#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uwc s PRO 4 N 0.00 3.50 0.18 0.54 0.04 -1.26 -4.96 135.00 133.04 2uwc s PRO 4 Ca 0.00 1.59 -0.33 0.00 0.04 0.00 0.00 61.00 62.30 2uwc s PRO 4 Cb 0.00 -2.08 -0.14 0.00 0.04 0.00 0.00 34.50 32.32 2uwc s PRO 4 CO 0.00 -0.73 1.44 0.45 0.04 0.00 0.00 177.00 178.20 2uwc n SER 5 N -1.12 2.59 0.04 6.66 2.88 -1.26 -4.78 113.62 118.63 2uwc n SER 5 Ca 0.11 1.12 0.09 0.00 -1.33 0.00 0.00 58.87 58.86 2uwc n SER 5 Cb 0.51 -1.37 0.40 0.00 -0.75 0.00 0.00 64.21 63.00 2uwc n SER 5 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2uwc n PRO 6 N 2.61 0.06 -0.80 -1.46 -0.04 -1.26 -4.81 135.00 129.30 2uwc n PRO 6 Ca 0.15 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 2uwc n PRO 6 Cb 0.28 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 2uwc n PRO 6 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2uwc n GLY 7 N 0.27 1.24 3.21 0.55 0.00 -1.26 -3.13 105.19 106.08 2uwc n GLY 7 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 2uwc n GLY 7 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2uwc s TYR 8 N -3.75 -0.40 -0.56 1.61 5.04 -1.26 -5.05 117.35 112.99 2uwc s TYR 8 Ca 0.00 0.95 0.04 0.00 -2.44 0.00 0.00 57.07 55.62 2uwc s TYR 8 Cb 0.00 0.14 0.16 0.00 0.35 0.00 0.00 41.96 42.61 2uwc s TYR 8 CO 0.00 -0.21 0.38 0.71 -1.34 0.00 0.00 175.55 175.09 2uwc s TYR 9 N 0.48 2.57 0.36 4.97 1.51 -1.26 -4.90 117.35 121.08 2uwc s TYR 9 Ca -0.02 -2.87 0.10 0.00 -1.01 0.00 0.00 57.07 53.26 2uwc s TYR 9 Cb -0.04 -2.09 0.85 0.00 -0.11 0.00 0.00 41.96 40.56 2uwc s TYR 9 CO -0.03 -0.68 1.85 -1.35 -1.11 0.00 0.00 175.55 174.24 2uwc h PRO 10 N 5.85 0.64 0.00 -1.71 0.11 -1.87 -1.70 132.00 133.32 2uwc h PRO 10 Ca 0.12 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.14 2uwc h PRO 10 Cb 0.84 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 2uwc h PRO 10 CO 0.58 0.42 -0.25 0.66 -0.21 0.00 0.00 178.00 179.20 2uwc h SER 11 N 0.66 0.00 0.75 -2.05 4.64 -1.94 -1.44 113.55 114.18 2uwc h SER 11 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2uwc h SER 11 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2uwc h SER 11 CO -0.22 0.25 0.00 -1.54 -0.87 0.00 0.00 176.83 174.45 2uwc n SER 12 N -3.85 0.42 0.03 4.97 3.41 -0.64 -2.68 113.62 115.28 2uwc n SER 12 Ca -0.02 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.30 2uwc n SER 12 Cb 0.34 -0.69 0.09 0.00 -0.26 0.00 0.00 64.21 63.69 2uwc n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2uwc n GLN 13 N -1.95 0.24 -4.66 4.33 1.13 -0.54 -4.89 117.38 111.04 2uwc n GLN 13 Ca 0.03 0.02 -0.33 0.00 -1.94 0.00 0.00 57.00 54.78 2uwc n GLN 13 Cb 0.24 -1.60 -0.14 0.00 0.11 0.00 0.00 30.24 28.85 2uwc n GLN 13 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2uwc s ILE 14 N -3.15 3.26 0.35 5.09 1.01 -1.09 -5.09 121.20 121.57 2uwc s ILE 14 Ca 0.05 -0.58 -0.28 0.00 0.00 0.00 0.00 60.65 59.84 2uwc s ILE 14 Cb 0.15 -2.39 -0.09 0.00 0.01 0.00 0.00 42.46 40.13 2uwc s ILE 14 CO 0.77 0.51 1.23 -0.89 0.00 0.00 0.00 174.94 176.56 2uwc s THR 15 N 0.39 2.98 0.60 2.92 2.01 -1.26 -4.97 115.64 118.31 2uwc s THR 15 Ca -0.09 0.94 -0.14 0.00 0.31 0.00 0.00 61.69 62.71 2uwc s THR 15 Cb -0.15 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.75 2uwc s THR 15 CO 0.05 0.18 1.04 -0.44 -0.69 0.00 0.00 174.62 174.76 2uwc s SER 16 N -0.76 5.89 0.15 3.53 0.01 -1.26 -4.59 113.70 116.67 2uwc s SER 16 Ca 0.51 1.69 0.07 0.00 1.31 0.00 0.00 55.95 59.52 2uwc s SER 16 Cb -0.36 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.32 2uwc s SER 16 CO 0.46 -1.09 -0.15 -1.48 0.41 0.00 0.00 173.24 171.39 2uwc s LEU 17 N -4.71 2.45 0.46 2.44 2.34 0.47 -4.95 118.68 117.19 2uwc s LEU 17 Ca 0.61 -0.87 -0.20 0.00 0.06 0.00 0.00 54.13 53.72 2uwc s LEU 17 Cb -0.14 -0.62 -0.10 0.00 -0.56 0.00 0.00 46.19 44.78 2uwc s LEU 17 CO 0.41 -0.14 0.98 -0.83 -1.06 0.00 0.00 176.35 175.72 2uwc s GLY 18 N -2.70 2.37 0.29 -3.48 0.00 -1.26 -2.90 107.32 99.64 2uwc s GLY 18 Ca 0.13 0.43 -0.04 0.00 0.00 0.00 0.00 44.72 45.24 2uwc s GLY 18 CO 0.04 0.72 1.57 -2.75 0.00 0.00 0.00 173.10 172.69 2uwc h PHE 19 N 1.62 -0.30 0.00 1.90 3.57 -1.72 -2.60 116.94 119.42 2uwc h PHE 19 Ca -0.49 0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.09 2uwc h PHE 19 Cb 1.19 0.28 0.00 0.00 2.79 0.00 0.00 35.95 40.22 2uwc h PHE 19 CO 0.61 -0.41 0.00 -0.44 -2.23 0.00 0.00 178.31 175.83 2uwc h ASP 20 N 0.01 0.00 1.33 0.41 3.32 -1.87 -0.05 116.42 119.57 2uwc h ASP 20 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2uwc h ASP 20 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 2uwc h ASP 20 CO -0.95 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 178.13 2uwc h GLN 21 N 0.00 0.00 0.00 3.56 4.20 -1.86 -3.38 115.11 117.63 2uwc h GLN 21 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2uwc h GLN 21 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2uwc h GLN 21 CO 0.00 0.00 -0.58 0.41 -0.67 0.00 0.00 178.83 177.99 2uwc n GLY 22 N 0.73 0.11 3.22 3.46 0.00 -0.92 -5.01 105.19 106.77 2uwc n GLY 22 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 2uwc n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uwc s TYR 23 N -1.23 0.60 0.03 1.61 1.51 -0.08 -1.40 117.35 118.39 2uwc s TYR 23 Ca 0.00 -0.99 -0.07 0.00 -1.01 0.00 0.00 57.07 55.01 2uwc s TYR 23 Cb 0.00 -0.28 -0.01 0.00 -0.11 0.00 0.00 41.96 41.57 2uwc s TYR 23 CO 0.00 -0.58 0.12 -0.08 -1.11 0.00 0.00 175.55 173.90 2uwc s THR 24 N -3.99 0.12 0.33 -0.71 -1.32 -0.02 -4.30 115.64 105.75 2uwc s THR 24 Ca 0.18 -0.98 -0.29 0.00 -1.21 0.00 0.00 61.69 59.39 2uwc s THR 24 Cb 0.06 -0.81 -0.12 0.00 -1.51 0.00 0.00 72.50 70.12 2uwc s THR 24 CO -0.01 -0.54 1.48 -3.20 -2.21 0.00 0.00 174.62 170.14 2uwc n ASN 25 N 0.87 3.55 -0.08 8.08 5.15 -1.26 -0.70 115.26 130.87 2uwc n ASN 25 Ca -0.20 1.19 -0.17 0.00 -0.60 0.00 0.00 54.58 54.80 2uwc n ASN 25 Cb 0.58 -1.57 -0.06 0.00 -0.53 0.00 0.00 39.78 38.20 2uwc n ASN 25 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2uwc n LEU 26 N 1.20 1.27 -3.96 1.20 7.94 0.33 -4.75 117.00 120.23 2uwc n LEU 26 Ca 0.05 0.19 -0.10 0.00 -1.11 0.00 0.00 56.01 55.04 2uwc n LEU 26 Cb 0.37 -0.49 -0.07 0.00 0.53 0.00 0.00 43.42 43.76 2uwc n LEU 26 CO 0.64 0.37 -0.03 -1.66 -1.11 0.00 0.00 177.39 175.59 2uwc s TRP 27 N -2.30 0.41 -1.15 1.96 -2.14 -0.83 -4.94 118.94 109.94 2uwc s TRP 27 Ca -0.23 -0.77 -0.05 0.00 2.66 0.00 0.00 56.10 57.71 2uwc s TRP 27 Cb 0.09 -0.07 -0.03 0.00 -3.10 0.00 0.00 33.47 30.36 2uwc s TRP 27 CO 0.30 -0.71 0.90 0.41 -2.66 0.00 0.00 176.95 175.19 2uwc n GLY 28 N -0.21 -0.75 0.26 3.67 0.00 -1.26 -1.44 105.19 105.45 2uwc n GLY 28 Ca -0.07 0.34 0.03 0.00 0.00 0.00 0.00 46.02 46.32 2uwc n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2uwc h PRO 29 N -1.55 0.28 0.00 1.61 0.13 -1.92 -1.47 132.00 129.08 2uwc h PRO 29 Ca -0.61 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2uwc h PRO 29 Cb 1.33 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2uwc h PRO 29 CO 0.48 0.34 0.00 -0.56 -0.23 0.00 0.00 178.00 178.03 2uwc h GLN 30 N 0.28 0.00 -0.73 0.86 -0.00 -1.95 -3.01 115.11 110.56 2uwc h GLN 30 Ca 0.06 0.00 -0.40 0.00 -0.00 0.00 0.00 58.65 58.32 2uwc h GLN 30 Cb 0.24 0.00 -0.23 0.00 -0.00 0.00 0.00 27.48 27.49 2uwc h GLN 30 CO 0.01 0.00 0.33 0.72 -0.00 0.00 0.00 178.83 179.88 2uwc n HIS 31 N -2.83 2.27 -3.82 0.06 8.25 -0.55 -4.93 115.22 113.66 2uwc n HIS 31 Ca -0.01 -1.85 -0.13 0.00 -0.26 0.00 0.00 57.72 55.47 2uwc n HIS 31 Cb 0.17 -0.78 -0.14 0.00 1.12 0.00 0.00 29.99 30.35 2uwc n HIS 31 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2uwc s GLN 32 N -3.33 0.01 0.02 -0.41 0.74 -1.14 -1.66 119.66 113.89 2uwc s GLN 32 Ca 0.52 0.11 0.00 0.00 0.05 0.00 0.00 55.36 56.05 2uwc s GLN 32 Cb 0.45 -0.08 -0.02 0.00 1.10 0.00 0.00 33.01 34.46 2uwc s GLN 32 CO 0.05 -0.07 -0.04 -0.98 -0.55 0.00 0.00 175.29 173.71 2uwc s ARG 33 N 0.44 0.34 -0.13 1.67 1.70 0.04 -4.99 118.95 118.01 2uwc s ARG 33 Ca -0.04 -0.63 0.02 0.00 -0.47 0.00 0.00 55.73 54.61 2uwc s ARG 33 Cb -0.05 0.05 0.01 0.00 -0.57 0.00 0.00 34.95 34.39 2uwc s ARG 33 CO -0.01 -0.04 -0.19 0.08 -1.08 0.00 0.00 175.30 174.06 2uwc s VAL 34 N -1.45 1.85 -0.24 4.99 1.01 -1.26 -0.96 120.40 124.35 2uwc s VAL 34 Ca -0.15 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2uwc s VAL 34 Cb -0.10 -1.66 0.06 0.00 0.00 0.00 0.00 36.38 34.69 2uwc s VAL 34 CO -0.01 0.51 -0.03 -1.81 0.00 0.00 0.00 175.10 173.76 2uwc s ASP 35 N 0.90 3.78 -1.42 3.32 1.01 0.78 -4.77 116.67 120.26 2uwc s ASP 35 Ca -0.06 -1.20 -0.10 0.00 0.71 0.00 0.00 52.55 51.90 2uwc s ASP 35 Cb -0.15 -1.11 0.01 0.00 1.01 0.00 0.00 42.92 42.68 2uwc s ASP 35 CO -0.02 -0.26 0.29 0.00 0.21 0.00 0.00 175.17 175.39 2uwc n GLN 36 N 4.71 -1.17 -0.28 8.23 3.00 -1.26 -0.84 117.38 129.77 2uwc n GLN 36 Ca -0.10 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2uwc n GLN 36 Cb 0.44 -3.49 0.00 0.00 0.00 0.00 0.00 30.24 27.19 2uwc n GLN 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2uwc n GLY 37 N -2.31 1.86 3.76 1.08 0.00 -1.26 -4.96 105.19 103.36 2uwc n GLY 37 Ca -0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 2uwc n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2uwc s SER 38 N -3.38 6.77 -0.16 1.61 0.01 -0.02 -1.77 113.70 116.76 2uwc s SER 38 Ca 0.00 0.91 -0.07 0.00 1.31 0.00 0.00 55.95 58.11 2uwc s SER 38 Cb 0.00 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 2uwc s SER 38 CO 0.00 0.10 0.07 -0.22 0.41 0.00 0.00 173.24 173.61 2uwc s LEU 39 N 0.03 3.93 -0.08 2.44 0.20 0.11 -0.16 118.68 125.14 2uwc s LEU 39 Ca 0.26 0.18 0.04 0.00 0.69 0.00 0.00 54.13 55.30 2uwc s LEU 39 Cb -0.16 -1.97 0.00 0.00 -0.43 0.00 0.00 46.19 43.63 2uwc s LEU 39 CO 0.12 0.26 -0.21 -0.89 -0.29 0.00 0.00 176.35 175.34 2uwc s THR 40 N -0.12 1.78 0.09 3.68 2.01 -0.13 -0.77 115.64 122.18 2uwc s THR 40 Ca 0.08 -0.87 0.04 0.00 0.31 0.00 0.00 61.69 61.24 2uwc s THR 40 Cb -0.12 -1.55 -0.03 0.00 0.01 0.00 0.00 72.50 70.80 2uwc s THR 40 CO 0.01 0.50 -0.10 0.27 -0.69 0.00 0.00 174.62 174.61 2uwc s ILE 41 N 0.36 0.89 0.17 1.82 -4.36 -0.07 -0.78 121.20 119.24 2uwc s ILE 41 Ca -0.16 -1.57 -0.17 0.00 -0.26 0.00 0.00 60.65 58.49 2uwc s ILE 41 Cb -0.17 -1.27 0.03 0.00 1.25 0.00 0.00 42.46 42.31 2uwc s ILE 41 CO 0.07 -0.53 0.49 -1.66 0.24 0.00 0.00 174.94 173.55 2uwc s TRP 42 N -2.30 -0.15 -0.05 1.37 -2.14 -0.67 -0.25 118.94 114.77 2uwc s TRP 42 Ca 0.03 -0.18 0.07 0.00 2.66 0.00 0.00 56.10 58.68 2uwc s TRP 42 Cb -0.04 0.35 -0.01 0.00 -3.10 0.00 0.00 33.47 30.67 2uwc s TRP 42 CO -0.00 -0.85 -0.25 -1.17 -2.66 0.00 0.00 176.95 172.02 2uwc s LEU 43 N -2.85 2.06 0.00 -4.66 2.96 -0.56 -3.79 118.68 111.84 2uwc s LEU 43 Ca 0.07 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.49 2uwc s LEU 43 Cb -0.00 -1.36 0.00 0.00 0.50 0.00 0.00 46.19 45.33 2uwc s LEU 43 CO -0.06 0.27 0.00 -0.90 -1.32 0.00 0.00 176.35 174.34 2uwc n ASP 44 N 2.78 0.00 0.25 3.68 5.68 -0.71 -0.46 116.55 127.77 2uwc n ASP 44 Ca -0.17 -0.89 0.17 0.00 -0.50 0.00 0.00 54.79 53.40 2uwc n ASP 44 Cb 0.52 0.00 0.74 0.00 -1.14 0.00 0.00 41.12 41.24 2uwc n ASP 44 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2uwc h SER 45 N 0.00 0.00 0.50 -1.12 4.64 -1.92 -2.59 113.55 113.06 2uwc h SER 45 Ca 0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 2uwc h SER 45 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2uwc h SER 45 CO 0.00 0.00 -1.44 0.74 -0.87 0.00 0.00 176.83 175.26 2uwc h THR 46 N 0.00 1.27 0.00 2.95 2.02 -1.98 -3.49 112.91 113.69 2uwc h THR 46 Ca 0.00 -2.88 0.00 0.00 0.77 0.00 0.00 66.41 64.30 2uwc h THR 46 Cb 0.35 2.84 0.00 0.00 -1.74 0.00 0.00 68.15 69.60 2uwc h THR 46 CO 0.00 0.84 0.00 -0.24 0.37 0.00 0.00 175.52 176.49 2uwc n SER 47 N -3.50 0.00 -1.03 4.18 2.88 -0.98 -5.16 113.62 110.02 2uwc n SER 47 Ca -0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 2uwc n SER 47 Cb 1.04 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.50 2uwc n SER 47 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2uwc n GLY 48 N -0.06 1.15 3.39 0.46 0.00 -1.26 -1.75 105.19 107.12 2uwc n GLY 48 Ca 0.00 -1.86 -0.13 0.00 0.00 0.00 0.00 46.02 44.02 2uwc n GLY 48 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2uwc s SER 49 N -1.00 -0.43 0.12 1.61 0.15 -1.21 -4.20 113.70 108.74 2uwc s SER 49 Ca 0.00 0.11 -0.25 0.00 0.70 0.00 0.00 55.95 56.51 2uwc s SER 49 Cb 0.00 0.50 0.08 0.00 -1.71 0.00 0.00 66.02 64.89 2uwc s SER 49 CO 0.00 -0.76 0.70 -0.83 1.20 0.00 0.00 173.24 173.55 2uwc s GLY 50 N -2.14 -0.53 0.29 9.45 0.00 -0.52 -2.44 107.32 111.42 2uwc s GLY 50 Ca -0.04 0.57 0.05 0.00 0.00 0.00 0.00 44.72 45.31 2uwc s GLY 50 CO -0.04 0.19 -0.02 -0.11 0.00 0.00 0.00 173.10 173.12 2uwc s PHE 51 N -3.57 1.92 0.01 1.90 -0.12 -0.43 -0.51 117.98 117.17 2uwc s PHE 51 Ca 0.03 -0.79 -0.03 0.00 -0.05 0.00 0.00 56.93 56.09 2uwc s PHE 51 Cb -0.01 -1.15 -0.01 0.00 -0.63 0.00 0.00 43.02 41.21 2uwc s PHE 51 CO -0.10 0.17 0.03 0.21 -0.05 0.00 0.00 175.22 175.48 2uwc s LYS 52 N -3.79 0.34 0.57 1.99 2.20 0.12 -2.58 119.74 118.59 2uwc s LYS 52 Ca 0.31 -0.46 -0.21 0.00 -0.36 0.00 0.00 55.97 55.25 2uwc s LYS 52 Cb 0.06 0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.46 2uwc s LYS 52 CO 0.12 -0.07 1.32 -1.54 -0.36 0.00 0.00 175.35 174.83 2uwc s SER 53 N -1.26 5.17 0.49 1.43 1.04 0.72 -0.84 113.70 120.46 2uwc s SER 53 Ca -0.14 2.69 0.31 0.00 0.48 0.00 0.00 55.95 59.29 2uwc s SER 53 Cb -0.08 -2.63 1.21 0.00 0.10 0.00 0.00 66.02 64.62 2uwc s SER 53 CO -0.00 -1.63 1.91 0.16 0.98 0.00 0.00 173.24 174.66 2uwc h ILE 54 N 1.24 0.00 -3.20 -1.02 3.07 -1.55 -3.45 117.51 112.60 2uwc h ILE 54 Ca -0.51 -0.52 -0.64 0.00 1.55 0.00 0.00 64.86 64.74 2uwc h ILE 54 Cb 1.30 1.48 -0.15 0.00 -0.27 0.00 0.00 36.82 39.18 2uwc h ILE 54 CO 0.56 0.00 -0.74 0.20 -1.05 0.00 0.00 178.15 177.12 2uwc s ASN 55 N -5.52 4.16 0.14 2.16 0.01 -1.26 -5.10 114.94 109.54 2uwc s ASN 55 Ca 0.02 -0.57 -0.00 0.00 -0.71 0.00 0.00 52.86 51.60 2uwc s ASN 55 Cb 0.09 -0.68 -0.04 0.00 0.41 0.00 0.00 41.25 41.03 2uwc s ASN 55 CO 0.54 0.13 0.31 0.00 -1.51 0.00 0.00 177.10 176.56 2uwc s ARG 56 N -2.63 3.49 0.06 -0.60 1.70 -1.26 -4.46 118.95 115.25 2uwc s ARG 56 Ca 0.23 -0.39 0.08 0.00 -0.47 0.00 0.00 55.73 55.18 2uwc s ARG 56 Cb -0.09 -2.93 -0.03 0.00 -0.57 0.00 0.00 34.95 31.33 2uwc s ARG 56 CO 0.14 0.50 -0.21 0.71 -1.08 0.00 0.00 175.30 175.36 2uwc s TYR 57 N -1.70 1.83 -0.88 5.89 2.02 -0.37 -1.33 117.35 122.81 2uwc s TYR 57 Ca 0.37 -0.39 0.22 0.00 -0.37 0.00 0.00 57.07 56.91 2uwc s TYR 57 Cb -0.12 -1.07 0.01 0.00 -0.40 0.00 0.00 41.96 40.39 2uwc s TYR 57 CO 0.28 0.12 1.04 2.89 -1.57 0.00 0.00 175.55 178.31 2uwc n ARG 58 N 1.66 0.09 -3.65 -0.62 1.85 0.21 -2.04 116.66 114.16 2uwc n ARG 58 Ca -0.18 -0.01 -0.02 0.00 -1.00 0.00 0.00 57.85 56.65 2uwc n ARG 58 Cb 0.53 -1.52 -0.05 0.00 -1.05 0.00 0.00 32.46 30.38 2uwc n ARG 58 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2uwc s SER 59 N -3.25 -0.02 0.00 2.89 0.15 -1.23 -4.81 113.70 107.43 2uwc s SER 59 Ca 0.07 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2uwc s SER 59 Cb 0.16 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 2uwc s SER 59 CO 0.81 -0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.85 2uwc n GLY 60 N 0.67 -0.71 3.30 9.45 0.00 0.48 -1.04 105.19 117.34 2uwc n GLY 60 Ca -0.01 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.40 2uwc n GLY 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2uwc s TYR 61 N -2.93 2.80 -0.16 1.61 5.04 -0.95 -1.07 117.35 121.70 2uwc s TYR 61 Ca 0.00 -0.91 -0.02 0.00 -2.44 0.00 0.00 57.07 53.71 2uwc s TYR 61 Cb 0.00 -1.88 0.05 0.00 0.35 0.00 0.00 41.96 40.47 2uwc s TYR 61 CO 0.00 -0.39 -0.01 -0.06 -1.34 0.00 0.00 175.55 173.75 2uwc s PHE 62 N 0.70 1.22 0.17 4.97 0.40 -0.42 -1.72 117.98 123.30 2uwc s PHE 62 Ca -0.07 -0.80 0.00 0.00 -0.60 0.00 0.00 56.93 55.46 2uwc s PHE 62 Cb -0.15 -1.09 -0.04 0.00 0.51 0.00 0.00 43.02 42.24 2uwc s PHE 62 CO 0.02 -0.55 0.05 0.20 0.70 0.00 0.00 175.22 175.63 2uwc s GLY 63 N 1.79 1.22 -0.14 4.36 0.00 -0.19 -1.28 107.32 113.09 2uwc s GLY 63 Ca 0.01 -1.59 -0.29 0.00 0.00 0.00 0.00 44.72 42.84 2uwc s GLY 63 CO -0.07 -1.46 0.78 0.00 0.00 0.00 0.00 173.10 172.35 2uwc s ALA 64 N -3.87 -1.82 0.04 3.20 0.00 -0.75 -0.58 121.76 117.97 2uwc s ALA 64 Ca 0.27 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.51 2uwc s ALA 64 Cb 0.07 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 2uwc s ALA 64 CO 0.05 -0.34 0.96 -0.80 0.00 0.00 0.00 175.76 175.64 2uwc s ASN 65 N -0.71 7.40 -0.01 0.00 0.02 0.26 -1.22 114.94 120.69 2uwc s ASN 65 Ca -0.06 1.69 0.03 0.00 -1.02 0.00 0.00 52.86 53.50 2uwc s ASN 65 Cb -0.02 -2.57 -0.01 0.00 0.02 0.00 0.00 41.25 38.68 2uwc s ASN 65 CO 0.05 -0.19 -0.08 -0.63 0.02 0.00 0.00 177.10 176.27 2uwc s ILE 66 N 0.64 0.66 -0.06 0.60 1.01 0.19 -0.95 121.20 123.30 2uwc s ILE 66 Ca 0.50 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.82 2uwc s ILE 66 Cb -0.22 -0.56 0.01 0.00 0.01 0.00 0.00 42.46 41.70 2uwc s ILE 66 CO 0.28 0.19 -0.14 -0.75 0.00 0.00 0.00 174.94 174.52 2uwc s LYS 67 N -0.16 1.71 0.24 2.79 2.20 -0.31 -1.20 119.74 125.00 2uwc s LYS 67 Ca 0.03 -0.48 0.05 0.00 -0.36 0.00 0.00 55.97 55.21 2uwc s LYS 67 Cb -0.04 -1.43 -0.03 0.00 -1.51 0.00 0.00 37.83 34.82 2uwc s LYS 67 CO -0.00 0.10 0.36 -0.51 -0.36 0.00 0.00 175.35 174.94 2uwc s LEU 68 N 0.44 4.32 0.26 5.43 1.43 -0.64 -2.34 118.68 127.57 2uwc s LEU 68 Ca -0.11 0.08 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 2uwc s LEU 68 Cb -0.14 -2.87 -0.10 0.00 0.03 0.00 0.00 46.19 43.11 2uwc s LEU 68 CO 0.03 -0.07 1.48 -1.58 0.23 0.00 0.00 176.35 176.44 2uwc s GLN 69 N -3.97 4.23 0.39 1.70 2.00 -1.20 -4.28 119.66 118.53 2uwc s GLN 69 Ca 0.34 2.38 -0.12 0.00 -2.00 0.00 0.00 55.36 55.96 2uwc s GLN 69 Cb -0.09 -3.08 -0.07 0.00 0.80 0.00 0.00 33.01 30.57 2uwc s GLN 69 CO 0.29 -0.48 0.77 -1.12 -0.50 0.00 0.00 175.29 174.25 2uwc s SER 70 N 0.38 6.58 0.00 6.67 0.01 -1.26 -4.84 113.70 121.24 2uwc s SER 70 Ca 0.60 1.18 0.00 0.00 1.31 0.00 0.00 55.95 59.04 2uwc s SER 70 Cb -0.43 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.45 2uwc s SER 70 CO 0.45 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 174.35 2uwc n GLY 71 N -1.08 -0.15 3.64 3.44 0.00 -1.26 -4.80 105.19 104.97 2uwc n GLY 71 Ca 0.03 -1.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.20 2uwc n GLY 71 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2uwc s TYR 72 N 0.00 2.71 -0.03 1.61 5.04 -1.26 -4.34 117.35 121.08 2uwc s TYR 72 Ca 0.00 0.90 0.04 0.00 -2.44 0.00 0.00 57.07 55.57 2uwc s TYR 72 Cb 0.00 -3.80 0.06 0.00 0.35 0.00 0.00 41.96 38.57 2uwc s TYR 72 CO 0.00 -1.74 0.96 0.25 -1.34 0.00 0.00 175.55 173.68 2uwc n THR 73 N 6.00 0.45 -1.63 4.34 -2.24 0.71 -4.90 114.28 117.01 2uwc n THR 73 Ca 0.15 -0.53 -0.47 0.00 -2.27 0.00 0.00 64.05 60.92 2uwc n THR 73 Cb 0.46 0.41 -0.04 0.00 -2.10 0.00 0.00 70.33 69.07 2uwc n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2uwc n ALA 74 N -0.33 0.26 -0.69 6.98 0.00 -0.82 -1.85 120.51 124.06 2uwc n ALA 74 Ca 0.03 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2uwc n ALA 74 Cb 0.64 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2uwc n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uwc n GLY 75 N 2.31 0.77 3.40 0.00 0.00 -1.21 -3.05 105.19 107.40 2uwc n GLY 75 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2uwc n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwc s VAL 76 N -2.84 2.78 -0.14 1.61 0.11 -0.77 -0.40 120.40 120.74 2uwc s VAL 76 Ca 0.00 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.23 2uwc s VAL 76 Cb 0.00 -2.09 -0.02 0.00 -1.53 0.00 0.00 36.38 32.75 2uwc s VAL 76 CO 0.00 0.57 -0.10 -0.63 -3.33 0.00 0.00 175.10 171.61 2uwc s ILE 77 N -0.35 3.24 -0.14 7.04 1.01 -0.17 -0.64 121.20 131.19 2uwc s ILE 77 Ca 0.03 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 2uwc s ILE 77 Cb -0.12 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 2uwc s ILE 77 CO 0.02 0.51 -0.07 -0.89 0.00 0.00 0.00 174.94 174.51 2uwc s THR 78 N 0.48 3.61 0.08 2.92 2.01 -0.91 -1.16 115.64 122.67 2uwc s THR 78 Ca -0.08 -0.46 0.02 0.00 0.31 0.00 0.00 61.69 61.48 2uwc s THR 78 Cb -0.15 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 2uwc s THR 78 CO 0.04 0.51 -0.07 -0.94 -0.69 0.00 0.00 174.62 173.47 2uwc s SER 79 N 0.26 1.00 -0.15 3.53 1.04 0.37 0.25 113.70 120.00 2uwc s SER 79 Ca -0.05 -0.84 -0.05 0.00 0.48 0.00 0.00 55.95 55.49 2uwc s SER 79 Cb -0.14 0.08 0.07 0.00 0.10 0.00 0.00 66.02 66.13 2uwc s SER 79 CO 0.04 -0.38 0.30 0.12 0.98 0.00 0.00 173.24 174.30 2uwc s PHE 80 N -2.84 -0.51 0.16 5.02 5.36 -0.35 -2.63 117.98 122.19 2uwc s PHE 80 Ca 0.04 1.05 -0.23 0.00 -0.96 0.00 0.00 56.93 56.83 2uwc s PHE 80 Cb -0.00 0.02 0.07 0.00 -0.34 0.00 0.00 43.02 42.77 2uwc s PHE 80 CO -0.03 -0.41 0.60 1.52 -1.46 0.00 0.00 175.22 175.44 2uwc s TYR 81 N 2.46 -0.53 -0.07 10.12 1.13 -0.30 -1.14 117.35 129.02 2uwc s TYR 81 Ca 0.01 0.31 0.02 0.00 -1.41 0.00 0.00 57.07 56.00 2uwc s TYR 81 Cb -0.12 0.56 -0.02 0.00 -1.10 0.00 0.00 41.96 41.27 2uwc s TYR 81 CO -0.10 -0.86 -0.12 -0.51 -2.51 0.00 0.00 175.55 171.46 2uwc s LEU 82 N -2.76 2.86 0.03 -3.49 1.43 -0.50 0.56 118.68 116.83 2uwc s LEU 82 Ca 0.01 -0.17 -0.24 0.00 -1.03 0.00 0.00 54.13 52.70 2uwc s LEU 82 Cb -0.01 -1.61 0.06 0.00 0.03 0.00 0.00 46.19 44.66 2uwc s LEU 82 CO -0.12 0.31 0.56 -0.55 0.23 0.00 0.00 176.35 176.77 2uwc s SER 83 N -0.49 -0.49 -0.17 2.29 0.15 -0.30 -1.29 113.70 113.40 2uwc s SER 83 Ca 0.07 0.28 0.15 0.00 0.70 0.00 0.00 55.95 57.15 2uwc s SER 83 Cb -0.12 0.51 0.43 0.00 -1.71 0.00 0.00 66.02 65.13 2uwc s SER 83 CO 0.02 -0.71 1.20 -0.46 1.20 0.00 0.00 173.24 174.49 2uwc n ASN 84 N 0.48 1.82 -0.02 5.45 0.23 -0.74 -0.93 115.26 121.56 2uwc n ASN 84 Ca -0.18 -3.34 0.04 0.00 -0.53 0.00 0.00 54.58 50.57 2uwc n ASN 84 Cb 0.60 -0.45 0.42 0.00 -2.08 0.00 0.00 39.78 38.27 2uwc n ASN 84 CO 0.00 0.00 0.00 -1.13 -0.93 0.00 0.00 177.26 175.20 2uwc h ASN 85 N 1.17 0.48 0.80 0.53 -0.73 -1.83 -0.86 115.58 115.13 2uwc h ASN 85 Ca -0.03 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.13 2uwc h ASN 85 Cb 1.29 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 39.76 2uwc h ASN 85 CO 0.10 0.35 0.00 1.56 -0.37 0.00 0.00 177.43 179.07 2uwc h GLN 86 N 0.57 0.00 0.00 6.67 4.20 -1.98 -2.08 115.11 122.50 2uwc h GLN 86 Ca 0.16 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.60 2uwc h GLN 86 Cb -0.03 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 2uwc h GLN 86 CO -0.04 0.00 -1.83 -0.25 -0.67 0.00 0.00 178.83 176.04 2uwc n ASP 87 N -2.96 0.61 -3.18 1.46 8.00 -0.42 -4.64 116.55 115.42 2uwc n ASP 87 Ca 0.00 0.28 -0.22 0.00 0.71 0.00 0.00 54.79 55.56 2uwc n ASP 87 Cb 0.25 0.34 -0.06 0.00 -0.02 0.00 0.00 41.12 41.64 2uwc n ASP 87 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2uwc n TYR 88 N -2.90 -0.32 -1.68 1.24 4.02 -0.64 -5.11 117.16 111.77 2uwc n TYR 88 Ca -0.19 -3.57 -0.44 0.00 -0.01 0.00 0.00 57.90 53.69 2uwc n TYR 88 Cb 1.02 -0.31 -0.03 0.00 -0.02 0.00 0.00 39.34 39.99 2uwc n TYR 88 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 2uwc n PRO 89 N 1.13 2.64 -0.34 -0.72 -0.02 -0.79 -1.16 135.00 135.74 2uwc n PRO 89 Ca 0.22 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.66 2uwc n PRO 89 Cb 0.57 -2.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 2uwc n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2uwc n GLY 90 N 4.29 1.44 2.68 -1.23 0.00 -1.26 -4.85 105.19 106.26 2uwc n GLY 90 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 2uwc n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2uwc n LYS 91 N -2.00 1.75 -4.08 1.61 5.02 -0.31 -4.47 118.16 115.67 2uwc n LYS 91 Ca 0.00 -3.46 -0.26 0.00 -2.02 0.00 0.00 58.31 52.57 2uwc n LYS 91 Cb 0.00 -1.55 -0.05 0.00 -0.02 0.00 0.00 35.03 33.41 2uwc n LYS 91 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2uwc s HIS 92 N -3.54 2.23 0.14 2.13 -3.43 -1.19 -4.09 115.29 107.54 2uwc s HIS 92 Ca 0.29 -0.70 0.07 0.00 -0.80 0.00 0.00 55.06 53.92 2uwc s HIS 92 Cb 0.33 -1.92 -0.04 0.00 -1.43 0.00 0.00 32.58 29.52 2uwc s HIS 92 CO -0.04 -0.04 -0.03 -0.51 -2.00 0.00 0.00 174.74 172.12 2uwc s ASP 93 N -4.04 4.72 -0.23 7.38 1.01 -1.26 0.96 116.67 125.20 2uwc s ASP 93 Ca 0.35 -0.36 -0.26 0.00 0.71 0.00 0.00 52.55 52.99 2uwc s ASP 93 Cb 0.01 -1.00 0.09 0.00 1.01 0.00 0.00 42.92 43.03 2uwc s ASP 93 CO 0.20 0.12 0.80 -0.70 0.21 0.00 0.00 175.17 175.81 2uwc s GLU 94 N -2.67 0.79 -0.14 8.23 2.12 -0.71 -1.79 118.70 124.54 2uwc s GLU 94 Ca 0.26 0.74 -0.02 0.00 0.36 0.00 0.00 54.97 56.31 2uwc s GLU 94 Cb -0.10 0.38 0.04 0.00 0.26 0.00 0.00 34.13 34.71 2uwc s GLU 94 CO 0.17 -0.13 -0.00 0.42 -0.54 0.00 0.00 175.26 175.18 2uwc s ILE 95 N 0.00 0.61 -0.05 -3.70 1.01 -0.41 0.10 121.20 118.76 2uwc s ILE 95 Ca -0.01 -0.29 0.06 0.00 0.00 0.00 0.00 60.65 60.40 2uwc s ILE 95 Cb -0.04 -0.89 -0.02 0.00 0.01 0.00 0.00 42.46 41.52 2uwc s ILE 95 CO 0.01 0.07 -0.22 -1.81 0.00 0.00 0.00 174.94 172.99 2uwc s ASP 96 N 1.85 3.37 -0.27 3.58 1.01 -0.13 -1.41 116.67 124.66 2uwc s ASP 96 Ca 0.02 -0.41 -0.09 0.00 0.71 0.00 0.00 52.55 52.79 2uwc s ASP 96 Cb -0.15 -0.73 -0.03 0.00 1.01 0.00 0.00 42.92 43.02 2uwc s ASP 96 CO -0.07 0.29 0.12 -0.63 0.21 0.00 0.00 175.17 175.09 2uwc s ILE 97 N -0.42 4.64 -0.07 0.77 1.01 -0.29 -2.18 121.20 124.66 2uwc s ILE 97 Ca 0.04 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2uwc s ILE 97 Cb -0.12 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 2uwc s ILE 97 CO 0.01 0.27 -0.24 -1.61 0.00 0.00 0.00 174.94 173.37 2uwc s GLU 98 N 1.66 2.68 -0.33 2.79 2.02 0.28 -1.21 118.70 126.59 2uwc s GLU 98 Ca 0.06 -0.86 -0.14 0.00 0.02 0.00 0.00 54.97 54.05 2uwc s GLU 98 Cb -0.16 -2.16 -0.02 0.00 0.10 0.00 0.00 34.13 31.89 2uwc s GLU 98 CO 0.06 0.28 0.30 -0.06 0.02 0.00 0.00 175.26 175.86 2uwc s PHE 99 N 0.08 3.22 -0.38 1.61 0.40 0.14 -0.80 117.98 122.25 2uwc s PHE 99 Ca -0.10 -0.03 -0.20 0.00 -0.60 0.00 0.00 56.93 56.00 2uwc s PHE 99 Cb -0.15 -2.56 0.01 0.00 0.51 0.00 0.00 43.02 40.82 2uwc s PHE 99 CO 0.06 -0.36 0.59 -0.51 0.70 0.00 0.00 175.22 175.69 2uwc s LEU 100 N 1.89 4.39 0.79 -0.37 1.43 -0.39 -2.15 118.68 124.28 2uwc s LEU 100 Ca 0.10 -0.10 -0.13 0.00 -1.03 0.00 0.00 54.13 52.97 2uwc s LEU 100 Cb -0.17 -2.68 0.07 0.00 0.03 0.00 0.00 46.19 43.45 2uwc s LEU 100 CO 0.11 -0.61 1.16 -0.83 0.23 0.00 0.00 176.35 176.41 2uwc s GLY 101 N 1.84 1.99 0.17 -3.19 0.00 0.19 -3.56 107.32 104.76 2uwc s GLY 101 Ca 0.21 0.64 0.02 0.00 0.00 0.00 0.00 44.72 45.59 2uwc s GLY 101 CO 0.15 1.03 0.18 -0.37 0.00 0.00 0.00 173.10 174.10 2uwc n THR 102 N -3.32 0.00 -3.95 0.90 5.66 -1.20 -3.92 114.28 108.46 2uwc n THR 102 Ca 0.12 -1.11 -0.32 0.00 -3.05 0.00 0.00 64.05 59.69 2uwc n THR 102 Cb 0.51 0.59 -0.05 0.00 -1.55 0.00 0.00 70.33 69.84 2uwc n THR 102 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2uwc s ILE 103 N -2.66 5.24 0.23 1.09 1.01 -1.26 -0.21 121.20 124.64 2uwc s ILE 103 Ca 0.18 -0.32 -0.30 0.00 0.00 0.00 0.00 60.65 60.21 2uwc s ILE 103 Cb 0.00 -3.48 -0.10 0.00 0.01 0.00 0.00 42.46 38.89 2uwc s ILE 103 CO 0.13 0.26 1.49 -2.84 0.00 0.00 0.00 174.94 173.98 2uwc s PRO 104 N -2.12 4.24 0.00 2.79 0.02 -1.26 -1.60 135.00 137.07 2uwc s PRO 104 Ca 0.29 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.66 2uwc s PRO 104 Cb -0.13 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.28 2uwc s PRO 104 CO 0.21 -0.50 0.00 0.41 -0.33 0.00 0.00 177.00 176.79 2uwc n GLY 105 N 2.65 0.55 3.32 0.52 0.00 -1.26 -5.08 105.19 105.89 2uwc n GLY 105 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 2uwc n GLY 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwc s LYS 106 N -0.80 1.24 0.46 1.61 -0.14 -0.63 -5.13 119.74 116.34 2uwc s LYS 106 Ca 0.00 -1.34 -0.22 0.00 -1.36 0.00 0.00 55.97 53.05 2uwc s LYS 106 Cb 0.00 -1.36 -0.08 0.00 -1.68 0.00 0.00 37.83 34.70 2uwc s LYS 106 CO 0.00 0.29 1.07 -2.14 -0.76 0.00 0.00 175.35 173.81 2uwc s PRO 107 N -2.54 3.89 0.55 -1.68 0.02 -1.26 -4.69 135.00 129.29 2uwc s PRO 107 Ca 0.13 1.50 -0.22 0.00 0.02 0.00 0.00 61.00 62.43 2uwc s PRO 107 Cb -0.07 -2.29 -0.05 0.00 0.02 0.00 0.00 34.50 32.11 2uwc s PRO 107 CO 0.06 -0.38 1.37 0.71 -0.33 0.00 0.00 177.00 178.43 2uwc s TYR 108 N -1.78 2.25 -0.12 6.54 2.02 -1.26 -4.82 117.35 120.18 2uwc s TYR 108 Ca 0.64 1.36 -0.03 0.00 -0.37 0.00 0.00 57.07 58.67 2uwc s TYR 108 Cb -0.21 -3.83 -0.03 0.00 -0.40 0.00 0.00 41.96 37.50 2uwc s TYR 108 CO 0.25 -2.98 -0.01 0.99 -1.57 0.00 0.00 175.55 172.23 2uwc s THR 109 N -1.29 4.17 -0.21 -0.71 2.01 -1.23 -4.12 115.64 114.26 2uwc s THR 109 Ca 0.72 -0.28 -0.08 0.00 0.31 0.00 0.00 61.69 62.36 2uwc s THR 109 Cb -0.41 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2uwc s THR 109 CO 0.48 0.55 0.08 -0.22 -0.69 0.00 0.00 174.62 174.83 2uwc s LEU 110 N -0.35 3.77 -0.12 4.42 0.20 0.03 -1.26 118.68 125.37 2uwc s LEU 110 Ca 0.07 0.01 -0.01 0.00 0.69 0.00 0.00 54.13 54.88 2uwc s LEU 110 Cb -0.12 -1.98 -0.03 0.00 -0.43 0.00 0.00 46.19 43.63 2uwc s LEU 110 CO 0.02 0.10 -0.07 -1.58 -0.29 0.00 0.00 176.35 174.54 2uwc s GLN 111 N 0.80 3.30 0.01 1.98 0.74 0.02 -0.16 119.66 126.36 2uwc s GLN 111 Ca 0.04 -0.56 0.03 0.00 0.05 0.00 0.00 55.36 54.91 2uwc s GLN 111 Cb -0.13 -2.74 -0.04 0.00 1.10 0.00 0.00 33.01 31.20 2uwc s GLN 111 CO 0.02 0.38 -0.03 0.95 -0.55 0.00 0.00 175.29 176.06 2uwc s THR 112 N -0.04 3.91 0.08 -0.34 -4.23 -0.43 -0.56 115.64 114.04 2uwc s THR 112 Ca -0.00 -0.72 -0.18 0.00 -1.18 0.00 0.00 61.69 59.61 2uwc s THR 112 Cb -0.13 -2.74 0.04 0.00 1.34 0.00 0.00 72.50 71.01 2uwc s THR 112 CO 0.03 0.36 0.44 0.21 -0.54 0.00 0.00 174.62 175.12 2uwc s ASN 113 N -1.56 -0.31 -0.03 3.99 3.84 -0.93 -1.76 114.94 118.18 2uwc s ASN 113 Ca 0.19 -0.09 0.01 0.00 0.21 0.00 0.00 52.86 53.18 2uwc s ASN 113 Cb -0.11 0.46 0.02 0.00 -0.55 0.00 0.00 41.25 41.07 2uwc s ASN 113 CO 0.10 -0.76 -0.01 -0.69 -2.79 0.00 0.00 177.10 172.94 2uwc s VAL 114 N -3.04 0.27 0.02 -5.21 1.01 -1.25 -0.96 120.40 111.24 2uwc s VAL 114 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.04 2uwc s VAL 114 Cb 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 2uwc s VAL 114 CO -0.06 0.15 -0.23 -0.36 0.00 0.00 0.00 175.10 174.60 2uwc s PHE 115 N 0.83 2.44 -0.08 5.22 0.40 0.11 -3.97 117.98 122.92 2uwc s PHE 115 Ca -0.09 -0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 55.89 2uwc s PHE 115 Cb -0.12 -1.46 0.03 0.00 0.51 0.00 0.00 43.02 41.97 2uwc s PHE 115 CO -0.01 0.13 -0.03 0.42 0.70 0.00 0.00 175.22 176.43 2uwc s ILE 116 N -0.79 0.65 -1.50 0.64 1.09 -1.26 -1.74 121.20 118.29 2uwc s ILE 116 Ca 0.12 -0.06 -0.05 0.00 -1.10 0.00 0.00 60.65 59.55 2uwc s ILE 116 Cb -0.10 -0.74 0.05 0.00 -1.06 0.00 0.00 42.46 40.61 2uwc s ILE 116 CO 0.02 0.30 0.49 -0.62 -0.10 0.00 0.00 174.94 175.03 2uwc n GLU 117 N 4.94 -3.10 0.00 2.79 1.02 -0.74 -4.78 120.64 120.77 2uwc n GLU 117 Ca -0.11 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 2uwc n GLU 117 Cb 0.50 -4.62 0.00 0.00 -0.02 0.00 0.00 31.44 27.30 2uwc n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2uwc n GLY 118 N -1.87 2.47 3.74 0.62 0.00 0.27 -4.45 105.19 105.97 2uwc n GLY 118 Ca -0.20 -1.54 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 2uwc n GLY 118 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2uwc s SER 119 N 0.00 3.91 0.66 1.61 1.04 -1.26 -4.89 113.70 114.77 2uwc s SER 119 Ca 0.00 1.70 -0.14 0.00 0.48 0.00 0.00 55.95 57.99 2uwc s SER 119 Cb 0.00 -2.37 -0.00 0.00 0.10 0.00 0.00 66.02 63.74 2uwc s SER 119 CO 0.00 -2.39 1.08 -0.83 0.98 0.00 0.00 173.24 172.08 2uwc s GLY 120 N -3.34 2.01 -0.20 7.32 0.00 -1.22 -4.97 107.32 106.90 2uwc s GLY 120 Ca 0.63 0.39 0.00 0.00 0.00 0.00 0.00 44.72 45.74 2uwc s GLY 120 CO 0.57 0.73 0.01 1.22 0.00 0.00 0.00 173.10 175.62 2uwc n ASP 121 N -2.56 1.91 -0.00 1.64 8.00 -1.26 -4.59 116.55 119.68 2uwc n ASP 121 Ca 0.09 -0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.70 2uwc n ASP 121 Cb 0.53 -0.49 -0.15 0.00 -0.02 0.00 0.00 41.12 40.99 2uwc n ASP 121 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2uwc n TYR 122 N -3.31 0.04 -4.09 1.24 4.02 -1.26 -5.00 117.16 108.81 2uwc n TYR 122 Ca -0.40 0.01 -0.10 0.00 -0.01 0.00 0.00 57.90 57.40 2uwc n TYR 122 Cb 1.02 -0.44 -0.11 0.00 -0.02 0.00 0.00 39.34 39.80 2uwc n TYR 122 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 2uwc s ASN 123 N -4.30 0.80 -0.34 7.72 0.01 -1.26 -5.11 114.94 112.46 2uwc s ASN 123 Ca -0.05 -0.79 -0.21 0.00 -0.71 0.00 0.00 52.86 51.10 2uwc s ASN 123 Cb 0.14 0.10 -0.00 0.00 0.41 0.00 0.00 41.25 41.90 2uwc s ASN 123 CO 0.90 -0.39 0.65 -0.63 -1.51 0.00 0.00 177.10 176.11 2uwc s ILE 124 N -2.70 4.89 -0.94 0.60 1.01 -1.26 -3.45 121.20 119.35 2uwc s ILE 124 Ca 0.00 0.70 -0.03 0.00 0.00 0.00 0.00 60.65 61.33 2uwc s ILE 124 Cb -0.01 -4.06 0.24 0.00 0.01 0.00 0.00 42.46 38.64 2uwc s ILE 124 CO -0.04 -0.27 0.90 -0.38 0.00 0.00 0.00 174.94 175.16 2uwc n ILE 125 N 5.54 3.46 -3.74 2.92 5.41 -1.26 -4.95 119.36 126.73 2uwc n ILE 125 Ca -0.01 -5.24 -0.29 0.00 1.00 0.00 0.00 62.75 58.21 2uwc n ILE 125 Cb 0.49 -2.37 -0.04 0.00 -0.71 0.00 0.00 39.64 37.01 2uwc n ILE 125 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2uwc s GLY 126 N -0.19 1.95 -0.45 7.39 0.00 -1.26 -4.72 107.32 110.03 2uwc s GLY 126 Ca 0.29 -0.78 0.07 0.00 0.00 0.00 0.00 44.72 44.30 2uwc s GLY 126 CO -0.09 -0.74 1.04 0.54 0.00 0.00 0.00 173.10 173.85 2uwc n ARG 127 N -0.33 3.01 -2.93 2.90 1.74 -1.25 -4.97 116.66 114.82 2uwc n ARG 127 Ca -0.04 -4.39 -0.39 0.00 -0.77 0.00 0.00 57.85 52.25 2uwc n ARG 127 Cb 0.53 -2.10 -0.06 0.00 -1.02 0.00 0.00 32.46 29.80 2uwc n ARG 127 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2uwc s GLU 128 N -3.43 4.62 -0.04 5.56 8.01 -1.26 -3.84 118.70 128.33 2uwc s GLU 128 Ca 0.45 1.22 -0.01 0.00 0.01 0.00 0.00 54.97 56.64 2uwc s GLU 128 Cb 0.38 -3.25 0.03 0.00 -4.31 0.00 0.00 34.13 26.98 2uwc s GLU 128 CO -0.15 0.55 0.04 -1.17 0.01 0.00 0.00 175.26 174.55 2uwc s LEU 129 N -1.19 0.45 0.04 1.80 0.20 -0.73 -1.10 118.68 118.15 2uwc s LEU 129 Ca 0.37 0.05 0.06 0.00 0.69 0.00 0.00 54.13 55.30 2uwc s LEU 129 Cb -0.23 -0.16 -0.03 0.00 -0.43 0.00 0.00 46.19 45.33 2uwc s LEU 129 CO 0.27 -0.21 -0.13 -0.13 -0.29 0.00 0.00 176.35 175.86 2uwc s ARG 130 N 1.85 2.22 0.09 1.98 0.52 0.00 -1.31 118.95 124.30 2uwc s ARG 130 Ca 0.01 -0.91 0.05 0.00 -0.52 0.00 0.00 55.73 54.36 2uwc s ARG 130 Cb -0.12 -2.30 -0.03 0.00 0.52 0.00 0.00 34.95 33.01 2uwc s ARG 130 CO -0.03 0.55 -0.14 0.96 0.02 0.00 0.00 175.30 176.66 2uwc s ILE 131 N -0.99 1.19 0.57 1.52 -4.36 0.77 -0.52 121.20 119.38 2uwc s ILE 131 Ca 0.16 -1.50 -0.10 0.00 -0.26 0.00 0.00 60.65 58.96 2uwc s ILE 131 Cb -0.11 -1.28 -0.04 0.00 1.25 0.00 0.00 42.46 42.28 2uwc s ILE 131 CO 0.07 -0.33 0.95 -1.00 0.24 0.00 0.00 174.94 174.88 2uwc s HIS 132 N -1.71 3.60 0.12 1.37 3.76 0.74 -0.79 115.29 122.37 2uwc s HIS 132 Ca 0.03 1.16 0.03 0.00 -0.15 0.00 0.00 55.06 56.13 2uwc s HIS 132 Cb -0.07 -2.60 -0.04 0.00 1.11 0.00 0.00 32.58 30.98 2uwc s HIS 132 CO 0.02 -0.54 0.15 -0.51 -0.85 0.00 0.00 174.74 173.02 2uwc s LEU 133 N -4.95 3.96 -0.03 0.89 1.43 -1.26 -4.80 118.68 113.92 2uwc s LEU 133 Ca 0.53 0.00 0.13 0.00 -1.03 0.00 0.00 54.13 53.76 2uwc s LEU 133 Cb -0.11 -2.58 0.42 0.00 0.03 0.00 0.00 46.19 43.95 2uwc s LEU 133 CO 0.49 0.11 1.32 -2.67 0.23 0.00 0.00 176.35 175.83 2uwc n TRP 134 N -0.06 0.74 -3.93 0.29 2.14 -1.26 -4.87 117.44 110.48 2uwc n TRP 134 Ca -0.08 -0.33 -0.09 0.00 2.07 0.00 0.00 57.50 59.07 2uwc n TRP 134 Cb 0.53 -0.07 -0.07 0.00 -0.81 0.00 0.00 31.31 30.89 2uwc n TRP 134 CO 0.00 0.00 0.00 -0.59 2.07 0.00 0.00 177.69 179.17 2uwc s PHE 135 N -1.53 0.34 -0.54 -2.67 -0.12 -1.26 -5.05 117.98 107.15 2uwc s PHE 135 Ca 0.31 -0.71 -0.26 0.00 -0.05 0.00 0.00 56.93 56.22 2uwc s PHE 135 Cb 0.18 -0.05 0.04 0.00 -0.63 0.00 0.00 43.02 42.55 2uwc s PHE 135 CO 0.19 -0.69 1.01 0.34 -0.05 0.00 0.00 175.22 176.01 2uwc s ASP 136 N -2.95 6.41 0.00 1.98 -1.08 -1.26 -4.92 116.67 114.85 2uwc s ASP 136 Ca 0.15 -0.12 0.19 0.00 -0.52 0.00 0.00 52.55 52.25 2uwc s ASP 136 Cb 0.03 -2.47 0.90 0.00 -1.46 0.00 0.00 42.92 39.92 2uwc s ASP 136 CO -0.02 -1.26 1.58 -0.81 0.52 0.00 0.00 175.17 175.18 2uwc n PRO 137 N 7.66 0.19 0.02 4.34 -0.04 -1.26 -2.45 135.00 143.46 2uwc n PRO 137 Ca 0.05 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.76 2uwc n PRO 137 Cb 0.48 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.76 2uwc n PRO 137 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2uwc n THR 138 N -1.35 0.12 -0.03 0.52 -2.24 -1.26 -1.62 114.28 108.41 2uwc n THR 138 Ca 0.08 -0.08 -0.01 0.00 -2.27 0.00 0.00 64.05 61.76 2uwc n THR 138 Cb 0.17 -0.06 -0.14 0.00 -2.10 0.00 0.00 70.33 68.20 2uwc n THR 138 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2uwc n GLN 139 N -1.70 0.66 -4.02 -0.78 1.13 -1.02 -4.62 117.38 107.03 2uwc n GLN 139 Ca 0.05 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.00 2uwc n GLN 139 Cb 0.37 -1.60 -0.04 0.00 0.11 0.00 0.00 30.24 29.07 2uwc n GLN 139 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2uwc s ASP 140 N -5.29 0.34 0.16 1.08 -1.08 -1.26 -5.12 116.67 105.50 2uwc s ASP 140 Ca -0.07 -1.20 -0.30 0.00 -0.52 0.00 0.00 52.55 50.46 2uwc s ASP 140 Cb 0.09 0.64 -0.08 0.00 -1.46 0.00 0.00 42.92 42.11 2uwc s ASP 140 CO 0.85 -1.26 1.29 -0.31 0.52 0.00 0.00 175.17 176.26 2uwc s TYR 141 N -3.44 3.31 0.13 -5.34 1.51 -1.26 -4.46 117.35 107.79 2uwc s TYR 141 Ca 0.25 1.21 0.06 0.00 -1.01 0.00 0.00 57.07 57.59 2uwc s TYR 141 Cb -0.01 -3.57 -0.04 0.00 -0.11 0.00 0.00 41.96 38.24 2uwc s TYR 141 CO 0.14 -1.80 -0.15 -1.01 -1.11 0.00 0.00 175.55 171.62 2uwc s HIS 142 N 0.41 1.48 -0.02 2.71 3.76 -0.34 -4.85 115.29 118.44 2uwc s HIS 142 Ca 0.58 -0.54 -0.25 0.00 -0.15 0.00 0.00 55.06 54.70 2uwc s HIS 142 Cb -0.35 -0.77 -0.04 0.00 1.11 0.00 0.00 32.58 32.53 2uwc s HIS 142 CO 0.35 0.18 0.78 1.21 -0.85 0.00 0.00 174.74 176.41 2uwc s ASN 143 N -2.48 7.13 -0.02 1.40 3.84 -1.26 -0.64 114.94 122.91 2uwc s ASN 143 Ca 0.10 1.36 0.04 0.00 0.21 0.00 0.00 52.86 54.57 2uwc s ASN 143 Cb -0.05 -2.46 -0.01 0.00 -0.55 0.00 0.00 41.25 38.18 2uwc s ASN 143 CO 0.04 -0.12 -0.14 -0.31 -2.79 0.00 0.00 177.10 173.78 2uwc s TYR 144 N 0.63 1.36 -0.01 0.43 2.02 -0.36 -0.31 117.35 121.13 2uwc s TYR 144 Ca 0.41 -0.32 -0.08 0.00 -0.37 0.00 0.00 57.07 56.71 2uwc s TYR 144 Cb -0.19 -0.91 0.01 0.00 -0.40 0.00 0.00 41.96 40.47 2uwc s TYR 144 CO 0.22 -0.08 0.16 0.00 -1.57 0.00 0.00 175.55 174.28 2uwc s ALA 145 N -0.11 -0.40 -0.10 3.71 0.00 -0.47 -1.82 121.76 122.56 2uwc s ALA 145 Ca 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 51.96 51.97 2uwc s ALA 145 Cb -0.08 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 2uwc s ALA 145 CO 0.00 -0.21 -0.17 0.42 0.00 0.00 0.00 175.76 175.81 2uwc s ILE 146 N -1.25 2.72 -0.17 0.00 1.01 -0.41 -1.50 121.20 121.60 2uwc s ILE 146 Ca -0.13 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.73 2uwc s ILE 146 Cb -0.07 -2.10 0.01 0.00 0.01 0.00 0.00 42.46 40.31 2uwc s ILE 146 CO 0.02 0.55 -0.17 -0.47 0.00 0.00 0.00 174.94 174.87 2uwc s TYR 147 N 0.15 2.78 -0.06 3.97 5.04 -0.17 -1.30 117.35 127.77 2uwc s TYR 147 Ca -0.09 -1.24 -0.02 0.00 -2.44 0.00 0.00 57.07 53.29 2uwc s TYR 147 Cb -0.15 -1.91 0.03 0.00 0.35 0.00 0.00 41.96 40.28 2uwc s TYR 147 CO 0.06 -0.59 0.03 -0.46 -1.34 0.00 0.00 175.55 173.24 2uwc s TRP 148 N 1.00 0.38 0.35 4.97 -0.00 -0.23 -0.61 118.94 124.80 2uwc s TRP 148 Ca -0.02 0.03 0.03 0.00 -0.00 0.00 0.00 56.10 56.15 2uwc s TRP 148 Cb -0.15 -0.64 -0.04 0.00 -0.00 0.00 0.00 33.47 32.64 2uwc s TRP 148 CO -0.04 -0.26 0.12 0.95 -0.00 0.00 0.00 176.95 177.73 2uwc s THR 149 N 2.03 0.62 -1.19 5.86 -4.23 -0.71 -0.39 115.64 117.64 2uwc s THR 149 Ca 0.04 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.68 2uwc s THR 149 Cb -0.12 -2.50 0.15 0.00 1.34 0.00 0.00 72.50 71.37 2uwc s THR 149 CO -0.04 0.00 1.36 -2.65 -0.54 0.00 0.00 174.62 172.75 2uwc n PRO 150 N -0.74 0.08 -0.01 3.99 -0.02 -1.26 -3.00 135.00 134.04 2uwc n PRO 150 Ca -0.03 0.24 0.08 0.00 -2.02 0.00 0.00 63.50 61.77 2uwc n PRO 150 Cb 0.65 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.50 2uwc n PRO 150 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2uwc n SER 151 N -1.41 1.18 -3.49 2.55 3.41 -1.26 -4.84 113.62 109.76 2uwc n SER 151 Ca 0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.56 2uwc n SER 151 Cb 0.13 1.74 -0.02 0.00 -0.26 0.00 0.00 64.21 65.79 2uwc n SER 151 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2uwc s GLU 152 N -3.14 0.90 -0.07 4.33 -1.05 -1.16 -0.93 118.70 117.57 2uwc s GLU 152 Ca -0.06 -0.27 0.04 0.00 -0.15 0.00 0.00 54.97 54.53 2uwc s GLU 152 Cb 0.11 0.42 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 2uwc s GLU 152 CO 0.69 -0.38 -0.20 0.42 0.95 0.00 0.00 175.26 176.74 2uwc s ILE 153 N -2.99 1.75 -0.04 1.83 1.01 0.26 -1.74 121.20 121.28 2uwc s ILE 153 Ca 0.03 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.86 2uwc s ILE 153 Cb -0.01 -1.51 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 2uwc s ILE 153 CO -0.08 0.49 -0.14 -0.63 0.00 0.00 0.00 174.94 174.58 2uwc s ILE 154 N 0.25 1.16 -0.14 2.92 1.01 0.22 0.80 121.20 127.42 2uwc s ILE 154 Ca -0.12 -0.57 -0.02 0.00 0.00 0.00 0.00 60.65 59.93 2uwc s ILE 154 Cb -0.15 -1.01 -0.02 0.00 0.01 0.00 0.00 42.46 41.28 2uwc s ILE 154 CO 0.06 0.34 -0.07 -0.36 0.00 0.00 0.00 174.94 174.90 2uwc s PHE 155 N 0.09 2.94 -0.02 3.97 0.40 -0.27 -1.00 117.98 124.09 2uwc s PHE 155 Ca -0.03 -0.43 0.07 0.00 -0.60 0.00 0.00 56.93 55.95 2uwc s PHE 155 Cb -0.10 -1.91 -0.02 0.00 0.51 0.00 0.00 43.02 41.50 2uwc s PHE 155 CO 0.01 -0.10 -0.24 -0.06 0.70 0.00 0.00 175.22 175.54 2uwc s PHE 156 N 0.33 2.38 -0.14 0.36 0.40 -0.57 -0.75 117.98 120.00 2uwc s PHE 156 Ca -0.07 -0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 55.87 2uwc s PHE 156 Cb -0.15 -1.52 0.03 0.00 0.51 0.00 0.00 43.02 41.89 2uwc s PHE 156 CO 0.04 -0.01 -0.10 0.08 0.70 0.00 0.00 175.22 175.93 2uwc s VAL 157 N -0.63 1.32 -1.49 -0.44 1.01 0.23 -1.37 120.40 119.03 2uwc s VAL 157 Ca 0.10 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.41 2uwc s VAL 157 Cb -0.10 -1.31 0.11 0.00 0.00 0.00 0.00 36.38 35.08 2uwc s VAL 157 CO -0.01 0.36 0.69 0.47 0.00 0.00 0.00 175.10 176.61 2uwc n ASP 158 N 4.84 -3.71 0.00 3.32 8.00 0.58 -1.22 116.55 128.35 2uwc n ASP 158 Ca -0.14 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.65 2uwc n ASP 158 Cb 0.49 -3.04 0.00 0.00 -0.02 0.00 0.00 41.12 38.55 2uwc n ASP 158 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2uwc n ASP 159 N -2.52 -0.85 -4.64 -2.24 8.00 -1.26 -5.00 116.55 108.04 2uwc n ASP 159 Ca 0.04 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.14 2uwc n ASP 159 Cb 0.51 -0.45 -0.07 0.00 -0.02 0.00 0.00 41.12 41.10 2uwc n ASP 159 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2uwc s VAL 160 N -3.19 5.05 0.19 2.53 1.01 -0.36 -4.80 120.40 120.83 2uwc s VAL 160 Ca 0.00 1.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.70 2uwc s VAL 160 Cb 0.00 -3.88 -0.08 0.00 0.00 0.00 0.00 36.38 32.42 2uwc s VAL 160 CO 0.00 0.10 1.26 -2.16 0.00 0.00 0.00 175.10 174.30 2uwc s PRO 161 N 2.09 4.43 -0.01 2.72 0.04 -1.26 -0.60 135.00 142.42 2uwc s PRO 161 Ca 0.25 1.97 0.08 0.00 0.04 0.00 0.00 61.00 63.35 2uwc s PRO 161 Cb -0.16 -3.21 -0.12 0.00 0.04 0.00 0.00 34.50 31.05 2uwc s PRO 161 CO 0.09 -0.18 0.22 0.44 0.04 0.00 0.00 177.00 177.61 2uwc n ILE 162 N 2.57 0.00 -3.62 0.56 -5.35 0.07 -3.44 119.36 110.15 2uwc n ILE 162 Ca 0.05 -0.22 -0.13 0.00 -0.27 0.00 0.00 62.75 62.18 2uwc n ILE 162 Cb 0.44 0.48 -0.07 0.00 -1.74 0.00 0.00 39.64 38.74 2uwc n ILE 162 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 2uwc s ARG 163 N -2.39 0.76 -0.13 6.28 3.52 -1.23 -4.79 118.95 120.98 2uwc s ARG 163 Ca -0.02 0.81 0.02 0.00 -0.13 0.00 0.00 55.73 56.41 2uwc s ARG 163 Cb 0.06 0.37 0.01 0.00 -1.56 0.00 0.00 34.95 33.83 2uwc s ARG 163 CO 0.35 -0.11 -0.17 0.50 -0.81 0.00 0.00 175.30 175.05 2uwc s ARG 164 N 0.18 2.53 -0.40 5.12 3.52 -1.26 -1.11 118.95 127.52 2uwc s ARG 164 Ca -0.00 -0.67 -0.03 0.00 -0.13 0.00 0.00 55.73 54.90 2uwc s ARG 164 Cb -0.04 -2.13 0.10 0.00 -1.56 0.00 0.00 34.95 31.32 2uwc s ARG 164 CO -0.00 -0.08 0.20 -0.47 -0.81 0.00 0.00 175.30 174.14 2uwc s TYR 165 N 1.02 3.55 0.52 5.12 5.04 0.24 -4.97 117.35 127.87 2uwc s TYR 165 Ca -0.04 -2.32 -0.10 0.00 -2.44 0.00 0.00 57.07 52.17 2uwc s TYR 165 Cb -0.15 -3.14 -0.05 0.00 0.35 0.00 0.00 41.96 38.97 2uwc s TYR 165 CO -0.04 -0.96 0.89 -1.25 -1.34 0.00 0.00 175.55 172.86 2uwc s PRO 166 N 1.17 3.66 -0.49 4.97 0.04 -1.26 -0.57 135.00 142.52 2uwc s PRO 166 Ca 0.07 0.54 -0.29 0.00 0.04 0.00 0.00 61.00 61.36 2uwc s PRO 166 Cb -0.23 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.09 2uwc s PRO 166 CO -0.04 -0.31 1.20 0.50 0.04 0.00 0.00 177.00 178.40 2uwc s ARG 167 N -4.63 3.66 -0.02 4.56 3.52 -0.11 -4.86 118.95 121.06 2uwc s ARG 167 Ca 0.52 0.57 0.19 0.00 -0.13 0.00 0.00 55.73 56.88 2uwc s ARG 167 Cb -0.10 -3.95 -0.28 0.00 -1.56 0.00 0.00 34.95 29.05 2uwc s ARG 167 CO 0.44 -1.48 0.45 1.63 -0.81 0.00 0.00 175.30 175.53 2uwc n LYS 168 N 8.00 0.61 -3.48 5.12 5.02 -1.26 -5.02 118.16 127.16 2uwc n LYS 168 Ca 0.12 -0.15 -0.10 0.00 -2.02 0.00 0.00 58.31 56.16 2uwc n LYS 168 Cb 0.49 -1.44 -0.02 0.00 -0.02 0.00 0.00 35.03 34.04 2uwc n LYS 168 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2uwc s SER 169 N -4.02 -0.44 0.26 4.39 1.04 -1.26 -5.02 113.70 108.66 2uwc s SER 169 Ca -0.05 -0.01 -0.00 0.00 0.48 0.00 0.00 55.95 56.36 2uwc s SER 169 Cb 0.12 0.46 0.35 0.00 0.10 0.00 0.00 66.02 67.05 2uwc s SER 169 CO 0.78 -0.75 1.72 0.44 0.98 0.00 0.00 173.24 176.41 2uwc h ASP 170 N 2.00 0.64 0.56 7.02 5.19 -1.95 -2.72 116.42 127.15 2uwc h ASP 170 Ca -0.26 -0.19 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2uwc h ASP 170 Cb 1.27 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.60 2uwc h ASP 170 CO 0.33 0.81 0.00 0.00 -3.12 0.00 0.00 179.24 177.26 2uwc h ALA 171 N 1.25 1.00 -0.19 3.45 0.00 -2.02 -3.10 119.26 119.65 2uwc h ALA 171 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2uwc h ALA 171 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2uwc h ALA 171 CO 0.04 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.54 2uwc n THR 172 N -2.67 1.27 -3.78 0.00 -2.24 -1.04 -4.92 114.28 100.90 2uwc n THR 172 Ca 0.00 -1.25 -0.15 0.00 -2.27 0.00 0.00 64.05 60.38 2uwc n THR 172 Cb 0.19 0.32 -0.16 0.00 -2.10 0.00 0.00 70.33 68.58 2uwc n THR 172 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2uwc s PHE 173 N -1.45 -0.00 -0.15 4.78 5.36 -1.15 -4.89 117.98 120.48 2uwc s PHE 173 Ca 0.19 0.17 -0.29 0.00 -0.96 0.00 0.00 56.93 56.05 2uwc s PHE 173 Cb 0.13 -0.19 -0.05 0.00 -0.34 0.00 0.00 43.02 42.57 2uwc s PHE 173 CO 0.08 -0.09 1.83 -2.14 -1.46 0.00 0.00 175.22 173.44 2uwc s PRO 174 N 0.99 3.75 0.00 10.12 0.02 -1.26 -4.86 135.00 143.76 2uwc s PRO 174 Ca -0.08 1.99 0.00 0.00 0.02 0.00 0.00 61.00 62.93 2uwc s PRO 174 Cb -0.12 -4.14 0.00 0.00 0.02 0.00 0.00 34.50 30.27 2uwc s PRO 174 CO -0.03 -1.37 0.65 1.28 -0.33 0.00 0.00 177.00 177.20 2uwc n LEU 175 N 8.87 0.81 -4.63 -5.54 4.77 -1.26 -4.92 117.00 115.10 2uwc n LEU 175 Ca 0.21 -0.81 -0.25 0.00 -0.03 0.00 0.00 56.01 55.13 2uwc n LEU 175 Cb 0.44 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.45 2uwc n LEU 175 CO 0.66 0.20 -0.35 -0.13 -1.33 0.00 0.00 177.39 176.44 2uwc s ARG 176 N -0.37 2.26 0.63 3.23 0.52 -1.26 -5.11 118.95 118.85 2uwc s ARG 176 Ca 0.00 -1.30 -0.18 0.00 -0.52 0.00 0.00 55.73 53.73 2uwc s ARG 176 Cb 0.00 -2.21 -0.02 0.00 0.52 0.00 0.00 34.95 33.24 2uwc s ARG 176 CO 0.00 0.40 1.15 -2.30 0.02 0.00 0.00 175.30 174.58 2uwc n PRO 177 N -0.47 1.01 -4.22 3.54 -0.02 -1.26 -4.98 135.00 128.61 2uwc n PRO 177 Ca -0.08 0.40 -0.17 0.00 -2.02 0.00 0.00 63.50 61.63 2uwc n PRO 177 Cb 0.57 -2.38 -0.13 0.00 -0.02 0.00 0.00 33.50 31.54 2uwc n PRO 177 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2uwc s MET 178 N -3.13 0.68 0.31 -0.52 -1.94 -0.87 -4.55 119.30 109.28 2uwc s MET 178 Ca 0.80 -0.61 0.06 0.00 -1.71 0.00 0.00 55.69 54.24 2uwc s MET 178 Cb -0.39 -0.61 -0.02 0.00 2.01 0.00 0.00 34.83 35.82 2uwc s MET 178 CO 0.43 0.15 0.37 -1.58 -0.01 0.00 0.00 175.02 174.38 2uwc s TRP 179 N -0.82 3.14 -0.07 -0.03 0.52 -0.11 -1.23 118.94 120.33 2uwc s TRP 179 Ca -0.02 -0.18 -0.08 0.00 0.02 0.00 0.00 56.10 55.84 2uwc s TRP 179 Cb -0.07 -1.79 -0.04 0.00 -1.15 0.00 0.00 33.47 30.41 2uwc s TRP 179 CO 0.01 0.19 0.22 0.08 0.02 0.00 0.00 176.95 177.46 2uwc s VAL 180 N -2.16 5.37 0.05 4.03 1.01 -1.26 -1.15 120.40 126.30 2uwc s VAL 180 Ca 0.40 0.30 0.01 0.00 0.00 0.00 0.00 61.98 62.70 2uwc s VAL 180 Cb -0.08 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2uwc s VAL 180 CO 0.29 0.55 -0.06 -0.31 0.00 0.00 0.00 175.10 175.57 2uwc s TYR 181 N -1.11 0.62 0.08 5.22 1.51 0.19 -0.20 117.35 123.67 2uwc s TYR 181 Ca 0.20 -0.68 -0.04 0.00 -1.01 0.00 0.00 57.07 55.54 2uwc s TYR 181 Cb -0.13 -0.39 -0.03 0.00 -0.11 0.00 0.00 41.96 41.31 2uwc s TYR 181 CO 0.09 -0.16 0.07 0.20 -1.11 0.00 0.00 175.55 174.64 2uwc s GLY 182 N -2.09 0.42 -0.13 0.71 0.00 -1.06 -1.15 107.32 104.01 2uwc s GLY 182 Ca -0.04 -1.03 -0.32 0.00 0.00 0.00 0.00 44.72 43.33 2uwc s GLY 182 CO -0.02 -1.13 1.09 -1.35 0.00 0.00 0.00 173.10 171.68 2uwc s SER 183 N -2.92 -0.24 -0.10 1.64 1.04 -1.08 -1.32 113.70 110.72 2uwc s SER 183 Ca 0.09 0.06 0.03 0.00 0.48 0.00 0.00 55.95 56.61 2uwc s SER 183 Cb 0.07 0.23 0.01 0.00 0.10 0.00 0.00 66.02 66.43 2uwc s SER 183 CO -0.08 -0.36 -0.19 -0.69 0.98 0.00 0.00 173.24 172.90 2uwc s VAL 184 N -2.34 1.72 0.19 5.02 1.01 -1.02 -0.48 120.40 124.50 2uwc s VAL 184 Ca 0.06 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 2uwc s VAL 184 Cb -0.01 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.87 2uwc s VAL 184 CO -0.05 0.48 0.51 -1.66 0.00 0.00 0.00 175.10 174.38 2uwc s TRP 185 N 0.69 -0.12 -0.45 5.22 1.48 -0.30 -3.33 118.94 122.12 2uwc s TRP 185 Ca -0.12 -0.22 -0.22 0.00 -1.06 0.00 0.00 56.10 54.47 2uwc s TRP 185 Cb -0.16 0.37 0.03 0.00 -1.16 0.00 0.00 33.47 32.54 2uwc s TRP 185 CO 0.03 -0.89 0.75 0.34 -4.06 0.00 0.00 176.95 173.12 2uwc s ASP 186 N -2.87 6.38 -0.58 -2.66 -1.08 -1.26 -1.00 116.67 113.60 2uwc s ASP 186 Ca 0.09 -0.19 0.01 0.00 -0.52 0.00 0.00 52.55 51.94 2uwc s ASP 186 Cb -0.01 -2.37 0.43 0.00 -1.46 0.00 0.00 42.92 39.52 2uwc s ASP 186 CO -0.04 -0.89 1.71 0.00 0.52 0.00 0.00 175.17 176.47 2uwc n ALA 187 N 6.62 5.89 0.30 3.66 0.00 0.47 -4.75 120.51 132.71 2uwc n ALA 187 Ca 0.01 -3.78 0.17 0.00 0.00 0.00 0.00 53.44 49.84 2uwc n ALA 187 Cb 0.48 -1.30 0.73 0.00 0.00 0.00 0.00 19.45 19.36 2uwc n ALA 187 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2uwc h SER 188 N 2.31 0.00 -0.33 0.00 0.02 -1.92 -2.85 113.55 110.78 2uwc h SER 188 Ca 0.50 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.44 2uwc h SER 188 Cb 0.86 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.38 2uwc h SER 188 CO 1.27 0.00 0.15 0.28 -1.14 0.00 0.00 176.83 177.39 2uwc h SER 189 N 0.00 0.47 -0.56 3.07 0.02 -1.93 -3.01 113.55 111.62 2uwc h SER 189 Ca 0.00 -0.04 -0.71 0.00 -0.84 0.00 0.00 61.79 60.19 2uwc h SER 189 Cb 0.41 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.77 2uwc h SER 189 CO 0.00 0.43 3.00 0.79 -1.14 0.00 0.00 176.83 179.91 2uwc n TRP 190 N -4.39 2.79 -4.22 3.45 8.01 -1.08 -4.93 117.44 117.07 2uwc n TRP 190 Ca 0.02 -2.94 -0.34 0.00 -1.31 0.00 0.00 57.50 52.93 2uwc n TRP 190 Cb 0.14 -2.23 -0.10 0.00 -2.01 0.00 0.00 31.31 27.10 2uwc n TRP 190 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2uwc s ALA 191 N 1.17 3.27 0.00 6.99 0.00 -1.14 -4.91 121.76 127.14 2uwc s ALA 191 Ca 0.55 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.74 2uwc s ALA 191 Cb 0.16 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.59 2uwc s ALA 191 CO -0.06 0.32 0.00 0.25 0.00 0.00 0.00 175.76 176.27 2uwc n THR 192 N 3.07 0.00 -2.17 0.00 -2.24 -1.26 -5.15 114.28 106.53 2uwc n THR 192 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2uwc n THR 192 Cb 0.53 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2uwc n THR 192 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2uwc n TYR 197 N 0.00 0.00 -4.30 4.78 4.19 -1.26 -5.28 117.16 115.29 2uwc n TYR 197 Ca 0.00 0.00 -0.29 0.00 3.31 0.00 0.00 57.90 60.92 2uwc n TYR 197 Cb 0.00 0.00 -0.11 0.00 0.49 0.00 0.00 39.34 39.72 2uwc n TYR 197 CO 0.00 0.00 0.00 0.21 0.91 0.00 0.00 176.86 177.98 2uwc s LYS 198 N 2.17 1.81 -0.09 2.98 2.20 -1.26 -3.34 119.74 124.21 2uwc s LYS 198 Ca 0.00 -1.20 -0.29 0.00 -0.36 0.00 0.00 55.97 54.12 2uwc s LYS 198 Cb 0.00 -2.12 -0.05 0.00 -1.51 0.00 0.00 37.83 34.15 2uwc s LYS 198 CO 0.00 0.47 1.75 0.00 -0.36 0.00 0.00 175.35 177.21 2uwc s ALA 199 N -1.22 3.45 -0.43 3.13 0.00 -1.17 -4.52 121.76 120.99 2uwc s ALA 199 Ca 0.19 0.88 -0.11 0.00 0.00 0.00 0.00 51.96 52.92 2uwc s ALA 199 Cb -0.10 -3.82 0.08 0.00 0.00 0.00 0.00 23.12 19.28 2uwc s ALA 199 CO 0.11 -1.68 0.29 0.34 0.00 0.00 0.00 175.76 174.82 2uwc s ASP 200 N 4.18 5.76 0.00 0.00 -1.08 -1.26 -4.99 116.67 119.29 2uwc s ASP 200 Ca 0.78 -1.46 0.28 0.00 -0.52 0.00 0.00 52.55 51.63 2uwc s ASP 200 Cb -0.33 -2.03 1.55 0.00 -1.46 0.00 0.00 42.92 40.65 2uwc s ASP 200 CO 0.32 -0.56 1.99 -1.22 0.52 0.00 0.00 175.17 176.22 2uwc n TYR 201 N 4.99 0.00 0.22 -5.34 4.02 -1.26 -2.37 117.16 117.42 2uwc n TYR 201 Ca -0.11 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 57.93 2uwc n TYR 201 Cb 0.43 -0.14 0.76 0.00 -0.02 0.00 0.00 39.34 40.37 2uwc n TYR 201 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2uwc h ARG 202 N 0.00 0.00 -1.97 -0.72 3.08 -2.02 -3.28 114.38 109.47 2uwc h ARG 202 Ca 0.00 0.00 -0.75 0.00 0.07 0.00 0.00 59.98 59.30 2uwc h ARG 202 Cb 0.13 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 29.88 2uwc h ARG 202 CO 0.00 0.00 0.79 0.66 -1.07 0.00 0.00 179.97 180.35 2uwc n TYR 203 N -2.49 3.04 0.03 3.04 4.02 -1.00 -4.94 117.16 118.86 2uwc n TYR 203 Ca -0.02 -2.49 -0.19 0.00 -0.01 0.00 0.00 57.90 55.19 2uwc n TYR 203 Cb 0.07 -1.03 -0.13 0.00 -0.02 0.00 0.00 39.34 38.23 2uwc n TYR 203 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 2uwc h GLN 204 N 3.10 0.36 -6.10 -0.72 5.75 -1.85 -3.40 115.11 112.24 2uwc h GLN 204 Ca 0.52 -0.48 -0.56 0.00 -0.15 0.00 0.00 58.65 57.98 2uwc h GLN 204 Cb 0.19 0.16 -0.05 0.00 1.07 0.00 0.00 27.48 28.85 2uwc h GLN 204 CO 1.32 1.18 0.14 -1.25 -2.65 0.00 0.00 178.83 177.56 2uwc s PRO 205 N -2.82 4.46 -0.29 -2.39 0.04 -1.26 -4.36 135.00 128.39 2uwc s PRO 205 Ca -0.13 0.98 -0.05 0.00 0.04 0.00 0.00 61.00 61.84 2uwc s PRO 205 Cb 0.02 -3.45 0.02 0.00 0.04 0.00 0.00 34.50 31.13 2uwc s PRO 205 CO 0.83 0.04 0.04 -0.06 0.04 0.00 0.00 177.00 177.89 2uwc s PHE 206 N 0.84 3.15 -0.06 0.56 0.08 0.40 -4.93 117.98 118.01 2uwc s PHE 206 Ca 0.40 -1.27 -0.01 0.00 0.12 0.00 0.00 56.93 56.17 2uwc s PHE 206 Cb -0.18 -2.19 -0.03 0.00 -0.57 0.00 0.00 43.02 40.04 2uwc s PHE 206 CO 0.20 -0.66 0.02 0.08 -0.10 0.00 0.00 175.22 174.76 2uwc s VAL 207 N 1.42 4.39 -0.08 -0.44 1.01 -1.26 -1.49 120.40 123.94 2uwc s VAL 207 Ca 0.01 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 61.70 2uwc s VAL 207 Cb -0.17 -2.90 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 2uwc s VAL 207 CO 0.00 0.52 -0.22 -0.83 0.00 0.00 0.00 175.10 174.57 2uwc s GLY 208 N -1.17 1.23 -0.12 4.51 0.00 0.66 -3.26 107.32 109.16 2uwc s GLY 208 Ca 0.16 -0.89 0.02 0.00 0.00 0.00 0.00 44.72 44.01 2uwc s GLY 208 CO 0.06 -0.33 -0.19 0.54 0.00 0.00 0.00 173.10 173.17 2uwc s LYS 209 N 0.26 3.17 -0.06 2.90 1.02 -0.99 -0.89 119.74 125.15 2uwc s LYS 209 Ca -0.14 -0.80 0.01 0.00 0.02 0.00 0.00 55.97 55.06 2uwc s LYS 209 Cb -0.16 -2.47 0.02 0.00 -0.52 0.00 0.00 37.83 34.69 2uwc s LYS 209 CO 0.07 0.13 -0.08 0.71 -0.92 0.00 0.00 175.35 175.26 2uwc s TYR 210 N 0.50 1.12 0.27 3.18 1.51 0.05 -1.16 117.35 122.82 2uwc s TYR 210 Ca -0.12 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.51 2uwc s TYR 210 Cb -0.17 -0.90 0.01 0.00 -0.11 0.00 0.00 41.96 40.80 2uwc s TYR 210 CO 0.05 -0.26 0.41 -0.85 -1.11 0.00 0.00 175.55 173.79 2uwc n GLU 211 N 4.04 0.60 -3.81 -0.62 0.28 -0.12 0.04 120.64 121.05 2uwc n GLU 211 Ca -0.22 -2.05 -0.24 0.00 -0.16 0.00 0.00 57.16 54.49 2uwc n GLU 211 Cb 0.51 2.06 0.01 0.00 1.43 0.00 0.00 31.44 35.45 2uwc n GLU 211 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2uwc n ASP 212 N -1.68 -1.00 -4.73 -1.84 8.00 -1.26 -0.57 116.55 113.47 2uwc n ASP 212 Ca -0.01 -0.91 -0.42 0.00 0.71 0.00 0.00 54.79 54.16 2uwc n ASP 212 Cb 0.45 -3.58 -0.01 0.00 -0.02 0.00 0.00 41.12 37.96 2uwc n ASP 212 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2uwc n PHE 213 N -4.32 2.61 -4.94 1.24 3.01 -1.14 -3.86 117.46 110.05 2uwc n PHE 213 Ca -0.29 0.42 -0.28 0.00 1.01 0.00 0.00 57.45 58.30 2uwc n PHE 213 Cb 0.68 -2.51 -0.17 0.00 -0.01 0.00 0.00 39.48 37.48 2uwc n PHE 213 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2uwc s LYS 214 N -1.27 2.33 -0.13 -1.08 1.02 0.25 -0.39 119.74 120.46 2uwc s LYS 214 Ca 0.60 -0.68 -0.01 0.00 0.02 0.00 0.00 55.97 55.90 2uwc s LYS 214 Cb -0.54 -1.85 0.04 0.00 -0.52 0.00 0.00 37.83 34.95 2uwc s LYS 214 CO 0.56 0.16 -0.03 -0.51 -0.92 0.00 0.00 175.35 174.61 2uwc s LEU 215 N 0.35 1.16 -0.56 3.17 1.43 -1.26 -1.02 118.68 121.95 2uwc s LEU 215 Ca -0.14 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.60 2uwc s LEU 215 Cb -0.16 -0.72 0.24 0.00 0.03 0.00 0.00 46.19 45.58 2uwc s LEU 215 CO 0.06 -0.19 0.66 0.61 0.23 0.00 0.00 176.35 177.72 2uwc n GLY 216 N 4.99 4.13 3.29 -3.19 0.00 -0.70 -4.96 105.19 108.75 2uwc n GLY 216 Ca -0.10 -2.37 -0.13 0.00 0.00 0.00 0.00 46.02 43.41 2uwc n GLY 216 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2uwc s SER 217 N -1.98 0.46 -0.22 1.61 0.01 -1.26 -0.25 113.70 112.07 2uwc s SER 217 Ca 0.38 -1.41 0.01 0.00 1.31 0.00 0.00 55.95 56.24 2uwc s SER 217 Cb 0.14 0.46 0.05 0.00 0.21 0.00 0.00 66.02 66.89 2uwc s SER 217 CO -0.05 -0.95 -0.07 0.00 0.41 0.00 0.00 173.24 172.57 2uwc n THR 219 N 4.69 0.39 -0.21 0.00 -2.24 -1.26 -0.62 114.28 115.03 2uwc n THR 219 Ca -0.13 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2uwc n THR 219 Cb 0.45 -0.95 0.12 0.00 -2.10 0.00 0.00 70.33 67.84 2uwc n THR 219 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2uwc h VAL 220 N -1.63 0.76 -0.02 2.28 2.07 -1.49 -2.74 116.25 115.48 2uwc h VAL 220 Ca -0.44 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.94 2uwc h VAL 220 Cb 1.28 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 2uwc h VAL 220 CO 0.41 0.08 -0.02 -0.62 0.02 0.00 0.00 177.57 177.43 2uwc n GLU 221 N -5.00 1.63 -1.47 1.57 -0.58 -1.26 -4.90 120.64 110.63 2uwc n GLU 221 Ca 0.09 -0.98 -0.42 0.00 -0.42 0.00 0.00 57.16 55.43 2uwc n GLU 221 Cb 0.29 -1.48 0.01 0.00 -0.57 0.00 0.00 31.44 29.68 2uwc n GLU 221 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2uwc n ALA 222 N 0.17 -1.35 -1.28 0.62 0.00 -1.03 -4.88 120.51 112.76 2uwc n ALA 222 Ca 0.18 0.19 -0.44 0.00 0.00 0.00 0.00 53.44 53.37 2uwc n ALA 222 Cb 0.37 -1.81 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 2uwc n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uwc n ALA 223 N -0.76 -2.75 0.29 0.00 0.00 -1.26 -4.86 120.51 111.18 2uwc n ALA 223 Ca 0.11 0.38 0.19 0.00 0.00 0.00 0.00 53.44 54.12 2uwc n ALA 223 Cb 0.39 -1.47 0.82 0.00 0.00 0.00 0.00 19.45 19.18 2uwc n ALA 223 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2uwc h SER 224 N 0.87 0.00 -0.03 0.00 4.64 -1.98 -1.74 113.55 115.30 2uwc h SER 224 Ca -0.27 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.06 2uwc h SER 224 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2uwc h SER 224 CO 0.52 0.00 0.09 0.77 -0.87 0.00 0.00 176.83 177.34 2uwc h SER 225 N 0.00 0.00 -3.16 4.97 4.64 -2.03 -3.43 113.55 114.54 2uwc h SER 225 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2uwc h SER 225 Cb 0.38 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.49 2uwc h SER 225 CO 0.00 0.00 0.63 0.00 -0.87 0.00 0.00 176.83 176.59 2uwc s ASN 227 N 0.91 2.20 0.64 0.00 0.01 -1.26 -4.98 114.94 112.47 2uwc s ASN 227 Ca 0.60 -0.92 -0.18 0.00 -0.71 0.00 0.00 52.86 51.65 2uwc s ASN 227 Cb -0.33 -0.09 -0.03 0.00 0.41 0.00 0.00 41.25 41.21 2uwc s ASN 227 CO 0.31 -0.18 0.97 -2.65 -1.51 0.00 0.00 177.10 174.04 2uwc n PRO 228 N 0.07 0.79 -1.54 -0.60 -0.02 -1.26 -4.77 135.00 127.67 2uwc n PRO 228 Ca -0.12 0.32 -0.37 0.00 -2.02 0.00 0.00 63.50 61.31 2uwc n PRO 228 Cb 0.59 -2.20 0.05 0.00 -0.02 0.00 0.00 33.50 31.93 2uwc n PRO 228 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2uwc n ALA 229 N -1.97 -0.27 -1.77 3.55 0.00 0.65 -4.94 120.51 115.76 2uwc n ALA 229 Ca 0.14 -0.04 -0.38 0.00 0.00 0.00 0.00 53.44 53.15 2uwc n ALA 229 Cb 0.48 -2.03 -0.02 0.00 0.00 0.00 0.00 19.45 17.88 2uwc n ALA 229 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2uwc s SER 230 N -1.30 6.52 0.00 0.00 0.15 -1.26 -4.83 113.70 112.98 2uwc s SER 230 Ca 0.74 2.39 0.00 0.00 0.70 0.00 0.00 55.95 59.78 2uwc s SER 230 Cb -0.41 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.28 2uwc s SER 230 CO 0.49 -0.68 0.51 0.55 1.20 0.00 0.00 173.24 175.30 2uwc n VAL 231 N 0.12 0.25 -3.65 4.45 3.14 -1.26 -4.83 118.33 116.56 2uwc n VAL 231 Ca 0.04 -0.39 -0.09 0.00 -2.96 0.00 0.00 64.34 60.94 2uwc n VAL 231 Cb 0.46 1.12 -0.02 0.00 -1.06 0.00 0.00 33.84 34.34 2uwc n VAL 231 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2uwc s SER 232 N -0.25 -0.38 0.04 6.55 1.04 -1.26 -4.79 113.70 114.64 2uwc s SER 232 Ca 0.00 -0.31 -0.30 0.00 0.48 0.00 0.00 55.95 55.82 2uwc s SER 232 Cb 0.00 0.63 -0.06 0.00 0.10 0.00 0.00 66.02 66.70 2uwc s SER 232 CO 0.00 -1.11 1.25 -2.16 0.98 0.00 0.00 173.24 172.20 2uwc s PRO 233 N -3.74 4.39 -1.71 4.02 0.05 -1.26 -3.93 135.00 132.83 2uwc s PRO 233 Ca 0.07 1.82 0.00 0.00 0.05 0.00 0.00 61.00 62.93 2uwc s PRO 233 Cb -0.03 -3.39 0.00 0.00 0.05 0.00 0.00 34.50 31.12 2uwc s PRO 233 CO -0.03 -0.35 0.00 0.66 0.05 0.00 0.00 177.00 177.34 2uwc n TYR 234 N 4.29 -0.28 -1.03 0.56 4.02 -1.26 -4.30 117.16 119.16 2uwc n TYR 234 Ca 0.10 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.98 2uwc n TYR 234 Cb 0.45 -3.13 -0.00 0.00 -0.02 0.00 0.00 39.34 36.64 2uwc n TYR 234 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2uwc n GLY 235 N -0.91 0.42 3.19 2.72 0.00 -1.25 -4.95 105.19 104.40 2uwc n GLY 235 Ca -0.18 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 2uwc n GLY 235 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2uwc s GLN 236 N -1.00 0.91 0.21 1.61 0.00 -1.26 -5.08 119.66 115.04 2uwc s GLN 236 Ca 0.00 -1.28 -0.32 0.00 -0.00 0.00 0.00 55.36 53.75 2uwc s GLN 236 Cb 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 33.01 33.15 2uwc s GLN 236 CO 0.00 -0.27 1.46 1.28 0.00 0.00 0.00 175.29 177.76 2uwc n LEU 237 N -0.08 3.02 -4.77 2.60 4.77 -1.26 -4.64 117.00 116.64 2uwc n LEU 237 Ca -0.09 1.12 -0.30 0.00 -0.03 0.00 0.00 56.01 56.71 2uwc n LEU 237 Cb 0.63 -1.42 0.10 0.00 -2.33 0.00 0.00 43.42 40.40 2uwc n LEU 237 CO 0.28 -0.45 0.70 -0.94 -1.33 0.00 0.00 177.39 175.64 2uwc s SER 238 N 0.50 4.35 0.46 -1.43 1.04 -1.26 -4.80 113.70 112.56 2uwc s SER 238 Ca 0.72 1.52 0.21 0.00 0.48 0.00 0.00 55.95 58.89 2uwc s SER 238 Cb -0.67 -2.26 1.14 0.00 0.10 0.00 0.00 66.02 64.32 2uwc s SER 238 CO 0.46 -2.09 1.97 1.56 0.98 0.00 0.00 173.24 176.12 2uwc h GLN 239 N -1.17 0.00 -0.07 4.02 1.08 -1.95 -0.82 115.11 116.20 2uwc h GLN 239 Ca -0.46 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 56.53 2uwc h GLN 239 Cb 1.25 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 2uwc h GLN 239 CO 0.56 0.21 -0.82 0.37 -0.95 0.00 0.00 178.83 178.20 2uwc h GLN 240 N 0.00 0.50 -0.23 1.46 4.15 -1.92 -0.10 115.11 118.97 2uwc h GLN 240 Ca -0.00 -0.45 -0.01 0.00 0.77 0.00 0.00 58.65 58.96 2uwc h GLN 240 Cb 0.46 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 2uwc h GLN 240 CO 0.03 1.09 0.11 1.96 -1.93 0.00 0.00 178.83 180.08 2uwc h GLN 241 N 0.32 0.34 -0.58 1.69 4.20 -1.40 -2.07 115.11 117.62 2uwc h GLN 241 Ca -0.05 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.66 2uwc h GLN 241 Cb 1.43 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 29.09 2uwc h GLN 241 CO 0.15 0.36 0.29 0.28 -0.67 0.00 0.00 178.83 179.24 2uwc h VAL 242 N 0.24 0.93 -0.40 -0.54 2.07 -1.13 -1.33 116.25 116.09 2uwc h VAL 242 Ca 0.08 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 2uwc h VAL 242 Cb 0.14 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2uwc h VAL 242 CO -0.01 0.10 0.12 0.00 0.02 0.00 0.00 177.57 177.80 2uwc h ALA 243 N 1.32 1.47 -0.31 1.67 0.00 -0.90 -0.10 119.26 122.41 2uwc h ALA 243 Ca 0.26 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.85 2uwc h ALA 243 Cb 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2uwc h ALA 243 CO -0.19 0.40 -0.51 0.00 0.00 0.00 0.00 179.25 178.95 2uwc h ALA 244 N 1.56 0.51 -0.30 0.00 0.00 -0.73 -1.94 119.26 118.37 2uwc h ALA 244 Ca 0.14 -0.50 0.02 0.00 0.00 0.00 0.00 54.91 54.57 2uwc h ALA 244 Cb 0.18 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2uwc h ALA 244 CO -0.01 0.68 0.14 1.98 0.00 0.00 0.00 179.25 182.05 2uwc h MET 245 N 0.68 0.29 -0.97 0.00 -1.53 -0.94 -1.73 114.93 110.74 2uwc h MET 245 Ca 0.03 -0.02 0.01 0.00 -3.44 0.00 0.00 59.70 56.27 2uwc h MET 245 Cb 1.11 -0.07 -0.05 0.00 -0.55 0.00 0.00 31.60 32.04 2uwc h MET 245 CO 0.11 0.19 0.63 0.93 0.14 0.00 0.00 176.91 178.91 2uwc h GLU 246 N 0.30 1.29 -0.65 0.39 5.08 -0.92 -0.92 114.58 119.15 2uwc h GLU 246 Ca 0.12 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2uwc h GLU 246 Cb 0.05 -0.28 -0.03 0.00 0.50 0.00 0.00 28.75 28.98 2uwc h GLU 246 CO -0.09 0.87 0.17 2.35 -1.00 0.00 0.00 179.01 181.30 2uwc h TRP 247 N 1.32 1.06 -0.26 4.33 7.01 -1.20 -0.43 115.95 127.77 2uwc h TRP 247 Ca 0.35 -0.11 -0.02 0.00 2.11 0.00 0.00 58.89 61.22 2uwc h TRP 247 Cb -0.13 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.62 2uwc h TRP 247 CO 0.00 0.86 0.08 0.28 -2.79 0.00 0.00 178.44 176.87 2uwc h VAL 248 N 0.97 1.20 -0.23 2.65 2.07 -0.57 -2.02 116.25 120.32 2uwc h VAL 248 Ca 0.21 -0.65 -0.16 0.00 0.82 0.00 0.00 66.70 66.92 2uwc h VAL 248 Cb 0.33 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2uwc h VAL 248 CO -0.00 0.21 -0.51 1.56 0.02 0.00 0.00 177.57 178.85 2uwc h GLN 249 N 0.25 0.64 -0.46 1.57 4.20 -1.07 0.37 115.11 120.60 2uwc h GLN 249 Ca 0.08 -0.38 -0.11 0.00 0.06 0.00 0.00 58.65 58.30 2uwc h GLN 249 Cb 0.25 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 2uwc h GLN 249 CO -0.00 0.99 -0.14 -0.22 -0.67 0.00 0.00 178.83 178.79 2uwc h LYS 250 N 0.50 0.87 0.00 1.46 3.64 -1.07 -3.12 116.57 118.86 2uwc h LYS 250 Ca 0.02 -0.32 -0.12 0.00 -1.27 0.00 0.00 60.65 58.96 2uwc h LYS 250 Cb 1.06 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 2uwc h LYS 250 CO 0.10 0.96 -1.97 0.09 -2.27 0.00 0.00 179.45 176.36 2uwc n ASN 251 N -4.14 0.15 0.00 4.20 3.02 -0.76 -4.71 115.26 113.02 2uwc n ASN 251 Ca 0.01 0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 2uwc n ASN 251 Cb 0.40 1.42 0.00 0.00 -0.61 0.00 0.00 39.78 40.99 2uwc n ASN 251 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2uwc n TYR 252 N -2.49 0.00 -2.73 3.10 4.01 0.13 -5.01 117.16 114.17 2uwc n TYR 252 Ca -0.12 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.20 2uwc n TYR 252 Cb 0.75 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.75 2uwc n TYR 252 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 2uwc s MET 253 N -0.26 4.58 -0.00 -0.72 1.75 -1.18 -0.19 119.30 123.28 2uwc s MET 253 Ca 0.00 1.41 0.04 0.00 -1.25 0.00 0.00 55.69 55.89 2uwc s MET 253 Cb 0.00 -3.44 -0.06 0.00 2.84 0.00 0.00 34.83 34.17 2uwc s MET 253 CO 0.00 0.01 0.12 1.33 -0.65 0.00 0.00 175.02 175.83 2uwc n VAL 254 N 3.65 0.00 -3.71 10.11 0.24 0.32 -4.92 118.33 124.02 2uwc n VAL 254 Ca 0.05 -0.19 -0.11 0.00 -2.04 0.00 0.00 64.34 62.05 2uwc n VAL 254 Cb 0.51 0.57 -0.11 0.00 -1.47 0.00 0.00 33.84 33.34 2uwc n VAL 254 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2uwc s TYR 255 N -2.04 -0.53 -0.16 6.34 5.04 -1.16 -4.97 117.35 119.87 2uwc s TYR 255 Ca -0.01 1.18 -0.01 0.00 -2.44 0.00 0.00 57.07 55.79 2uwc s TYR 255 Cb 0.03 0.21 0.05 0.00 0.35 0.00 0.00 41.96 42.60 2uwc s TYR 255 CO 0.17 -0.29 -0.01 1.21 -1.34 0.00 0.00 175.55 175.29 2uwc s ASN 256 N 1.01 2.66 0.34 4.32 2.47 -1.26 -0.82 114.94 123.67 2uwc s ASN 256 Ca -0.07 -0.63 0.10 0.00 0.42 0.00 0.00 52.86 52.68 2uwc s ASN 256 Cb -0.07 -0.72 0.84 0.00 -1.45 0.00 0.00 41.25 39.85 2uwc s ASN 256 CO -0.08 -0.23 1.80 0.10 -3.72 0.00 0.00 177.10 174.97 2uwc h TYR 257 N 8.20 0.91 -0.63 0.43 -0.00 -1.47 0.19 116.97 124.60 2uwc h TYR 257 Ca -0.20 0.03 0.04 0.00 -0.00 0.00 0.00 58.73 58.60 2uwc h TYR 257 Cb 1.12 -0.28 -0.04 0.00 -0.00 0.00 0.00 36.73 37.53 2uwc h TYR 257 CO 0.40 0.21 0.42 0.00 -0.00 0.00 0.00 178.16 179.19 2uwc n ASP 259 N -4.47 0.11 -4.64 0.00 8.00 0.65 -4.84 116.55 111.38 2uwc n ASP 259 Ca 0.08 0.14 -0.43 0.00 0.71 0.00 0.00 54.79 55.29 2uwc n ASP 259 Cb 0.16 -0.31 -0.02 0.00 -0.02 0.00 0.00 41.12 40.92 2uwc n ASP 259 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2uwc s ASP 260 N -2.84 6.68 0.51 -2.24 -1.08 -0.87 -4.90 116.67 111.93 2uwc s ASP 260 Ca 0.19 1.35 0.30 0.00 -0.52 0.00 0.00 52.55 53.86 2uwc s ASP 260 Cb 0.19 -2.54 1.23 0.00 -1.46 0.00 0.00 42.92 40.34 2uwc s ASP 260 CO 0.53 -1.05 1.94 1.55 0.52 0.00 0.00 175.17 178.66 2uwc h PRO 261 N 9.29 0.00 0.00 4.34 0.14 -1.88 -3.40 132.00 140.49 2uwc h PRO 261 Ca -0.27 0.00 -0.12 0.00 0.14 0.00 0.00 66.00 65.74 2uwc h PRO 261 Cb 1.11 0.00 0.04 0.00 0.14 0.00 0.00 31.00 32.29 2uwc h PRO 261 CO 1.02 0.10 0.10 0.25 0.14 0.00 0.00 178.00 179.61 2uwc n THR 262 N -3.25 0.00 -0.19 1.56 -2.24 -1.26 -4.96 114.28 103.93 2uwc n THR 262 Ca 0.00 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2uwc n THR 262 Cb 0.34 -1.73 0.00 0.00 -2.10 0.00 0.00 70.33 66.84 2uwc n THR 262 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2uwc n ARG 263 N -1.75 -0.38 -2.67 -0.78 5.12 -1.26 -4.87 116.66 110.08 2uwc n ARG 263 Ca 0.05 0.33 -0.42 0.00 -1.93 0.00 0.00 57.85 55.88 2uwc n ARG 263 Cb 0.17 -0.30 -0.03 0.00 -1.16 0.00 0.00 32.46 31.14 2uwc n ARG 263 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2uwc s ASP 264 N -0.95 6.25 0.00 0.55 2.15 -1.26 -4.86 116.67 118.55 2uwc s ASP 264 Ca 0.00 -0.88 0.02 0.00 0.43 0.00 0.00 52.55 52.12 2uwc s ASP 264 Cb 0.00 -2.51 0.13 0.00 -0.30 0.00 0.00 42.92 40.24 2uwc s ASP 264 CO 0.00 -1.61 0.83 1.41 -0.17 0.00 0.00 175.17 175.62 2uwc n HIS 265 N 8.60 0.00 0.68 -5.34 8.25 -1.26 -1.14 115.22 125.01 2uwc n HIS 265 Ca 0.07 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.65 2uwc n HIS 265 Cb 0.48 0.00 0.29 0.00 1.12 0.00 0.00 29.99 31.88 2uwc n HIS 265 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2uwc n THR 266 N -0.54 0.35 1.13 1.59 -2.24 -1.26 -3.32 114.28 109.98 2uwc n THR 266 Ca 0.02 -0.22 0.12 0.00 -2.27 0.00 0.00 64.05 61.70 2uwc n THR 266 Cb 0.01 -0.25 0.19 0.00 -2.10 0.00 0.00 70.33 68.17 2uwc n THR 266 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2uwc n LEU 267 N -2.03 2.16 -3.15 3.22 4.77 -0.29 -4.43 117.00 117.25 2uwc n LEU 267 Ca 0.05 -0.73 -0.22 0.00 -0.03 0.00 0.00 56.01 55.08 2uwc n LEU 267 Cb 0.42 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.43 2uwc n LEU 267 CO 0.34 0.37 -0.22 0.35 -1.33 0.00 0.00 177.39 176.90 2uwc n THR 268 N 0.45 -0.67 0.70 -5.08 -2.24 -1.22 -5.02 114.28 101.20 2uwc n THR 268 Ca 0.13 -3.44 0.09 0.00 -2.27 0.00 0.00 64.05 58.56 2uwc n THR 268 Cb 0.48 -1.31 0.41 0.00 -2.10 0.00 0.00 70.33 67.81 2uwc n THR 268 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2uwc n PRO 269 N 1.76 0.08 0.19 -0.78 -0.05 -1.21 -2.97 135.00 132.02 2uwc n PRO 269 Ca 0.21 0.17 0.14 0.00 -0.05 0.00 0.00 63.50 63.96 2uwc n PRO 269 Cb 0.54 -1.50 0.64 0.00 -0.05 0.00 0.00 33.50 33.13 2uwc n PRO 269 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 175.50 176.50 2uwc h GLU 270 N 0.00 0.00 0.00 0.54 9.09 -1.95 -3.51 114.58 118.74 2uwc h GLU 270 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2uwc h GLU 270 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 2uwc h GLU 270 CO 0.00 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.06