#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wbs s ARG 5 N 0.00 4.28 0.74 5.31 3.52 -1.26 -5.00 118.95 126.54 1wbs s ARG 5 Ca 0.00 2.21 -0.12 0.00 -0.13 0.00 0.00 55.73 57.69 1wbs s ARG 5 Cb 0.00 -3.20 0.04 0.00 -1.56 0.00 0.00 34.95 30.23 1wbs s ARG 5 CO 0.00 -0.50 1.10 -2.14 -0.81 0.00 0.00 175.30 172.95 1wbs s PRO 6 N 0.99 2.39 0.21 5.12 0.02 -1.26 -5.00 135.00 137.47 1wbs s PRO 6 Ca 0.66 1.23 -0.30 0.00 0.02 0.00 0.00 61.00 62.62 1wbs s PRO 6 Cb -0.40 -1.91 -0.08 0.00 0.02 0.00 0.00 34.50 32.13 1wbs s PRO 6 CO 0.32 -1.55 1.03 0.99 -0.33 0.00 0.00 177.00 177.45 1wbs s THR 7 N -2.75 3.94 0.06 0.99 2.01 -1.26 -4.97 115.64 113.65 1wbs s THR 7 Ca 0.63 1.81 0.03 0.00 0.31 0.00 0.00 61.69 64.46 1wbs s THR 7 Cb -0.18 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 1wbs s THR 7 CO 0.52 0.37 0.03 -0.36 -0.69 0.00 0.00 174.62 174.49 1wbs s PHE 8 N -0.72 3.08 0.15 4.92 0.40 -1.26 -1.38 117.98 123.17 1wbs s PHE 8 Ca 0.45 0.04 0.08 0.00 -0.60 0.00 0.00 56.93 56.91 1wbs s PHE 8 Cb -0.28 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.60 1wbs s PHE 8 CO 0.35 0.49 -0.18 1.52 0.70 0.00 0.00 175.22 178.10 1wbs s TYR 9 N -1.26 1.78 0.07 0.36 1.13 -0.48 -4.91 117.35 114.03 1wbs s TYR 9 Ca 0.25 -0.47 0.02 0.00 -1.41 0.00 0.00 57.07 55.46 1wbs s TYR 9 Cb -0.12 -0.90 -0.04 0.00 -1.10 0.00 0.00 41.96 39.81 1wbs s TYR 9 CO 0.17 0.30 0.11 1.03 -2.51 0.00 0.00 175.55 174.65 1wbs s ARG 10 N -2.71 3.04 -0.28 -3.49 0.52 -1.26 -2.20 118.95 112.57 1wbs s ARG 10 Ca 0.14 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.54 1wbs s ARG 10 Cb -0.06 -2.82 0.09 0.00 0.52 0.00 0.00 34.95 32.68 1wbs s ARG 10 CO 0.06 0.58 0.76 -1.14 0.02 0.00 0.00 175.30 175.58 1wbs s GLN 11 N -2.41 0.69 -0.19 3.54 0.74 -0.27 -5.00 119.66 116.76 1wbs s GLN 11 Ca 0.31 1.04 -0.12 0.00 0.05 0.00 0.00 55.36 56.64 1wbs s GLN 11 Cb -0.12 0.22 -0.05 0.00 1.10 0.00 0.00 33.01 34.15 1wbs s GLN 11 CO 0.23 -0.12 0.20 -2.00 -0.55 0.00 0.00 175.29 173.05 1wbs s GLU 12 N 1.13 4.20 -0.15 1.67 2.12 -1.26 0.15 118.70 126.56 1wbs s GLU 12 Ca -0.06 -0.10 -0.04 0.00 0.36 0.00 0.00 54.97 55.13 1wbs s GLU 12 Cb -0.05 -3.44 0.05 0.00 0.26 0.00 0.00 34.13 30.96 1wbs s GLU 12 CO -0.12 0.24 0.06 -0.51 -0.54 0.00 0.00 175.26 174.39 1wbs s LEU 13 N 0.51 0.59 -1.29 2.70 1.43 0.83 -4.86 118.68 118.60 1wbs s LEU 13 Ca 0.11 -0.53 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1wbs s LEU 13 Cb -0.12 -0.35 -0.00 0.00 0.03 0.00 0.00 46.19 45.74 1wbs s LEU 13 CO 0.01 -0.31 0.68 0.59 0.23 0.00 0.00 176.35 177.55 1wbs n ASN 14 N 5.20 -1.75 -1.01 2.29 3.02 -1.26 -2.05 115.26 119.70 1wbs n ASN 14 Ca -0.07 -0.86 -0.13 0.00 -0.03 0.00 0.00 54.58 53.48 1wbs n ASN 14 Cb 0.49 -3.90 -0.06 0.00 -0.61 0.00 0.00 39.78 35.70 1wbs n ASN 14 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1wbs n LYS 15 N -4.23 -1.31 -4.97 3.52 4.76 -1.26 -4.99 118.16 109.69 1wbs n LYS 15 Ca -0.27 0.94 -0.32 0.00 -2.87 0.00 0.00 58.31 55.79 1wbs n LYS 15 Cb 0.67 -5.17 -0.15 0.00 -1.84 0.00 0.00 35.03 28.53 1wbs n LYS 15 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1wbs s THR 16 N -2.29 2.66 -0.05 -0.18 2.01 -0.87 -5.11 115.64 111.80 1wbs s THR 16 Ca 0.00 -0.81 -0.27 0.00 0.31 0.00 0.00 61.69 60.92 1wbs s THR 16 Cb 0.00 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1wbs s THR 16 CO 0.00 0.55 0.86 -0.63 -0.69 0.00 0.00 174.62 174.70 1wbs s ILE 17 N 0.21 4.93 -0.20 1.82 -1.09 -1.26 -0.12 121.20 125.49 1wbs s ILE 17 Ca -0.11 1.77 -0.02 0.00 -2.23 0.00 0.00 60.65 60.06 1wbs s ILE 17 Cb -0.16 -4.19 -0.00 0.00 -1.58 0.00 0.00 42.46 36.53 1wbs s ILE 17 CO 0.06 0.17 -0.09 0.26 -1.23 0.00 0.00 174.94 174.11 1wbs s TRP 18 N 1.15 2.90 -0.30 3.97 0.52 0.12 -4.98 118.94 122.33 1wbs s TRP 18 Ca 0.45 -1.08 0.01 0.00 0.02 0.00 0.00 56.10 55.50 1wbs s TRP 18 Cb -0.19 -2.03 0.07 0.00 -1.15 0.00 0.00 33.47 30.16 1wbs s TRP 18 CO 0.22 -0.58 -0.02 -1.21 0.02 0.00 0.00 176.95 175.38 1wbs s GLU 19 N 1.32 2.17 0.14 4.98 2.02 -1.26 -1.12 118.70 126.94 1wbs s GLU 19 Ca 0.04 -1.44 0.06 0.00 0.02 0.00 0.00 54.97 53.65 1wbs s GLU 19 Cb -0.14 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 30.94 1wbs s GLU 19 CO -0.05 -0.69 -0.14 0.14 0.02 0.00 0.00 175.26 174.54 1wbs s VAL 20 N 1.13 1.39 0.58 2.63 -7.23 -0.93 -4.67 120.40 113.29 1wbs s VAL 20 Ca -0.03 -1.81 -0.20 0.00 -1.81 0.00 0.00 61.98 58.13 1wbs s VAL 20 Cb -0.20 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.06 1wbs s VAL 20 CO -0.04 -0.46 1.20 -2.65 -0.31 0.00 0.00 175.10 172.85 1wbs n PRO 21 N 0.36 1.29 -0.03 4.82 -0.02 -1.26 -1.38 135.00 138.78 1wbs n PRO 21 Ca -0.14 0.48 0.22 0.00 -2.02 0.00 0.00 63.50 62.04 1wbs n PRO 21 Cb 0.58 -2.41 0.70 0.00 -0.02 0.00 0.00 33.50 32.35 1wbs n PRO 21 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1wbs h GLU 22 N 0.93 0.00 -0.38 -0.52 5.08 -1.58 -1.86 114.58 116.24 1wbs h GLU 22 Ca -0.50 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 57.97 1wbs h GLU 22 Cb 1.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.57 1wbs h GLU 22 CO 0.54 0.00 0.36 0.07 -1.00 0.00 0.00 179.01 178.98 1wbs h ARG 23 N 0.00 0.00 -5.16 2.33 0.11 -1.90 -3.39 114.38 106.37 1wbs h ARG 23 Ca 0.28 0.00 -0.65 0.00 0.10 0.00 0.00 59.98 59.71 1wbs h ARG 23 Cb 1.14 0.00 -0.16 0.00 1.11 0.00 0.00 29.97 32.06 1wbs h ARG 23 CO -0.00 0.00 -0.12 0.71 0.10 0.00 0.00 179.97 180.66 1wbs s TYR 24 N -4.74 3.19 0.31 4.08 2.02 -0.70 -0.84 117.35 120.67 1wbs s TYR 24 Ca -0.05 0.13 0.09 0.00 -0.37 0.00 0.00 57.07 56.88 1wbs s TYR 24 Cb 0.17 -2.84 -0.06 0.00 -0.40 0.00 0.00 41.96 38.82 1wbs s TYR 24 CO 0.60 -0.50 -0.10 -0.65 -1.57 0.00 0.00 175.55 173.34 1wbs s GLN 25 N 2.28 1.70 -1.34 -0.62 -1.52 -0.34 -4.83 119.66 114.98 1wbs s GLN 25 Ca 0.17 -1.86 -0.04 0.00 -1.95 0.00 0.00 55.36 51.68 1wbs s GLN 25 Cb -0.16 -1.51 0.02 0.00 -0.22 0.00 0.00 33.01 31.15 1wbs s GLN 25 CO 0.13 0.13 0.90 0.09 -0.25 0.00 0.00 175.29 176.28 1wbs n ASN 26 N -0.69 -2.93 -4.75 5.90 5.03 -1.26 -0.51 115.26 116.05 1wbs n ASN 26 Ca -0.05 -0.73 -0.41 0.00 0.87 0.00 0.00 54.58 54.26 1wbs n ASN 26 Cb 0.63 -4.38 -0.02 0.00 -1.02 0.00 0.00 39.78 34.99 1wbs n ASN 26 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1wbs s LEU 27 N -6.84 4.36 -0.13 3.41 1.02 -1.26 -4.36 118.68 114.87 1wbs s LEU 27 Ca 0.24 2.86 -0.05 0.00 0.02 0.00 0.00 54.13 57.20 1wbs s LEU 27 Cb -0.11 -3.63 0.07 0.00 0.02 0.00 0.00 46.19 42.53 1wbs s LEU 27 CO 0.79 -0.83 0.25 -0.55 0.02 0.00 0.00 176.35 176.03 1wbs s SER 28 N 0.36 0.45 0.12 2.29 0.15 -0.36 -4.96 113.70 111.74 1wbs s SER 28 Ca 0.61 0.51 -0.36 0.00 0.70 0.00 0.00 55.95 57.41 1wbs s SER 28 Cb -0.45 0.65 -0.16 0.00 -1.71 0.00 0.00 66.02 64.34 1wbs s SER 28 CO 0.48 -0.25 1.39 -2.65 1.20 0.00 0.00 173.24 173.41 1wbs n PRO 29 N 5.35 1.42 -0.05 5.44 -0.02 -1.26 -0.00 135.00 145.87 1wbs n PRO 29 Ca -0.06 0.51 -0.07 0.00 -2.02 0.00 0.00 63.50 61.86 1wbs n PRO 29 Cb 0.50 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1wbs n PRO 29 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1wbs n VAL 30 N 2.64 0.60 -3.61 -1.45 0.31 0.92 -4.80 118.33 112.94 1wbs n VAL 30 Ca 0.18 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1wbs n VAL 30 Cb 0.22 -0.89 -0.01 0.00 -0.91 0.00 0.00 33.84 32.25 1wbs n VAL 30 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1wbs s GLY 31 N -5.01 -0.38 0.16 2.92 0.00 -1.08 -5.00 107.32 98.92 1wbs s GLY 31 Ca -0.14 0.94 -0.17 0.00 0.00 0.00 0.00 44.72 45.34 1wbs s GLY 31 CO 0.24 0.23 0.47 -1.35 0.00 0.00 0.00 173.10 172.69 1wbs s SER 32 N -2.77 -0.29 0.00 1.64 1.04 -1.26 0.11 113.70 112.17 1wbs s SER 32 Ca 0.13 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1wbs s SER 32 Cb 0.03 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1wbs s SER 32 CO -0.04 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1wbs n GLY 33 N -0.29 2.04 0.26 7.32 0.00 0.48 -4.98 105.19 110.01 1wbs n GLY 33 Ca -0.14 -0.95 0.04 0.00 0.00 0.00 0.00 46.02 44.97 1wbs n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbs h ALA 34 N 2.00 1.66 0.00 4.61 0.00 -1.40 -3.10 119.26 123.03 1wbs h ALA 34 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1wbs h ALA 34 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1wbs h ALA 34 CO 0.00 0.26 -1.30 0.66 0.00 0.00 0.00 179.25 178.86 1wbs n TYR 35 N -4.37 0.51 -3.59 0.00 4.01 0.31 -4.66 117.16 109.37 1wbs n TYR 35 Ca -0.01 0.15 0.02 0.00 -0.16 0.00 0.00 57.90 57.91 1wbs n TYR 35 Cb 0.19 -0.70 -0.00 0.00 -0.31 0.00 0.00 39.34 38.52 1wbs n TYR 35 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1wbs s GLY 36 N -4.24 -0.45 0.05 2.72 0.00 -1.17 -0.81 107.32 103.42 1wbs s GLY 36 Ca -0.02 0.83 0.07 0.00 0.00 0.00 0.00 44.72 45.60 1wbs s GLY 36 CO 0.83 0.15 -0.20 -0.56 0.00 0.00 0.00 173.10 173.32 1wbs s SER 37 N -2.98 2.41 -0.06 1.64 0.01 -0.23 -0.39 113.70 114.11 1wbs s SER 37 Ca 0.14 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 56.90 1wbs s SER 37 Cb 0.06 -0.19 0.01 0.00 0.21 0.00 0.00 66.02 66.11 1wbs s SER 37 CO -0.05 0.14 -0.15 -0.69 0.41 0.00 0.00 173.24 172.90 1wbs s VAL 38 N -0.85 1.33 0.01 3.43 1.01 0.12 -0.45 120.40 125.01 1wbs s VAL 38 Ca 0.07 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.51 1wbs s VAL 38 Cb -0.09 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 1wbs s VAL 38 CO 0.02 0.39 -0.25 0.00 0.00 0.00 0.00 175.10 175.26 1wbs s ALA 40 N -0.69 2.96 0.24 0.00 0.00 0.99 -0.57 121.76 124.69 1wbs s ALA 40 Ca 0.10 0.39 -0.22 0.00 0.00 0.00 0.00 51.96 52.24 1wbs s ALA 40 Cb -0.10 -3.18 0.04 0.00 0.00 0.00 0.00 23.12 19.88 1wbs s ALA 40 CO 0.01 -0.22 0.69 0.00 0.00 0.00 0.00 175.76 176.23 1wbs s ALA 41 N -2.29 -1.34 -0.22 0.00 0.00 -0.10 -1.23 121.76 116.58 1wbs s ALA 41 Ca 0.63 -0.06 -0.06 0.00 0.00 0.00 0.00 51.96 52.47 1wbs s ALA 41 Cb -0.12 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 1wbs s ALA 41 CO 0.23 -0.96 0.02 0.12 0.00 0.00 0.00 175.76 175.17 1wbs s PHE 42 N -3.86 3.04 -0.56 0.00 5.36 0.33 -0.82 117.98 121.47 1wbs s PHE 42 Ca 0.08 -0.54 -0.22 0.00 -0.96 0.00 0.00 56.93 55.29 1wbs s PHE 42 Cb -0.04 -2.14 0.05 0.00 -0.34 0.00 0.00 43.02 40.54 1wbs s PHE 42 CO 0.01 -0.34 0.86 0.34 -1.46 0.00 0.00 175.22 174.62 1wbs s ASP 43 N 1.32 6.27 0.57 6.13 2.15 0.12 -1.20 116.67 132.03 1wbs s ASP 43 Ca 0.04 -0.66 0.35 0.00 0.43 0.00 0.00 52.55 52.71 1wbs s ASP 43 Cb -0.15 -2.39 1.51 0.00 -0.30 0.00 0.00 42.92 41.60 1wbs s ASP 43 CO 0.01 -1.18 2.04 0.71 -0.17 0.00 0.00 175.17 176.58 1wbs h THR 44 N 5.97 0.00 -0.10 1.71 1.35 -1.29 0.32 112.91 120.87 1wbs h THR 44 Ca -0.27 -0.44 -0.23 0.00 -0.55 0.00 0.00 66.41 64.91 1wbs h THR 44 Cb 1.08 1.44 0.01 0.00 -1.73 0.00 0.00 68.15 68.95 1wbs h THR 44 CO 1.08 0.00 -0.85 0.11 -0.25 0.00 0.00 175.52 175.60 1wbs h LYS 45 N 0.00 0.73 0.00 4.72 1.79 -1.91 -3.36 116.57 118.53 1wbs h LYS 45 Ca 0.00 -0.64 0.00 0.00 -2.18 0.00 0.00 60.65 57.83 1wbs h LYS 45 Cb 0.44 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1wbs h LYS 45 CO 0.00 1.25 -1.08 0.25 -1.08 0.00 0.00 179.45 178.79 1wbs n THR 46 N -3.90 0.00 -1.03 -0.16 -2.24 -1.12 -5.00 114.28 100.83 1wbs n THR 46 Ca -0.08 -0.24 -0.01 0.00 -2.27 0.00 0.00 64.05 61.45 1wbs n THR 46 Cb 0.78 0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 69.65 1wbs n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbs n GLY 47 N 1.49 0.50 3.89 3.38 0.00 0.11 -4.97 105.19 109.59 1wbs n GLY 47 Ca 0.00 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.36 1wbs n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wbs s LEU 48 N -0.27 4.37 -0.12 0.99 1.43 -1.15 -4.89 118.68 119.04 1wbs s LEU 48 Ca 0.00 0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 53.25 1wbs s LEU 48 Cb 0.00 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 1wbs s LEU 48 CO 0.00 0.27 1.13 -0.13 0.23 0.00 0.00 176.35 177.85 1wbs s ARG 49 N -1.78 4.33 0.22 1.70 0.52 -1.26 -0.70 118.95 121.98 1wbs s ARG 49 Ca 0.26 1.54 0.10 0.00 -0.52 0.00 0.00 55.73 57.11 1wbs s ARG 49 Cb -0.13 -3.61 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 1wbs s ARG 49 CO 0.16 -0.49 -0.18 0.14 0.02 0.00 0.00 175.30 174.95 1wbs s VAL 50 N 2.58 2.06 -0.15 3.52 -7.23 0.00 -0.73 120.40 120.45 1wbs s VAL 50 Ca 0.51 -2.18 -0.02 0.00 -1.81 0.00 0.00 61.98 58.48 1wbs s VAL 50 Cb -0.21 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 1wbs s VAL 50 CO 0.17 -0.41 -0.07 0.00 -0.31 0.00 0.00 175.10 174.47 1wbs s ALA 51 N -2.45 2.83 -0.23 1.32 0.00 0.37 -0.92 121.76 122.66 1wbs s ALA 51 Ca 0.23 -0.89 -0.05 0.00 0.00 0.00 0.00 51.96 51.25 1wbs s ALA 51 Cb -0.04 -1.44 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 1wbs s ALA 51 CO 0.10 0.15 -0.01 0.08 0.00 0.00 0.00 175.76 176.07 1wbs s VAL 52 N 0.50 3.55 -0.25 0.00 1.01 0.26 -1.60 120.40 123.88 1wbs s VAL 52 Ca -0.06 -0.49 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 1wbs s VAL 52 Cb -0.15 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1wbs s VAL 52 CO 0.03 0.36 0.13 -0.75 0.00 0.00 0.00 175.10 174.88 1wbs s LYS 53 N 1.49 3.90 -0.31 2.72 2.20 0.74 -1.17 119.74 129.31 1wbs s LYS 53 Ca 0.05 -0.36 -0.14 0.00 -0.36 0.00 0.00 55.97 55.16 1wbs s LYS 53 Cb -0.15 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 1wbs s LYS 53 CO -0.02 -0.06 0.34 0.21 -0.36 0.00 0.00 175.35 175.46 1wbs s LYS 54 N 1.36 3.76 0.34 4.03 2.20 0.41 -0.21 119.74 131.63 1wbs s LYS 54 Ca 0.06 -0.27 -0.28 0.00 -0.36 0.00 0.00 55.97 55.13 1wbs s LYS 54 Cb -0.15 -3.74 -0.10 0.00 -1.51 0.00 0.00 37.83 32.34 1wbs s LYS 54 CO 0.06 -0.40 1.24 -0.51 -0.36 0.00 0.00 175.35 175.38 1wbs s LEU 55 N 1.99 4.38 -0.31 5.43 1.43 -0.77 -1.06 118.68 129.77 1wbs s LEU 55 Ca 0.12 2.54 -0.17 0.00 -1.03 0.00 0.00 54.13 55.59 1wbs s LEU 55 Cb -0.16 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.30 1wbs s LEU 55 CO 0.11 -0.52 0.47 -0.44 0.23 0.00 0.00 176.35 176.20 1wbs s SER 56 N -0.71 6.32 -1.19 2.29 0.01 0.01 -4.48 113.70 115.94 1wbs s SER 56 Ca 0.51 0.15 -0.26 0.00 1.31 0.00 0.00 55.95 57.66 1wbs s SER 56 Cb -0.36 -2.25 0.02 0.00 0.21 0.00 0.00 66.02 63.63 1wbs s SER 56 CO 0.47 -0.36 0.71 0.54 0.41 0.00 0.00 173.24 175.01 1wbs n ARG 57 N 5.58 -0.84 0.30 12.44 1.74 -1.26 -4.80 116.66 129.82 1wbs n ARG 57 Ca -0.06 0.27 0.16 0.00 -0.77 0.00 0.00 57.85 57.45 1wbs n ARG 57 Cb 0.49 -3.38 0.95 0.00 -1.02 0.00 0.00 32.46 29.50 1wbs n ARG 57 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1wbs h PRO 58 N -2.24 0.00 -0.01 5.56 0.13 -1.81 -2.43 132.00 131.20 1wbs h PRO 58 Ca -0.69 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1wbs h PRO 58 Cb 1.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 1wbs h PRO 58 CO 0.51 0.00 -0.31 1.19 -0.23 0.00 0.00 178.00 179.17 1wbs n PHE 59 N -3.76 0.03 -0.07 1.56 3.72 -1.26 -2.39 117.46 115.29 1wbs n PHE 59 Ca -0.03 -1.32 0.01 0.00 -0.05 0.00 0.00 57.45 56.06 1wbs n PHE 59 Cb 0.08 -0.22 0.31 0.00 -0.94 0.00 0.00 39.48 38.71 1wbs n PHE 59 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1wbs h GLN 60 N 0.65 0.68 -4.44 -1.08 3.07 -1.80 -3.45 115.11 108.74 1wbs h GLN 60 Ca 0.00 -0.09 -0.21 0.00 0.09 0.00 0.00 58.65 58.45 1wbs h GLN 60 Cb 1.02 -0.13 -0.14 0.00 0.08 0.00 0.00 27.48 28.31 1wbs h GLN 60 CO 0.01 0.55 -0.54 -1.54 0.09 0.00 0.00 178.83 177.40 1wbs s SER 61 N -6.62 0.11 0.13 0.06 1.04 -1.26 -5.03 113.70 102.14 1wbs s SER 61 Ca -0.09 -1.32 -0.21 0.00 0.48 0.00 0.00 55.95 54.81 1wbs s SER 61 Cb 0.17 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 1wbs s SER 61 CO 0.76 -0.88 1.68 0.40 0.98 0.00 0.00 173.24 176.18 1wbs h ILE 62 N 2.57 0.69 -0.63 -1.02 2.04 -1.94 0.20 117.51 119.41 1wbs h ILE 62 Ca -0.34 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.58 1wbs h ILE 62 Cb 1.25 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.96 1wbs h ILE 62 CO 0.50 0.00 0.33 0.40 0.00 0.00 0.00 178.15 179.39 1wbs h ILE 63 N -0.11 0.94 -0.23 -0.67 5.03 -1.96 0.12 117.51 120.62 1wbs h ILE 63 Ca 0.09 -0.21 -0.15 0.00 -0.12 0.00 0.00 64.86 64.47 1wbs h ILE 63 Cb 0.25 0.27 0.00 0.00 -3.03 0.00 0.00 36.82 34.30 1wbs h ILE 63 CO -0.21 0.11 -0.42 0.45 -0.68 0.00 0.00 178.15 177.40 1wbs h HIS 64 N 0.61 0.87 -0.75 1.37 3.86 -1.79 -2.11 115.15 117.22 1wbs h HIS 64 Ca 0.29 -0.31 0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1wbs h HIS 64 Cb 0.21 -0.16 -0.06 0.00 1.06 0.00 0.00 27.41 28.46 1wbs h HIS 64 CO -0.09 1.08 0.45 0.00 0.86 0.00 0.00 177.93 180.23 1wbs h ALA 65 N 0.63 1.01 -0.45 2.45 0.00 -0.10 -0.57 119.26 122.24 1wbs h ALA 65 Ca 0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1wbs h ALA 65 Cb 1.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1wbs h ALA 65 CO 0.10 0.17 -0.08 -0.22 0.00 0.00 0.00 179.25 179.22 1wbs h LYS 66 N 0.83 0.85 -0.71 0.00 3.64 -0.74 -2.33 116.57 118.11 1wbs h LYS 66 Ca 0.32 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1wbs h LYS 66 Cb 0.14 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1wbs h LYS 66 CO -0.16 0.94 0.36 -0.09 -2.27 0.00 0.00 179.45 178.23 1wbs h ARG 67 N 0.68 1.00 0.10 1.90 2.43 -1.03 0.34 114.38 119.80 1wbs h ARG 67 Ca 0.12 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1wbs h ARG 67 Cb 0.61 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1wbs h ARG 67 CO 0.04 0.75 -0.05 1.15 -1.51 0.00 0.00 179.97 180.35 1wbs h THR 68 N 1.00 1.02 -0.37 0.20 2.02 -0.98 -1.43 112.91 114.36 1wbs h THR 68 Ca 0.25 -0.43 0.05 0.00 0.77 0.00 0.00 66.41 67.05 1wbs h THR 68 Cb 0.07 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 1wbs h THR 68 CO -0.04 0.11 0.11 0.22 0.37 0.00 0.00 175.52 176.29 1wbs h TYR 69 N -0.33 0.20 -0.29 3.16 3.20 -1.18 -2.11 116.97 119.62 1wbs h TYR 69 Ca -0.01 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1wbs h TYR 69 Cb 0.27 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 1wbs h TYR 69 CO -0.01 0.07 -0.01 -0.09 -1.64 0.00 0.00 178.16 176.48 1wbs h ARG 70 N 0.26 0.07 -0.27 1.82 2.43 -0.84 -0.45 114.38 117.40 1wbs h ARG 70 Ca 0.17 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1wbs h ARG 70 Cb 0.17 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1wbs h ARG 70 CO -0.19 0.05 0.16 1.49 -1.51 0.00 0.00 179.97 179.97 1wbs h GLU 71 N 0.08 0.37 -0.19 0.20 4.81 -0.99 -0.64 114.58 118.21 1wbs h GLU 71 Ca 0.14 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1wbs h GLU 71 Cb 0.18 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1wbs h GLU 71 CO -0.24 0.29 0.13 1.25 -0.73 0.00 0.00 179.01 179.71 1wbs h LEU 72 N 0.34 0.22 -0.27 1.64 5.85 -1.15 0.15 115.31 122.09 1wbs h LEU 72 Ca 0.10 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.87 1wbs h LEU 72 Cb 0.02 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 1wbs h LEU 72 CO -0.02 0.16 -0.08 0.03 -0.34 0.00 0.00 178.44 178.19 1wbs h ARG 73 N 0.26 -0.03 0.43 1.25 2.47 -0.97 0.93 114.38 118.73 1wbs h ARG 73 Ca 0.07 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.79 1wbs h ARG 73 Cb -0.03 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.27 1wbs h ARG 73 CO -0.02 -0.02 -0.42 1.25 0.56 0.00 0.00 179.97 181.33 1wbs h LEU 74 N -0.03 -1.14 -0.82 3.04 5.85 -0.77 -2.36 115.31 119.09 1wbs h LEU 74 Ca 0.13 0.09 0.07 0.00 0.84 0.00 0.00 57.88 59.02 1wbs h LEU 74 Cb 0.23 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 1wbs h LEU 74 CO -0.29 -0.58 0.49 -0.07 -0.34 0.00 0.00 178.44 177.65 1wbs h LEU 75 N -0.86 0.76 -1.81 2.25 4.07 -0.51 -0.95 115.31 118.25 1wbs h LEU 75 Ca -0.04 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.91 1wbs h LEU 75 Cb 0.76 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.37 1wbs h LEU 75 CO -0.06 0.48 -0.15 0.11 -1.08 0.00 0.00 178.44 177.74 1wbs h LYS 76 N 0.89 0.00 0.07 1.13 1.57 -0.71 -3.18 116.57 116.34 1wbs h LYS 76 Ca 0.36 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.87 1wbs h LYS 76 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 1wbs h LYS 76 CO -0.19 0.15 -1.41 1.25 -0.57 0.00 0.00 179.45 178.68 1wbs h HIS 77 N 0.00 0.28 -3.60 -1.35 2.76 -0.64 -3.46 115.15 109.14 1wbs h HIS 77 Ca -0.00 -0.20 -0.57 0.00 -2.20 0.00 0.00 60.37 57.39 1wbs h HIS 77 Cb 0.34 -0.01 -0.08 0.00 1.55 0.00 0.00 27.41 29.21 1wbs h HIS 77 CO 0.00 1.22 0.81 -1.64 -1.30 0.00 0.00 177.93 177.02 1wbs s MET 78 N -2.64 3.77 -0.42 5.26 -1.94 -0.88 -4.94 119.30 117.52 1wbs s MET 78 Ca -0.06 0.59 0.02 0.00 -1.71 0.00 0.00 55.69 54.54 1wbs s MET 78 Cb 0.08 -3.86 0.15 0.00 2.01 0.00 0.00 34.83 33.20 1wbs s MET 78 CO 0.84 -1.21 0.27 0.15 -0.01 0.00 0.00 175.02 175.07 1wbs s LYS 79 N 4.05 1.02 -0.19 2.03 1.02 -1.26 -4.61 119.74 121.81 1wbs s LYS 79 Ca 0.44 -1.89 -0.18 0.00 0.02 0.00 0.00 55.97 54.36 1wbs s LYS 79 Cb -0.09 -1.83 0.05 0.00 -0.52 0.00 0.00 37.83 35.43 1wbs s LYS 79 CO 0.26 -1.24 0.51 -1.58 -0.92 0.00 0.00 175.35 172.38 1wbs s HIS 80 N 0.40 -0.56 0.47 3.18 2.46 -1.26 -5.06 115.29 114.92 1wbs s HIS 80 Ca 0.22 1.35 0.21 0.00 0.47 0.00 0.00 55.06 57.31 1wbs s HIS 80 Cb -0.16 0.19 1.21 0.00 -0.13 0.00 0.00 32.58 33.70 1wbs s HIS 80 CO -0.06 -0.27 1.93 0.93 -2.47 0.00 0.00 174.74 174.80 1wbs h GLU 81 N 5.29 0.24 -0.54 2.88 5.08 -1.98 -2.15 114.58 123.39 1wbs h GLU 81 Ca -0.28 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1wbs h GLU 81 Cb 1.17 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1wbs h GLU 81 CO 0.19 0.16 0.00 0.09 -1.00 0.00 0.00 179.01 178.45 1wbs n ASN 82 N -4.43 4.99 -4.11 1.42 5.03 -1.26 -4.75 115.26 112.16 1wbs n ASN 82 Ca 0.14 -2.73 -0.18 0.00 0.87 0.00 0.00 54.58 52.68 1wbs n ASN 82 Cb 0.64 -0.61 -0.13 0.00 -1.02 0.00 0.00 39.78 38.66 1wbs n ASN 82 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1wbs s VAL 83 N -2.37 0.92 0.19 2.41 1.01 -0.81 -0.56 120.40 121.18 1wbs s VAL 83 Ca 0.50 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 1wbs s VAL 83 Cb 0.36 -0.86 -0.16 0.00 0.00 0.00 0.00 36.38 35.73 1wbs s VAL 83 CO 0.18 -0.07 0.97 0.00 0.00 0.00 0.00 175.10 176.18 1wbs n ILE 84 N 1.90 1.34 -4.64 2.22 3.06 -0.07 -4.59 119.36 118.59 1wbs n ILE 84 Ca -0.19 -0.34 -0.33 0.00 -2.50 0.00 0.00 62.75 59.40 1wbs n ILE 84 Cb 0.55 -0.62 -0.11 0.00 0.54 0.00 0.00 39.64 39.99 1wbs n ILE 84 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 1wbs s GLY 85 N -0.37 1.67 -0.45 4.50 0.00 -1.26 -4.75 107.32 106.65 1wbs s GLY 85 Ca 0.69 -0.95 -0.25 0.00 0.00 0.00 0.00 44.72 44.21 1wbs s GLY 85 CO 0.55 -0.76 0.87 -2.27 0.00 0.00 0.00 173.10 171.50 1wbs s LEU 86 N -0.97 4.10 0.11 0.66 0.20 -1.26 -4.44 118.68 117.08 1wbs s LEU 86 Ca 0.13 0.05 -0.04 0.00 0.69 0.00 0.00 54.13 54.96 1wbs s LEU 86 Cb -0.11 -3.11 -0.18 0.00 -0.43 0.00 0.00 46.19 42.36 1wbs s LEU 86 CO 0.03 -0.99 1.23 -0.07 -0.29 0.00 0.00 176.35 176.25 1wbs h LEU 87 N 10.39 0.45 -7.00 -0.68 3.38 -1.14 -3.41 115.31 117.30 1wbs h LEU 87 Ca -0.24 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.32 1wbs h LEU 87 Cb 1.08 -0.14 -0.21 0.00 0.09 0.00 0.00 40.66 41.48 1wbs h LEU 87 CO 1.00 1.27 0.38 -0.62 0.09 0.00 0.00 178.44 180.56 1wbs s ASP 88 N -7.11 -0.50 -0.02 -0.43 2.15 -1.16 -4.58 116.67 105.03 1wbs s ASP 88 Ca -0.05 0.55 0.01 0.00 0.43 0.00 0.00 52.55 53.49 1wbs s ASP 88 Cb 0.08 0.41 0.01 0.00 -0.30 0.00 0.00 42.92 43.12 1wbs s ASP 88 CO 0.87 -0.47 -0.02 0.54 -0.17 0.00 0.00 175.17 175.92 1wbs s VAL 89 N -1.16 0.28 0.12 1.11 0.11 -1.26 -1.00 120.40 118.60 1wbs s VAL 89 Ca -0.06 -0.06 -0.10 0.00 -2.93 0.00 0.00 61.98 58.82 1wbs s VAL 89 Cb -0.00 -0.29 0.00 0.00 -1.53 0.00 0.00 36.38 34.56 1wbs s VAL 89 CO 0.05 0.12 0.26 0.72 -3.33 0.00 0.00 175.10 172.92 1wbs s PHE 90 N 0.43 0.17 0.00 1.54 -0.12 -0.72 -4.97 117.98 114.31 1wbs s PHE 90 Ca -0.04 -0.56 0.00 0.00 -0.05 0.00 0.00 56.93 56.28 1wbs s PHE 90 Cb -0.07 0.00 -0.01 0.00 -0.63 0.00 0.00 43.02 42.31 1wbs s PHE 90 CO -0.01 -0.63 -0.01 -0.08 -0.05 0.00 0.00 175.22 174.44 1wbs s THR 91 N -3.89 0.06 -0.75 -4.49 -1.32 -1.26 -1.36 115.64 102.63 1wbs s THR 91 Ca 0.09 -0.23 0.19 0.00 -1.21 0.00 0.00 61.69 60.53 1wbs s THR 91 Cb 0.04 -0.09 0.19 0.00 -1.51 0.00 0.00 72.50 71.12 1wbs s THR 91 CO -0.08 -0.11 1.60 -0.81 -2.21 0.00 0.00 174.62 173.01 1wbs n PRO 92 N 2.72 0.10 -1.92 7.08 -0.04 -1.26 -4.84 135.00 136.84 1wbs n PRO 92 Ca -0.15 0.33 -0.41 0.00 -0.04 0.00 0.00 63.50 63.23 1wbs n PRO 92 Cb 0.59 -1.68 -0.01 0.00 -0.04 0.00 0.00 33.50 32.35 1wbs n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1wbs s ALA 93 N -3.15 3.56 -1.71 0.55 0.00 -1.26 -4.93 121.76 114.82 1wbs s ALA 93 Ca 0.06 1.45 0.23 0.00 0.00 0.00 0.00 51.96 53.71 1wbs s ALA 93 Cb 0.10 -3.56 0.18 0.00 0.00 0.00 0.00 23.12 19.83 1wbs s ALA 93 CO 0.34 -0.89 1.20 0.54 0.00 0.00 0.00 175.76 176.95 1wbs n ARG 94 N 0.83 0.82 -3.80 0.00 1.74 -1.26 -4.97 116.66 110.02 1wbs n ARG 94 Ca 0.02 -0.63 -0.09 0.00 -0.77 0.00 0.00 57.85 56.37 1wbs n ARG 94 Cb 0.40 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.31 1wbs n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wbs s SER 95 N -2.61 -0.21 0.37 0.55 1.04 -1.26 -5.03 113.70 106.54 1wbs s SER 95 Ca 0.18 -0.58 0.05 0.00 0.48 0.00 0.00 55.95 56.08 1wbs s SER 95 Cb 0.18 0.58 0.74 0.00 0.10 0.00 0.00 66.02 67.63 1wbs s SER 95 CO 0.62 -1.08 2.00 0.25 0.98 0.00 0.00 173.24 176.01 1wbs h LEU 96 N 2.21 0.63 -0.96 2.42 5.85 -1.95 -1.97 115.31 121.54 1wbs h LEU 96 Ca -0.28 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1wbs h LEU 96 Cb 1.26 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 1wbs h LEU 96 CO 0.37 0.44 0.56 -0.33 -0.34 0.00 0.00 178.44 179.13 1wbs h GLU 97 N 0.74 1.28 -0.65 1.25 3.07 -2.01 -2.40 114.58 115.85 1wbs h GLU 97 Ca 0.25 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1wbs h GLU 97 Cb 0.09 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 27.74 1wbs h GLU 97 CO -0.07 0.90 0.00 -0.85 -1.40 0.00 0.00 179.01 177.59 1wbs n GLU 98 N -4.35 2.68 -2.08 2.33 0.28 -1.10 -4.94 120.64 113.46 1wbs n GLU 98 Ca 0.11 -2.58 -0.43 0.00 -0.16 0.00 0.00 57.16 54.10 1wbs n GLU 98 Cb 0.06 -1.56 -0.03 0.00 1.43 0.00 0.00 31.44 31.35 1wbs n GLU 98 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1wbs s PHE 99 N -1.13 2.02 0.00 -1.84 5.36 -0.76 -4.69 117.98 116.94 1wbs s PHE 99 Ca 0.47 0.55 0.00 0.00 -0.96 0.00 0.00 56.93 56.98 1wbs s PHE 99 Cb 0.25 -4.03 0.00 0.00 -0.34 0.00 0.00 43.02 38.90 1wbs s PHE 99 CO 0.33 -2.97 0.00 0.09 -1.46 0.00 0.00 175.22 171.21 1wbs n ASN 100 N 8.87 0.00 -3.96 6.13 3.02 -1.26 -5.03 115.26 123.04 1wbs n ASN 100 Ca 0.20 -0.67 -0.11 0.00 -0.03 0.00 0.00 54.58 53.96 1wbs n ASN 100 Cb 0.46 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.50 1wbs n ASN 100 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1wbs s ASP 101 N 0.00 0.32 -0.04 6.41 1.01 -1.26 -4.59 116.67 118.51 1wbs s ASP 101 Ca 0.00 -0.32 0.01 0.00 0.71 0.00 0.00 52.55 52.95 1wbs s ASP 101 Cb 0.00 0.04 0.02 0.00 1.01 0.00 0.00 42.92 43.99 1wbs s ASP 101 CO 0.00 -0.16 -0.04 -0.69 0.21 0.00 0.00 175.17 174.49 1wbs s VAL 102 N -0.88 0.51 -0.06 -1.27 1.01 -1.26 -4.49 120.40 113.96 1wbs s VAL 102 Ca -0.08 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 61.84 1wbs s VAL 102 Cb -0.06 -0.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 1wbs s VAL 102 CO -0.00 0.22 -0.23 -0.31 0.00 0.00 0.00 175.10 174.77 1wbs s TYR 103 N 0.88 2.28 -0.08 5.22 1.51 -0.46 -1.84 117.35 124.87 1wbs s TYR 103 Ca -0.12 -0.70 0.05 0.00 -1.01 0.00 0.00 57.07 55.29 1wbs s TYR 103 Cb -0.14 -1.51 -0.00 0.00 -0.11 0.00 0.00 41.96 40.19 1wbs s TYR 103 CO 0.00 -0.22 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.47 1wbs s LEU 104 N -0.07 2.05 -0.08 -1.29 1.43 0.71 -1.76 118.68 119.67 1wbs s LEU 104 Ca -0.05 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.58 1wbs s LEU 104 Cb -0.14 -1.33 -0.00 0.00 0.03 0.00 0.00 46.19 44.75 1wbs s LEU 104 CO 0.04 0.19 -0.23 -0.69 0.23 0.00 0.00 176.35 175.89 1wbs s VAL 105 N 0.11 1.93 0.28 -1.59 1.01 -0.17 -0.18 120.40 121.78 1wbs s VAL 105 Ca -0.11 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1wbs s VAL 105 Cb -0.16 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 1wbs s VAL 105 CO 0.06 0.53 0.21 0.28 0.00 0.00 0.00 175.10 176.18 1wbs s THR 106 N 0.24 0.03 0.36 3.92 -1.32 -0.63 -0.47 115.64 117.77 1wbs s THR 106 Ca -0.14 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.06 1wbs s THR 106 Cb -0.16 -2.50 -0.11 0.00 -1.51 0.00 0.00 72.50 68.22 1wbs s THR 106 CO 0.07 0.00 1.42 -1.00 -2.21 0.00 0.00 174.62 172.90 1wbs s HIS 107 N -3.72 2.76 0.13 9.09 3.76 -1.26 -0.48 115.29 125.56 1wbs s HIS 107 Ca 0.40 1.25 -0.30 0.00 -0.15 0.00 0.00 55.06 56.25 1wbs s HIS 107 Cb 0.04 -3.90 -0.07 0.00 1.11 0.00 0.00 32.58 29.76 1wbs s HIS 107 CO 0.21 -2.60 1.23 -1.17 -0.85 0.00 0.00 174.74 171.57 1wbs s LEU 108 N -1.95 4.40 0.00 0.89 2.96 0.09 -4.39 118.68 120.68 1wbs s LEU 108 Ca 0.52 2.17 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 1wbs s LEU 108 Cb -0.44 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.66 1wbs s LEU 108 CO 0.59 -0.46 0.20 0.80 -1.32 0.00 0.00 176.35 176.16 1wbs n MET 109 N 3.30 0.00 0.00 1.98 0.00 -1.26 -4.94 117.12 116.20 1wbs n MET 109 Ca 0.07 0.29 0.00 0.00 -0.00 0.00 0.00 57.70 58.06 1wbs n MET 109 Cb 0.45 -0.91 0.00 0.00 0.00 0.00 0.00 33.22 32.75 1wbs n MET 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1wbs n GLY 110 N 1.45 2.15 3.76 -5.12 0.00 -1.26 -4.92 105.19 101.25 1wbs n GLY 110 Ca 0.00 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1wbs n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbs s ALA 111 N -1.00 3.55 0.53 4.61 0.00 -1.26 -5.06 121.76 123.13 1wbs s ALA 111 Ca 0.00 -0.20 0.05 0.00 0.00 0.00 0.00 51.96 51.81 1wbs s ALA 111 Cb 0.00 -2.56 0.02 0.00 0.00 0.00 0.00 23.12 20.58 1wbs s ALA 111 CO 0.00 0.17 0.31 0.16 0.00 0.00 0.00 175.76 176.41 1wbs s ASP 112 N 0.00 4.54 0.39 0.00 1.47 -1.26 -1.67 116.67 120.14 1wbs s ASP 112 Ca 0.25 -1.30 0.20 0.00 1.18 0.00 0.00 52.55 52.88 1wbs s ASP 112 Cb -0.16 0.35 0.73 0.00 -0.34 0.00 0.00 42.92 43.50 1wbs s ASP 112 CO 0.11 -1.01 1.76 0.25 0.68 0.00 0.00 175.17 176.96 1wbs h LEU 113 N 0.91 0.00 -0.17 2.11 5.85 -0.68 -2.68 115.31 120.65 1wbs h LEU 113 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1wbs h LEU 113 Cb 1.30 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1wbs h LEU 113 CO 0.61 0.35 0.11 -1.13 -0.34 0.00 0.00 178.44 178.04 1wbs h ASN 114 N 0.00 0.20 1.11 1.25 -1.24 -1.86 -0.39 115.58 114.65 1wbs h ASN 114 Ca -0.00 -0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.93 1wbs h ASN 114 Cb 0.85 -0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 1wbs h ASN 114 CO 0.04 0.14 -0.34 -0.55 -1.29 0.00 0.00 177.43 175.44 1wbs h ASN 115 N 0.23 0.00 0.09 1.15 -0.00 -1.87 -0.07 115.58 115.12 1wbs h ASN 115 Ca 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.36 1wbs h ASN 115 Cb -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.29 1wbs h ASN 115 CO -0.02 0.34 -0.04 0.40 -0.00 0.00 0.00 177.43 178.11 1wbs h ILE 116 N 0.00 1.03 0.00 6.14 1.08 -1.23 -0.86 117.51 123.66 1wbs h ILE 116 Ca -0.00 -0.43 -0.12 0.00 -0.39 0.00 0.00 64.86 63.92 1wbs h ILE 116 Cb 0.98 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 36.02 1wbs h ILE 116 CO 0.04 0.11 -0.55 1.62 -0.69 0.00 0.00 178.15 178.68 1wbs h VAL 117 N -0.32 1.35 -0.01 1.67 3.04 -0.87 -2.34 116.25 118.77 1wbs h VAL 117 Ca -0.01 -1.93 -0.18 0.00 -1.01 0.00 0.00 66.70 63.57 1wbs h VAL 117 Cb 0.27 2.05 -0.02 0.00 -2.01 0.00 0.00 31.29 31.59 1wbs h VAL 117 CO 0.02 0.54 -0.80 0.11 -1.01 0.00 0.00 177.57 176.43 1wbs h LYS 118 N 0.00 0.14 -0.06 4.17 1.79 -1.00 -3.39 116.57 118.21 1wbs h LYS 118 Ca -0.01 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1wbs h LYS 118 Cb 1.01 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.69 1wbs h LYS 118 CO 0.07 0.86 0.00 0.00 -1.08 0.00 0.00 179.45 179.30 1wbs s GLN 120 N -1.06 1.12 -0.01 0.00 -2.07 -0.89 -5.02 119.66 111.73 1wbs s GLN 120 Ca 0.05 -0.34 -0.30 0.00 -1.82 0.00 0.00 55.36 52.95 1wbs s GLN 120 Cb 0.03 0.51 -0.04 0.00 -1.09 0.00 0.00 33.01 32.42 1wbs s GLN 120 CO 0.03 -0.43 1.13 0.15 -1.32 0.00 0.00 175.29 174.84 1wbs s LYS 121 N -2.96 4.44 -0.17 9.60 1.02 -1.26 -4.76 119.74 125.65 1wbs s LYS 121 Ca -0.02 1.62 -0.03 0.00 0.02 0.00 0.00 55.97 57.56 1wbs s LYS 121 Cb -0.00 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.83 1wbs s LYS 121 CO -0.06 -0.27 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.52 1wbs s LEU 122 N 1.49 2.95 0.80 3.17 1.43 -1.26 -5.10 118.68 122.15 1wbs s LEU 122 Ca 0.55 -0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 53.25 1wbs s LEU 122 Cb -0.25 -1.71 0.08 0.00 0.03 0.00 0.00 46.19 44.34 1wbs s LEU 122 CO 0.26 0.10 1.16 0.42 0.23 0.00 0.00 176.35 178.51 1wbs s THR 123 N 0.78 2.05 0.35 5.49 -4.23 -1.26 -4.92 115.64 113.89 1wbs s THR 123 Ca -0.03 -0.05 0.03 0.00 -1.18 0.00 0.00 61.69 60.46 1wbs s THR 123 Cb -0.15 -3.00 0.23 0.00 1.34 0.00 0.00 72.50 70.93 1wbs s THR 123 CO 0.02 0.00 1.97 -0.78 -0.54 0.00 0.00 174.62 175.29 1wbs h ASP 124 N -1.01 0.66 -0.70 3.99 3.58 -1.99 -2.05 116.42 118.90 1wbs h ASP 124 Ca -0.46 -0.05 0.03 0.00 0.42 0.00 0.00 57.03 56.97 1wbs h ASP 124 Cb 1.32 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 42.16 1wbs h ASP 124 CO 0.63 0.54 0.45 -0.78 -2.88 0.00 0.00 179.24 177.19 1wbs h ASP 125 N 0.75 0.74 -0.51 2.28 3.58 -1.99 -0.18 116.42 121.10 1wbs h ASP 125 Ca 0.19 -0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.65 1wbs h ASP 125 Cb 0.02 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 40.88 1wbs h ASP 125 CO -0.03 0.52 0.33 0.45 -2.88 0.00 0.00 179.24 177.63 1wbs h HIS 126 N 0.88 0.62 -0.34 0.28 3.86 -1.76 -1.83 115.15 116.87 1wbs h HIS 126 Ca 0.28 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.48 1wbs h HIS 126 Cb -0.01 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 1wbs h HIS 126 CO -0.04 0.39 0.12 0.28 0.86 0.00 0.00 177.93 179.54 1wbs h VAL 127 N 0.67 1.19 -0.39 2.45 2.07 -0.98 0.08 116.25 121.34 1wbs h VAL 127 Ca 0.19 -0.61 0.08 0.00 0.82 0.00 0.00 66.70 67.18 1wbs h VAL 127 Cb -0.06 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 1wbs h VAL 127 CO -0.05 0.21 -0.12 1.56 0.02 0.00 0.00 177.57 179.19 1wbs h GLN 128 N 0.39 -0.04 -0.31 1.57 4.20 -0.89 -1.14 115.11 118.90 1wbs h GLN 128 Ca 0.11 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.74 1wbs h GLN 128 Cb 0.21 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1wbs h GLN 128 CO -0.01 -0.02 -0.14 0.35 -0.67 0.00 0.00 178.83 178.34 1wbs h PHE 129 N -0.04 0.74 0.11 2.96 3.57 -1.00 -1.17 116.94 122.11 1wbs h PHE 129 Ca 0.19 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1wbs h PHE 129 Cb 0.33 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.90 1wbs h PHE 129 CO -0.37 0.87 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.45 1wbs h LEU 130 N 0.41 -0.13 -0.66 0.59 3.38 -0.77 -2.11 115.31 116.02 1wbs h LEU 130 Ca 0.07 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1wbs h LEU 130 Cb 0.67 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1wbs h LEU 130 CO 0.04 0.07 -0.14 0.40 0.09 0.00 0.00 178.44 178.90 1wbs h ILE 131 N -0.32 1.27 -0.49 1.22 1.08 -1.26 -2.23 117.51 116.77 1wbs h ILE 131 Ca -0.02 -1.27 0.08 0.00 -0.39 0.00 0.00 64.86 63.27 1wbs h ILE 131 Cb 0.27 1.06 -0.07 0.00 -3.07 0.00 0.00 36.82 35.00 1wbs h ILE 131 CO 0.03 0.44 0.09 0.22 -0.69 0.00 0.00 178.15 178.23 1wbs h TYR 132 N 0.80 0.14 -0.66 1.37 3.20 -1.16 -0.24 116.97 120.42 1wbs h TYR 132 Ca 0.12 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.98 1wbs h TYR 132 Cb 0.68 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 1wbs h TYR 132 CO 0.04 -0.01 0.23 1.96 -1.64 0.00 0.00 178.16 178.74 1wbs h GLN 133 N 0.22 1.01 -0.25 1.82 4.20 -1.11 0.99 115.11 121.98 1wbs h GLN 133 Ca 0.24 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1wbs h GLN 133 Cb 0.33 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1wbs h GLN 133 CO -0.32 0.87 0.16 0.82 -0.67 0.00 0.00 178.83 179.68 1wbs h ILE 134 N 0.94 1.06 -0.33 2.54 2.04 -1.09 -1.14 117.51 121.53 1wbs h ILE 134 Ca 0.21 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.91 1wbs h ILE 134 Cb 0.26 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1wbs h ILE 134 CO -0.01 0.06 -0.02 -0.07 0.00 0.00 0.00 178.15 178.11 1wbs h LEU 135 N 0.33 0.48 -0.26 1.44 3.38 -0.69 0.05 115.31 120.06 1wbs h LEU 135 Ca 0.09 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1wbs h LEU 135 Cb -0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1wbs h LEU 135 CO -0.02 0.56 -0.08 -0.09 0.09 0.00 0.00 178.44 178.90 1wbs h ARG 136 N 0.49 0.51 -0.43 1.13 2.43 -0.58 -0.07 114.38 117.87 1wbs h ARG 136 Ca 0.10 -0.20 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1wbs h ARG 136 Cb 0.35 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1wbs h ARG 136 CO 0.01 0.74 0.28 0.78 -1.51 0.00 0.00 179.97 180.27 1wbs h GLY 137 N 0.25 0.60 1.04 2.80 0.00 -0.94 -2.88 103.07 103.94 1wbs h GLY 137 Ca 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 1wbs h GLY 137 CO 0.03 0.21 0.42 1.41 0.00 0.00 0.00 176.54 178.61 1wbs h LEU 138 N 0.57 1.12 -0.48 3.11 4.07 -0.84 -0.09 115.31 122.77 1wbs h LEU 138 Ca 0.16 -0.13 0.07 0.00 0.08 0.00 0.00 57.88 58.05 1wbs h LEU 138 Cb -0.05 -0.29 -0.06 0.00 1.08 0.00 0.00 40.66 41.34 1wbs h LEU 138 CO -0.04 0.93 0.16 0.50 -1.08 0.00 0.00 178.44 178.91 1wbs h LYS 139 N 1.22 0.32 0.49 1.13 3.64 -0.93 0.20 116.57 122.63 1wbs h LYS 139 Ca 0.29 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 1wbs h LYS 139 Cb 0.11 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1wbs h LYS 139 CO -0.04 0.21 -0.24 -0.92 -2.27 0.00 0.00 179.45 176.20 1wbs h TYR 140 N 0.33 -0.61 -0.56 1.91 3.20 -1.18 -1.46 116.97 118.60 1wbs h TYR 140 Ca 0.23 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.99 1wbs h TYR 140 Cb 0.24 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 1wbs h TYR 140 CO -0.17 -0.37 0.00 -0.84 -1.64 0.00 0.00 178.16 175.15 1wbs h ILE 141 N -0.68 1.26 -0.19 1.81 3.07 -0.74 -2.71 117.51 119.33 1wbs h ILE 141 Ca -0.07 -1.12 -0.04 0.00 1.55 0.00 0.00 64.86 65.18 1wbs h ILE 141 Cb 0.52 0.87 -0.01 0.00 -0.27 0.00 0.00 36.82 37.92 1wbs h ILE 141 CO 0.11 0.40 -0.05 0.45 -1.05 0.00 0.00 178.15 178.02 1wbs h HIS 142 N 0.88 0.29 0.00 0.16 3.86 -0.62 -1.25 115.15 118.47 1wbs h HIS 142 Ca 0.16 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 1wbs h HIS 142 Cb 0.54 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.93 1wbs h HIS 142 CO 0.04 0.34 -0.03 0.66 0.86 0.00 0.00 177.93 179.80 1wbs h SER 143 N 0.28 0.00 -0.48 2.45 4.64 -0.92 -0.46 113.55 119.06 1wbs h SER 143 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1wbs h SER 143 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1wbs h SER 143 CO 0.01 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 1wbs n ALA 144 N -2.15 2.43 -2.98 5.18 0.00 -0.52 -4.77 120.51 117.70 1wbs n ALA 144 Ca -0.02 -0.91 -0.22 0.00 0.00 0.00 0.00 53.44 52.28 1wbs n ALA 144 Cb 0.17 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 18.69 1wbs n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1wbs n ASP 145 N 1.08 -6.04 -4.60 0.00 8.00 -0.18 -4.67 116.55 110.14 1wbs n ASP 145 Ca 0.18 -0.27 -0.35 0.00 0.71 0.00 0.00 54.79 55.07 1wbs n ASP 145 Cb 0.47 -4.90 -0.10 0.00 -0.02 0.00 0.00 41.12 36.57 1wbs n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1wbs s ILE 146 N -3.16 4.64 -0.10 0.53 1.01 -0.91 -5.02 121.20 118.18 1wbs s ILE 146 Ca 0.28 -0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.86 1wbs s ILE 146 Cb -0.13 -3.09 -0.02 0.00 0.01 0.00 0.00 42.46 39.23 1wbs s ILE 146 CO 0.35 0.45 -0.14 -0.63 0.00 0.00 0.00 174.94 174.97 1wbs s ILE 147 N 0.52 3.02 -0.04 2.92 1.01 -1.26 -3.54 121.20 123.82 1wbs s ILE 147 Ca 0.02 -0.69 -0.21 0.00 0.00 0.00 0.00 60.65 59.77 1wbs s ILE 147 Cb -0.13 -2.24 -0.16 0.00 0.01 0.00 0.00 42.46 39.95 1wbs s ILE 147 CO 0.01 0.55 0.92 -0.74 0.00 0.00 0.00 174.94 175.68 1wbs h HIS 148 N 6.30 -0.23 0.00 3.97 -0.00 -1.98 -3.47 115.15 119.74 1wbs h HIS 148 Ca -0.31 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.05 1wbs h HIS 148 Cb 1.20 0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.68 1wbs h HIS 148 CO 0.50 0.19 0.00 0.54 -0.00 0.00 0.00 177.93 179.16 1wbs n ARG 149 N -4.95 0.00 -2.64 5.26 1.74 -1.26 -4.77 116.66 110.03 1wbs n ARG 149 Ca -0.08 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.91 1wbs n ARG 149 Cb 0.26 -1.60 0.03 0.00 -1.02 0.00 0.00 32.46 30.14 1wbs n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1wbs n ASP 150 N 0.00 2.24 -4.71 0.55 2.03 -1.26 -4.95 116.55 110.45 1wbs n ASP 150 Ca 0.00 -2.63 -0.42 0.00 0.52 0.00 0.00 54.79 52.26 1wbs n ASP 150 Cb 0.00 -0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 39.89 1wbs n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1wbs s LEU 151 N -3.52 4.35 -0.03 -2.67 1.43 -1.26 -4.87 118.68 112.10 1wbs s LEU 151 Ca 0.32 2.10 -0.29 0.00 -1.03 0.00 0.00 54.13 55.23 1wbs s LEU 151 Cb 0.39 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 43.14 1wbs s LEU 151 CO -0.02 -0.58 0.89 -1.59 0.23 0.00 0.00 176.35 175.28 1wbs s LYS 152 N 1.48 0.80 0.38 1.70 -2.85 -1.26 -4.80 119.74 115.19 1wbs s LYS 152 Ca 0.61 -0.21 0.18 0.00 -1.00 0.00 0.00 55.97 55.56 1wbs s LYS 152 Cb -0.31 0.37 1.11 0.00 -2.06 0.00 0.00 37.83 36.94 1wbs s LYS 152 CO 0.28 -0.33 1.73 -1.35 0.10 0.00 0.00 175.35 175.78 1wbs h PRO 153 N 2.13 0.36 0.00 1.78 0.11 -1.94 0.17 132.00 134.62 1wbs h PRO 153 Ca -0.22 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1wbs h PRO 153 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1wbs h PRO 153 CO 0.31 0.24 0.00 -1.13 -0.21 0.00 0.00 178.00 177.21 1wbs n SER 154 N -4.74 0.48 -1.68 -2.05 3.41 -1.26 -2.25 113.62 105.53 1wbs n SER 154 Ca 0.28 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.59 1wbs n SER 154 Cb 0.95 -0.71 0.37 0.00 -0.26 0.00 0.00 64.21 64.56 1wbs n SER 154 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1wbs n ASN 155 N -2.02 5.08 -3.93 4.04 3.02 0.05 -4.80 115.26 116.71 1wbs n ASN 155 Ca 0.03 -2.60 -0.30 0.00 -0.03 0.00 0.00 54.58 51.68 1wbs n ASN 155 Cb 0.24 -0.61 -0.16 0.00 -0.61 0.00 0.00 39.78 38.64 1wbs n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wbs s LEU 156 N -2.13 2.51 0.07 3.41 1.43 -0.97 -1.35 118.68 121.64 1wbs s LEU 156 Ca 0.53 -1.17 -0.26 0.00 -1.03 0.00 0.00 54.13 52.20 1wbs s LEU 156 Cb 0.36 -1.15 -0.06 0.00 0.03 0.00 0.00 46.19 45.37 1wbs s LEU 156 CO 0.22 -0.24 0.79 0.00 0.23 0.00 0.00 176.35 177.35 1wbs s ALA 157 N 1.42 3.36 -0.06 4.21 0.00 -0.08 -1.16 121.76 129.45 1wbs s ALA 157 Ca -0.05 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1wbs s ALA 157 Cb -0.19 -3.03 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1wbs s ALA 157 CO -0.06 0.08 -0.03 0.08 0.00 0.00 0.00 175.76 175.82 1wbs s VAL 158 N -0.17 0.51 0.22 0.00 1.01 -0.67 -0.70 120.40 120.60 1wbs s VAL 158 Ca 0.39 -0.06 -0.00 0.00 0.00 0.00 0.00 61.98 62.31 1wbs s VAL 158 Cb -0.21 -0.57 0.04 0.00 0.00 0.00 0.00 36.38 35.64 1wbs s VAL 158 CO 0.24 0.24 0.30 -0.46 0.00 0.00 0.00 175.10 175.42 1wbs n ASN 159 N 4.40 0.40 0.23 3.32 0.23 -0.20 -4.48 115.26 119.16 1wbs n ASN 159 Ca -0.19 -1.34 0.14 0.00 -0.53 0.00 0.00 54.58 52.66 1wbs n ASN 159 Cb 0.51 -0.19 0.36 0.00 -2.08 0.00 0.00 39.78 38.37 1wbs n ASN 159 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1wbs h GLU 160 N 0.00 0.00 -0.71 -3.83 3.07 -2.00 -1.77 114.58 109.35 1wbs h GLU 160 Ca -0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1wbs h GLU 160 Cb 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1wbs h GLU 160 CO 0.11 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.47 1wbs n ASP 161 N -3.02 3.79 -1.04 1.42 8.00 -1.26 -4.92 116.55 119.51 1wbs n ASP 161 Ca 0.03 -2.51 -0.14 0.00 0.71 0.00 0.00 54.79 52.88 1wbs n ASP 161 Cb 0.44 -0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 1wbs n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wbs s GLU 163 N -3.08 4.66 -0.03 0.00 2.02 -1.26 -4.78 118.70 116.23 1wbs s GLU 163 Ca 0.00 1.39 0.07 0.00 0.02 0.00 0.00 54.97 56.45 1wbs s GLU 163 Cb 0.00 -3.38 -0.02 0.00 0.10 0.00 0.00 34.13 30.83 1wbs s GLU 163 CO 0.00 0.21 -0.24 -1.17 0.02 0.00 0.00 175.26 174.08 1wbs s LEU 164 N 0.06 2.04 -0.02 1.80 0.20 -1.26 -1.04 118.68 120.47 1wbs s LEU 164 Ca 0.46 -0.44 0.04 0.00 0.69 0.00 0.00 54.13 54.88 1wbs s LEU 164 Cb -0.23 -1.24 -0.01 0.00 -0.43 0.00 0.00 46.19 44.29 1wbs s LEU 164 CO 0.29 0.28 -0.13 -0.54 -0.29 0.00 0.00 176.35 175.96 1wbs s LYS 165 N -0.46 1.11 -0.12 1.98 1.02 0.12 -4.35 119.74 119.05 1wbs s LYS 165 Ca 0.06 -0.46 -0.21 0.00 0.02 0.00 0.00 55.97 55.39 1wbs s LYS 165 Cb -0.10 -1.06 -0.04 0.00 -0.52 0.00 0.00 37.83 36.11 1wbs s LYS 165 CO 0.00 0.26 0.59 0.42 -0.92 0.00 0.00 175.35 175.70 1wbs s ILE 166 N -0.21 5.10 0.06 2.17 1.01 0.27 -0.90 121.20 128.70 1wbs s ILE 166 Ca 0.03 1.18 0.01 0.00 0.00 0.00 0.00 60.65 61.88 1wbs s ILE 166 Cb -0.06 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 1wbs s ILE 166 CO -0.00 0.25 0.06 0.00 0.00 0.00 0.00 174.94 175.25 1wbs n LEU 167 N 4.01 0.00 -3.64 2.97 -0.00 -0.46 -0.89 117.00 119.00 1wbs n LEU 167 Ca -0.04 -0.60 -0.27 0.00 -0.00 0.00 0.00 56.01 55.11 1wbs n LEU 167 Cb 0.51 0.34 -0.17 0.00 -0.00 0.00 0.00 43.42 44.11 1wbs n LEU 167 CO 0.45 -0.10 -0.34 -0.62 -0.00 0.00 0.00 177.39 176.77 1wbs s ASP 168 N -1.44 2.64 -0.09 1.45 -1.08 -1.26 -4.74 116.67 112.14 1wbs s ASP 168 Ca 0.07 -0.75 0.11 0.00 -0.52 0.00 0.00 52.55 51.46 1wbs s ASP 168 Cb 0.00 -0.36 0.48 0.00 -1.46 0.00 0.00 42.92 41.59 1wbs s ASP 168 CO 0.05 -0.35 1.32 0.33 0.52 0.00 0.00 175.17 177.04 1wbs n PHE 169 N 5.21 1.04 -2.07 -5.34 -0.00 -1.26 -4.93 117.46 110.11 1wbs n PHE 169 Ca -0.07 -0.40 -0.42 0.00 -0.00 0.00 0.00 57.45 56.55 1wbs n PHE 169 Cb 0.48 -0.21 -0.03 0.00 -0.00 0.00 0.00 39.48 39.72 1wbs n PHE 169 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1wbs s GLY 170 N -0.70 1.68 0.00 7.13 0.00 -1.26 -4.88 107.32 109.29 1wbs s GLY 170 Ca 0.33 1.02 0.00 0.00 0.00 0.00 0.00 44.72 46.07 1wbs s GLY 170 CO 0.15 2.75 0.79 1.04 0.00 0.00 0.00 173.10 177.83 1wbs n LEU 171 N 5.74 1.49 -4.30 0.66 4.77 -1.26 -4.95 117.00 119.16 1wbs n LEU 171 Ca 0.15 -1.49 -0.16 0.00 -0.03 0.00 0.00 56.01 54.48 1wbs n LEU 171 Cb 0.42 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.41 1wbs n LEU 171 CO 0.61 0.37 -0.30 0.00 -1.33 0.00 0.00 177.39 176.74 1wbs s ALA 172 N -0.63 1.63 0.31 -1.18 0.00 -1.26 0.11 121.76 120.75 1wbs s ALA 172 Ca 0.00 -1.75 -0.29 0.00 0.00 0.00 0.00 51.96 49.92 1wbs s ALA 172 Cb 0.00 0.72 -0.10 0.00 0.00 0.00 0.00 23.12 23.74 1wbs s ALA 172 CO 0.00 -0.35 1.20 0.50 0.00 0.00 0.00 175.76 177.10 1wbs s ARG 173 N -3.95 4.46 -1.48 0.00 3.52 -1.26 -4.86 118.95 115.38 1wbs s ARG 173 Ca 0.30 1.99 -0.10 0.00 -0.13 0.00 0.00 55.73 57.79 1wbs s ARG 173 Cb 0.07 -3.09 0.02 0.00 -1.56 0.00 0.00 34.95 30.38 1wbs s ARG 173 CO 0.09 -0.01 2.54 1.58 -0.81 0.00 0.00 175.30 178.69 1wbs n HIS 174 N 0.91 2.79 -1.95 5.12 -0.00 -1.26 -4.91 115.22 115.92 1wbs n HIS 174 Ca -0.00 -2.98 -0.29 0.00 -0.00 0.00 0.00 57.72 54.45 1wbs n HIS 174 Cb 0.44 -2.32 0.15 0.00 -0.00 0.00 0.00 29.99 28.26 1wbs n HIS 174 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 1wbs s THR 175 N 1.55 2.01 0.16 3.57 -4.23 -1.26 -4.96 115.64 112.47 1wbs s THR 175 Ca 0.57 -0.03 -0.09 0.00 -1.18 0.00 0.00 61.69 60.97 1wbs s THR 175 Cb 0.16 -2.99 -0.04 0.00 1.34 0.00 0.00 72.50 70.97 1wbs s THR 175 CO -0.07 0.00 1.49 0.44 -0.54 0.00 0.00 174.62 175.94 1wbs h ASP 176 N -1.39 0.93 -0.42 3.99 3.32 -1.97 -3.09 116.42 117.80 1wbs h ASP 176 Ca -0.45 -0.43 0.05 0.00 0.02 0.00 0.00 57.03 56.22 1wbs h ASP 176 Cb 1.27 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.51 1wbs h ASP 176 CO 0.48 1.22 0.15 -0.78 -1.72 0.00 0.00 179.24 178.58 1wbs h ASP 177 N 0.71 0.16 0.35 6.45 3.58 -1.95 -1.79 116.42 123.92 1wbs h ASP 177 Ca 0.05 0.05 -0.05 0.00 0.42 0.00 0.00 57.03 57.50 1wbs h ASP 177 Cb 0.99 0.03 -0.01 0.00 1.72 0.00 0.00 39.33 42.06 1wbs h ASP 177 CO 0.10 0.13 -0.22 1.05 -2.88 0.00 0.00 179.24 177.41 1wbs h GLU 178 N 0.32 0.00 -0.17 0.28 4.11 -1.91 -2.24 114.58 114.97 1wbs h GLU 178 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.63 1wbs h GLU 178 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1wbs h GLU 178 CO -0.20 0.22 0.00 -1.33 0.07 0.00 0.00 179.01 177.77 1wbs n MET 179 N -3.96 1.84 -3.47 1.06 2.81 -0.87 -4.76 117.12 109.78 1wbs n MET 179 Ca -0.02 -1.25 -0.38 0.00 -1.81 0.00 0.00 57.70 54.24 1wbs n MET 179 Cb 0.30 -1.42 -0.06 0.00 -0.71 0.00 0.00 33.22 31.33 1wbs n MET 179 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1wbs s THR 180 N -1.79 5.11 0.00 2.03 2.01 -0.73 -4.80 115.64 117.48 1wbs s THR 180 Ca 0.34 0.81 0.00 0.00 0.31 0.00 0.00 61.69 63.15 1wbs s THR 180 Cb 0.19 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.98 1wbs s THR 180 CO 0.28 0.50 0.00 0.61 -0.69 0.00 0.00 174.62 175.31 1wbs n GLY 181 N 2.37 -0.98 3.50 4.40 0.00 -1.26 -4.62 105.19 108.60 1wbs n GLY 181 Ca -0.12 -1.62 -0.44 0.00 0.00 0.00 0.00 46.02 43.84 1wbs n GLY 181 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wbs s TYR 182 N 0.00 3.28 -0.03 1.61 5.04 -1.16 -3.87 117.35 122.22 1wbs s TYR 182 Ca 0.00 -1.96 0.01 0.00 -2.44 0.00 0.00 57.07 52.68 1wbs s TYR 182 Cb 0.00 -4.44 0.02 0.00 0.35 0.00 0.00 41.96 37.89 1wbs s TYR 182 CO 0.00 -1.52 -0.02 0.14 -1.34 0.00 0.00 175.55 172.81 1wbs s VAL 183 N 2.37 0.32 0.65 3.14 -7.23 -1.26 -5.01 120.40 113.38 1wbs s VAL 183 Ca 0.45 -0.03 0.34 0.00 -1.81 0.00 0.00 61.98 60.94 1wbs s VAL 183 Cb -0.01 -0.37 0.36 0.00 0.56 0.00 0.00 36.38 36.92 1wbs s VAL 183 CO 0.02 0.16 2.10 0.00 -0.31 0.00 0.00 175.10 177.07 1wbs h ALA 184 N 7.04 1.36 -0.99 1.32 0.00 -1.94 -1.95 119.26 124.10 1wbs h ALA 184 Ca -0.39 -0.00 0.28 0.00 0.00 0.00 0.00 54.91 54.79 1wbs h ALA 184 Cb 1.15 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1wbs h ALA 184 CO 0.48 -0.24 0.70 1.15 0.00 0.00 0.00 179.25 181.34 1wbs h THR 185 N 0.00 0.52 0.00 0.00 2.02 -1.95 -3.13 112.91 110.37 1wbs h THR 185 Ca 0.03 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1wbs h THR 185 Cb 0.44 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1wbs h THR 185 CO -0.00 0.01 -0.51 -1.14 0.37 0.00 0.00 175.52 174.25 1wbs n ARG 186 N -4.29 3.90 0.27 6.66 0.63 -0.74 -4.79 116.66 118.31 1wbs n ARG 186 Ca 0.21 -0.01 0.15 0.00 -0.92 0.00 0.00 57.85 57.28 1wbs n ARG 186 Cb 1.01 -0.82 0.70 0.00 0.45 0.00 0.00 32.46 33.81 1wbs n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1wbs h TRP 187 N 0.00 0.00 -0.17 -0.14 6.55 -1.54 -2.62 115.95 118.03 1wbs h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1wbs h TRP 187 Cb 0.12 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.42 1wbs h TRP 187 CO 0.00 0.08 0.00 0.66 -1.05 0.00 0.00 178.44 178.13 1wbs n TYR 188 N -3.27 0.20 -2.72 0.49 4.02 -1.26 -4.58 117.16 110.04 1wbs n TYR 188 Ca -0.00 -0.13 -0.41 0.00 -0.01 0.00 0.00 57.90 57.34 1wbs n TYR 188 Cb 0.30 -0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.57 1wbs n TYR 188 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1wbs s ARG 189 N -1.40 4.71 0.33 -0.72 1.81 -0.99 -3.76 118.95 118.93 1wbs s ARG 189 Ca 0.26 1.47 -0.29 0.00 -1.72 0.00 0.00 55.73 55.46 1wbs s ARG 189 Cb 0.17 -3.36 -0.12 0.00 -0.45 0.00 0.00 34.95 31.18 1wbs s ARG 189 CO 0.24 0.25 1.34 0.00 -0.68 0.00 0.00 175.30 176.44 1wbs n ALA 190 N 2.60 1.42 -0.09 2.13 0.00 -1.26 -4.81 120.51 120.49 1wbs n ALA 190 Ca 0.02 0.37 0.06 0.00 0.00 0.00 0.00 53.44 53.89 1wbs n ALA 190 Cb 0.49 -2.28 0.40 0.00 0.00 0.00 0.00 19.45 18.06 1wbs n ALA 190 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1wbs h PRO 191 N 2.94 0.61 0.00 0.00 0.13 -1.95 -1.31 132.00 132.42 1wbs h PRO 191 Ca -0.46 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 1wbs h PRO 191 Cb 1.28 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1wbs h PRO 191 CO 0.65 0.40 -0.21 1.05 -0.23 0.00 0.00 178.00 179.66 1wbs h GLU 192 N 0.62 0.00 0.05 0.86 9.09 -1.91 -1.27 114.58 122.02 1wbs h GLU 192 Ca 0.24 0.00 -0.32 0.00 0.05 0.00 0.00 59.36 59.33 1wbs h GLU 192 Cb 0.16 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.22 1wbs h GLU 192 CO -0.07 0.21 -1.81 1.51 0.05 0.00 0.00 179.01 178.91 1wbs n ILE 193 N -4.19 1.69 -0.24 -1.06 3.06 -0.78 -0.60 119.36 117.23 1wbs n ILE 193 Ca -0.02 -0.74 -0.03 0.00 -2.50 0.00 0.00 62.75 59.46 1wbs n ILE 193 Cb 0.28 -1.33 0.16 0.00 0.54 0.00 0.00 39.64 39.29 1wbs n ILE 193 CO 0.00 0.00 0.00 -0.03 -2.50 0.00 0.00 176.55 174.02 1wbs h MET 194 N 0.03 1.06 -0.34 9.51 4.05 -0.89 -3.07 114.93 125.29 1wbs h MET 194 Ca -0.34 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 1wbs h MET 194 Cb 2.02 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 32.62 1wbs h MET 194 CO 0.09 0.81 0.00 1.28 0.23 0.00 0.00 176.91 179.31 1wbs n LEU 195 N -4.33 2.89 -3.86 3.39 7.99 -0.51 -5.03 117.00 117.53 1wbs n LEU 195 Ca 0.07 -1.95 -0.35 0.00 -0.01 0.00 0.00 56.01 53.77 1wbs n LEU 195 Cb 0.12 -0.22 0.02 0.00 -0.11 0.00 0.00 43.42 43.23 1wbs n LEU 195 CO 0.39 0.72 -0.15 -3.20 -1.51 0.00 0.00 177.39 173.64 1wbs n ASN 196 N 0.53 -4.78 0.10 -1.43 5.15 -0.89 -4.90 115.26 109.05 1wbs n ASN 196 Ca 0.11 -1.08 -0.02 0.00 -0.60 0.00 0.00 54.58 52.99 1wbs n ASN 196 Cb 0.42 -2.16 -0.02 0.00 -0.53 0.00 0.00 39.78 37.50 1wbs n ASN 196 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1wbs h TRP 197 N -1.60 0.00 -1.34 1.20 6.55 -1.13 -3.43 115.95 116.21 1wbs h TRP 197 Ca -0.64 0.00 0.37 0.00 0.95 0.00 0.00 58.89 59.56 1wbs h TRP 197 Cb 1.38 0.00 -0.12 0.00 -0.86 0.00 0.00 29.16 29.55 1wbs h TRP 197 CO 0.31 0.74 0.92 0.00 -1.05 0.00 0.00 178.44 179.36 1wbs s MET 198 N -2.92 0.20 0.25 0.49 0.23 -1.26 -0.86 119.30 115.43 1wbs s MET 198 Ca 0.02 -0.11 -0.30 0.00 -1.03 0.00 0.00 55.69 54.27 1wbs s MET 198 Cb 0.09 0.07 -0.10 0.00 -1.53 0.00 0.00 34.83 33.36 1wbs s MET 198 CO 0.78 -0.09 1.47 -1.01 -2.03 0.00 0.00 175.02 174.14 1wbs s HIS 199 N -2.18 2.98 0.05 3.16 3.76 -1.26 -4.89 115.29 116.91 1wbs s HIS 199 Ca 0.17 0.96 0.01 0.00 -0.15 0.00 0.00 55.06 56.05 1wbs s HIS 199 Cb 0.06 -3.87 -0.04 0.00 1.11 0.00 0.00 32.58 29.84 1wbs s HIS 199 CO -0.05 -2.86 0.13 1.52 -0.85 0.00 0.00 174.74 172.63 1wbs s TYR 200 N 0.05 3.34 0.53 1.40 -0.85 -1.26 -5.12 117.35 115.45 1wbs s TYR 200 Ca 0.61 0.18 0.07 0.00 -0.52 0.00 0.00 57.07 57.40 1wbs s TYR 200 Cb -0.43 -1.70 0.04 0.00 0.38 0.00 0.00 41.96 40.25 1wbs s TYR 200 CO 0.43 0.56 0.52 0.54 -1.52 0.00 0.00 175.55 176.08 1wbs s ASN 201 N -2.29 4.84 0.58 -0.18 6.03 -1.26 -5.02 114.94 117.65 1wbs s ASN 201 Ca 0.30 -1.05 0.38 0.00 -1.03 0.00 0.00 52.86 51.46 1wbs s ASN 201 Cb -0.12 0.23 1.79 0.00 -3.03 0.00 0.00 41.25 40.12 1wbs s ASN 201 CO 0.22 -1.11 2.13 0.06 -2.03 0.00 0.00 177.10 176.37 1wbs h GLN 202 N 0.62 0.00 0.00 3.55 3.07 -1.97 -2.65 115.11 117.73 1wbs h GLN 202 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.39 1wbs h GLN 202 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.85 1wbs h GLN 202 CO 0.52 0.00 0.00 0.25 0.09 0.00 0.00 178.83 179.69 1wbs n THR 203 N -3.04 0.26 -0.22 1.86 -2.24 -1.26 -1.70 114.28 107.94 1wbs n THR 203 Ca -0.01 0.06 0.15 0.00 -2.27 0.00 0.00 64.05 61.99 1wbs n THR 203 Cb 0.20 -0.79 0.47 0.00 -2.10 0.00 0.00 70.33 68.10 1wbs n THR 203 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 1wbs h VAL 204 N 0.00 0.78 0.00 2.28 -1.51 -1.85 -1.06 116.25 114.89 1wbs h VAL 204 Ca 0.00 -0.17 -0.09 0.00 -1.23 0.00 0.00 66.70 65.20 1wbs h VAL 204 Cb 0.08 0.24 -0.01 0.00 -2.13 0.00 0.00 31.29 29.46 1wbs h VAL 204 CO 0.00 0.09 -0.45 0.44 -1.23 0.00 0.00 177.57 176.42 1wbs h ASP 205 N 0.50 0.00 -0.02 4.19 3.32 -1.59 -2.99 116.42 119.83 1wbs h ASP 205 Ca 0.42 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.30 1wbs h ASP 205 Cb 0.89 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 1wbs h ASP 205 CO -0.16 0.45 -0.57 0.40 -1.72 0.00 0.00 179.24 177.64 1wbs h ILE 206 N 0.00 1.32 -0.38 0.35 1.08 -1.36 -1.97 117.51 116.53 1wbs h ILE 206 Ca -0.00 -1.82 0.04 0.00 -0.39 0.00 0.00 64.86 62.69 1wbs h ILE 206 Cb 0.88 1.78 -0.04 0.00 -3.07 0.00 0.00 36.82 36.38 1wbs h ILE 206 CO 0.06 0.57 0.15 -0.25 -0.69 0.00 0.00 178.15 177.99 1wbs h TRP 207 N 0.46 0.27 -0.83 1.37 2.91 -1.31 -1.14 115.95 117.68 1wbs h TRP 207 Ca 0.00 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.09 1wbs h TRP 207 Cb 1.13 -0.07 -0.05 0.00 -0.51 0.00 0.00 29.16 29.66 1wbs h TRP 207 CO 0.05 0.12 0.52 0.77 -1.03 0.00 0.00 178.44 178.88 1wbs h SER 208 N 0.32 0.85 -0.65 2.65 0.02 -1.38 -1.88 113.55 113.49 1wbs h SER 208 Ca 0.17 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1wbs h SER 208 Cb 0.13 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 1wbs h SER 208 CO -0.16 0.57 0.39 0.58 -1.14 0.00 0.00 176.83 177.07 1wbs h VAL 209 N 1.00 1.19 -0.54 2.27 2.07 -0.79 -0.00 116.25 121.45 1wbs h VAL 209 Ca 0.34 -0.42 0.06 0.00 0.82 0.00 0.00 66.70 67.50 1wbs h VAL 209 Cb 0.07 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 1wbs h VAL 209 CO -0.14 0.20 0.25 1.23 0.02 0.00 0.00 177.57 179.13 1wbs h GLY 210 N 0.88 0.75 1.20 2.17 0.00 -0.70 0.41 103.07 107.78 1wbs h GLY 210 Ca 0.23 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 1wbs h GLY 210 CO -0.04 0.08 0.29 0.00 0.00 0.00 0.00 176.54 176.86 1wbs h ILE 212 N 1.00 1.35 -0.48 0.00 2.04 -0.43 -2.79 117.51 118.21 1wbs h ILE 212 Ca 0.24 -1.26 0.04 0.00 1.00 0.00 0.00 64.86 64.88 1wbs h ILE 212 Cb 0.18 1.91 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 1wbs h ILE 212 CO -0.02 0.36 0.25 -0.03 0.00 0.00 0.00 178.15 178.71 1wbs h MET 213 N -0.10 0.47 -0.54 2.37 4.05 -0.02 -1.20 114.93 119.96 1wbs h MET 213 Ca 0.02 -0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.49 1wbs h MET 213 Cb 0.63 -0.11 -0.07 0.00 -0.80 0.00 0.00 31.60 31.26 1wbs h MET 213 CO 0.03 0.31 0.18 0.00 0.23 0.00 0.00 176.91 177.66 1wbs h ALA 214 N 1.25 0.66 -0.19 0.39 0.00 -1.16 -1.06 119.26 119.16 1wbs h ALA 214 Ca 0.21 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1wbs h ALA 214 Cb 0.11 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1wbs h ALA 214 CO -0.14 -0.23 -0.40 1.49 0.00 0.00 0.00 179.25 179.97 1wbs h GLU 215 N 0.34 0.43 -0.78 0.00 4.81 -1.18 -1.11 114.58 117.09 1wbs h GLU 215 Ca 0.27 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1wbs h GLU 215 Cb 0.32 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1wbs h GLU 215 CO -0.29 0.76 0.35 -0.07 -0.73 0.00 0.00 179.01 179.03 1wbs h LEU 216 N 0.36 1.04 -0.34 1.64 3.38 -0.81 0.49 115.31 121.08 1wbs h LEU 216 Ca 0.03 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.70 1wbs h LEU 216 Cb 0.86 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1wbs h LEU 216 CO 0.07 0.90 -0.42 -0.07 0.09 0.00 0.00 178.44 179.01 1wbs h LEU 217 N 1.13 0.95 0.00 1.67 3.38 -0.84 -3.36 115.31 118.24 1wbs h LEU 217 Ca 0.27 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1wbs h LEU 217 Cb 0.16 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1wbs h LEU 217 CO -0.03 1.25 -1.78 0.35 0.09 0.00 0.00 178.44 178.32 1wbs n THR 218 N -4.08 0.00 -0.80 0.22 -2.24 -0.45 -4.99 114.28 101.93 1wbs n THR 218 Ca -0.03 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1wbs n THR 218 Cb 0.56 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 1wbs n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wbs n GLY 219 N 1.46 0.89 3.23 3.38 0.00 0.17 -5.03 105.19 109.29 1wbs n GLY 219 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.79 1wbs n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wbs s ARG 220 N -0.20 0.96 0.33 1.61 1.81 -1.21 -4.93 118.95 117.32 1wbs s ARG 220 Ca 0.00 -1.08 -0.29 0.00 -1.72 0.00 0.00 55.73 52.64 1wbs s ARG 220 Cb 0.00 -1.05 -0.11 0.00 -0.45 0.00 0.00 34.95 33.33 1wbs s ARG 220 CO 0.00 0.23 1.56 2.41 -0.68 0.00 0.00 175.30 178.82 1wbs n THR 221 N 1.09 1.39 -0.03 0.02 -1.04 -1.26 -3.98 114.28 110.47 1wbs n THR 221 Ca -0.20 -0.35 -0.14 0.00 -2.04 0.00 0.00 64.05 61.33 1wbs n THR 221 Cb 0.54 -1.97 -0.10 0.00 -1.82 0.00 0.00 70.33 66.98 1wbs n THR 221 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1wbs h LEU 222 N 4.10 0.11 -5.95 -4.42 5.85 -1.92 -3.40 115.31 109.68 1wbs h LEU 222 Ca -0.48 -0.65 -0.57 0.00 0.84 0.00 0.00 57.88 57.02 1wbs h LEU 222 Cb 1.23 -0.03 -0.41 0.00 0.37 0.00 0.00 40.66 41.82 1wbs h LEU 222 CO 0.74 0.74 -0.81 0.49 -0.34 0.00 0.00 178.44 179.25 1wbs n PHE 223 N -4.68 2.23 -1.33 1.25 3.72 -1.26 -5.00 117.46 112.38 1wbs n PHE 223 Ca -0.09 -3.93 -0.38 0.00 -0.05 0.00 0.00 57.45 53.01 1wbs n PHE 223 Cb 0.37 -0.47 -0.02 0.00 -0.94 0.00 0.00 39.48 38.41 1wbs n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1wbs n PRO 224 N 0.73 2.68 -2.22 -1.08 -0.04 -1.26 -4.70 135.00 129.11 1wbs n PRO 224 Ca 0.27 -2.15 -0.37 0.00 -0.04 0.00 0.00 63.50 61.21 1wbs n PRO 224 Cb 0.47 -2.94 -0.01 0.00 -0.04 0.00 0.00 33.50 30.98 1wbs n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1wbs s GLY 225 N 3.32 2.81 0.15 0.55 0.00 -1.26 -4.93 107.32 107.96 1wbs s GLY 225 Ca 0.54 0.98 0.26 0.00 0.00 0.00 0.00 44.72 46.51 1wbs s GLY 225 CO -0.03 1.46 1.80 -1.30 0.00 0.00 0.00 173.10 175.03 1wbs n THR 226 N -0.40 0.48 -3.88 0.90 -2.24 -1.26 -4.26 114.28 103.62 1wbs n THR 226 Ca 0.07 -0.15 -0.04 0.00 -2.27 0.00 0.00 64.05 61.66 1wbs n THR 226 Cb 0.47 -0.63 0.02 0.00 -2.10 0.00 0.00 70.33 68.09 1wbs n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1wbs s ASP 227 N -4.07 0.01 0.22 3.42 1.47 -1.25 -3.00 116.67 113.47 1wbs s ASP 227 Ca 0.11 -0.73 -0.07 0.00 1.18 0.00 0.00 52.55 53.03 1wbs s ASP 227 Cb 0.14 0.54 0.33 0.00 -0.34 0.00 0.00 42.92 43.59 1wbs s ASP 227 CO 0.55 -1.08 1.77 0.45 0.68 0.00 0.00 175.17 177.54 1wbs h HIS 228 N 2.00 0.59 0.16 2.11 3.86 -1.88 -0.97 115.15 121.02 1wbs h HIS 228 Ca -0.28 0.03 -0.30 0.00 -1.16 0.00 0.00 60.37 58.66 1wbs h HIS 228 Cb 1.22 -0.16 0.03 0.00 1.06 0.00 0.00 27.41 29.57 1wbs h HIS 228 CO 1.38 0.20 -1.28 0.82 0.86 0.00 0.00 177.93 179.90 1wbs h ILE 229 N 0.56 1.30 -0.97 2.45 1.08 -1.99 -1.47 117.51 118.47 1wbs h ILE 229 Ca 0.35 -2.52 0.05 0.00 -0.39 0.00 0.00 64.86 62.34 1wbs h ILE 229 Cb 0.39 2.82 -0.06 0.00 -3.07 0.00 0.00 36.82 36.90 1wbs h ILE 229 CO -0.28 0.76 0.63 -0.78 -0.69 0.00 0.00 178.15 177.79 1wbs h ASP 230 N 0.20 1.03 -0.37 1.72 3.58 -1.92 -1.10 116.42 119.56 1wbs h ASP 230 Ca -0.21 -0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.17 1wbs h ASP 230 Cb 1.97 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 42.78 1wbs h ASP 230 CO 0.24 0.68 -0.07 -0.61 -2.88 0.00 0.00 179.24 176.61 1wbs h GLN 231 N 1.18 0.70 -0.58 0.28 4.15 -1.10 -1.65 115.11 118.09 1wbs h GLN 231 Ca 0.40 -0.26 0.08 0.00 0.77 0.00 0.00 58.65 59.64 1wbs h GLN 231 Cb 0.07 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.65 1wbs h GLN 231 CO -0.14 0.84 0.23 1.25 -1.93 0.00 0.00 178.83 179.08 1wbs h LEU 232 N 0.50 0.25 -0.87 -2.39 5.85 -0.92 -1.08 115.31 116.66 1wbs h LEU 232 Ca 0.10 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1wbs h LEU 232 Cb 0.57 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1wbs h LEU 232 CO 0.03 0.16 0.50 0.11 -0.34 0.00 0.00 178.44 178.90 1wbs h LYS 233 N 0.43 1.20 -0.63 1.25 1.57 -0.98 0.64 116.57 120.05 1wbs h LYS 233 Ca 0.29 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1wbs h LYS 233 Cb 0.32 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 1wbs h LYS 233 CO -0.27 0.86 0.37 -0.07 -0.57 0.00 0.00 179.45 179.78 1wbs h LEU 234 N 1.21 0.75 0.02 2.94 3.38 -0.74 -1.12 115.31 121.75 1wbs h LEU 234 Ca 0.31 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1wbs h LEU 234 Cb -0.00 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1wbs h LEU 234 CO -0.05 0.60 -0.01 0.40 0.09 0.00 0.00 178.44 179.46 1wbs h ILE 235 N 0.85 1.11 0.00 1.22 2.04 -0.82 -3.08 117.51 118.82 1wbs h ILE 235 Ca 0.22 -0.41 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 1wbs h ILE 235 Cb -0.02 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1wbs h ILE 235 CO -0.04 0.10 -0.33 -0.07 0.00 0.00 0.00 178.15 177.81 1wbs h LEU 236 N -0.21 0.00 -1.15 1.44 3.38 -0.79 -1.26 115.31 116.72 1wbs h LEU 236 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1wbs h LEU 236 Cb 0.20 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1wbs h LEU 236 CO 0.01 0.33 0.31 -0.09 0.09 0.00 0.00 178.44 179.09 1wbs h ARG 237 N 0.00 0.91 0.00 1.13 2.43 -1.18 -0.46 114.38 117.22 1wbs h ARG 237 Ca -0.00 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.01 1wbs h ARG 237 Cb 0.72 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1wbs h ARG 237 CO 0.04 0.70 -0.20 1.25 -1.51 0.00 0.00 179.97 180.25 1wbs h LEU 238 N 0.91 0.00 -0.02 3.80 5.85 -1.28 -3.39 115.31 121.18 1wbs h LEU 238 Ca 0.23 -0.88 0.00 0.00 0.84 0.00 0.00 57.88 58.06 1wbs h LEU 238 Cb 0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1wbs h LEU 238 CO -0.03 1.06 -0.90 0.52 -0.34 0.00 0.00 178.44 178.75 1wbs n VAL 239 N -4.59 0.00 0.00 1.05 0.31 -0.55 -0.29 118.33 114.26 1wbs n VAL 239 Ca -0.13 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1wbs n VAL 239 Cb 0.49 0.87 0.00 0.00 -0.91 0.00 0.00 33.84 34.30 1wbs n VAL 239 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wbs n GLY 240 N 1.50 0.36 3.78 2.92 0.00 -0.18 -4.23 105.19 109.34 1wbs n GLY 240 Ca 0.04 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 1wbs n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wbs s THR 241 N -2.80 3.36 0.59 2.61 -4.23 -0.70 -4.70 115.64 109.76 1wbs s THR 241 Ca 0.00 0.80 -0.18 0.00 -1.18 0.00 0.00 61.69 61.13 1wbs s THR 241 Cb 0.00 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.50 1wbs s THR 241 CO 0.00 -0.23 1.13 -2.16 -0.54 0.00 0.00 174.62 172.81 1wbs s PRO 242 N -3.46 3.11 0.76 3.99 0.04 -1.26 -4.86 135.00 133.33 1wbs s PRO 242 Ca 0.70 1.54 -0.05 0.00 0.04 0.00 0.00 61.00 63.23 1wbs s PRO 242 Cb -0.21 -1.98 0.16 0.00 0.04 0.00 0.00 34.50 32.51 1wbs s PRO 242 CO 0.28 -1.03 1.04 0.41 0.04 0.00 0.00 177.00 177.75 1wbs n GLY 243 N -0.07 -0.00 0.23 0.56 0.00 -1.26 -4.90 105.19 99.75 1wbs n GLY 243 Ca 0.11 -1.93 0.01 0.00 0.00 0.00 0.00 46.02 44.21 1wbs n GLY 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbs h ALA 244 N -0.97 1.40 -0.37 4.61 0.00 -1.98 -1.83 119.26 120.12 1wbs h ALA 244 Ca -0.34 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 1wbs h ALA 244 Cb 1.15 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1wbs h ALA 244 CO 0.32 0.42 0.21 1.49 0.00 0.00 0.00 179.25 181.69 1wbs h GLU 245 N 0.23 0.50 -0.31 0.00 4.81 -2.00 -1.06 114.58 116.76 1wbs h GLU 245 Ca 0.04 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.04 1wbs h GLU 245 Cb 0.48 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1wbs h GLU 245 CO 0.03 0.40 -0.50 1.25 -0.73 0.00 0.00 179.01 179.46 1wbs h LEU 246 N 0.47 0.96 -1.13 1.64 7.12 -1.90 -3.24 115.31 119.23 1wbs h LEU 246 Ca 0.13 -0.49 0.05 0.00 0.13 0.00 0.00 57.88 57.70 1wbs h LEU 246 Cb 0.03 -0.27 -0.06 0.00 -0.53 0.00 0.00 40.66 39.83 1wbs h LEU 246 CO -0.02 1.29 0.59 -0.07 -0.13 0.00 0.00 178.44 180.10 1wbs h LEU 247 N 0.68 0.94 -1.62 2.25 3.38 -1.02 -1.29 115.31 118.63 1wbs h LEU 247 Ca 0.03 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1wbs h LEU 247 Cb 1.10 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1wbs h LEU 247 CO 0.11 0.62 0.11 0.11 0.09 0.00 0.00 178.44 179.48 1wbs h LYS 248 N 1.08 0.36 0.00 1.13 1.57 -1.22 -2.49 116.57 116.99 1wbs h LYS 248 Ca 0.38 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1wbs h LYS 248 Cb 0.12 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1wbs h LYS 248 CO -0.13 0.30 0.00 1.63 -0.57 0.00 0.00 179.45 180.68 1wbs n LYS 249 N -4.43 0.22 -2.40 3.15 5.02 -0.50 -4.63 118.16 114.59 1wbs n LYS 249 Ca 0.01 0.24 -0.41 0.00 -2.02 0.00 0.00 58.31 56.13 1wbs n LYS 249 Cb 0.12 -1.79 -0.03 0.00 -0.02 0.00 0.00 35.03 33.32 1wbs n LYS 249 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1wbs s ILE 250 N -3.14 3.76 0.31 -0.18 1.01 -0.94 -4.80 121.20 117.21 1wbs s ILE 250 Ca 0.09 0.62 0.04 0.00 0.00 0.00 0.00 60.65 61.40 1wbs s ILE 250 Cb 0.12 -4.48 0.11 0.00 0.01 0.00 0.00 42.46 38.22 1wbs s ILE 250 CO 0.54 -1.24 1.79 0.28 0.00 0.00 0.00 174.94 176.31 1wbs h SER 251 N 11.12 0.47 -2.96 3.58 0.02 -1.26 -3.41 113.55 121.12 1wbs h SER 251 Ca -0.27 -0.13 -0.57 0.00 -0.84 0.00 0.00 61.79 59.98 1wbs h SER 251 Cb 1.09 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 1wbs h SER 251 CO 1.19 0.64 1.16 -0.55 -1.14 0.00 0.00 176.83 178.14 1wbs s SER 252 N -6.78 6.18 0.23 3.07 0.15 -1.10 -4.89 113.70 110.56 1wbs s SER 252 Ca -0.07 1.15 -0.07 0.00 0.70 0.00 0.00 55.95 57.66 1wbs s SER 252 Cb 0.15 -2.53 0.26 0.00 -1.71 0.00 0.00 66.02 62.18 1wbs s SER 252 CO 0.78 -1.51 1.88 -0.08 1.20 0.00 0.00 173.24 175.51 1wbs h GLU 253 N 11.53 1.05 -0.28 5.44 4.81 -1.94 -0.71 114.58 134.48 1wbs h GLU 253 Ca -0.31 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 1wbs h GLU 253 Cb 1.14 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1wbs h GLU 253 CO 1.05 0.70 0.02 0.77 -0.73 0.00 0.00 179.01 180.82 1wbs h SER 254 N 1.08 0.46 -0.43 1.04 0.02 -1.96 0.35 113.55 114.11 1wbs h SER 254 Ca 0.34 -0.29 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1wbs h SER 254 Cb -0.01 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1wbs h SER 254 CO -0.11 0.63 0.20 0.00 -1.14 0.00 0.00 176.83 176.41 1wbs h ALA 255 N 0.84 0.56 -0.48 3.77 0.00 -1.90 -0.94 119.26 121.11 1wbs h ALA 255 Ca 0.08 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1wbs h ALA 255 Cb 0.39 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1wbs h ALA 255 CO 0.01 0.13 0.27 -0.09 0.00 0.00 0.00 179.25 179.58 1wbs h ARG 256 N 0.55 0.53 -0.43 0.00 2.43 -1.02 -1.44 114.38 115.00 1wbs h ARG 256 Ca 0.15 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 1wbs h ARG 256 Cb 0.14 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1wbs h ARG 256 CO -0.02 0.35 -0.02 -0.97 -1.51 0.00 0.00 179.97 177.80 1wbs h ASN 257 N 0.54 0.69 -0.17 -3.80 -1.24 -0.77 -2.78 115.58 108.05 1wbs h ASN 257 Ca 0.20 -0.16 -0.02 0.00 0.71 0.00 0.00 56.30 57.02 1wbs h ASN 257 Cb 0.04 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 38.91 1wbs h ASN 257 CO -0.10 0.77 0.03 0.22 -1.29 0.00 0.00 177.43 177.06 1wbs h TYR 258 N 0.67 0.29 -0.85 0.67 3.20 -0.73 -3.14 116.97 117.08 1wbs h TYR 258 Ca 0.13 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.01 1wbs h TYR 258 Cb 0.45 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.58 1wbs h TYR 258 CO 0.02 0.43 0.56 0.82 -1.64 0.00 0.00 178.16 178.35 1wbs h ILE 259 N 0.06 1.09 0.00 1.81 2.04 -1.12 -1.33 117.51 120.06 1wbs h ILE 259 Ca 0.05 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1wbs h ILE 259 Cb 0.30 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1wbs h ILE 259 CO 0.00 0.18 0.00 1.56 0.00 0.00 0.00 178.15 179.89 1wbs h GLN 260 N 1.00 0.00 0.00 2.37 4.20 -1.47 -2.14 115.11 119.06 1wbs h GLN 260 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 1wbs h GLN 260 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1wbs h GLN 260 CO -0.12 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.70 1wbs h SER 261 N 0.00 0.00 -3.79 1.46 4.64 -1.19 -3.45 113.55 111.22 1wbs h SER 261 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 1wbs h SER 261 Cb 0.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1wbs h SER 261 CO 0.00 0.00 0.31 -0.76 -0.87 0.00 0.00 176.83 175.51 1wbs s LEU 262 N -4.92 4.46 0.33 5.97 1.02 -0.81 -5.02 118.68 119.71 1wbs s LEU 262 Ca 0.06 1.82 -0.29 0.00 0.02 0.00 0.00 54.13 55.75 1wbs s LEU 262 Cb 0.10 -3.79 -0.10 0.00 0.02 0.00 0.00 46.19 42.42 1wbs s LEU 262 CO 0.51 0.04 1.31 -0.89 0.02 0.00 0.00 176.35 177.34 1wbs s THR 263 N -1.43 2.72 0.29 5.49 2.01 -1.26 -4.96 115.64 118.50 1wbs s THR 263 Ca 0.45 0.72 -0.29 0.00 0.31 0.00 0.00 61.69 62.88 1wbs s THR 263 Cb -0.21 -3.46 -0.10 0.00 0.01 0.00 0.00 72.50 68.74 1wbs s THR 263 CO 0.26 0.17 1.11 -1.10 -0.69 0.00 0.00 174.62 174.37 1wbs s GLN 264 N -1.74 4.60 -0.00 4.92 -0.21 -1.26 -4.92 119.66 121.05 1wbs s GLN 264 Ca 0.49 1.81 0.01 0.00 0.02 0.00 0.00 55.36 57.70 1wbs s GLN 264 Cb -0.40 -3.15 -0.00 0.00 1.00 0.00 0.00 33.01 30.45 1wbs s GLN 264 CO 0.53 0.17 -0.05 -1.64 -2.12 0.00 0.00 175.29 172.18 1wbs s MET 265 N -1.51 0.38 0.60 2.91 -1.94 -1.26 -5.00 119.30 113.48 1wbs s MET 265 Ca 0.45 -0.19 -0.14 0.00 -1.71 0.00 0.00 55.69 54.11 1wbs s MET 265 Cb -0.32 -0.36 -0.04 0.00 2.01 0.00 0.00 34.83 36.12 1wbs s MET 265 CO 0.41 0.10 1.04 -1.25 -0.01 0.00 0.00 175.02 175.30 1wbs s PRO 266 N -0.16 3.43 0.29 2.03 0.04 -1.26 -1.73 135.00 137.64 1wbs s PRO 266 Ca 0.01 1.02 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1wbs s PRO 266 Cb -0.02 -2.06 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 1wbs s PRO 266 CO -0.00 -0.70 1.53 1.17 0.04 0.00 0.00 177.00 179.04 1wbs n LYS 267 N -2.27 2.53 -1.60 4.56 4.81 -1.26 -4.05 118.16 120.87 1wbs n LYS 267 Ca 0.07 0.90 -0.30 0.00 -0.87 0.00 0.00 58.31 58.12 1wbs n LYS 267 Cb 0.53 -2.64 0.09 0.00 0.02 0.00 0.00 35.03 33.03 1wbs n LYS 267 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1wbs s MET 268 N -0.65 2.11 -0.42 1.64 -1.94 0.60 -4.91 119.30 115.73 1wbs s MET 268 Ca 0.64 0.58 -0.28 0.00 -1.71 0.00 0.00 55.69 54.92 1wbs s MET 268 Cb -0.53 -1.93 0.02 0.00 2.01 0.00 0.00 34.83 34.41 1wbs s MET 268 CO 0.50 -1.59 1.05 1.21 -0.01 0.00 0.00 175.02 176.19 1wbs s ASN 269 N -3.99 6.68 0.42 3.03 3.84 -1.26 -4.93 114.94 118.73 1wbs s ASN 269 Ca 0.61 0.55 0.18 0.00 0.21 0.00 0.00 52.86 54.40 1wbs s ASN 269 Cb -0.14 -2.52 0.92 0.00 -0.55 0.00 0.00 41.25 38.96 1wbs s ASN 269 CO 0.54 -1.07 1.88 -0.26 -2.79 0.00 0.00 177.10 175.40 1wbs h PHE 270 N 8.82 0.00 0.00 0.43 -1.00 -1.95 -2.09 116.94 121.16 1wbs h PHE 270 Ca -0.23 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.52 1wbs h PHE 270 Cb 1.07 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.62 1wbs h PHE 270 CO 0.90 0.29 -0.16 0.00 -1.61 0.00 0.00 178.31 177.73 1wbs h ALA 271 N 1.71 1.48 -0.00 2.45 0.00 -1.92 0.19 119.26 123.17 1wbs h ALA 271 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1wbs h ALA 271 Cb 0.60 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1wbs h ALA 271 CO 0.04 0.20 -0.36 0.09 0.00 0.00 0.00 179.25 179.22 1wbs n ASN 272 N -3.98 0.78 -0.12 0.00 3.02 -0.80 -3.71 115.26 110.45 1wbs n ASN 272 Ca -0.02 -0.60 -0.24 0.00 -0.03 0.00 0.00 54.58 53.69 1wbs n ASN 272 Cb 0.25 0.18 -0.10 0.00 -0.61 0.00 0.00 39.78 39.50 1wbs n ASN 272 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1wbs n VAL 273 N -1.03 1.52 -2.77 2.41 0.31 -0.96 -4.68 118.33 113.12 1wbs n VAL 273 Ca 0.09 -0.18 -0.43 0.00 -0.01 0.00 0.00 64.34 63.81 1wbs n VAL 273 Cb 0.34 -2.00 0.01 0.00 -0.91 0.00 0.00 33.84 31.28 1wbs n VAL 273 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1wbs n PHE 274 N -4.35 2.44 -2.00 3.52 3.72 0.65 -5.00 117.46 116.44 1wbs n PHE 274 Ca -0.41 -2.63 -0.42 0.00 -0.05 0.00 0.00 57.45 53.94 1wbs n PHE 274 Cb 0.75 -1.47 -0.03 0.00 -0.94 0.00 0.00 39.48 37.79 1wbs n PHE 274 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1wbs s ILE 275 N -1.84 3.29 0.00 4.37 1.01 -1.24 -2.18 121.20 124.60 1wbs s ILE 275 Ca 0.34 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.64 1wbs s ILE 275 Cb 0.07 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 39.12 1wbs s ILE 275 CO 0.07 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.60 1wbs n GLY 276 N 3.96 0.89 3.78 6.18 0.00 -1.26 -5.03 105.19 113.72 1wbs n GLY 276 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1wbs n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wbs s ALA 277 N -3.54 3.05 -0.46 4.61 0.00 -0.93 -4.94 121.76 119.55 1wbs s ALA 277 Ca 0.00 0.71 -0.46 0.00 0.00 0.00 0.00 51.96 52.21 1wbs s ALA 277 Cb 0.00 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.65 1wbs s ALA 277 CO 0.00 -0.26 1.59 -1.71 0.00 0.00 0.00 175.76 175.37 1wbs n ASN 278 N -0.23 1.25 -0.28 0.00 2.85 -1.26 -4.81 115.26 112.78 1wbs n ASN 278 Ca 0.06 1.18 0.29 0.00 -0.11 0.00 0.00 54.58 56.00 1wbs n ASN 278 Cb 0.50 -0.90 0.66 0.00 1.24 0.00 0.00 39.78 41.27 1wbs n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1wbs h PRO 279 N 5.08 0.14 -0.24 1.20 0.11 -1.97 0.75 132.00 137.07 1wbs h PRO 279 Ca -0.45 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 1wbs h PRO 279 Cb 1.37 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.44 1wbs h PRO 279 CO 0.96 0.09 -0.40 -0.07 -0.21 0.00 0.00 178.00 178.37 1wbs h LEU 280 N 0.14 0.60 -0.50 2.35 4.07 -1.99 -0.61 115.31 119.37 1wbs h LEU 280 Ca 0.54 -0.26 -0.09 0.00 0.08 0.00 0.00 57.88 58.14 1wbs h LEU 280 Cb 1.84 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 43.40 1wbs h LEU 280 CO -0.10 0.93 -0.05 0.00 -1.08 0.00 0.00 178.44 178.13 1wbs h ALA 281 N 1.10 0.68 -0.42 1.53 0.00 -1.24 -1.91 119.26 118.99 1wbs h ALA 281 Ca 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1wbs h ALA 281 Cb 0.90 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1wbs h ALA 281 CO 0.08 0.54 0.27 0.28 0.00 0.00 0.00 179.25 180.41 1wbs h VAL 282 N 0.77 1.12 -0.41 0.00 2.07 -1.17 -1.03 116.25 117.61 1wbs h VAL 282 Ca 0.13 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.43 1wbs h VAL 282 Cb 0.59 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1wbs h VAL 282 CO 0.04 0.12 0.22 -0.78 0.02 0.00 0.00 177.57 177.18 1wbs h ASP 283 N 0.56 0.33 -0.55 0.57 3.58 -1.01 -1.91 116.42 118.00 1wbs h ASP 283 Ca 0.15 0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.55 1wbs h ASP 283 Cb -0.03 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 40.95 1wbs h ASP 283 CO -0.03 0.24 0.06 0.25 -2.88 0.00 0.00 179.24 176.87 1wbs h LEU 284 N 0.44 0.89 -0.68 2.28 5.85 -1.21 -2.82 115.31 120.06 1wbs h LEU 284 Ca 0.17 -0.28 0.08 0.00 0.84 0.00 0.00 57.88 58.69 1wbs h LEU 284 Cb 0.06 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.79 1wbs h LEU 284 CO -0.11 0.95 0.35 -0.07 -0.34 0.00 0.00 178.44 179.22 1wbs h LEU 285 N 0.81 0.48 -2.05 2.25 3.38 -0.90 -1.35 115.31 117.94 1wbs h LEU 285 Ca 0.16 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1wbs h LEU 285 Cb 0.45 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1wbs h LEU 285 CO 0.02 0.30 -0.04 -0.33 0.09 0.00 0.00 178.44 178.47 1wbs h GLU 286 N 0.62 0.00 0.00 1.13 5.08 -1.12 0.37 114.58 120.67 1wbs h GLU 286 Ca 0.32 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.62 1wbs h GLU 286 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1wbs h GLU 286 CO -0.23 0.04 -0.76 0.87 -1.00 0.00 0.00 179.01 177.93 1wbs h LYS 287 N 0.00 0.00 0.13 2.33 1.79 -1.05 -3.37 116.57 116.40 1wbs h LYS 287 Ca -0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 1wbs h LYS 287 Cb 0.08 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 1wbs h LYS 287 CO 0.01 0.17 -1.95 0.52 -1.08 0.00 0.00 179.45 177.11 1wbs h MET 288 N 0.00 0.29 -2.76 3.15 2.86 -0.79 -2.30 114.93 115.37 1wbs h MET 288 Ca -0.04 -0.49 -0.76 0.00 -2.06 0.00 0.00 59.70 56.36 1wbs h MET 288 Cb 1.21 0.18 -0.15 0.00 0.06 0.00 0.00 31.60 32.90 1wbs h MET 288 CO 0.02 1.22 2.12 1.28 1.06 0.00 0.00 176.91 182.62 1wbs n LEU 289 N -3.49 7.65 -4.32 1.22 4.32 0.08 -4.33 117.00 118.12 1wbs n LEU 289 Ca -0.30 -4.92 -0.34 0.00 -0.02 0.00 0.00 56.01 50.44 1wbs n LEU 289 Cb 1.05 -1.36 -0.14 0.00 -1.62 0.00 0.00 43.42 41.35 1wbs n LEU 289 CO 0.45 1.92 -0.44 -0.69 -1.22 0.00 0.00 177.39 177.40 1wbs s VAL 290 N -1.29 3.02 0.16 4.08 1.01 -1.26 -4.89 120.40 121.22 1wbs s VAL 290 Ca 0.49 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.67 1wbs s VAL 290 Cb 0.16 -2.30 0.04 0.00 0.00 0.00 0.00 36.38 34.28 1wbs s VAL 290 CO -0.07 0.49 1.79 0.25 0.00 0.00 0.00 175.10 177.57 1wbs h LEU 291 N 7.31 0.58 -8.78 3.92 5.85 -1.91 -3.40 115.31 118.90 1wbs h LEU 291 Ca -0.33 -0.06 -0.57 0.00 0.84 0.00 0.00 57.88 57.77 1wbs h LEU 291 Cb 1.19 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 1wbs h LEU 291 CO 0.58 0.47 1.03 -0.62 -0.34 0.00 0.00 178.44 179.56 1wbs s ASP 292 N -5.72 6.43 0.60 1.25 -1.08 -1.26 -4.89 116.67 112.00 1wbs s ASP 292 Ca -0.13 0.74 0.37 0.00 -0.52 0.00 0.00 52.55 53.01 1wbs s ASP 292 Cb 0.12 -2.54 1.86 0.00 -1.46 0.00 0.00 42.92 40.89 1wbs s ASP 292 CO 0.74 -1.37 2.18 0.77 0.52 0.00 0.00 175.17 178.01 1wbs h SER 293 N 10.23 0.00 0.24 -0.34 4.64 -1.98 0.33 113.55 126.67 1wbs h SER 293 Ca -0.26 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.02 1wbs h SER 293 Cb 1.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1wbs h SER 293 CO 1.10 0.03 -0.17 0.44 -0.87 0.00 0.00 176.83 177.35 1wbs h ASP 294 N 0.00 0.00 -0.01 4.97 3.32 -1.94 -3.26 116.42 119.49 1wbs h ASP 294 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1wbs h ASP 294 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1wbs h ASP 294 CO 0.00 0.17 -0.41 0.29 -1.72 0.00 0.00 179.24 177.57 1wbs n LYS 295 N -4.08 1.42 -2.22 3.56 5.02 0.10 -4.96 118.16 117.00 1wbs n LYS 295 Ca -0.02 -0.96 -0.39 0.00 -2.02 0.00 0.00 58.31 54.92 1wbs n LYS 295 Cb 0.24 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1wbs n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1wbs s ARG 296 N -2.23 4.05 0.47 1.97 0.52 -1.18 -4.99 118.95 117.56 1wbs s ARG 296 Ca 0.17 1.94 -0.24 0.00 -0.52 0.00 0.00 55.73 57.09 1wbs s ARG 296 Cb 0.16 -2.72 -0.07 0.00 0.52 0.00 0.00 34.95 32.84 1wbs s ARG 296 CO 0.50 -0.36 1.28 -1.50 0.02 0.00 0.00 175.30 175.25 1wbs s ILE 297 N -1.35 2.56 0.63 1.52 2.07 -0.87 -5.02 121.20 120.74 1wbs s ILE 297 Ca 0.56 0.45 -0.03 0.00 -1.41 0.00 0.00 60.65 60.22 1wbs s ILE 297 Cb -0.33 -3.24 0.05 0.00 0.13 0.00 0.00 42.46 39.06 1wbs s ILE 297 CO 0.42 0.02 0.91 0.42 -1.91 0.00 0.00 174.94 174.80 1wbs s THR 298 N -1.36 2.55 0.15 4.00 -4.23 -1.26 -4.91 115.64 110.57 1wbs s THR 298 Ca 0.64 -0.41 -0.16 0.00 -1.18 0.00 0.00 61.69 60.59 1wbs s THR 298 Cb -0.36 -3.04 0.02 0.00 1.34 0.00 0.00 72.50 70.46 1wbs s THR 298 CO 0.44 -0.04 1.76 0.00 -0.54 0.00 0.00 174.62 176.25 1wbs h ALA 299 N -0.30 0.56 -0.84 3.99 0.00 -1.93 -0.55 119.26 120.18 1wbs h ALA 299 Ca -0.44 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1wbs h ALA 299 Cb 1.30 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 1wbs h ALA 299 CO 0.57 0.07 0.41 0.00 0.00 0.00 0.00 179.25 180.30 1wbs h ALA 300 N 1.10 1.09 -0.41 0.00 0.00 -1.94 -1.15 119.26 117.94 1wbs h ALA 300 Ca 0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1wbs h ALA 300 Cb 0.04 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1wbs h ALA 300 CO -0.03 0.65 0.07 1.96 0.00 0.00 0.00 179.25 181.90 1wbs h GLN 301 N 1.20 0.69 -0.58 0.00 4.20 -1.92 -3.24 115.11 115.45 1wbs h GLN 301 Ca 0.29 -0.18 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1wbs h GLN 301 Cb 0.12 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1wbs h GLN 301 CO -0.04 0.72 0.22 0.00 -0.67 0.00 0.00 178.83 179.07 1wbs h ALA 302 N 0.93 1.29 0.00 3.87 0.00 -0.55 -1.90 119.26 122.91 1wbs h ALA 302 Ca 0.13 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wbs h ALA 302 Cb 0.37 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1wbs h ALA 302 CO 0.01 0.52 -0.01 -0.07 0.00 0.00 0.00 179.25 179.70 1wbs h LEU 303 N 0.84 0.00 -0.74 0.00 3.38 -1.25 -1.37 115.31 116.17 1wbs h LEU 303 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1wbs h LEU 303 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1wbs h LEU 303 CO -0.02 0.01 -0.06 0.00 0.09 0.00 0.00 178.44 178.46 1wbs n ALA 304 N -2.34 2.71 -1.77 1.53 0.00 -0.72 -4.76 120.51 115.16 1wbs n ALA 304 Ca -0.03 -0.41 -0.38 0.00 0.00 0.00 0.00 53.44 52.63 1wbs n ALA 304 Cb 0.09 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.34 1wbs n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1wbs s HIS 305 N -2.14 2.88 0.62 0.00 5.04 -0.52 -4.91 115.29 116.26 1wbs s HIS 305 Ca 0.35 1.52 0.39 0.00 -1.54 0.00 0.00 55.06 55.78 1wbs s HIS 305 Cb 0.21 -3.42 2.18 0.00 0.04 0.00 0.00 32.58 31.58 1wbs s HIS 305 CO 0.39 -1.58 2.32 0.00 -2.34 0.00 0.00 174.74 173.53 1wbs h ALA 306 N 2.19 1.18 -0.57 1.58 0.00 -1.91 -2.12 119.26 119.60 1wbs h ALA 306 Ca -0.49 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.51 1wbs h ALA 306 Cb 1.25 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1wbs h ALA 306 CO 0.61 0.01 0.39 -0.92 0.00 0.00 0.00 179.25 179.33 1wbs h TYR 307 N 0.00 0.40 -0.61 0.00 3.20 -1.91 -2.02 116.97 116.03 1wbs h TYR 307 Ca -0.00 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 1wbs h TYR 307 Cb 0.03 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 1wbs h TYR 307 CO 0.00 0.19 0.06 1.19 -1.64 0.00 0.00 178.16 177.96 1wbs n PHE 308 N -4.47 2.18 -0.34 -3.82 3.72 -0.80 -4.66 117.46 109.28 1wbs n PHE 308 Ca 0.09 -0.83 0.14 0.00 -0.05 0.00 0.00 57.45 56.81 1wbs n PHE 308 Cb 0.37 -0.55 0.36 0.00 -0.94 0.00 0.00 39.48 38.71 1wbs n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wbs h ALA 309 N 3.74 1.77 -0.15 4.37 0.00 -1.49 0.24 119.26 127.73 1wbs h ALA 309 Ca 0.05 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1wbs h ALA 309 Cb 2.07 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1wbs h ALA 309 CO 0.55 -0.14 0.11 0.37 0.00 0.00 0.00 179.25 180.14 1wbs h GLN 310 N 0.70 0.00 0.00 0.00 4.15 -1.85 -3.32 115.11 114.79 1wbs h GLN 310 Ca 0.57 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.95 1wbs h GLN 310 Cb 0.98 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 1wbs h GLN 310 CO -0.36 0.00 -1.22 0.66 -1.93 0.00 0.00 178.83 175.98 1wbs n TYR 311 N -4.48 0.00 -1.69 3.99 4.01 -0.13 -5.04 117.16 113.82 1wbs n TYR 311 Ca 0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.32 1wbs n TYR 311 Cb 0.24 -0.15 -0.03 0.00 -0.31 0.00 0.00 39.34 39.09 1wbs n TYR 311 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1wbs n HIS 312 N -2.01 2.59 -3.59 -0.72 -0.00 -0.12 -4.97 115.22 106.40 1wbs n HIS 312 Ca -0.04 -0.07 -0.28 0.00 0.46 0.00 0.00 57.72 57.79 1wbs n HIS 312 Cb 0.50 -2.70 -0.16 0.00 -0.12 0.00 0.00 29.99 27.51 1wbs n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1wbs s ASP 313 N 2.41 2.97 0.49 0.26 -1.08 -1.26 -4.99 116.67 115.47 1wbs s ASP 313 Ca 0.81 -0.96 0.33 0.00 -0.52 0.00 0.00 52.55 52.21 1wbs s ASP 313 Cb -0.52 -0.32 1.67 0.00 -1.46 0.00 0.00 42.92 42.29 1wbs s ASP 313 CO 0.38 -0.39 2.01 1.55 0.52 0.00 0.00 175.17 179.24 1wbs h PRO 314 N 8.40 0.00 -0.17 4.34 0.13 -1.97 -1.01 132.00 141.71 1wbs h PRO 314 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1wbs h PRO 314 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1wbs h PRO 314 CO 0.37 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.89 1wbs n ASP 315 N -2.75 1.65 -2.78 1.44 8.00 -1.26 -4.14 116.55 116.71 1wbs n ASP 315 Ca -0.01 -1.72 -0.03 0.00 0.71 0.00 0.00 54.79 53.74 1wbs n ASP 315 Cb 0.14 -0.11 0.04 0.00 -0.02 0.00 0.00 41.12 41.17 1wbs n ASP 315 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1wbs n ASP 316 N 0.31 1.62 -3.35 -2.24 2.03 -0.39 -4.91 116.55 109.62 1wbs n ASP 316 Ca 0.16 -2.23 -0.26 0.00 0.52 0.00 0.00 54.79 52.98 1wbs n ASP 316 Cb 0.32 -0.49 -0.08 0.00 -0.72 0.00 0.00 41.12 40.15 1wbs n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1wbs n GLU 317 N -0.47 1.07 -2.09 -0.67 1.02 -1.22 -4.87 120.64 113.42 1wbs n GLU 317 Ca 0.08 -3.63 -0.34 0.00 -0.02 0.00 0.00 57.16 53.26 1wbs n GLU 317 Cb 0.81 -1.63 0.01 0.00 -0.02 0.00 0.00 31.44 30.61 1wbs n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1wbs s PRO 318 N -1.19 3.21 0.36 3.49 0.04 -1.26 -4.98 135.00 134.67 1wbs s PRO 318 Ca 0.35 1.45 0.06 0.00 0.04 0.00 0.00 61.00 62.89 1wbs s PRO 318 Cb 0.12 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 32.65 1wbs s PRO 318 CO -0.12 -0.93 0.51 0.14 0.04 0.00 0.00 177.00 176.64 1wbs s VAL 319 N -2.09 3.85 0.44 -0.36 -7.23 -1.26 -4.13 120.40 109.62 1wbs s VAL 319 Ca 0.69 -0.95 -0.19 0.00 -1.81 0.00 0.00 61.98 59.72 1wbs s VAL 319 Cb -0.21 -3.34 -0.10 0.00 0.56 0.00 0.00 36.38 33.30 1wbs s VAL 319 CO 0.33 -0.14 0.94 0.00 -0.31 0.00 0.00 175.10 175.91 1wbs s ALA 320 N -2.25 3.07 0.79 1.32 0.00 -1.25 -5.01 121.76 118.43 1wbs s ALA 320 Ca 0.47 0.32 -0.13 0.00 0.00 0.00 0.00 51.96 52.62 1wbs s ALA 320 Cb -0.10 -3.10 0.08 0.00 0.00 0.00 0.00 23.12 19.99 1wbs s ALA 320 CO 0.32 0.07 1.20 -0.51 0.00 0.00 0.00 175.76 176.84 1wbs s ASP 321 N -2.38 3.72 0.22 0.00 1.01 -1.26 -4.81 116.67 113.17 1wbs s ASP 321 Ca 0.61 2.34 -0.32 0.00 0.71 0.00 0.00 52.55 55.88 1wbs s ASP 321 Cb -0.09 -2.58 -0.14 0.00 1.01 0.00 0.00 42.92 41.11 1wbs s ASP 321 CO 0.17 -2.58 1.36 -2.65 0.21 0.00 0.00 175.17 171.68 1wbs n PRO 322 N -3.23 1.84 -4.00 8.23 -0.02 -1.26 -4.80 135.00 131.76 1wbs n PRO 322 Ca 0.13 0.66 -0.34 0.00 -2.02 0.00 0.00 63.50 61.93 1wbs n PRO 322 Cb 0.51 -2.28 -0.15 0.00 -0.02 0.00 0.00 33.50 31.56 1wbs n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1wbs s TYR 323 N -0.04 3.16 -0.55 6.00 5.04 -1.26 -5.08 117.35 124.62 1wbs s TYR 323 Ca 0.70 -1.93 -0.28 0.00 -2.44 0.00 0.00 57.07 53.12 1wbs s TYR 323 Cb -0.70 -2.01 0.03 0.00 0.35 0.00 0.00 41.96 39.63 1wbs s TYR 323 CO 0.50 -0.81 1.22 0.34 -1.34 0.00 0.00 175.55 175.46 1wbs s ASP 324 N 1.22 6.44 -0.28 4.32 -1.08 -1.26 -4.88 116.67 121.16 1wbs s ASP 324 Ca -0.04 0.25 0.12 0.00 -0.52 0.00 0.00 52.55 52.35 1wbs s ASP 324 Cb -0.18 -2.55 0.64 0.00 -1.46 0.00 0.00 42.92 39.36 1wbs s ASP 324 CO -0.05 -1.46 1.63 0.00 0.52 0.00 0.00 175.17 175.81 1wbs n GLN 325 N 8.32 3.11 -0.02 4.34 6.02 -1.26 -4.67 117.38 133.23 1wbs n GLN 325 Ca 0.10 -3.04 0.21 0.00 -0.01 0.00 0.00 57.00 54.26 1wbs n GLN 325 Cb 0.49 -2.03 0.69 0.00 1.02 0.00 0.00 30.24 30.41 1wbs n GLN 325 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1wbs h SER 326 N 2.08 0.01 -0.08 1.08 4.64 -2.03 -1.80 113.55 117.45 1wbs h SER 326 Ca 0.18 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.52 1wbs h SER 326 Cb 1.94 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.03 1wbs h SER 326 CO 0.52 0.01 0.08 2.19 -0.87 0.00 0.00 176.83 178.75 1wbs h PHE 327 N 0.01 0.00 -0.39 4.77 -0.00 -1.96 -2.44 116.94 116.93 1wbs h PHE 327 Ca 0.27 0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.26 1wbs h PHE 327 Cb 1.05 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.98 1wbs h PHE 327 CO -0.00 0.00 0.26 0.93 -0.00 0.00 0.00 178.31 179.50 1wbs h GLU 328 N 0.00 0.44 -0.17 6.09 4.39 -1.71 -1.59 114.58 122.02 1wbs h GLU 328 Ca 0.04 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1wbs h GLU 328 Cb 0.19 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1wbs h GLU 328 CO -0.00 0.29 0.00 0.43 -1.16 0.00 0.00 179.01 178.57 1wbs n SER 329 N -4.48 1.66 -4.64 1.42 7.64 -0.92 -4.93 113.62 109.36 1wbs n SER 329 Ca 0.04 -1.72 -0.34 0.00 1.01 0.00 0.00 58.87 57.86 1wbs n SER 329 Cb 0.12 -0.11 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 1wbs n SER 329 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1wbs s ARG 330 N -1.78 2.82 -0.32 1.43 3.52 -0.60 -5.09 118.95 118.93 1wbs s ARG 330 Ca 0.32 -0.53 -0.06 0.00 -0.13 0.00 0.00 55.73 55.33 1wbs s ARG 330 Cb 0.17 -2.67 0.03 0.00 -1.56 0.00 0.00 34.95 30.92 1wbs s ARG 330 CO 0.26 0.66 0.08 -0.51 -0.81 0.00 0.00 175.30 174.98 1wbs s ASP 331 N -1.07 5.19 0.26 -2.12 1.01 -1.26 -5.03 116.67 113.65 1wbs s ASP 331 Ca 0.15 -0.98 0.05 0.00 0.71 0.00 0.00 52.55 52.48 1wbs s ASP 331 Cb -0.11 -1.86 -0.06 0.00 1.01 0.00 0.00 42.92 41.90 1wbs s ASP 331 CO 0.04 -0.27 -0.03 -0.76 0.21 0.00 0.00 175.17 174.36 1wbs s LEU 332 N 1.43 2.36 0.61 1.23 1.43 -1.26 -5.16 118.68 119.33 1wbs s LEU 332 Ca -0.00 -1.20 -0.10 0.00 -1.03 0.00 0.00 54.13 51.79 1wbs s LEU 332 Cb -0.19 -0.48 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 1wbs s LEU 332 CO 0.02 -0.42 1.00 -0.76 0.23 0.00 0.00 176.35 176.43 1wbs s LEU 333 N -3.38 3.24 0.17 1.79 1.43 -1.26 -4.88 118.68 115.78 1wbs s LEU 333 Ca 0.29 1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 54.50 1wbs s LEU 333 Cb 0.05 -4.31 0.09 0.00 0.03 0.00 0.00 46.19 42.04 1wbs s LEU 333 CO 0.10 -0.89 1.63 0.40 0.23 0.00 0.00 176.35 177.82 1wbs h ILE 334 N -0.28 0.38 -0.05 -0.59 2.04 -1.92 -0.88 117.51 116.20 1wbs h ILE 334 Ca -0.45 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.43 1wbs h ILE 334 Cb 1.20 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1wbs h ILE 334 CO 0.62 0.00 0.04 0.44 0.00 0.00 0.00 178.15 179.25 1wbs h ASP 335 N -0.16 0.00 -0.01 1.72 3.32 -1.95 0.24 116.42 119.58 1wbs h ASP 335 Ca 0.19 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1wbs h ASP 335 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1wbs h ASP 335 CO -0.48 0.00 -0.13 -0.33 -1.72 0.00 0.00 179.24 176.58 1wbs h GLU 336 N 0.00 0.11 -0.95 3.56 5.08 -1.59 -1.84 114.58 118.95 1wbs h GLU 336 Ca 0.03 -0.10 0.08 0.00 -1.00 0.00 0.00 59.36 58.37 1wbs h GLU 336 Cb 0.11 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 1wbs h GLU 336 CO -0.00 0.80 0.61 -1.49 -1.00 0.00 0.00 179.01 177.93 1wbs h TRP 337 N -0.55 1.09 -0.70 4.33 -0.00 -0.66 -1.65 115.95 117.80 1wbs h TRP 337 Ca -0.01 0.03 -0.04 0.00 -0.00 0.00 0.00 58.89 58.86 1wbs h TRP 337 Cb 0.84 -0.35 -0.03 0.00 -0.00 0.00 0.00 29.16 29.61 1wbs h TRP 337 CO 0.17 0.53 0.27 -0.22 -0.00 0.00 0.00 178.44 179.19 1wbs h LYS 338 N 1.04 1.05 -0.31 0.49 3.64 -0.57 -1.02 116.57 120.88 1wbs h LYS 338 Ca 0.42 -0.20 -0.18 0.00 -1.27 0.00 0.00 60.65 59.42 1wbs h LYS 338 Cb 0.28 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1wbs h LYS 338 CO -0.18 0.88 -0.52 1.03 -2.27 0.00 0.00 179.45 178.39 1wbs h SER 339 N 1.00 0.98 -0.46 4.20 0.87 -0.74 0.11 113.55 119.52 1wbs h SER 339 Ca 0.23 -0.52 0.02 0.00 -1.23 0.00 0.00 61.79 60.29 1wbs h SER 339 Cb 0.22 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 1wbs h SER 339 CO -0.02 1.32 0.27 -0.07 -0.53 0.00 0.00 176.83 177.80 1wbs h LEU 340 N 0.68 0.43 -0.22 2.23 4.07 -1.26 -1.23 115.31 120.00 1wbs h LEU 340 Ca 0.02 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1wbs h LEU 340 Cb 1.12 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.77 1wbs h LEU 340 CO 0.12 0.30 0.09 0.74 -1.08 0.00 0.00 178.44 178.61 1wbs h THR 341 N 0.54 1.16 -0.68 0.22 2.02 -0.94 -2.64 112.91 112.58 1wbs h THR 341 Ca 0.18 -0.48 0.09 0.00 0.77 0.00 0.00 66.41 66.97 1wbs h THR 341 Cb 0.02 1.07 -0.07 0.00 -1.74 0.00 0.00 68.15 67.43 1wbs h THR 341 CO -0.09 0.16 0.33 0.22 0.37 0.00 0.00 175.52 176.51 1wbs h TYR 342 N 0.21 0.58 -0.54 3.16 3.20 -0.58 -1.66 116.97 121.34 1wbs h TYR 342 Ca 0.07 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 1wbs h TYR 342 Cb 0.17 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1wbs h TYR 342 CO -0.01 0.20 0.28 -0.44 -1.64 0.00 0.00 178.16 176.55 1wbs h ASP 343 N 0.56 0.66 0.72 -2.11 3.32 -1.01 -2.18 116.42 116.38 1wbs h ASP 343 Ca 0.34 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.19 1wbs h ASP 343 Cb 0.36 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1wbs h ASP 343 CO -0.27 0.54 -0.68 -0.33 -1.72 0.00 0.00 179.24 176.78 1wbs h GLU 344 N 0.74 0.00 0.07 3.56 4.39 -0.97 -1.87 114.58 120.50 1wbs h GLU 344 Ca 0.19 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 1wbs h GLU 344 Cb 0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1wbs h GLU 344 CO -0.03 0.68 -0.03 0.28 -1.16 0.00 0.00 179.01 178.75 1wbs h VAL 345 N 0.00 1.10 -0.44 3.13 2.07 -0.89 -3.00 116.25 118.22 1wbs h VAL 345 Ca -0.01 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 1wbs h VAL 345 Cb 1.23 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 1wbs h VAL 345 CO 0.09 0.15 0.16 0.40 0.02 0.00 0.00 177.57 178.39 1wbs h ILE 346 N -0.37 1.17 -0.00 4.57 5.03 -1.37 -2.47 117.51 124.06 1wbs h ILE 346 Ca -0.01 -0.55 0.00 0.00 -0.12 0.00 0.00 64.86 64.18 1wbs h ILE 346 Cb 0.32 0.66 0.00 0.00 -3.03 0.00 0.00 36.82 34.78 1wbs h ILE 346 CO 0.02 0.21 -0.14 -1.54 -0.68 0.00 0.00 178.15 176.02 1wbs n SER 347 N -4.36 0.60 -4.71 1.72 3.41 -0.71 -4.94 113.62 104.63 1wbs n SER 347 Ca 0.03 -0.65 -0.42 0.00 -0.26 0.00 0.00 58.87 57.57 1wbs n SER 347 Cb 0.16 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 1wbs n SER 347 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1wbs s PHE 348 N -2.47 2.79 -0.19 7.33 5.36 -0.93 -5.00 117.98 124.86 1wbs s PHE 348 Ca 0.28 0.35 -0.02 0.00 -0.96 0.00 0.00 56.93 56.58 1wbs s PHE 348 Cb 0.20 -4.08 -0.01 0.00 -0.34 0.00 0.00 43.02 38.79 1wbs s PHE 348 CO 0.48 -4.15 -0.09 0.08 -1.46 0.00 0.00 175.22 170.09 1wbs s VAL 349 N 1.52 3.13 0.61 3.12 1.01 -1.26 -5.06 120.40 123.47 1wbs s VAL 349 Ca 0.75 -0.59 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 1wbs s VAL 349 Cb -0.47 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.50 1wbs s VAL 349 CO 0.32 0.47 1.29 -2.65 0.00 0.00 0.00 175.10 174.53 1wbs n PRO 350 N 4.41 1.28 -1.63 2.72 -0.02 -1.26 -4.99 135.00 135.52 1wbs n PRO 350 Ca -0.19 0.49 -0.33 0.00 -2.02 0.00 0.00 63.50 61.46 1wbs n PRO 350 Cb 0.51 -2.52 0.06 0.00 -0.02 0.00 0.00 33.50 31.53 1wbs n PRO 350 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1wbs s PRO 351 N -3.17 2.59 0.17 0.52 0.04 -1.26 -4.92 135.00 128.97 1wbs s PRO 351 Ca 0.79 1.44 -0.32 0.00 0.04 0.00 0.00 61.00 62.95 1wbs s PRO 351 Cb -0.40 -1.92 -0.16 0.00 0.04 0.00 0.00 34.50 32.06 1wbs s PRO 351 CO 0.43 -1.43 0.93 -2.30 0.04 0.00 0.00 177.00 174.68 1wbs n PRO 352 N -2.62 0.66 -2.80 0.56 -0.02 -1.26 -4.87 135.00 124.65 1wbs n PRO 352 Ca 0.11 0.24 -0.43 0.00 -2.02 0.00 0.00 63.50 61.39 1wbs n PRO 352 Cb 0.52 -1.56 -0.04 0.00 -0.02 0.00 0.00 33.50 32.40 1wbs n PRO 352 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1wbs s LEU 353 N 1.23 3.98 -0.39 2.45 2.01 -1.26 -4.30 118.68 122.40 1wbs s LEU 353 Ca 0.71 0.09 0.11 0.00 0.01 0.00 0.00 54.13 55.05 1wbs s LEU 353 Cb -0.91 -3.18 0.38 0.00 0.01 0.00 0.00 46.19 42.48 1wbs s LEU 353 CO 0.55 -1.09 1.05 -0.90 1.01 0.00 0.00 176.35 176.97 1wbs n ASP 354 N 7.27 -0.51 0.00 2.29 5.68 -1.26 -5.21 116.55 124.81 1wbs n ASP 354 Ca 0.06 -2.96 0.00 0.00 -0.50 0.00 0.00 54.79 51.40 1wbs n ASP 354 Cb 0.48 0.46 0.00 0.00 -1.14 0.00 0.00 41.12 40.92 1wbs n ASP 354 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87