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.58 1wbw s LEU 108 CO 0.63 -0.77 0.70 -0.03 -1.32 0.00 0.00 176.35 175.56 1wbw h MET 109 N 8.18 -0.57 0.00 1.98 1.85 -1.92 -3.48 114.93 120.98 1wbw h MET 109 Ca -0.37 0.04 0.00 0.00 -0.61 0.00 0.00 59.70 58.76 1wbw h MET 109 Cb 1.17 0.13 0.00 0.00 0.43 0.00 0.00 31.60 33.33 1wbw h MET 109 CO 0.92 -0.38 0.00 0.41 -0.40 0.00 0.00 176.91 177.46 1wbw n GLY 110 N 0.24 2.04 3.18 1.39 0.00 -1.26 -4.83 105.19 105.94 1wbw n GLY 110 Ca -0.07 -0.20 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 1wbw n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbw s ALA 111 N 0.00 1.46 0.46 4.61 0.00 -1.26 -5.10 121.76 121.93 1wbw s ALA 111 Ca 0.00 -0.82 0.06 0.00 0.00 0.00 0.00 51.96 51.20 1wbw s ALA 111 Cb 0.00 -0.33 0.06 0.00 0.00 0.00 0.00 23.12 22.85 1wbw s ALA 111 CO 0.00 0.34 0.49 -0.40 0.00 0.00 0.00 175.76 176.19 1wbw n ASP 112 N 2.36 2.11 0.18 0.00 5.68 -1.26 -1.16 116.55 124.47 1wbw n ASP 112 Ca -0.16 -2.42 0.07 0.00 -0.50 0.00 0.00 54.79 51.78 1wbw n ASP 112 Cb 0.54 -0.18 0.22 0.00 -1.14 0.00 0.00 41.12 40.56 1wbw n ASP 112 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1wbw h LEU 113 N 0.00 0.00 -0.59 -2.12 5.85 -0.15 -2.92 115.31 115.38 1wbw h LEU 113 Ca -0.26 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.46 1wbw h LEU 113 Cb 1.04 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1wbw h LEU 113 CO 0.39 0.33 0.36 0.78 -0.34 0.00 0.00 178.44 179.96 1wbw h ASN 114 N 0.00 0.70 -0.54 1.25 -0.26 -1.87 -1.25 115.58 113.60 1wbw h ASN 114 Ca -0.00 -0.05 0.05 0.00 -0.56 0.00 0.00 56.30 55.74 1wbw h ASN 114 Cb 1.08 -0.18 -0.05 0.00 -1.06 0.00 0.00 38.32 38.11 1wbw h ASN 114 CO 0.04 0.54 0.27 0.78 -1.06 0.00 0.00 177.43 178.00 1wbw h ASN 115 N 0.80 0.37 0.49 5.81 -0.26 -1.88 0.26 115.58 121.16 1wbw h ASN 115 Ca 0.21 0.04 -0.20 0.00 -0.56 0.00 0.00 56.30 55.78 1wbw h ASN 115 Cb -0.04 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.19 1wbw h ASN 115 CO -0.04 0.25 -0.88 0.16 -1.06 0.00 0.00 177.43 175.85 1wbw h ILE 116 N 0.51 1.46 -0.05 2.81 3.07 -1.39 -1.44 117.51 122.48 1wbw h ILE 116 Ca 0.25 -2.53 -0.03 0.00 1.55 0.00 0.00 64.86 64.10 1wbw h ILE 116 Cb 0.18 2.42 0.00 0.00 -0.27 0.00 0.00 36.82 39.15 1wbw h ILE 116 CO -0.18 0.74 -0.08 0.58 -1.05 0.00 0.00 178.15 178.15 1wbw h VAL 117 N 0.16 1.42 -0.39 0.16 2.07 -1.06 -2.28 116.25 116.33 1wbw h VAL 117 Ca -0.05 -1.37 -0.07 0.00 0.82 0.00 0.00 66.70 66.03 1wbw h VAL 117 Cb 1.51 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 33.49 1wbw h VAL 117 CO 0.14 0.37 -0.01 0.11 0.02 0.00 0.00 177.57 178.20 1wbw h LYS 118 N -0.36 0.70 0.00 1.57 1.57 -0.54 -3.37 116.57 116.13 1wbw h LYS 118 Ca 0.00 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1wbw h LYS 118 Cb 0.65 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1wbw h LYS 118 CO 0.02 0.80 -1.85 0.00 -0.57 0.00 0.00 179.45 177.85 1wbw s GLN 120 N -3.31 1.41 -0.12 0.00 -0.21 -0.86 -5.06 119.66 111.52 1wbw s GLN 120 Ca -0.07 -1.63 -0.05 0.00 0.02 0.00 0.00 55.36 53.63 1wbw s GLN 120 Cb 0.12 -1.27 -0.04 0.00 1.00 0.00 0.00 33.01 32.82 1wbw s GLN 120 CO 0.87 0.22 0.06 0.15 -2.12 0.00 0.00 175.29 174.47 1wbw s LYS 121 N -3.61 3.41 -0.17 2.91 3.01 -1.26 -4.52 119.74 119.51 1wbw s LYS 121 Ca 0.24 -0.31 -0.02 0.00 -1.01 0.00 0.00 55.97 54.87 1wbw s LYS 121 Cb -0.02 -3.03 -0.01 0.00 -1.01 0.00 0.00 37.83 33.76 1wbw s LYS 121 CO 0.09 0.60 -0.08 -0.51 0.51 0.00 0.00 175.35 175.95 1wbw s LEU 122 N -0.55 2.87 0.75 3.17 1.43 -1.26 -5.10 118.68 119.98 1wbw s LEU 122 Ca 0.11 -0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 52.77 1wbw s LEU 122 Cb -0.12 -1.69 0.04 0.00 0.03 0.00 0.00 46.19 44.46 1wbw s LEU 122 CO 0.02 0.10 1.12 0.42 0.23 0.00 0.00 176.35 178.23 1wbw s THR 123 N 0.77 3.07 0.50 5.49 -4.23 -1.26 -4.91 115.64 115.07 1wbw s THR 123 Ca -0.03 0.35 0.20 0.00 -1.18 0.00 0.00 61.69 61.03 1wbw s THR 123 Cb -0.15 -3.30 0.27 0.00 1.34 0.00 0.00 72.50 70.66 1wbw s THR 123 CO 0.01 -0.45 2.12 -0.78 -0.54 0.00 0.00 174.62 174.98 1wbw h ASP 124 N -0.83 0.00 1.23 3.99 3.58 -1.99 -2.02 116.42 120.38 1wbw h ASP 124 Ca -0.46 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 56.88 1wbw h ASP 124 Cb 1.27 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.31 1wbw h ASP 124 CO 0.64 0.07 -0.56 -0.78 -2.88 0.00 0.00 179.24 175.73 1wbw h ASP 125 N 0.00 0.00 -0.37 2.28 3.58 -1.99 -1.09 116.42 118.83 1wbw h ASP 125 Ca -0.00 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.34 1wbw h ASP 125 Cb 0.14 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1wbw h ASP 125 CO 0.01 0.56 -0.20 0.45 -2.88 0.00 0.00 179.24 177.18 1wbw h HIS 126 N 0.00 0.92 -0.63 0.28 3.86 -1.74 -2.47 115.15 115.37 1wbw h HIS 126 Ca -0.01 -0.23 -0.07 0.00 -1.16 0.00 0.00 60.37 58.91 1wbw h HIS 126 Cb 1.32 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.56 1wbw h HIS 126 CO 0.00 0.98 0.14 0.28 0.86 0.00 0.00 177.93 180.19 1wbw h VAL 127 N 0.59 1.26 -0.22 2.45 2.07 -1.37 0.12 116.25 121.15 1wbw h VAL 127 Ca 0.08 -0.95 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1wbw h VAL 127 Cb 0.75 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 1wbw h VAL 127 CO 0.06 0.36 -0.13 1.56 0.02 0.00 0.00 177.57 179.44 1wbw h GLN 128 N 0.94 -0.11 -0.39 1.57 4.20 -1.19 -1.63 115.11 118.50 1wbw h GLN 128 Ca 0.20 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.83 1wbw h GLN 128 Cb 0.38 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1wbw h GLN 128 CO 0.00 -0.07 -0.09 0.35 -0.67 0.00 0.00 178.83 178.36 1wbw h PHE 129 N -0.11 0.83 -0.03 2.96 3.57 -1.03 0.72 116.94 123.85 1wbw h PHE 129 Ca 0.12 -0.18 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 1wbw h PHE 129 Cb 0.29 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1wbw h PHE 129 CO -0.29 0.87 0.01 -0.07 -2.23 0.00 0.00 178.31 176.60 1wbw h LEU 130 N 0.55 0.05 -0.48 0.59 3.38 -0.69 -2.28 115.31 116.42 1wbw h LEU 130 Ca 0.10 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1wbw h LEU 130 Cb 0.60 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1wbw h LEU 130 CO 0.04 0.27 -0.09 0.40 0.09 0.00 0.00 178.44 179.14 1wbw h ILE 131 N -0.17 1.27 -0.63 1.22 1.08 -1.30 -2.45 117.51 116.51 1wbw h ILE 131 Ca 0.01 -1.21 0.13 0.00 -0.39 0.00 0.00 64.86 63.40 1wbw h ILE 131 Cb 0.24 1.06 -0.11 0.00 -3.07 0.00 0.00 36.82 34.94 1wbw h ILE 131 CO 0.00 0.42 -0.05 0.22 -0.69 0.00 0.00 178.15 178.05 1wbw h TYR 132 N 0.76 -0.15 -0.40 1.37 3.20 -0.80 -1.16 116.97 119.80 1wbw h TYR 132 Ca 0.13 0.05 -0.14 0.00 3.14 0.00 0.00 58.73 61.90 1wbw h TYR 132 Cb 0.64 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 1wbw h TYR 132 CO 0.05 -0.21 -0.31 1.96 -1.64 0.00 0.00 178.16 178.00 1wbw h GLN 133 N 0.07 0.89 -0.92 1.82 4.20 -1.27 -0.45 115.11 119.45 1wbw h GLN 133 Ca 0.32 -0.42 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1wbw h GLN 133 Cb 0.53 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 1wbw h GLN 133 CO -0.58 1.07 0.53 0.82 -0.67 0.00 0.00 178.83 179.99 1wbw h ILE 134 N 0.75 1.26 0.01 2.54 2.04 -0.96 -2.40 117.51 120.75 1wbw h ILE 134 Ca 0.08 -0.61 -0.21 0.00 1.00 0.00 0.00 64.86 65.12 1wbw h ILE 134 Cb 0.88 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1wbw h ILE 134 CO 0.08 0.29 -0.91 -0.07 0.00 0.00 0.00 178.15 177.53 1wbw h LEU 135 N 1.28 0.29 -0.31 1.44 3.38 -0.91 -1.14 115.31 119.34 1wbw h LEU 135 Ca 0.33 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1wbw h LEU 135 Cb -0.01 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1wbw h LEU 135 CO -0.06 1.06 0.10 -0.09 0.09 0.00 0.00 178.44 179.54 1wbw h ARG 136 N 0.12 0.48 -0.02 1.13 2.43 -1.02 0.14 114.38 117.63 1wbw h ARG 136 Ca -0.05 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 1wbw h ARG 136 Cb 1.55 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 1wbw h ARG 136 CO 0.14 0.52 -0.44 0.78 -1.51 0.00 0.00 179.97 179.46 1wbw h GLY 137 N 0.34 0.05 1.07 2.80 0.00 -1.36 -2.92 103.07 103.05 1wbw h GLY 137 Ca 0.10 -0.05 -0.20 0.00 0.00 0.00 0.00 47.33 47.18 1wbw h GLY 137 CO -0.00 0.05 -0.72 -2.00 0.00 0.00 0.00 176.54 173.87 1wbw h LEU 138 N 0.04 0.82 -0.98 3.11 5.85 -0.90 -1.17 115.31 122.07 1wbw h LEU 138 Ca 0.00 -0.65 0.16 0.00 0.84 0.00 0.00 57.88 58.23 1wbw h LEU 138 Cb 0.79 -0.25 -0.10 0.00 0.37 0.00 0.00 40.66 41.48 1wbw h LEU 138 CO 0.06 1.35 0.60 0.50 -0.34 0.00 0.00 178.44 180.60 1wbw h LYS 139 N 0.36 0.79 0.06 1.25 3.64 -0.68 0.11 116.57 122.11 1wbw h LYS 139 Ca -0.06 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1wbw h LYS 139 Cb 1.36 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1wbw h LYS 139 CO 0.15 0.52 -0.03 -0.92 -2.27 0.00 0.00 179.45 176.90 1wbw h TYR 140 N 0.82 -0.08 0.29 1.91 5.03 -1.31 -2.44 116.97 121.19 1wbw h TYR 140 Ca 0.54 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.85 1wbw h TYR 140 Cb 0.75 0.03 -0.02 0.00 1.55 0.00 0.00 36.73 39.03 1wbw h TYR 140 CO -0.02 0.37 -0.28 0.82 -1.32 0.00 0.00 178.16 177.74 1wbw h ILE 141 N -0.56 0.41 0.00 1.81 2.04 -0.87 -2.72 117.51 117.61 1wbw h ILE 141 Ca -0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 1wbw h ILE 141 Cb 0.49 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1wbw h ILE 141 CO 0.01 0.00 -0.05 0.45 0.00 0.00 0.00 178.15 178.56 1wbw h HIS 142 N -0.60 0.00 0.00 1.37 3.86 -0.86 -1.39 115.15 117.53 1wbw h HIS 142 Ca -0.01 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 1wbw h HIS 142 Cb 0.55 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.01 1wbw h HIS 142 CO -0.17 0.05 -0.09 0.66 0.86 0.00 0.00 177.93 179.24 1wbw h SER 143 N 0.00 0.00 -0.45 2.45 4.64 -1.12 -2.19 113.55 116.88 1wbw h SER 143 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1wbw h SER 143 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1wbw h SER 143 CO 0.01 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.06 1wbw n ALA 144 N -2.13 3.07 -4.15 5.18 0.00 -0.56 -4.77 120.51 117.15 1wbw n ALA 144 Ca 0.02 -1.18 -0.35 0.00 0.00 0.00 0.00 53.44 51.93 1wbw n ALA 144 Cb 0.44 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 1wbw n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wbw n ASP 145 N 0.66 -3.74 -4.84 0.00 8.00 -0.82 -4.46 116.55 111.34 1wbw n ASP 145 Ca 0.19 -0.95 -0.37 0.00 0.71 0.00 0.00 54.79 54.37 1wbw n ASP 145 Cb 0.73 -3.04 -0.07 0.00 -0.02 0.00 0.00 41.12 38.73 1wbw n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wbw s ILE 146 N -3.28 5.32 -0.15 0.53 1.01 -0.97 -5.01 121.20 118.65 1wbw s ILE 146 Ca 0.73 0.14 0.01 0.00 0.00 0.00 0.00 60.65 61.53 1wbw s ILE 146 Cb -0.39 -3.31 -0.00 0.00 0.01 0.00 0.00 42.46 38.77 1wbw s ILE 146 CO 0.90 0.61 -0.17 -0.63 0.00 0.00 0.00 174.94 175.66 1wbw s ILE 147 N -0.95 2.57 0.03 2.92 1.01 -1.26 -3.62 121.20 121.91 1wbw s ILE 147 Ca 0.14 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 1wbw s ILE 147 Cb -0.12 -2.07 -0.15 0.00 0.01 0.00 0.00 42.46 40.13 1wbw s ILE 147 CO 0.04 0.52 1.37 -0.74 0.00 0.00 0.00 174.94 176.13 1wbw h HIS 148 N 7.24 0.31 0.00 3.97 -0.00 -1.93 -3.47 115.15 121.28 1wbw h HIS 148 Ca -0.31 -0.08 0.00 0.00 -0.00 0.00 0.00 60.37 59.97 1wbw h HIS 148 Cb 1.19 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 28.53 1wbw h HIS 148 CO 0.50 0.63 0.00 0.54 -0.00 0.00 0.00 177.93 179.60 1wbw n ARG 149 N -4.66 0.00 -2.75 5.26 5.12 -1.26 -4.70 116.66 113.66 1wbw n ARG 149 Ca -0.06 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.85 1wbw n ARG 149 Cb 0.30 -2.30 0.07 0.00 -1.16 0.00 0.00 32.46 29.37 1wbw n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1wbw n ASP 150 N 0.00 0.60 -4.66 0.55 2.03 -1.26 -5.01 116.55 108.80 1wbw n ASP 150 Ca 0.00 -2.08 -0.43 0.00 0.52 0.00 0.00 54.79 52.80 1wbw n ASP 150 Cb 0.00 -0.11 -0.02 0.00 -0.72 0.00 0.00 41.12 40.27 1wbw n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1wbw s LEU 151 N -3.82 4.11 0.16 -2.67 1.43 -1.26 -4.87 118.68 111.76 1wbw s LEU 151 Ca 0.21 1.46 -0.10 0.00 -1.03 0.00 0.00 54.13 54.67 1wbw s LEU 151 Cb 0.36 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 43.04 1wbw s LEU 151 CO -0.07 -0.73 0.31 -1.59 0.23 0.00 0.00 176.35 174.50 1wbw s LYS 152 N 3.36 1.17 0.56 1.70 -2.85 -1.26 -4.83 119.74 117.59 1wbw s LYS 152 Ca 0.48 -1.13 0.30 0.00 -1.00 0.00 0.00 55.97 54.62 1wbw s LYS 152 Cb -0.17 0.39 1.46 0.00 -2.06 0.00 0.00 37.83 37.45 1wbw s LYS 152 CO 0.10 -0.43 1.89 -1.35 0.10 0.00 0.00 175.35 175.65 1wbw h PRO 153 N 2.51 0.00 0.00 1.78 0.11 -1.94 -2.60 132.00 131.87 1wbw h PRO 153 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1wbw h PRO 153 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1wbw h PRO 153 CO 0.47 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.92 1wbw h SER 154 N 0.00 0.00 -0.74 -2.05 4.64 -1.96 -1.69 113.55 111.75 1wbw h SER 154 Ca 0.32 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 61.26 1wbw h SER 154 Cb 1.45 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.31 1wbw h SER 154 CO -0.00 0.00 0.36 -0.46 -0.87 0.00 0.00 176.83 175.86 1wbw n ASN 155 N -2.99 3.27 -4.02 4.97 0.23 -0.98 -4.86 115.26 110.89 1wbw n ASN 155 Ca 0.04 -3.67 -0.31 0.00 -0.53 0.00 0.00 54.58 50.11 1wbw n ASN 155 Cb 0.51 -0.76 -0.15 0.00 -2.08 0.00 0.00 39.78 37.30 1wbw n ASN 155 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1wbw s LEU 156 N -3.28 3.32 0.03 -4.53 1.43 -1.10 -1.01 118.68 113.55 1wbw s LEU 156 Ca 0.52 -1.42 -0.24 0.00 -1.03 0.00 0.00 54.13 51.96 1wbw s LEU 156 Cb 0.45 -1.44 -0.06 0.00 0.03 0.00 0.00 46.19 45.18 1wbw s LEU 156 CO 0.07 -0.23 0.71 0.00 0.23 0.00 0.00 176.35 177.13 1wbw s ALA 157 N 1.17 3.41 -0.05 4.21 0.00 -0.23 -1.10 121.76 129.17 1wbw s ALA 157 Ca -0.06 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.14 1wbw s ALA 157 Cb -0.20 -2.92 0.01 0.00 0.00 0.00 0.00 23.12 20.02 1wbw s ALA 157 CO -0.06 0.11 -0.12 0.08 0.00 0.00 0.00 175.76 175.77 1wbw s VAL 158 N -0.14 1.05 0.43 0.00 1.01 -0.31 -0.96 120.40 121.49 1wbw s VAL 158 Ca 0.36 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.90 1wbw s VAL 158 Cb -0.20 -0.95 0.08 0.00 0.00 0.00 0.00 36.38 35.31 1wbw s VAL 158 CO 0.21 0.33 0.60 -0.46 0.00 0.00 0.00 175.10 175.78 1wbw n ASN 159 N 3.60 1.08 0.22 3.32 0.23 -0.35 -4.13 115.26 119.23 1wbw n ASN 159 Ca -0.21 -1.85 0.08 0.00 -0.53 0.00 0.00 54.58 52.08 1wbw n ASN 159 Cb 0.52 -0.36 0.49 0.00 -2.08 0.00 0.00 39.78 38.35 1wbw n ASN 159 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1wbw h GLU 160 N 0.00 0.00 -0.57 -3.83 3.07 -1.97 -0.97 114.58 110.30 1wbw h GLU 160 Ca -0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.66 1wbw h GLU 160 Cb 0.80 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.71 1wbw h GLU 160 CO 0.24 0.26 0.00 -0.25 -1.40 0.00 0.00 179.01 177.86 1wbw n ASP 161 N -3.60 1.54 -2.25 1.42 8.00 -1.26 -4.88 116.55 115.52 1wbw n ASP 161 Ca -0.01 -2.12 -0.17 0.00 0.71 0.00 0.00 54.79 53.21 1wbw n ASP 161 Cb 0.39 -0.35 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 1wbw n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wbw s GLU 163 N -4.74 4.24 -0.01 0.00 2.02 -1.26 -4.77 118.70 114.19 1wbw s GLU 163 Ca 0.00 0.81 0.04 0.00 0.02 0.00 0.00 54.97 55.84 1wbw s GLU 163 Cb 0.00 -3.09 -0.01 0.00 0.10 0.00 0.00 34.13 31.13 1wbw s GLU 163 CO 0.00 0.53 -0.14 -1.17 0.02 0.00 0.00 175.26 174.49 1wbw s LEU 164 N -1.51 2.04 -0.01 1.80 0.20 -1.26 -1.21 118.68 118.72 1wbw s LEU 164 Ca 0.36 -0.28 0.06 0.00 0.69 0.00 0.00 54.13 54.96 1wbw s LEU 164 Cb -0.19 -0.73 -0.01 0.00 -0.43 0.00 0.00 46.19 44.83 1wbw s LEU 164 CO 0.21 0.17 -0.19 -0.54 -0.29 0.00 0.00 176.35 175.70 1wbw s LYS 165 N -0.41 1.54 -0.31 1.98 1.02 -0.13 -4.27 119.74 119.16 1wbw s LYS 165 Ca 0.05 -0.68 -0.27 0.00 0.02 0.00 0.00 55.97 55.09 1wbw s LYS 165 Cb -0.06 -1.49 0.01 0.00 -0.52 0.00 0.00 37.83 35.78 1wbw s LYS 165 CO -0.00 0.41 0.99 0.42 -0.92 0.00 0.00 175.35 176.25 1wbw s ILE 166 N -0.44 4.60 0.49 2.17 1.01 0.35 -1.07 121.20 128.31 1wbw s ILE 166 Ca 0.07 1.62 0.05 0.00 0.00 0.00 0.00 60.65 62.39 1wbw s ILE 166 Cb -0.07 -4.33 -0.01 0.00 0.01 0.00 0.00 42.46 38.05 1wbw s ILE 166 CO -0.01 -0.39 0.19 -0.76 0.00 0.00 0.00 174.94 173.97 1wbw s LEU 167 N 3.42 2.68 -0.54 2.97 1.02 -0.18 -1.12 118.68 126.93 1wbw s LEU 167 Ca 0.42 -1.35 -0.17 0.00 0.02 0.00 0.00 54.13 53.05 1wbw s LEU 167 Cb -0.13 -1.09 0.02 0.00 0.02 0.00 0.00 46.19 45.02 1wbw s LEU 167 CO 0.14 -0.84 0.64 -0.67 0.02 0.00 0.00 176.35 175.63 1wbw n ASP 168 N -1.42 -6.99 0.00 2.29 -0.08 -1.26 -4.72 116.55 104.37 1wbw n ASP 168 Ca -0.08 0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 1wbw n ASP 168 Cb 0.65 -4.05 0.02 0.00 2.34 0.00 0.00 41.12 40.09 1wbw n ASP 168 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1wbw n PHE 169 N -0.79 0.00 -1.47 -0.67 3.01 -1.26 -4.75 117.46 111.52 1wbw n PHE 169 Ca -0.00 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 1wbw n PHE 169 Cb 0.55 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.99 1wbw n PHE 169 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1wbw n GLY 170 N -0.25 0.80 0.32 1.37 0.00 -1.26 -4.76 105.19 101.40 1wbw n GLY 170 Ca 0.01 -0.62 0.13 0.00 0.00 0.00 0.00 46.02 45.54 1wbw n GLY 170 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wbw h LEU 171 N 0.00 0.37 -8.02 0.99 -0.00 -1.93 -3.25 115.31 103.47 1wbw h LEU 171 Ca -0.18 0.15 -0.54 0.00 -0.00 0.00 0.00 57.88 57.31 1wbw h LEU 171 Cb 0.70 0.12 -0.08 0.00 -0.00 0.00 0.00 40.66 41.41 1wbw h LEU 171 CO 0.25 0.02 1.55 0.00 -0.00 0.00 0.00 178.44 180.26 1wbw s ALA 172 N -5.88 2.61 0.52 1.53 0.00 -1.26 -4.97 121.76 114.30 1wbw s ALA 172 Ca -0.12 -2.35 -0.18 0.00 0.00 0.00 0.00 51.96 49.32 1wbw s ALA 172 Cb 0.25 -4.60 -0.14 0.00 0.00 0.00 0.00 23.12 18.63 1wbw s ALA 172 CO 0.78 -3.96 -0.03 2.89 0.00 0.00 0.00 175.76 175.45 1wbw n ARG 173 N 8.62 0.08 -2.68 0.00 0.00 -1.23 -4.90 116.66 116.56 1wbw n ARG 173 Ca 0.41 0.03 -0.34 0.00 -0.00 0.00 0.00 57.85 57.95 1wbw n ARG 173 Cb 0.48 -1.11 -0.05 0.00 -0.00 0.00 0.00 32.46 31.78 1wbw n ARG 173 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1wbw s HIS 174 N -1.96 3.24 0.54 2.89 3.76 -1.26 -5.04 115.29 117.45 1wbw s HIS 174 Ca 0.59 1.62 -0.19 0.00 -0.15 0.00 0.00 55.06 56.93 1wbw s HIS 174 Cb -0.49 -2.98 -0.06 0.00 1.11 0.00 0.00 32.58 30.16 1wbw s HIS 174 CO 0.64 -0.41 1.09 0.95 -0.85 0.00 0.00 174.74 176.16 1wbw s THR 175 N -1.96 3.48 0.29 1.30 -4.23 -1.26 -4.93 115.64 108.32 1wbw s THR 175 Ca 0.62 0.87 0.03 0.00 -1.18 0.00 0.00 61.69 62.02 1wbw s THR 175 Cb -0.15 -3.34 0.29 0.00 1.34 0.00 0.00 72.50 70.64 1wbw s THR 175 CO 0.19 -0.25 1.68 0.44 -0.54 0.00 0.00 174.62 176.15 1wbw h ASP 176 N 1.13 0.23 -0.49 3.99 3.32 -1.98 -2.52 116.42 120.11 1wbw h ASP 176 Ca -0.49 0.16 -0.11 0.00 0.02 0.00 0.00 57.03 56.61 1wbw h ASP 176 Cb 1.24 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.94 1wbw h ASP 176 CO 0.57 -0.04 -0.12 -0.78 -1.72 0.00 0.00 179.24 177.16 1wbw h ASP 177 N 0.35 0.95 -0.11 6.45 3.58 -1.96 -2.66 116.42 123.01 1wbw h ASP 177 Ca 0.54 -0.36 0.03 0.00 0.42 0.00 0.00 57.03 57.67 1wbw h ASP 177 Cb 1.04 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.83 1wbw h ASP 177 CO -0.55 1.09 0.10 -0.33 -2.88 0.00 0.00 179.24 176.67 1wbw h GLU 178 N 0.80 0.00 -0.51 0.28 5.08 -1.83 -2.17 114.58 116.22 1wbw h GLU 178 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1wbw h GLU 178 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1wbw h GLU 178 CO 0.05 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.73 1wbw n MET 179 N -4.10 2.27 -3.77 2.33 2.81 -1.01 -4.75 117.12 110.90 1wbw n MET 179 Ca -0.00 -1.97 -0.36 0.00 -1.81 0.00 0.00 57.70 53.56 1wbw n MET 179 Cb 0.21 -1.44 -0.07 0.00 -0.71 0.00 0.00 33.22 31.21 1wbw n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1wbw s THR 180 N -1.32 5.43 0.00 2.03 2.01 -0.82 -4.84 115.64 118.14 1wbw s THR 180 Ca 0.37 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.60 1wbw s THR 180 Cb 0.20 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 69.25 1wbw s THR 180 CO 0.26 0.50 0.00 0.61 -0.69 0.00 0.00 174.62 175.31 1wbw n GLY 181 N 2.92 0.02 3.38 4.40 0.00 -1.26 -4.59 105.19 110.06 1wbw n GLY 181 Ca -0.17 -1.24 -0.44 0.00 0.00 0.00 0.00 46.02 44.17 1wbw n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1wbw n TYR 182 N 3.41 4.78 -4.28 1.61 9.36 -1.17 -3.72 117.16 127.15 1wbw n TYR 182 Ca 0.00 -3.38 -0.19 0.00 3.32 0.00 0.00 57.90 57.65 1wbw n TYR 182 Cb 0.00 -2.07 -0.15 0.00 -0.63 0.00 0.00 39.34 36.49 1wbw n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1wbw s VAL 183 N 0.89 0.61 0.56 2.97 -7.23 -1.26 -5.02 120.40 111.93 1wbw s VAL 183 Ca 0.40 -0.28 0.35 0.00 -1.81 0.00 0.00 61.98 60.64 1wbw s VAL 183 Cb -0.03 -0.55 0.38 0.00 0.56 0.00 0.00 36.38 36.74 1wbw s VAL 183 CO -0.01 0.19 2.25 0.00 -0.31 0.00 0.00 175.10 177.23 1wbw h ALA 184 N 6.32 1.28 0.00 1.32 0.00 -1.93 -2.17 119.26 124.07 1wbw h ALA 184 Ca -0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1wbw h ALA 184 Cb 1.17 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1wbw h ALA 184 CO 0.49 0.03 0.11 1.79 0.00 0.00 0.00 179.25 181.67 1wbw h THR 185 N 0.00 0.00 0.00 0.00 1.35 -1.95 -3.14 112.91 109.17 1wbw h THR 185 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.84 1wbw h THR 185 Cb 0.09 0.87 -0.00 0.00 -1.73 0.00 0.00 68.15 67.38 1wbw h THR 185 CO 0.00 0.00 -1.22 -1.14 -0.25 0.00 0.00 175.52 172.92 1wbw n ARG 186 N -2.99 0.82 0.28 4.72 0.63 -0.82 -4.80 116.66 114.50 1wbw n ARG 186 Ca -0.03 -0.03 0.18 0.00 -0.92 0.00 0.00 57.85 57.05 1wbw n ARG 186 Cb 0.17 -1.10 0.95 0.00 0.45 0.00 0.00 32.46 32.93 1wbw n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1wbw h TRP 187 N 0.00 0.00 -0.24 -0.14 6.55 -1.50 -2.26 115.95 118.36 1wbw h TRP 187 Ca -0.02 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.82 1wbw h TRP 187 Cb 0.43 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.73 1wbw h TRP 187 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1wbw n TYR 188 N -3.54 0.30 -2.71 0.49 4.02 -1.26 -4.54 117.16 109.93 1wbw n TYR 188 Ca -0.01 -0.22 -0.41 0.00 -0.01 0.00 0.00 57.90 57.25 1wbw n TYR 188 Cb 0.21 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.47 1wbw n TYR 188 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1wbw s ARG 189 N -1.18 4.76 0.41 -0.72 1.81 -0.85 -3.67 118.95 119.50 1wbw s ARG 189 Ca 0.25 1.51 -0.27 0.00 -1.72 0.00 0.00 55.73 55.51 1wbw s ARG 189 Cb 0.15 -3.31 -0.09 0.00 -0.45 0.00 0.00 34.95 31.25 1wbw s ARG 189 CO 0.21 0.35 1.40 0.00 -0.68 0.00 0.00 175.30 176.58 1wbw s ALA 190 N -0.64 3.37 0.42 2.13 0.00 -1.26 -4.82 121.76 120.95 1wbw s ALA 190 Ca 0.44 1.41 0.16 0.00 0.00 0.00 0.00 51.96 53.98 1wbw s ALA 190 Cb -0.26 -3.56 1.05 0.00 0.00 0.00 0.00 23.12 20.36 1wbw s ALA 190 CO 0.32 -1.00 1.90 -1.00 0.00 0.00 0.00 175.76 175.98 1wbw h PRO 191 N 2.72 0.41 0.00 0.00 0.13 -1.96 -1.99 132.00 131.32 1wbw h PRO 191 Ca -0.50 -0.02 -0.10 0.00 -0.87 0.00 0.00 66.00 64.50 1wbw h PRO 191 Cb 1.25 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1wbw h PRO 191 CO 0.63 0.27 -0.47 1.05 -0.23 0.00 0.00 178.00 179.25 1wbw h GLU 192 N 0.43 0.00 0.11 0.86 9.09 -1.92 -2.03 114.58 121.11 1wbw h GLU 192 Ca 0.40 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.60 1wbw h GLU 192 Cb 0.92 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.02 1wbw h GLU 192 CO -0.13 0.47 -0.99 0.82 0.05 0.00 0.00 179.01 179.23 1wbw h ILE 193 N 0.00 1.32 -0.87 -1.06 2.04 -1.74 0.13 117.51 117.32 1wbw h ILE 193 Ca -0.00 -2.44 0.20 0.00 1.00 0.00 0.00 64.86 63.61 1wbw h ILE 193 Cb 0.89 2.97 -0.12 0.00 -0.74 0.00 0.00 36.82 39.82 1wbw h ILE 193 CO 0.06 0.67 0.39 -0.03 0.00 0.00 0.00 178.15 179.24 1wbw h MET 194 N -0.45 0.43 -0.04 2.37 4.05 -1.28 -2.44 114.93 117.57 1wbw h MET 194 Ca -0.20 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.19 1wbw h MET 194 Cb 1.60 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 32.30 1wbw h MET 194 CO 0.08 0.28 0.00 1.28 0.23 0.00 0.00 176.91 178.78 1wbw n LEU 195 N -5.02 2.07 -3.43 3.39 4.32 -0.77 -5.03 117.00 112.54 1wbw n LEU 195 Ca 0.20 -1.07 -0.21 0.00 -0.02 0.00 0.00 56.01 54.91 1wbw n LEU 195 Cb 0.59 -0.02 0.06 0.00 -1.62 0.00 0.00 43.42 42.43 1wbw n LEU 195 CO 0.15 0.40 -0.01 -3.20 -1.22 0.00 0.00 177.39 173.51 1wbw n ASN 196 N 0.67 -5.80 0.07 -1.43 5.15 -0.65 -4.92 115.26 108.35 1wbw n ASN 196 Ca 0.07 -0.82 -0.02 0.00 -0.60 0.00 0.00 54.58 53.21 1wbw n ASN 196 Cb 0.31 -4.52 -0.07 0.00 -0.53 0.00 0.00 39.78 34.97 1wbw n ASN 196 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1wbw h TRP 197 N -1.43 0.00 -1.89 1.20 6.55 -1.06 -3.43 115.95 115.89 1wbw h TRP 197 Ca -0.63 0.00 0.20 0.00 0.95 0.00 0.00 58.89 59.41 1wbw h TRP 197 Cb 1.33 0.00 -0.15 0.00 -0.86 0.00 0.00 29.16 29.48 1wbw h TRP 197 CO 0.32 0.74 0.65 0.00 -1.05 0.00 0.00 178.44 179.10 1wbw s MET 198 N -2.83 0.65 -0.10 0.49 0.23 -1.26 -0.78 119.30 115.70 1wbw s MET 198 Ca 0.00 -0.29 -0.34 0.00 -1.03 0.00 0.00 55.69 54.03 1wbw s MET 198 Cb 0.09 0.27 -0.12 0.00 -1.53 0.00 0.00 34.83 33.54 1wbw s MET 198 CO 0.79 -0.29 1.90 0.72 -2.03 0.00 0.00 175.02 176.12 1wbw n HIS 199 N -0.27 2.31 -2.30 3.16 8.25 -1.26 -4.85 115.22 120.27 1wbw n HIS 199 Ca -0.05 -0.01 -0.25 0.00 -0.26 0.00 0.00 57.72 57.15 1wbw n HIS 199 Cb 0.61 -2.67 0.08 0.00 1.12 0.00 0.00 29.99 29.13 1wbw n HIS 199 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1wbw s TYR 200 N 4.25 2.62 0.00 4.41 -0.85 -1.26 -5.12 117.35 121.40 1wbw s TYR 200 Ca 0.93 0.26 0.00 0.00 -0.52 0.00 0.00 57.07 57.75 1wbw s TYR 200 Cb -0.69 -3.18 0.00 0.00 0.38 0.00 0.00 41.96 38.47 1wbw s TYR 200 CO 0.51 -1.47 0.00 0.27 -1.52 0.00 0.00 175.55 173.34 1wbw n ASN 201 N -2.89 0.00 0.21 -0.18 0.23 -1.26 -5.06 115.26 106.31 1wbw n ASN 201 Ca 0.10 -0.76 0.15 0.00 -0.53 0.00 0.00 54.58 53.54 1wbw n ASN 201 Cb 0.60 0.00 0.68 0.00 -2.08 0.00 0.00 39.78 38.98 1wbw n ASN 201 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1wbw h GLN 202 N 0.00 0.00 -0.01 -3.83 3.07 -1.99 -2.13 115.11 110.21 1wbw h GLN 202 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1wbw h GLN 202 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 1wbw h GLN 202 CO 0.00 0.00 0.01 1.79 0.09 0.00 0.00 178.83 180.72 1wbw h THR 203 N 0.00 0.49 -0.98 1.86 1.35 -1.97 -2.58 112.91 111.08 1wbw h THR 203 Ca 0.00 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.95 1wbw h THR 203 Cb 0.30 0.99 -0.07 0.00 -1.73 0.00 0.00 68.15 67.63 1wbw h THR 203 CO 0.00 0.00 0.63 -0.37 -0.25 0.00 0.00 175.52 175.53 1wbw h VAL 204 N 0.00 1.01 0.00 6.82 -1.51 -1.77 -1.95 116.25 118.85 1wbw h VAL 204 Ca 0.01 -0.36 -0.02 0.00 -1.23 0.00 0.00 66.70 65.09 1wbw h VAL 204 Cb 0.03 -0.14 -0.00 0.00 -2.13 0.00 0.00 31.29 29.05 1wbw h VAL 204 CO -0.00 0.19 -0.10 0.44 -1.23 0.00 0.00 177.57 176.87 1wbw h ASP 205 N 1.06 0.00 -0.16 4.19 3.32 -1.70 -2.68 116.42 120.44 1wbw h ASP 205 Ca 0.45 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.37 1wbw h ASP 205 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1wbw h ASP 205 CO -0.20 0.10 -0.36 0.40 -1.72 0.00 0.00 179.24 177.46 1wbw h ILE 206 N 0.00 1.29 -0.13 0.35 1.08 -1.49 -0.95 117.51 117.65 1wbw h ILE 206 Ca -0.00 -1.51 0.02 0.00 -0.39 0.00 0.00 64.86 62.98 1wbw h ILE 206 Cb 0.18 1.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.34 1wbw h ILE 206 CO 0.01 0.49 -0.01 -0.25 -0.69 0.00 0.00 178.15 177.70 1wbw h TRP 207 N 0.56 -0.03 -0.65 1.37 2.91 -1.44 -0.93 115.95 117.74 1wbw h TRP 207 Ca 0.06 0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.15 1wbw h TRP 207 Cb 0.88 0.03 -0.06 0.00 -0.51 0.00 0.00 29.16 29.50 1wbw h TRP 207 CO 0.04 -0.03 0.34 0.77 -1.03 0.00 0.00 178.44 178.53 1wbw h SER 208 N 0.03 0.49 -0.41 2.65 0.02 -1.14 -1.99 113.55 113.21 1wbw h SER 208 Ca 0.06 0.04 0.06 0.00 -0.84 0.00 0.00 61.79 61.11 1wbw h SER 208 Cb 0.08 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 1wbw h SER 208 CO -0.12 0.31 0.09 0.58 -1.14 0.00 0.00 176.83 176.56 1wbw h VAL 209 N 0.63 0.80 -0.18 2.27 2.07 -0.65 -1.15 116.25 120.05 1wbw h VAL 209 Ca 0.30 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.79 1wbw h VAL 209 Cb 0.22 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.48 1wbw h VAL 209 CO -0.20 0.04 -0.24 1.23 0.02 0.00 0.00 177.57 178.42 1wbw h GLY 210 N 0.23 -0.21 0.32 2.17 0.00 -0.48 0.20 103.07 105.30 1wbw h GLY 210 Ca 0.20 0.29 0.13 0.00 0.00 0.00 0.00 47.33 47.95 1wbw h GLY 210 CO -0.25 -0.20 0.43 0.00 0.00 0.00 0.00 176.54 176.53 1wbw h ILE 212 N 0.66 1.24 -0.65 0.00 2.04 -0.66 -2.92 117.51 117.22 1wbw h ILE 212 Ca 0.44 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.59 1wbw h ILE 212 Cb 0.56 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 38.28 1wbw h ILE 212 CO -0.33 0.20 0.41 -0.03 0.00 0.00 0.00 178.15 178.40 1wbw h MET 213 N -0.24 0.79 -0.70 2.37 4.05 -0.26 -1.80 114.93 119.15 1wbw h MET 213 Ca 0.01 -0.05 0.03 0.00 -0.28 0.00 0.00 59.70 59.41 1wbw h MET 213 Cb 0.31 -0.18 -0.04 0.00 -0.80 0.00 0.00 31.60 30.90 1wbw h MET 213 CO 0.00 0.52 0.46 0.00 0.23 0.00 0.00 176.91 178.13 1wbw h ALA 214 N 1.27 1.59 0.00 0.39 0.00 -1.05 -2.11 119.26 119.34 1wbw h ALA 214 Ca 0.26 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 1wbw h ALA 214 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1wbw h ALA 214 CO -0.09 0.34 -0.78 1.49 0.00 0.00 0.00 179.25 180.22 1wbw h GLU 215 N 0.86 0.00 -0.20 0.00 4.81 -1.22 -0.81 114.58 118.02 1wbw h GLU 215 Ca 0.28 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.38 1wbw h GLU 215 Cb 0.04 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1wbw h GLU 215 CO -0.08 0.78 -0.42 -0.07 -0.73 0.00 0.00 179.01 178.49 1wbw h LEU 216 N 0.00 0.51 -0.18 1.64 3.38 -1.15 0.51 115.31 120.03 1wbw h LEU 216 Ca -0.01 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 1wbw h LEU 216 Cb 1.44 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1wbw h LEU 216 CO 0.10 0.88 -0.48 -0.07 0.09 0.00 0.00 178.44 178.95 1wbw h LEU 217 N 0.40 0.73 0.00 1.67 3.38 -1.17 -3.38 115.31 116.94 1wbw h LEU 217 Ca 0.03 -0.58 -0.18 0.00 0.09 0.00 0.00 57.88 57.24 1wbw h LEU 217 Cb 0.91 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1wbw h LEU 217 CO 0.08 1.18 -2.16 0.35 0.09 0.00 0.00 178.44 177.98 1wbw n THR 218 N -4.18 0.66 -0.81 0.22 -2.24 -0.33 -4.99 114.28 102.61 1wbw n THR 218 Ca -0.06 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1wbw n THR 218 Cb 0.59 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1wbw n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbw n GLY 219 N 1.53 0.83 3.19 3.38 0.00 0.18 -5.04 105.19 109.26 1wbw n GLY 219 Ca -0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 1wbw n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wbw s ARG 220 N -0.19 0.88 0.27 1.61 1.81 -1.22 -4.97 118.95 117.14 1wbw s ARG 220 Ca 0.00 -1.04 -0.30 0.00 -1.72 0.00 0.00 55.73 52.67 1wbw s ARG 220 Cb 0.00 -0.85 -0.10 0.00 -0.45 0.00 0.00 34.95 33.55 1wbw s ARG 220 CO 0.00 0.18 1.38 0.99 -0.68 0.00 0.00 175.30 177.17 1wbw s THR 221 N -1.55 2.74 -0.03 0.02 2.01 -1.26 -4.01 115.64 113.56 1wbw s THR 221 Ca 0.01 0.65 -0.26 0.00 0.31 0.00 0.00 61.69 62.41 1wbw s THR 221 Cb -0.08 -3.42 -0.20 0.00 0.01 0.00 0.00 72.50 68.81 1wbw s THR 221 CO 0.02 0.12 1.21 0.25 -0.69 0.00 0.00 174.62 175.53 1wbw h LEU 222 N 4.54 -0.03 -6.25 4.42 5.85 -1.91 -3.39 115.31 118.54 1wbw h LEU 222 Ca -0.47 -0.49 -0.59 0.00 0.84 0.00 0.00 57.88 57.17 1wbw h LEU 222 Cb 1.22 0.01 -0.41 0.00 0.37 0.00 0.00 40.66 41.85 1wbw h LEU 222 CO 0.74 0.49 -0.80 0.49 -0.34 0.00 0.00 178.44 179.01 1wbw n PHE 223 N -4.86 1.83 -1.27 1.25 3.72 -1.26 -5.00 117.46 111.87 1wbw n PHE 223 Ca -0.09 -3.90 -0.37 0.00 -0.05 0.00 0.00 57.45 53.05 1wbw n PHE 223 Cb 0.27 -0.42 -0.02 0.00 -0.94 0.00 0.00 39.48 38.36 1wbw n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1wbw n PRO 224 N 1.35 2.89 -1.97 -1.08 -0.04 -1.26 -4.64 135.00 130.24 1wbw n PRO 224 Ca 0.26 -2.10 -0.40 0.00 -0.04 0.00 0.00 63.50 61.22 1wbw n PRO 224 Cb 0.45 -2.86 -0.00 0.00 -0.04 0.00 0.00 33.50 31.05 1wbw n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1wbw s GLY 225 N 3.03 2.94 0.01 0.55 0.00 -1.26 -4.89 107.32 107.70 1wbw s GLY 225 Ca 0.56 1.35 0.19 0.00 0.00 0.00 0.00 44.72 46.82 1wbw s GLY 225 CO -0.04 1.96 1.61 -1.30 0.00 0.00 0.00 173.10 175.33 1wbw n THR 226 N 0.23 0.70 -3.87 0.90 -2.24 -1.26 -4.27 114.28 104.47 1wbw n THR 226 Ca 0.03 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1wbw n THR 226 Cb 0.42 -0.85 0.01 0.00 -2.10 0.00 0.00 70.33 67.81 1wbw n THR 226 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1wbw n ASP 227 N -1.53 -0.89 -0.19 3.42 5.68 -1.24 -3.02 116.55 118.78 1wbw n ASP 227 Ca 0.05 -1.31 -0.07 0.00 -0.50 0.00 0.00 54.79 52.96 1wbw n ASP 227 Cb 0.22 1.40 0.02 0.00 -1.14 0.00 0.00 41.12 41.63 1wbw n ASP 227 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 1wbw h HIS 228 N 1.63 0.75 0.03 2.11 3.86 -1.89 0.13 115.15 121.77 1wbw h HIS 228 Ca -0.15 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.04 1wbw h HIS 228 Cb 0.76 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1wbw h HIS 228 CO 0.00 0.55 -0.01 0.82 0.86 0.00 0.00 177.93 180.14 1wbw h ILE 229 N 0.74 1.42 -0.96 2.45 1.08 -1.99 -1.72 117.51 118.53 1wbw h ILE 229 Ca 0.19 -1.71 0.24 0.00 -0.39 0.00 0.00 64.86 63.20 1wbw h ILE 229 Cb 0.04 2.52 -0.13 0.00 -3.07 0.00 0.00 36.82 36.18 1wbw h ILE 229 CO -0.03 0.42 0.51 -0.78 -0.69 0.00 0.00 178.15 177.58 1wbw h ASP 230 N -0.82 0.53 -0.38 1.72 3.58 -1.94 -1.17 116.42 117.94 1wbw h ASP 230 Ca -0.00 0.15 -0.14 0.00 0.42 0.00 0.00 57.03 57.46 1wbw h ASP 230 Cb 0.71 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.83 1wbw h ASP 230 CO 0.01 0.04 -0.27 -0.61 -2.88 0.00 0.00 179.24 175.53 1wbw h GLN 231 N 0.49 0.90 -0.73 0.28 4.15 -0.57 -2.03 115.11 117.60 1wbw h GLN 231 Ca 0.62 -0.41 0.05 0.00 0.77 0.00 0.00 58.65 59.69 1wbw h GLN 231 Cb 1.19 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 28.81 1wbw h GLN 231 CO -0.51 1.06 0.43 1.25 -1.93 0.00 0.00 178.83 179.14 1wbw h LEU 232 N 0.77 0.67 -0.14 -2.39 5.85 -0.72 -0.81 115.31 118.54 1wbw h LEU 232 Ca 0.09 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1wbw h LEU 232 Cb 0.84 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 1wbw h LEU 232 CO 0.07 0.44 0.09 0.11 -0.34 0.00 0.00 178.44 178.81 1wbw h LYS 233 N 0.81 0.20 -0.50 1.25 1.57 -0.90 -0.19 116.57 118.81 1wbw h LYS 233 Ca 0.32 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 1wbw h LYS 233 Cb 0.15 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.34 1wbw h LYS 233 CO -0.16 0.17 -0.01 -0.07 -0.57 0.00 0.00 179.45 178.81 1wbw h LEU 234 N 0.17 -0.23 0.14 2.94 3.38 -1.12 -0.77 115.31 119.81 1wbw h LEU 234 Ca 0.05 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1wbw h LEU 234 Cb 0.03 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1wbw h LEU 234 CO -0.01 -0.08 -0.11 0.40 0.09 0.00 0.00 178.44 178.73 1wbw h ILE 235 N 0.10 0.76 0.00 1.22 2.04 -0.68 -2.83 117.51 118.12 1wbw h ILE 235 Ca 0.25 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 66.02 1wbw h ILE 235 Cb 0.38 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1wbw h ILE 235 CO -0.42 0.00 -0.42 -0.07 0.00 0.00 0.00 178.15 177.24 1wbw h LEU 236 N -0.26 0.00 -0.28 1.44 3.38 -0.79 -0.82 115.31 117.99 1wbw h LEU 236 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wbw h LEU 236 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1wbw h LEU 236 CO -0.01 0.42 0.19 -0.09 0.09 0.00 0.00 178.44 179.04 1wbw h ARG 237 N 0.00 0.37 -0.21 1.13 2.43 -0.96 0.22 114.38 117.35 1wbw h ARG 237 Ca -0.00 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 1wbw h ARG 237 Cb 0.77 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 1wbw h ARG 237 CO 0.05 0.24 -0.11 1.25 -1.51 0.00 0.00 179.97 179.90 1wbw h LEU 238 N 0.38 0.46 0.00 3.80 5.85 -1.22 -3.38 115.31 121.19 1wbw h LEU 238 Ca 0.10 -0.41 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1wbw h LEU 238 Cb -0.04 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.86 1wbw h LEU 238 CO -0.02 0.77 -1.33 0.52 -0.34 0.00 0.00 178.44 178.04 1wbw n VAL 239 N -4.54 0.00 0.00 1.05 0.31 -0.35 -0.81 118.33 113.99 1wbw n VAL 239 Ca -0.05 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 1wbw n VAL 239 Cb 0.33 0.60 0.00 0.00 -0.91 0.00 0.00 33.84 33.86 1wbw n VAL 239 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wbw n GLY 240 N 1.42 0.41 3.78 2.92 0.00 0.75 -4.03 105.19 110.44 1wbw n GLY 240 Ca 0.01 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.10 1wbw n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wbw s THR 241 N -2.72 3.23 0.65 2.61 -4.23 -0.21 -4.69 115.64 110.28 1wbw s THR 241 Ca 0.00 0.73 -0.17 0.00 -1.18 0.00 0.00 61.69 61.07 1wbw s THR 241 Cb 0.00 -3.27 -0.00 0.00 1.34 0.00 0.00 72.50 70.56 1wbw s THR 241 CO 0.00 -0.20 1.25 -2.16 -0.54 0.00 0.00 174.62 172.97 1wbw s PRO 242 N -3.43 2.55 0.67 3.99 0.04 -1.26 -4.84 135.00 132.72 1wbw s PRO 242 Ca 0.71 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.68 1wbw s PRO 242 Cb -0.23 -1.86 0.10 0.00 0.04 0.00 0.00 34.50 32.55 1wbw s PRO 242 CO 0.29 -1.56 0.93 0.20 0.04 0.00 0.00 177.00 176.90 1wbw s GLY 243 N -1.60 1.77 0.49 0.56 0.00 -1.26 -4.91 107.32 102.36 1wbw s GLY 243 Ca 0.79 -1.65 0.15 0.00 0.00 0.00 0.00 44.72 44.02 1wbw s GLY 243 CO 0.39 -1.15 2.08 0.00 0.00 0.00 0.00 173.10 174.42 1wbw h ALA 244 N -0.35 2.03 -0.03 3.20 0.00 -1.99 -1.46 119.26 120.66 1wbw h ALA 244 Ca -0.37 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1wbw h ALA 244 Cb 1.28 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1wbw h ALA 244 CO 0.43 -0.08 0.01 1.49 0.00 0.00 0.00 179.25 181.11 1wbw h GLU 245 N 0.18 0.05 -0.16 0.00 4.81 -2.01 -1.67 114.58 115.78 1wbw h GLU 245 Ca 0.12 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.21 1wbw h GLU 245 Cb 0.24 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1wbw h GLU 245 CO -0.02 0.18 -0.44 1.25 -0.73 0.00 0.00 179.01 179.25 1wbw h LEU 246 N -0.09 0.41 0.08 1.64 6.46 -1.81 -3.21 115.31 118.78 1wbw h LEU 246 Ca 0.01 -0.19 -0.00 0.00 -0.12 0.00 0.00 57.88 57.58 1wbw h LEU 246 Cb 0.15 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 39.96 1wbw h LEU 246 CO -0.00 0.80 -0.04 -0.07 -0.62 0.00 0.00 178.44 178.51 1wbw h LEU 247 N 0.32 -0.09 -0.91 2.25 3.38 -1.13 -2.67 115.31 116.46 1wbw h LEU 247 Ca 0.02 -0.05 0.25 0.00 0.09 0.00 0.00 57.88 58.19 1wbw h LEU 247 Cb 0.90 0.02 -0.16 0.00 0.09 0.00 0.00 40.66 41.52 1wbw h LEU 247 CO 0.08 -0.00 0.16 0.11 0.09 0.00 0.00 178.44 178.87 1wbw h LYS 248 N -0.17 0.11 0.00 1.13 1.57 -1.33 -0.34 116.57 117.54 1wbw h LYS 248 Ca -0.01 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1wbw h LYS 248 Cb 0.14 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 1wbw h LYS 248 CO 0.02 0.07 -0.06 0.87 -0.57 0.00 0.00 179.45 179.78 1wbw h LYS 249 N 0.11 0.00 -6.47 3.15 1.57 -1.48 -3.42 116.57 110.04 1wbw h LYS 249 Ca 0.57 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.80 1wbw h LYS 249 Cb 1.19 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.44 1wbw h LYS 249 CO -0.76 0.06 1.07 0.42 -0.57 0.00 0.00 179.45 179.67 1wbw s ILE 250 N -3.87 3.86 0.23 1.86 1.01 -0.14 -4.82 121.20 119.33 1wbw s ILE 250 Ca -0.01 0.77 0.03 0.00 0.00 0.00 0.00 60.65 61.44 1wbw s ILE 250 Cb 0.11 -4.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.09 1wbw s ILE 250 CO 0.54 -1.12 1.55 0.28 0.00 0.00 0.00 174.94 176.20 1wbw h SER 251 N 10.73 0.35 -1.56 3.58 0.02 -1.22 -3.40 113.55 122.05 1wbw h SER 251 Ca -0.26 -0.20 -0.42 0.00 -0.84 0.00 0.00 61.79 60.06 1wbw h SER 251 Cb 1.09 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.49 1wbw h SER 251 CO 1.16 0.86 1.16 -0.55 -1.14 0.00 0.00 176.83 178.32 1wbw s SER 252 N -6.90 5.13 0.30 3.07 0.15 -1.11 -4.83 113.70 109.52 1wbw s SER 252 Ca -0.05 0.10 0.06 0.00 0.70 0.00 0.00 55.95 56.76 1wbw s SER 252 Cb 0.12 -2.54 0.73 0.00 -1.71 0.00 0.00 66.02 62.63 1wbw s SER 252 CO 0.81 -2.56 1.77 -0.08 1.20 0.00 0.00 173.24 174.38 1wbw h GLU 253 N 14.22 0.74 0.01 5.44 4.22 -1.93 0.66 114.58 137.94 1wbw h GLU 253 Ca -0.15 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.24 1wbw h GLU 253 Cb 1.12 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1wbw h GLU 253 CO 1.21 0.49 -0.01 0.77 -2.18 0.00 0.00 179.01 179.29 1wbw h SER 254 N 0.76 -0.02 -0.77 1.04 0.02 -1.95 -1.04 113.55 111.59 1wbw h SER 254 Ca 0.58 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1wbw h SER 254 Cb 0.89 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.40 1wbw h SER 254 CO -0.38 0.33 0.49 0.00 -1.14 0.00 0.00 176.83 176.12 1wbw h ALA 255 N 0.61 0.98 -0.44 3.77 0.00 -1.75 -1.00 119.26 121.43 1wbw h ALA 255 Ca -0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1wbw h ALA 255 Cb 0.36 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1wbw h ALA 255 CO 0.00 0.43 -0.02 -0.09 0.00 0.00 0.00 179.25 179.57 1wbw h ARG 256 N 1.05 0.74 -0.44 0.00 2.43 -0.82 -1.99 114.38 115.36 1wbw h ARG 256 Ca 0.28 -0.20 -0.14 0.00 -0.81 0.00 0.00 59.98 59.11 1wbw h ARG 256 Cb -0.07 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1wbw h ARG 256 CO -0.06 0.77 -0.29 -0.97 -1.51 0.00 0.00 179.97 177.91 1wbw h ASN 257 N 0.69 1.00 -0.59 -3.80 -1.24 -0.84 -2.85 115.58 107.95 1wbw h ASN 257 Ca 0.13 -0.41 -0.01 0.00 0.71 0.00 0.00 56.30 56.72 1wbw h ASN 257 Cb 0.46 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 39.20 1wbw h ASN 257 CO 0.02 1.21 0.32 0.22 -1.29 0.00 0.00 177.43 177.91 1wbw h TYR 258 N 0.81 0.82 -0.71 0.67 3.20 -0.81 -3.03 116.97 117.91 1wbw h TYR 258 Ca 0.09 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 1wbw h TYR 258 Cb 0.87 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 1wbw h TYR 258 CO 0.06 0.59 0.29 0.82 -1.64 0.00 0.00 178.16 178.28 1wbw h ILE 259 N 0.80 1.25 0.00 1.81 2.04 -1.36 -1.38 117.51 120.67 1wbw h ILE 259 Ca 0.21 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1wbw h ILE 259 Cb 0.05 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1wbw h ILE 259 CO -0.03 0.31 0.00 0.00 0.00 0.00 0.00 178.15 178.42 1wbw n GLN 260 N -4.37 0.01 0.17 2.37 6.02 -1.08 -1.23 117.38 119.27 1wbw n GLN 260 Ca 0.06 0.34 0.05 0.00 -0.01 0.00 0.00 57.00 57.43 1wbw n GLN 260 Cb 0.17 -1.52 0.26 0.00 1.02 0.00 0.00 30.24 30.18 1wbw n GLN 260 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1wbw h SER 261 N 0.00 0.00 -3.91 1.08 4.64 -1.12 -3.46 113.55 110.78 1wbw h SER 261 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 1wbw h SER 261 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1wbw h SER 261 CO 0.00 0.42 0.42 -0.76 -0.87 0.00 0.00 176.83 176.04 1wbw s LEU 262 N -6.93 4.28 0.20 5.97 1.02 -0.37 -5.01 118.68 117.84 1wbw s LEU 262 Ca 0.01 2.07 -0.31 0.00 0.02 0.00 0.00 54.13 55.92 1wbw s LEU 262 Cb 0.10 -4.01 -0.09 0.00 0.02 0.00 0.00 46.19 42.21 1wbw s LEU 262 CO 0.70 -0.34 1.44 -0.89 0.02 0.00 0.00 176.35 177.29 1wbw s THR 263 N -1.52 2.84 0.25 5.49 2.01 -1.26 -4.94 115.64 118.51 1wbw s THR 263 Ca 0.53 0.66 -0.30 0.00 0.31 0.00 0.00 61.69 62.89 1wbw s THR 263 Cb -0.24 -3.42 -0.10 0.00 0.01 0.00 0.00 72.50 68.75 1wbw s THR 263 CO 0.30 0.08 1.44 -1.10 -0.69 0.00 0.00 174.62 174.66 1wbw s GLN 264 N 0.31 4.26 -0.03 4.92 -0.21 -1.26 -4.92 119.66 122.73 1wbw s GLN 264 Ca 0.63 2.31 0.04 0.00 0.02 0.00 0.00 55.36 58.35 1wbw s GLN 264 Cb -0.41 -3.11 -0.00 0.00 1.00 0.00 0.00 33.01 30.50 1wbw s GLN 264 CO 0.37 -0.42 -0.14 -1.64 -2.12 0.00 0.00 175.29 171.34 1wbw s MET 265 N -0.42 1.38 0.45 2.91 -1.94 -1.26 -4.98 119.30 115.44 1wbw s MET 265 Ca 0.59 -0.49 -0.18 0.00 -1.71 0.00 0.00 55.69 53.90 1wbw s MET 265 Cb -0.42 -1.24 -0.09 0.00 2.01 0.00 0.00 34.83 35.08 1wbw s MET 265 CO 0.44 0.22 0.93 -1.25 -0.01 0.00 0.00 175.02 175.35 1wbw s PRO 266 N 0.01 4.06 0.20 2.03 0.04 -1.26 -1.05 135.00 139.03 1wbw s PRO 266 Ca -0.01 0.97 -0.33 0.00 0.04 0.00 0.00 61.00 61.67 1wbw s PRO 266 Cb -0.09 -2.20 -0.14 0.00 0.04 0.00 0.00 34.50 32.11 1wbw s PRO 266 CO 0.01 -0.11 1.46 1.17 0.04 0.00 0.00 177.00 179.57 1wbw n LYS 267 N -1.05 2.00 -1.71 4.56 4.81 -1.26 -4.11 118.16 121.40 1wbw n LYS 267 Ca 0.06 0.72 -0.30 0.00 -0.87 0.00 0.00 58.31 57.92 1wbw n LYS 267 Cb 0.54 -2.41 0.07 0.00 0.02 0.00 0.00 35.03 33.25 1wbw n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1wbw s MET 268 N 0.18 2.35 -0.39 1.64 -1.94 0.01 -4.90 119.30 116.26 1wbw s MET 268 Ca 0.74 0.52 -0.29 0.00 -1.71 0.00 0.00 55.69 54.94 1wbw s MET 268 Cb -0.69 -1.96 0.02 0.00 2.01 0.00 0.00 34.83 34.21 1wbw s MET 268 CO 0.45 -1.41 1.17 1.21 -0.01 0.00 0.00 175.02 176.43 1wbw s ASN 269 N -4.14 6.70 0.40 3.03 3.84 -1.26 -4.92 114.94 118.59 1wbw s ASN 269 Ca 0.60 0.82 0.17 0.00 0.21 0.00 0.00 52.86 54.65 1wbw s ASN 269 Cb -0.13 -2.55 0.84 0.00 -0.55 0.00 0.00 41.25 38.87 1wbw s ASN 269 CO 0.53 -1.13 1.85 -0.26 -2.79 0.00 0.00 177.10 175.30 1wbw h PHE 270 N 9.03 0.00 0.00 0.43 -1.00 -1.94 -1.93 116.94 121.52 1wbw h PHE 270 Ca -0.23 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.52 1wbw h PHE 270 Cb 1.07 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.63 1wbw h PHE 270 CO 0.91 0.33 -0.13 0.00 -1.61 0.00 0.00 178.31 177.81 1wbw h ALA 271 N 1.67 1.51 0.00 2.45 0.00 -1.91 0.51 119.26 123.49 1wbw h ALA 271 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1wbw h ALA 271 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1wbw h ALA 271 CO 0.04 0.16 -0.90 0.09 0.00 0.00 0.00 179.25 178.65 1wbw n ASN 272 N -3.98 0.72 0.01 0.00 3.02 -0.82 -3.79 115.26 110.43 1wbw n ASN 272 Ca -0.02 0.13 -0.19 0.00 -0.03 0.00 0.00 54.58 54.47 1wbw n ASN 272 Cb 0.22 0.46 -0.14 0.00 -0.61 0.00 0.00 39.78 39.70 1wbw n ASN 272 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1wbw h VAL 273 N 0.00 1.44 -2.33 2.41 2.07 -0.61 -3.39 116.25 115.83 1wbw h VAL 273 Ca 0.00 -2.46 -0.77 0.00 0.82 0.00 0.00 66.70 64.30 1wbw h VAL 273 Cb 0.85 3.09 -0.30 0.00 -1.52 0.00 0.00 31.29 33.41 1wbw h VAL 273 CO 0.00 0.67 0.69 0.49 0.02 0.00 0.00 177.57 179.44 1wbw n PHE 274 N -4.19 2.95 -1.70 1.57 3.72 0.17 -5.03 117.46 114.94 1wbw n PHE 274 Ca -0.16 -2.84 -0.43 0.00 -0.05 0.00 0.00 57.45 53.96 1wbw n PHE 274 Cb 0.77 -1.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.20 1wbw n PHE 274 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1wbw n ILE 275 N 0.08 0.14 0.00 4.37 2.08 -1.25 -1.83 119.36 122.95 1wbw n ILE 275 Ca 0.42 -0.02 0.00 0.00 0.56 0.00 0.00 62.75 63.70 1wbw n ILE 275 Cb 0.29 -1.91 0.00 0.00 -0.75 0.00 0.00 39.64 37.28 1wbw n ILE 275 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1wbw n GLY 276 N 3.93 2.00 3.75 7.39 0.00 -1.26 -5.03 105.19 115.97 1wbw n GLY 276 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1wbw n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbw s ALA 277 N -2.53 2.47 0.11 4.61 0.00 -0.76 -4.93 121.76 120.73 1wbw s ALA 277 Ca 0.00 0.94 -0.33 0.00 0.00 0.00 0.00 51.96 52.57 1wbw s ALA 277 Cb 0.00 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.56 1wbw s ALA 277 CO 0.00 -1.28 1.74 -1.71 0.00 0.00 0.00 175.76 174.51 1wbw n ASN 278 N -1.84 3.58 -0.14 0.00 2.85 -1.26 -4.87 115.26 113.59 1wbw n ASN 278 Ca 0.13 1.03 0.20 0.00 -0.11 0.00 0.00 54.58 55.83 1wbw n ASN 278 Cb 0.50 -1.47 0.60 0.00 1.24 0.00 0.00 39.78 40.64 1wbw n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1wbw h PRO 279 N 7.48 0.22 -0.26 1.20 0.11 -1.97 0.15 132.00 138.93 1wbw h PRO 279 Ca -0.46 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.54 1wbw h PRO 279 Cb 1.24 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1wbw h PRO 279 CO 0.93 0.15 -0.25 -0.07 -0.21 0.00 0.00 178.00 178.54 1wbw h LEU 280 N 0.23 0.51 -0.48 2.35 4.07 -1.99 -1.41 115.31 118.58 1wbw h LEU 280 Ca 0.37 -0.17 -0.03 0.00 0.08 0.00 0.00 57.88 58.12 1wbw h LEU 280 Cb 1.10 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.68 1wbw h LEU 280 CO -0.08 0.75 0.17 0.00 -1.08 0.00 0.00 178.44 178.20 1wbw h ALA 281 N 1.29 0.62 -0.50 1.53 0.00 -1.08 -2.37 119.26 118.75 1wbw h ALA 281 Ca 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1wbw h ALA 281 Cb 0.68 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1wbw h ALA 281 CO 0.05 0.26 0.15 0.28 0.00 0.00 0.00 179.25 179.99 1wbw h VAL 282 N 0.64 1.23 -0.25 0.00 2.07 -1.26 -1.16 116.25 117.52 1wbw h VAL 282 Ca 0.16 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1wbw h VAL 282 Cb 0.24 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1wbw h VAL 282 CO -0.01 0.29 0.09 -0.78 0.02 0.00 0.00 177.57 177.18 1wbw h ASP 283 N 0.68 0.36 -0.18 0.57 3.58 -1.25 -0.92 116.42 119.27 1wbw h ASP 283 Ca 0.16 -0.19 0.01 0.00 0.42 0.00 0.00 57.03 57.43 1wbw h ASP 283 Cb 0.29 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 1wbw h ASP 283 CO -0.00 0.45 0.07 0.25 -2.88 0.00 0.00 179.24 177.13 1wbw h LEU 284 N 0.25 0.10 -0.48 2.28 5.85 -1.32 -2.73 115.31 119.26 1wbw h LEU 284 Ca 0.08 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.91 1wbw h LEU 284 Cb 0.22 -0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.16 1wbw h LEU 284 CO -0.00 0.08 -0.05 -0.07 -0.34 0.00 0.00 178.44 178.06 1wbw h LEU 285 N 0.17 -0.31 -1.92 2.25 3.38 -1.02 0.18 115.31 118.03 1wbw h LEU 285 Ca 0.07 0.13 0.19 0.00 0.09 0.00 0.00 57.88 58.36 1wbw h LEU 285 Cb 0.03 0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1wbw h LEU 285 CO -0.07 -0.11 0.49 -0.33 0.09 0.00 0.00 178.44 178.52 1wbw h GLU 286 N 0.06 0.07 0.00 1.13 5.08 -0.87 -0.13 114.58 119.92 1wbw h GLU 286 Ca 0.24 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1wbw h GLU 286 Cb 0.36 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1wbw h GLU 286 CO -0.44 0.05 -1.16 1.63 -1.00 0.00 0.00 179.01 178.09 1wbw n LYS 287 N -4.36 0.60 0.13 2.33 5.02 -0.13 -3.92 118.16 117.83 1wbw n LYS 287 Ca 0.14 0.07 -0.24 0.00 -2.02 0.00 0.00 58.31 56.25 1wbw n LYS 287 Cb 0.72 -1.77 -0.16 0.00 -0.02 0.00 0.00 35.03 33.80 1wbw n LYS 287 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1wbw h MET 288 N 0.00 0.51 -2.47 1.97 2.86 -0.37 -1.68 114.93 115.74 1wbw h MET 288 Ca 0.00 -0.87 -0.81 0.00 -2.06 0.00 0.00 59.70 55.96 1wbw h MET 288 Cb 0.99 0.33 -0.27 0.00 0.06 0.00 0.00 31.60 32.71 1wbw h MET 288 CO 0.00 1.42 1.03 1.28 1.06 0.00 0.00 176.91 181.69 1wbw n LEU 289 N -3.73 7.11 -4.52 1.22 4.32 -0.13 -4.39 117.00 116.89 1wbw n LEU 289 Ca -0.18 -5.31 -0.34 0.00 -0.02 0.00 0.00 56.01 50.16 1wbw n LEU 289 Cb 1.09 -1.21 -0.12 0.00 -1.62 0.00 0.00 43.42 41.56 1wbw n LEU 289 CO 0.59 1.94 -0.36 -0.69 -1.22 0.00 0.00 177.39 177.65 1wbw s VAL 290 N -3.73 3.87 0.09 4.08 1.01 -1.26 -4.89 120.40 119.57 1wbw s VAL 290 Ca 0.37 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.80 1wbw s VAL 290 Cb 0.15 -2.67 -0.07 0.00 0.00 0.00 0.00 36.38 33.79 1wbw s VAL 290 CO -0.06 0.52 1.52 0.25 0.00 0.00 0.00 175.10 177.33 1wbw h LEU 291 N 6.32 0.50 -8.76 3.92 5.85 -1.91 -3.39 115.31 117.84 1wbw h LEU 291 Ca -0.35 -0.33 -0.56 0.00 0.84 0.00 0.00 57.88 57.47 1wbw h LEU 291 Cb 1.19 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.02 1wbw h LEU 291 CO 0.60 0.71 0.99 -0.62 -0.34 0.00 0.00 178.44 179.78 1wbw s ASP 292 N -6.04 6.51 0.51 1.25 -1.08 -1.26 -4.91 116.67 111.65 1wbw s ASP 292 Ca -0.13 0.66 0.28 0.00 -0.52 0.00 0.00 52.55 52.83 1wbw s ASP 292 Cb 0.08 -2.55 1.34 0.00 -1.46 0.00 0.00 42.92 40.34 1wbw s ASP 292 CO 0.76 -1.32 2.01 0.77 0.52 0.00 0.00 175.17 177.91 1wbw h SER 293 N 9.86 0.00 0.16 -0.34 4.64 -1.98 -0.96 113.55 124.93 1wbw h SER 293 Ca -0.25 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 1wbw h SER 293 Cb 1.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1wbw h SER 293 CO 1.11 0.14 -0.11 0.44 -0.87 0.00 0.00 176.83 177.53 1wbw h ASP 294 N 0.00 0.00 0.07 4.97 3.32 -1.95 -2.95 116.42 119.89 1wbw h ASP 294 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wbw h ASP 294 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1wbw h ASP 294 CO 0.02 0.11 -0.15 0.29 -1.72 0.00 0.00 179.24 177.78 1wbw n LYS 295 N -4.14 1.41 -1.67 3.56 5.02 -0.37 -4.97 118.16 117.00 1wbw n LYS 295 Ca -0.03 -0.93 -0.34 0.00 -2.02 0.00 0.00 58.31 54.99 1wbw n LYS 295 Cb 0.19 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 33.78 1wbw n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1wbw s ARG 296 N -2.24 2.55 0.22 1.97 0.52 -1.11 -4.99 118.95 115.87 1wbw s ARG 296 Ca 0.29 1.63 -0.30 0.00 -0.52 0.00 0.00 55.73 56.83 1wbw s ARG 296 Cb 0.20 -1.90 -0.09 0.00 0.52 0.00 0.00 34.95 33.68 1wbw s ARG 296 CO 0.43 -1.49 1.19 -1.50 0.02 0.00 0.00 175.30 173.95 1wbw s ILE 297 N -2.05 3.44 0.69 1.52 2.07 -0.63 -5.04 121.20 121.20 1wbw s ILE 297 Ca 0.72 1.28 -0.07 0.00 -1.41 0.00 0.00 60.65 61.17 1wbw s ILE 297 Cb -0.26 -3.82 0.05 0.00 0.13 0.00 0.00 42.46 38.57 1wbw s ILE 297 CO 0.41 0.24 1.01 0.42 -1.91 0.00 0.00 174.94 175.10 1wbw s THR 298 N -0.40 2.46 0.24 4.00 -4.23 -1.26 -4.87 115.64 111.58 1wbw s THR 298 Ca 0.51 -0.22 -0.04 0.00 -1.18 0.00 0.00 61.69 60.76 1wbw s THR 298 Cb -0.33 -3.06 0.10 0.00 1.34 0.00 0.00 72.50 70.55 1wbw s THR 298 CO 0.39 -0.07 1.73 0.00 -0.54 0.00 0.00 174.62 176.14 1wbw h ALA 299 N -0.56 1.03 -0.30 3.99 0.00 -1.94 0.17 119.26 121.65 1wbw h ALA 299 Ca -0.45 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.04 1wbw h ALA 299 Cb 1.31 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1wbw h ALA 299 CO 0.61 0.60 -0.40 0.00 0.00 0.00 0.00 179.25 180.06 1wbw h ALA 300 N 1.19 0.45 -0.31 0.00 0.00 -1.93 -1.90 119.26 116.76 1wbw h ALA 300 Ca 0.16 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 1wbw h ALA 300 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1wbw h ALA 300 CO 0.02 0.56 -0.22 1.96 0.00 0.00 0.00 179.25 181.57 1wbw h GLN 301 N 0.56 0.59 -0.22 0.00 4.20 -1.89 -3.22 115.11 115.13 1wbw h GLN 301 Ca 0.04 -0.22 -0.13 0.00 0.06 0.00 0.00 58.65 58.40 1wbw h GLN 301 Cb 0.99 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 1wbw h GLN 301 CO 0.09 0.76 -0.41 0.00 -0.67 0.00 0.00 178.83 178.61 1wbw h ALA 302 N 1.24 0.88 -0.03 3.87 0.00 -0.54 -2.90 119.26 121.78 1wbw h ALA 302 Ca 0.08 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.56 1wbw h ALA 302 Cb 0.66 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1wbw h ALA 302 CO 0.05 0.64 0.03 -0.07 0.00 0.00 0.00 179.25 179.89 1wbw h LEU 303 N 0.43 0.00 -0.52 0.00 3.38 -1.36 -1.74 115.31 115.50 1wbw h LEU 303 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1wbw h LEU 303 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1wbw h LEU 303 CO 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 178.60 1wbw n ALA 304 N -2.50 2.64 -1.78 1.53 0.00 -1.10 -4.74 120.51 114.57 1wbw n ALA 304 Ca -0.02 -0.33 -0.40 0.00 0.00 0.00 0.00 53.44 52.68 1wbw n ALA 304 Cb 0.12 -1.32 -0.04 0.00 0.00 0.00 0.00 19.45 18.22 1wbw n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1wbw s HIS 305 N -2.04 3.46 0.63 0.00 5.04 -0.66 -4.91 115.29 116.81 1wbw s HIS 305 Ca 0.41 1.62 0.31 0.00 -1.54 0.00 0.00 55.06 55.86 1wbw s HIS 305 Cb 0.21 -3.38 1.68 0.00 0.04 0.00 0.00 32.58 31.13 1wbw s HIS 305 CO 0.36 -0.87 1.99 0.00 -2.34 0.00 0.00 174.74 173.89 1wbw h ALA 306 N 3.79 1.58 -0.20 1.58 0.00 -1.91 -1.75 119.26 122.35 1wbw h ALA 306 Ca -0.47 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.48 1wbw h ALA 306 Cb 1.21 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1wbw h ALA 306 CO 0.67 -0.38 0.14 -0.92 0.00 0.00 0.00 179.25 178.76 1wbw h TYR 307 N 0.00 0.05 -0.51 0.00 3.20 -1.91 -2.71 116.97 115.08 1wbw h TYR 307 Ca 0.06 0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.77 1wbw h TYR 307 Cb 0.68 -0.02 -0.10 0.00 1.54 0.00 0.00 36.73 38.84 1wbw h TYR 307 CO 0.00 0.03 0.13 1.19 -1.64 0.00 0.00 178.16 177.86 1wbw n PHE 308 N -4.49 1.69 -0.21 -3.82 3.72 -0.66 -4.69 117.46 109.00 1wbw n PHE 308 Ca 0.02 -1.27 0.07 0.00 -0.05 0.00 0.00 57.45 56.21 1wbw n PHE 308 Cb 0.25 -0.55 0.34 0.00 -0.94 0.00 0.00 39.48 38.58 1wbw n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wbw h ALA 309 N 1.82 1.70 -1.00 4.37 0.00 -1.63 0.23 119.26 124.74 1wbw h ALA 309 Ca 0.21 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.27 1wbw h ALA 309 Cb 1.94 -0.19 -0.10 0.00 0.00 0.00 0.00 17.79 19.43 1wbw h ALA 309 CO 0.52 0.17 0.62 0.37 0.00 0.00 0.00 179.25 180.93 1wbw h GLN 310 N 0.78 0.79 0.00 0.00 5.75 -1.86 -3.27 115.11 117.30 1wbw h GLN 310 Ca 0.34 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.70 1wbw h GLN 310 Cb 0.32 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.67 1wbw h GLN 310 CO -0.12 0.53 -1.65 0.66 -2.65 0.00 0.00 178.83 175.60 1wbw n TYR 311 N -4.70 0.00 -1.67 3.99 4.01 -0.36 -5.00 117.16 113.43 1wbw n TYR 311 Ca 0.22 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.52 1wbw n TYR 311 Cb 0.51 -0.40 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 1wbw n TYR 311 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1wbw n HIS 312 N -2.15 2.49 -3.78 -0.72 -0.00 0.66 -4.98 115.22 106.75 1wbw n HIS 312 Ca -0.10 -0.27 -0.27 0.00 0.46 0.00 0.00 57.72 57.54 1wbw n HIS 312 Cb 0.58 -2.77 -0.17 0.00 -0.12 0.00 0.00 29.99 27.51 1wbw n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1wbw s ASP 313 N 4.13 2.80 0.33 0.26 2.15 -1.26 -4.98 116.67 120.09 1wbw s ASP 313 Ca 0.89 -0.73 0.26 0.00 0.43 0.00 0.00 52.55 53.39 1wbw s ASP 313 Cb -0.49 -0.66 1.12 0.00 -0.30 0.00 0.00 42.92 42.58 1wbw s ASP 313 CO 0.43 -0.27 1.77 1.55 -0.17 0.00 0.00 175.17 178.48 1wbw h PRO 314 N 8.22 0.00 -0.26 4.34 0.13 -1.96 -1.85 132.00 140.62 1wbw h PRO 314 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1wbw h PRO 314 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1wbw h PRO 314 CO 0.34 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.86 1wbw n ASP 315 N -2.41 2.04 -2.41 1.44 8.00 -1.26 -4.07 116.55 117.87 1wbw n ASP 315 Ca 0.01 -1.83 -0.00 0.00 0.71 0.00 0.00 54.79 53.68 1wbw n ASP 315 Cb 0.21 -0.17 0.04 0.00 -0.02 0.00 0.00 41.12 41.18 1wbw n ASP 315 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1wbw n ASP 316 N 0.58 1.65 -3.51 -2.24 2.03 -0.70 -4.92 116.55 109.44 1wbw n ASP 316 Ca 0.16 -2.17 -0.27 0.00 0.52 0.00 0.00 54.79 53.03 1wbw n ASP 316 Cb 0.37 -0.43 -0.10 0.00 -0.72 0.00 0.00 41.12 40.24 1wbw n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wbw n GLU 317 N -0.36 0.97 -1.85 -0.67 1.02 -1.21 -4.87 120.64 113.68 1wbw n GLU 317 Ca 0.09 -3.71 -0.32 0.00 -0.02 0.00 0.00 57.16 53.21 1wbw n GLU 317 Cb 0.89 -1.84 0.02 0.00 -0.02 0.00 0.00 31.44 30.49 1wbw n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wbw s PRO 318 N -0.82 3.27 0.34 3.49 0.05 -1.26 -5.00 135.00 135.07 1wbw s PRO 318 Ca 0.32 1.00 0.07 0.00 0.05 0.00 0.00 61.00 62.43 1wbw s PRO 318 Cb 0.05 -2.03 -0.01 0.00 0.05 0.00 0.00 34.50 32.56 1wbw s PRO 318 CO -0.16 -0.84 0.48 0.14 0.05 0.00 0.00 177.00 176.67 1wbw s VAL 319 N -2.85 3.99 0.34 -0.36 -7.23 -1.26 -4.09 120.40 108.94 1wbw s VAL 319 Ca 0.59 -0.99 -0.12 0.00 -1.81 0.00 0.00 61.98 59.65 1wbw s VAL 319 Cb -0.14 -3.38 -0.08 0.00 0.56 0.00 0.00 36.38 33.35 1wbw s VAL 319 CO 0.47 -0.15 0.71 0.00 -0.31 0.00 0.00 175.10 175.82 1wbw s ALA 320 N -2.20 3.38 0.94 1.32 0.00 -1.25 -5.01 121.76 118.95 1wbw s ALA 320 Ca 0.46 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 52.20 1wbw s ALA 320 Cb -0.10 -2.68 0.16 0.00 0.00 0.00 0.00 23.12 20.50 1wbw s ALA 320 CO 0.31 0.24 1.11 -0.51 0.00 0.00 0.00 175.76 176.91 1wbw s ASP 321 N -2.63 2.81 0.43 0.00 1.01 -1.26 -4.75 116.67 112.28 1wbw s ASP 321 Ca 0.52 1.94 -0.26 0.00 0.71 0.00 0.00 52.55 55.46 1wbw s ASP 321 Cb -0.10 -2.47 -0.08 0.00 1.01 0.00 0.00 42.92 41.27 1wbw s ASP 321 CO 0.23 -3.13 1.37 -2.84 0.21 0.00 0.00 175.17 171.01 1wbw s PRO 322 N -4.68 3.81 -0.33 8.23 0.02 -1.26 -4.72 135.00 136.08 1wbw s PRO 322 Ca 0.66 2.30 0.01 0.00 0.02 0.00 0.00 61.00 63.99 1wbw s PRO 322 Cb -0.22 -2.70 0.08 0.00 0.02 0.00 0.00 34.50 31.69 1wbw s PRO 322 CO 0.59 -0.67 0.03 -0.47 -0.33 0.00 0.00 177.00 176.15 1wbw s TYR 323 N -1.23 3.53 -0.33 6.54 5.04 -1.26 -5.07 117.35 124.57 1wbw s TYR 323 Ca 0.59 -2.54 -0.29 0.00 -2.44 0.00 0.00 57.07 52.40 1wbw s TYR 323 Cb -0.41 -2.61 -0.01 0.00 0.35 0.00 0.00 41.96 39.28 1wbw s TYR 323 CO 0.53 -0.91 1.69 0.34 -1.34 0.00 0.00 175.55 175.85 1wbw s ASP 324 N 1.19 6.07 -0.25 4.32 -1.08 -1.26 -4.84 116.67 120.82 1wbw s ASP 324 Ca 0.03 1.27 0.09 0.00 -0.52 0.00 0.00 52.55 53.41 1wbw s ASP 324 Cb -0.20 -2.53 0.44 0.00 -1.46 0.00 0.00 42.92 39.17 1wbw s ASP 324 CO -0.05 -1.57 1.21 0.00 0.52 0.00 0.00 175.17 175.27 1wbw n GLN 325 N 8.22 2.64 0.24 4.34 10.64 -1.26 -4.73 117.38 137.47 1wbw n GLN 325 Ca 0.21 -3.76 0.15 0.00 -1.83 0.00 0.00 57.00 51.78 1wbw n GLN 325 Cb 0.47 -1.96 0.83 0.00 -0.86 0.00 0.00 30.24 28.72 1wbw n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1wbw h SER 326 N 1.61 0.00 -0.30 2.61 4.64 -2.02 -1.54 113.55 118.55 1wbw h SER 326 Ca 0.19 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.60 1wbw h SER 326 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1wbw h SER 326 CO 0.40 0.00 0.37 2.19 -0.87 0.00 0.00 176.83 178.92 1wbw h PHE 327 N 0.00 0.00 -0.63 4.77 -0.00 -1.98 -3.03 116.94 116.07 1wbw h PHE 327 Ca 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.01 1wbw h PHE 327 Cb 0.28 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 36.20 1wbw h PHE 327 CO 0.00 0.00 0.34 0.93 -0.00 0.00 0.00 178.31 179.58 1wbw h GLU 328 N 0.00 0.88 -1.03 6.09 4.39 -1.67 -2.14 114.58 121.09 1wbw h GLU 328 Ca 0.14 -0.10 -0.38 0.00 0.34 0.00 0.00 59.36 59.37 1wbw h GLU 328 Cb 0.88 -0.17 -0.22 0.00 -0.10 0.00 0.00 28.75 29.14 1wbw h GLU 328 CO -0.00 0.65 0.48 -1.13 -1.16 0.00 0.00 179.01 177.85 1wbw n SER 329 N -4.37 3.87 -4.34 1.42 3.41 -1.15 -4.95 113.62 107.50 1wbw n SER 329 Ca 0.06 -3.16 -0.32 0.00 -0.26 0.00 0.00 58.87 55.19 1wbw n SER 329 Cb 0.11 -0.77 -0.15 0.00 -0.26 0.00 0.00 64.21 63.14 1wbw n SER 329 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1wbw s ARG 330 N -2.36 2.78 -0.38 4.33 3.52 -0.81 -5.09 118.95 120.95 1wbw s ARG 330 Ca 0.41 -0.80 -0.11 0.00 -0.13 0.00 0.00 55.73 55.10 1wbw s ARG 330 Cb 0.34 -2.34 0.03 0.00 -1.56 0.00 0.00 34.95 31.41 1wbw s ARG 330 CO 0.07 0.39 0.21 -0.51 -0.81 0.00 0.00 175.30 174.65 1wbw s ASP 331 N -0.15 5.77 0.21 -2.12 1.01 -1.26 -5.05 116.67 115.07 1wbw s ASP 331 Ca -0.02 -0.97 0.05 0.00 0.71 0.00 0.00 52.55 52.32 1wbw s ASP 331 Cb -0.14 -2.04 -0.05 0.00 1.01 0.00 0.00 42.92 41.71 1wbw s ASP 331 CO 0.04 -0.39 -0.08 -0.76 0.21 0.00 0.00 175.17 174.19 1wbw s LEU 332 N 1.57 2.44 0.63 1.23 1.43 -1.26 -5.15 118.68 119.56 1wbw s LEU 332 Ca 0.02 -1.10 -0.07 0.00 -1.03 0.00 0.00 54.13 51.95 1wbw s LEU 332 Cb -0.19 -0.46 0.02 0.00 0.03 0.00 0.00 46.19 45.58 1wbw s LEU 332 CO 0.07 -0.34 0.95 -0.76 0.23 0.00 0.00 176.35 176.51 1wbw s LEU 333 N -3.29 3.12 0.14 1.79 1.43 -1.26 -4.90 118.68 115.71 1wbw s LEU 333 Ca 0.24 0.77 -0.28 0.00 -1.03 0.00 0.00 54.13 53.83 1wbw s LEU 333 Cb 0.03 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 1wbw s LEU 333 CO 0.06 -1.18 1.58 0.40 0.23 0.00 0.00 176.35 177.44 1wbw h ILE 334 N -0.32 0.13 0.00 -0.59 2.04 -1.92 -1.74 117.51 115.11 1wbw h ILE 334 Ca -0.45 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1wbw h ILE 334 Cb 1.26 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1wbw h ILE 334 CO 0.61 0.00 -0.01 0.44 0.00 0.00 0.00 178.15 179.20 1wbw h ASP 335 N -0.40 0.00 -0.02 1.72 5.19 -1.95 0.10 116.42 121.06 1wbw h ASP 335 Ca 0.11 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.34 1wbw h ASP 335 Cb 0.60 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.12 1wbw h ASP 335 CO -0.49 0.01 -0.68 -0.33 -3.12 0.00 0.00 179.24 174.63 1wbw h GLU 336 N 0.00 0.50 -0.57 3.56 5.08 -1.73 -1.60 114.58 119.82 1wbw h GLU 336 Ca -0.00 -0.51 -0.04 0.00 -1.00 0.00 0.00 59.36 57.82 1wbw h GLU 336 Cb 0.02 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1wbw h GLU 336 CO 0.00 1.15 0.22 -1.49 -1.00 0.00 0.00 179.01 177.88 1wbw h TRP 337 N 0.06 0.88 -0.35 4.33 4.06 -0.71 -1.99 115.95 122.22 1wbw h TRP 337 Ca -0.08 -0.07 0.03 0.00 2.06 0.00 0.00 58.89 60.83 1wbw h TRP 337 Cb 1.37 -0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 29.23 1wbw h TRP 337 CO 0.13 0.72 0.15 -0.22 -3.56 0.00 0.00 178.44 175.65 1wbw h LYS 338 N 0.79 0.31 -0.45 0.49 3.64 -0.85 0.17 116.57 120.67 1wbw h LYS 338 Ca 0.19 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1wbw h LYS 338 Cb 0.22 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1wbw h LYS 338 CO -0.01 0.20 0.09 1.03 -2.27 0.00 0.00 179.45 178.48 1wbw h SER 339 N 0.31 0.71 -0.34 4.20 0.87 -1.28 0.70 113.55 118.73 1wbw h SER 339 Ca 0.15 -0.25 0.07 0.00 -1.23 0.00 0.00 61.79 60.53 1wbw h SER 339 Cb 0.09 -0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 61.80 1wbw h SER 339 CO -0.13 0.78 -0.07 -0.07 -0.53 0.00 0.00 176.83 176.81 1wbw h LEU 340 N 0.61 -0.28 -0.18 2.23 4.07 -1.02 -1.31 115.31 119.43 1wbw h LEU 340 Ca 0.14 0.10 0.02 0.00 0.08 0.00 0.00 57.88 58.22 1wbw h LEU 340 Cb 0.36 0.20 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 1wbw h LEU 340 CO 0.01 -0.10 0.05 0.74 -1.08 0.00 0.00 178.44 178.06 1wbw h THR 341 N 0.02 0.94 -0.77 0.22 2.02 -0.36 -2.66 112.91 112.33 1wbw h THR 341 Ca 0.17 -0.04 0.14 0.00 0.77 0.00 0.00 66.41 67.44 1wbw h THR 341 Cb 0.25 0.80 -0.09 0.00 -1.74 0.00 0.00 68.15 67.36 1wbw h THR 341 CO -0.34 0.02 0.33 0.22 0.37 0.00 0.00 175.52 176.13 1wbw h TYR 342 N 0.13 0.57 -0.63 3.16 3.20 -0.47 0.36 116.97 123.27 1wbw h TYR 342 Ca 0.08 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1wbw h TYR 342 Cb 0.06 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 1wbw h TYR 342 CO -0.13 0.09 0.19 -0.44 -1.64 0.00 0.00 178.16 176.23 1wbw h ASP 343 N 0.48 0.93 -0.49 -2.11 3.32 -1.09 -0.52 116.42 116.95 1wbw h ASP 343 Ca 0.42 -0.21 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1wbw h ASP 343 Cb 0.62 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 1wbw h ASP 343 CO -0.39 0.90 0.17 -0.33 -1.72 0.00 0.00 179.24 177.87 1wbw h GLU 344 N 0.92 0.81 -0.16 3.56 4.39 -0.98 0.06 114.58 123.17 1wbw h GLU 344 Ca 0.20 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 1wbw h GLU 344 Cb 0.31 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 1wbw h GLU 344 CO -0.00 0.70 0.07 0.28 -1.16 0.00 0.00 179.01 178.89 1wbw h VAL 345 N 0.79 1.15 -0.53 3.13 2.07 -0.49 -2.96 116.25 119.40 1wbw h VAL 345 Ca 0.18 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 1wbw h VAL 345 Cb 0.23 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1wbw h VAL 345 CO -0.01 0.14 0.01 0.40 0.02 0.00 0.00 177.57 178.13 1wbw h ILE 346 N 0.11 1.25 -0.00 4.57 1.08 -0.80 -2.87 117.51 120.85 1wbw h ILE 346 Ca 0.05 -1.05 0.00 0.00 -0.39 0.00 0.00 64.86 63.47 1wbw h ILE 346 Cb 0.16 0.83 0.00 0.00 -3.07 0.00 0.00 36.82 34.74 1wbw h ILE 346 CO -0.00 0.38 -0.03 -1.54 -0.69 0.00 0.00 178.15 176.27 1wbw n SER 347 N -4.20 0.09 -4.68 1.72 3.41 -0.02 -4.91 113.62 105.03 1wbw n SER 347 Ca 0.03 -0.25 -0.45 0.00 -0.26 0.00 0.00 58.87 57.94 1wbw n SER 347 Cb 0.31 -0.23 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1wbw n SER 347 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1wbw n PHE 348 N -1.22 2.41 -4.58 7.33 7.35 -1.09 -4.99 117.46 122.67 1wbw n PHE 348 Ca 0.15 0.14 -0.33 0.00 -0.76 0.00 0.00 57.45 56.64 1wbw n PHE 348 Cb 0.24 -2.61 -0.15 0.00 0.35 0.00 0.00 39.48 37.32 1wbw n PHE 348 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1wbw s VAL 349 N 1.59 2.95 0.81 -2.13 1.01 -1.26 -5.05 120.40 118.31 1wbw s VAL 349 Ca 0.80 -0.68 -0.13 0.00 0.00 0.00 0.00 61.98 61.97 1wbw s VAL 349 Cb -0.63 -2.25 0.08 0.00 0.00 0.00 0.00 36.38 33.59 1wbw s VAL 349 CO 0.39 0.51 1.20 -2.84 0.00 0.00 0.00 175.10 174.36 1wbw s PRO 350 N 0.65 1.63 0.41 2.72 0.02 -1.26 -4.95 135.00 134.21 1wbw s PRO 350 Ca -0.07 1.74 -0.26 0.00 0.02 0.00 0.00 61.00 62.43 1wbw s PRO 350 Cb -0.15 -1.78 -0.09 0.00 0.02 0.00 0.00 34.50 32.50 1wbw s PRO 350 CO 0.03 -2.22 1.32 -1.25 -0.33 0.00 0.00 177.00 174.55 1wbw s PRO 351 N -4.16 3.92 0.33 5.54 0.04 -1.26 -4.94 135.00 134.47 1wbw s PRO 351 Ca 0.73 2.19 -0.25 0.00 0.04 0.00 0.00 61.00 63.71 1wbw s PRO 351 Cb -0.28 -2.74 -0.15 0.00 0.04 0.00 0.00 34.50 31.37 1wbw s PRO 351 CO 0.51 -0.54 0.56 -2.30 0.04 0.00 0.00 177.00 175.27 1wbw n PRO 352 N 0.07 0.47 -3.11 0.56 -0.02 -1.26 -4.96 135.00 126.76 1wbw n PRO 352 Ca 0.04 0.17 -0.33 0.00 -2.02 0.00 0.00 63.50 61.35 1wbw n PRO 352 Cb 0.43 -1.35 -0.06 0.00 -0.02 0.00 0.00 33.50 32.50 1wbw n PRO 352 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1wbw s LEU 353 N 2.25 4.11 0.00 2.45 2.96 -1.26 -5.05 118.68 124.14 1wbw s LEU 353 Ca 0.62 1.34 0.00 0.00 -0.22 0.00 0.00 54.13 55.87 1wbw s LEU 353 Cb -0.73 -4.01 0.00 0.00 0.50 0.00 0.00 46.19 41.95 1wbw s LEU 353 CO 0.59 -0.17 0.06 0.47 -1.32 0.00 0.00 176.35 175.98 1wbw n ASP 354 N -0.16 0.00 0.00 3.68 9.92 -1.26 -5.32 116.55 123.41 1wbw n ASP 354 Ca 0.03 0.11 0.00 0.00 -0.53 0.00 0.00 54.79 54.39 1wbw n ASP 354 Cb 0.53 -0.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 1wbw n ASP 354 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00