#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dww s TYR 78 N 0.00 -0.51 -0.14 3.69 -0.85 -1.26 -4.85 117.35 113.44 1dww s TYR 78 Ca 0.00 0.66 -0.13 0.00 -0.52 0.00 0.00 57.07 57.08 1dww s TYR 78 Cb 0.00 0.48 -0.05 0.00 0.38 0.00 0.00 41.96 42.77 1dww s TYR 78 CO 0.00 -0.59 0.28 0.08 -1.52 0.00 0.00 175.55 173.80 1dww s VAL 79 N -2.13 5.30 -0.13 -3.49 1.01 -0.95 -4.87 120.40 115.14 1dww s VAL 79 Ca -0.03 0.53 -0.26 0.00 0.00 0.00 0.00 61.98 62.21 1dww s VAL 79 Cb -0.01 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1dww s VAL 79 CO -0.01 0.45 0.87 -0.60 0.00 0.00 0.00 175.10 175.81 1dww s ARG 80 N 0.07 4.37 -0.04 2.72 3.52 -1.26 -0.63 118.95 127.70 1dww s ARG 80 Ca 0.17 1.12 0.06 0.00 -0.13 0.00 0.00 55.73 56.95 1dww s ARG 80 Cb -0.13 -3.54 -0.01 0.00 -1.56 0.00 0.00 34.95 29.71 1dww s ARG 80 CO 0.05 -0.25 -0.23 0.42 -0.81 0.00 0.00 175.30 174.47 1dww s ILE 81 N 1.85 1.89 0.08 4.11 1.09 0.46 -4.99 121.20 125.69 1dww s ILE 81 Ca 0.42 -0.99 0.08 0.00 -1.10 0.00 0.00 60.65 59.06 1dww s ILE 81 Cb -0.17 -1.59 -0.03 0.00 -1.06 0.00 0.00 42.46 39.60 1dww s ILE 81 CO 0.16 0.53 -0.21 -0.75 -0.10 0.00 0.00 174.94 174.56 1dww s LYS 82 N -0.25 1.27 -0.32 2.79 2.20 -1.26 -0.06 119.74 124.10 1dww s LYS 82 Ca 0.00 -1.08 -0.07 0.00 -0.36 0.00 0.00 55.97 54.46 1dww s LYS 82 Cb -0.12 -1.48 0.02 0.00 -1.51 0.00 0.00 37.83 34.74 1dww s LYS 82 CO 0.02 0.36 0.11 1.21 -0.36 0.00 0.00 175.35 176.68 1dww s ASN 83 N -1.59 5.27 0.00 1.43 3.84 -0.18 -1.83 114.94 121.87 1dww s ASN 83 Ca 0.07 -0.85 0.19 0.00 0.21 0.00 0.00 52.86 52.48 1dww s ASN 83 Cb -0.09 -1.90 1.03 0.00 -0.55 0.00 0.00 41.25 39.74 1dww s ASN 83 CO 0.03 -0.25 1.54 0.79 -2.79 0.00 0.00 177.10 176.42 1dww n TRP 84 N 4.87 0.00 -0.09 0.43 7.02 0.24 0.04 117.44 129.95 1dww n TRP 84 Ca -0.14 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.13 1dww n TRP 84 Cb 0.47 -0.14 -0.12 0.00 -2.42 0.00 0.00 31.31 29.10 1dww n TRP 84 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 1dww h GLY 85 N 3.00 0.02 0.23 6.99 0.00 -1.94 -3.41 103.07 107.96 1dww h GLY 85 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1dww h GLY 85 CO 0.00 0.05 -1.74 -1.14 0.00 0.00 0.00 176.54 173.71 1dww n SER 86 N -4.38 0.22 0.00 0.19 3.41 -1.20 -4.96 113.62 106.89 1dww n SER 86 Ca -0.30 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 1dww n SER 86 Cb 0.69 1.62 0.00 0.00 -0.26 0.00 0.00 64.21 66.26 1dww n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dww n GLY 87 N 1.25 1.33 3.75 5.00 0.00 0.11 -5.01 105.19 111.62 1dww n GLY 87 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1dww n GLY 87 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1dww s GLU 88 N -0.31 3.01 -0.02 1.61 2.12 -1.22 -4.75 118.70 119.14 1dww s GLU 88 Ca 0.00 1.86 0.05 0.00 0.36 0.00 0.00 54.97 57.24 1dww s GLU 88 Cb 0.00 -1.97 -0.01 0.00 0.26 0.00 0.00 34.13 32.41 1dww s GLU 88 CO 0.00 -1.19 -0.15 0.42 -0.54 0.00 0.00 175.26 173.80 1dww s ILE 89 N -1.56 1.23 0.14 -3.70 1.01 -1.26 -1.01 121.20 116.05 1dww s ILE 89 Ca 0.77 -0.65 0.07 0.00 0.00 0.00 0.00 60.65 60.83 1dww s ILE 89 Cb -0.31 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.08 1dww s ILE 89 CO 0.34 0.35 -0.16 -0.76 0.00 0.00 0.00 174.94 174.72 1dww s LEU 90 N -0.26 2.42 -0.22 2.97 1.43 0.91 -4.99 118.68 120.94 1dww s LEU 90 Ca 0.04 -0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 52.29 1dww s LEU 90 Cb -0.07 -0.66 0.02 0.00 0.03 0.00 0.00 46.19 45.50 1dww s LEU 90 CO -0.00 -0.10 -0.10 -1.00 0.23 0.00 0.00 176.35 175.37 1dww s HIS 91 N -2.14 2.96 -0.36 0.29 3.76 -1.26 -0.40 115.29 118.14 1dww s HIS 91 Ca 0.12 -1.47 -0.21 0.00 -0.15 0.00 0.00 55.06 53.34 1dww s HIS 91 Cb -0.05 -2.02 0.01 0.00 1.11 0.00 0.00 32.58 31.63 1dww s HIS 91 CO 0.04 -0.72 0.69 0.34 -0.85 0.00 0.00 174.74 174.24 1dww s ASP 92 N 1.34 6.46 -0.14 1.40 -1.08 0.20 -4.68 116.67 120.17 1dww s ASP 92 Ca 0.03 0.20 0.14 0.00 -0.52 0.00 0.00 52.55 52.39 1dww s ASP 92 Cb -0.15 -2.35 -0.20 0.00 -1.46 0.00 0.00 42.92 38.76 1dww s ASP 92 CO -0.07 -0.65 0.08 0.35 0.52 0.00 0.00 175.17 175.40 1dww n THR 93 N 5.66 0.97 -0.20 1.71 -2.24 0.84 -2.24 114.28 118.79 1dww n THR 93 Ca 0.00 -0.63 0.13 0.00 -2.27 0.00 0.00 64.05 61.29 1dww n THR 93 Cb 0.48 -0.53 0.45 0.00 -2.10 0.00 0.00 70.33 68.63 1dww n THR 93 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1dww h LEU 94 N 0.00 0.50 -2.40 3.22 6.46 -1.54 -2.63 115.31 118.93 1dww h LEU 94 Ca -0.38 0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.41 1dww h LEU 94 Cb 1.85 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 41.71 1dww h LEU 94 CO 0.02 0.26 0.20 1.12 -0.62 0.00 0.00 178.44 179.42 1dww h HIS 95 N 0.53 0.00 0.00 1.25 2.07 -1.85 -1.72 115.15 115.43 1dww h HIS 95 Ca 0.39 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.88 1dww h HIS 95 Cb 0.74 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.72 1dww h HIS 95 CO -0.00 0.00 -0.11 0.45 -3.07 0.00 0.00 177.93 175.20 1dww h HIS 96 N 0.00 0.00 -0.09 6.12 3.86 -1.81 -2.47 115.15 120.76 1dww h HIS 96 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1dww h HIS 96 Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1dww h HIS 96 CO 0.00 0.11 0.00 1.63 0.86 0.00 0.00 177.93 180.53 1dww n LYS 97 N -3.51 1.61 -1.71 2.45 5.02 -0.64 -4.95 118.16 116.42 1dww n LYS 97 Ca -0.01 -0.91 -0.43 0.00 -2.02 0.00 0.00 58.31 54.94 1dww n LYS 97 Cb 0.25 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 33.82 1dww n LYS 97 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dww n ALA 98 N 0.11 1.53 -1.00 7.82 0.00 -0.93 -4.84 120.51 123.20 1dww n ALA 98 Ca 0.18 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1dww n ALA 98 Cb 0.31 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1dww n ALA 98 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1dww n THR 99 N 0.98 0.00 -2.45 0.00 -1.04 -0.65 -5.01 114.28 106.11 1dww n THR 99 Ca 0.07 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.29 1dww n THR 99 Cb 0.35 -1.00 0.00 0.00 -1.82 0.00 0.00 70.33 67.87 1dww n THR 99 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1dww n SER 100 N 0.00 0.70 -4.68 8.00 7.64 -1.26 -5.12 113.62 118.90 1dww n SER 100 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.51 1dww n SER 100 Cb 0.00 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.26 1dww n SER 100 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1dww n ASP 101 N 0.00 1.51 -1.05 6.43 8.00 -1.26 -4.93 116.55 125.24 1dww n ASP 101 Ca 0.00 0.82 0.00 0.00 0.71 0.00 0.00 54.79 56.32 1dww n ASP 101 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.62 1dww n ASP 101 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1dww n PHE 102 N -1.80 -1.05 -0.13 1.24 7.35 -1.26 -4.89 117.46 116.93 1dww n PHE 102 Ca 0.15 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.74 1dww n PHE 102 Cb 0.48 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.29 1dww n PHE 102 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1dww h THR 103 N 0.18 1.24 -4.36 -2.13 2.02 -1.95 -3.45 112.91 104.45 1dww h THR 103 Ca 0.00 -0.86 -0.51 0.00 0.77 0.00 0.00 66.41 65.81 1dww h THR 103 Cb 0.00 1.06 0.08 0.00 -1.74 0.00 0.00 68.15 67.55 1dww h THR 103 CO 0.00 0.29 0.40 0.00 0.37 0.00 0.00 175.52 176.58 1dww n LYS 105 N -2.96 1.22 0.12 0.00 5.02 -0.56 -4.98 118.16 116.02 1dww n LYS 105 Ca 0.07 -0.50 -0.02 0.00 -2.02 0.00 0.00 58.31 55.83 1dww n LYS 105 Cb 0.54 0.02 0.11 0.00 -0.02 0.00 0.00 35.03 35.68 1dww n LYS 105 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1dww h SER 106 N 0.07 0.00 0.00 4.39 4.64 -2.02 -3.33 113.55 117.30 1dww h SER 106 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1dww h SER 106 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1dww h SER 106 CO 0.07 0.70 -0.00 0.29 -0.87 0.00 0.00 176.83 177.02 1dww n LYS 107 N -3.67 2.57 -3.80 4.77 5.02 -1.26 -5.04 118.16 116.75 1dww n LYS 107 Ca -0.01 -1.66 -0.12 0.00 -2.02 0.00 0.00 58.31 54.50 1dww n LYS 107 Cb 0.69 -1.07 -0.09 0.00 -0.02 0.00 0.00 35.03 34.54 1dww n LYS 107 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1dww s SER 108 N -1.30 -0.11 -0.16 4.39 0.01 -1.25 -5.14 113.70 110.13 1dww s SER 108 Ca 0.06 -0.02 -0.01 0.00 1.31 0.00 0.00 55.95 57.30 1dww s SER 108 Cb 0.05 0.28 -0.00 0.00 0.21 0.00 0.00 66.02 66.55 1dww s SER 108 CO 0.01 -0.41 -0.13 0.00 0.41 0.00 0.00 173.24 173.11 1dww n LEU 110 N 4.09 2.90 0.10 0.00 4.77 -1.26 -4.78 117.00 122.82 1dww n LEU 110 Ca -0.19 -3.59 0.06 0.00 -0.03 0.00 0.00 56.01 52.26 1dww n LEU 110 Cb 0.52 -0.52 0.30 0.00 -2.33 0.00 0.00 43.42 41.39 1dww n LEU 110 CO 0.29 1.13 0.69 0.61 -1.33 0.00 0.00 177.39 178.78 1dww n GLY 111 N -1.17 -0.63 0.08 -0.72 0.00 -1.26 -1.28 105.19 100.21 1dww n GLY 111 Ca 0.20 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.45 1dww n GLY 111 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1dww n SER 112 N -1.87 0.75 -4.70 1.61 2.88 -1.26 -4.88 113.62 106.15 1dww n SER 112 Ca -0.01 0.36 -0.42 0.00 -1.33 0.00 0.00 58.87 57.48 1dww n SER 112 Cb 0.12 -0.36 -0.03 0.00 -0.75 0.00 0.00 64.21 63.19 1dww n SER 112 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1dww s ILE 113 N -3.13 3.31 0.02 2.46 -1.09 -0.40 -4.97 121.20 117.40 1dww s ILE 113 Ca 0.09 0.82 -0.29 0.00 -2.23 0.00 0.00 60.65 59.04 1dww s ILE 113 Cb 0.13 -3.53 -0.16 0.00 -1.58 0.00 0.00 42.46 37.32 1dww s ILE 113 CO 0.65 0.02 1.23 0.24 -1.23 0.00 0.00 174.94 175.85 1dww h MET 114 N 7.58 -0.96 -2.70 2.79 2.86 -1.90 -3.39 114.93 119.22 1dww h MET 114 Ca -0.41 0.07 -0.64 0.00 -2.06 0.00 0.00 59.70 56.66 1dww h MET 114 Cb 1.20 0.22 -0.40 0.00 0.06 0.00 0.00 31.60 32.68 1dww h MET 114 CO 0.90 -0.63 -0.39 0.09 1.06 0.00 0.00 176.91 177.94 1dww n ASN 115 N -5.45 3.84 -4.85 1.22 3.02 -1.26 -5.07 115.26 106.71 1dww n ASN 115 Ca -0.13 -3.33 -0.32 0.00 -0.03 0.00 0.00 54.58 50.78 1dww n ASN 115 Cb 0.40 -0.81 -0.04 0.00 -0.61 0.00 0.00 39.78 38.73 1dww n ASN 115 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1dww s PRO 116 N -2.04 3.91 0.44 3.52 0.04 -1.26 -4.96 135.00 134.65 1dww s PRO 116 Ca 0.33 0.76 0.15 0.00 0.04 0.00 0.00 61.00 62.28 1dww s PRO 116 Cb 0.05 -2.26 1.07 0.00 0.04 0.00 0.00 34.50 33.40 1dww s PRO 116 CO -0.07 -0.13 1.98 0.87 0.04 0.00 0.00 177.00 179.70 1dww h LYS 117 N 1.24 0.36 0.00 4.56 1.57 -1.97 -1.19 116.57 121.13 1dww h LYS 117 Ca -0.47 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1dww h LYS 117 Cb 1.18 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1dww h LYS 117 CO 0.63 0.24 0.00 0.66 -0.57 0.00 0.00 179.45 180.40 1dww h SER 118 N 0.37 0.00 -0.41 0.86 4.64 -1.90 -0.16 113.55 116.95 1dww h SER 118 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 1dww h SER 118 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1dww h SER 118 CO -0.07 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.07 1dww n LEU 119 N -2.93 3.23 -4.25 5.97 4.32 -0.46 -4.94 117.00 117.94 1dww n LEU 119 Ca -0.01 -2.09 -0.30 0.00 -0.02 0.00 0.00 56.01 53.59 1dww n LEU 119 Cb 0.14 -0.31 -0.16 0.00 -1.62 0.00 0.00 43.42 41.48 1dww n LEU 119 CO 0.21 0.77 -0.55 -0.89 -1.22 0.00 0.00 177.39 175.71 1dww s THR 120 N -1.17 1.87 -0.31 -5.08 2.01 -0.07 -0.45 115.64 112.43 1dww s THR 120 Ca 0.30 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 61.33 1dww s THR 120 Cb 0.17 -1.56 0.09 0.00 0.01 0.00 0.00 72.50 71.20 1dww s THR 120 CO 0.18 0.53 0.03 -0.60 -0.69 0.00 0.00 174.62 174.07 1dww s ARG 121 N -0.37 1.41 0.10 4.92 6.06 -0.12 -4.87 118.95 126.08 1dww s ARG 121 Ca 0.04 -1.52 -0.02 0.00 -2.50 0.00 0.00 55.73 51.74 1dww s ARG 121 Cb -0.11 -2.82 0.03 0.00 0.06 0.00 0.00 34.95 32.11 1dww s ARG 121 CO 0.01 -0.86 0.10 0.41 -2.50 0.00 0.00 175.30 172.45 1dww n GLY 122 N 4.46 -2.27 3.73 8.12 0.00 -1.26 -4.53 105.19 113.44 1dww n GLY 122 Ca -0.02 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.22 1dww n GLY 122 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1dww s PRO 123 N -3.22 -0.45 0.02 1.61 0.02 -1.26 -4.98 135.00 126.75 1dww s PRO 123 Ca 0.06 -0.18 -0.18 0.00 0.02 0.00 0.00 61.00 60.71 1dww s PRO 123 Cb -0.01 -1.70 0.04 0.00 0.02 0.00 0.00 34.50 32.85 1dww s PRO 123 CO 0.05 -3.18 0.41 1.03 -0.33 0.00 0.00 177.00 174.98 1dww s ARG 124 N -5.58 0.88 -0.05 5.54 0.52 -1.26 -5.06 118.95 113.94 1dww s ARG 124 Ca 0.72 -0.28 0.09 0.00 -0.52 0.00 0.00 55.73 55.74 1dww s ARG 124 Cb -0.08 0.39 -0.14 0.00 0.52 0.00 0.00 34.95 35.65 1dww s ARG 124 CO 0.55 -0.29 0.14 -0.25 0.02 0.00 0.00 175.30 175.47 1dww n ASP 125 N 0.70 2.73 -4.31 0.23 8.00 -1.25 -4.06 116.55 118.59 1dww n ASP 125 Ca -0.19 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.14 1dww n ASP 125 Cb 0.59 1.14 -0.10 0.00 -0.02 0.00 0.00 41.12 42.73 1dww n ASP 125 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1dww s LYS 126 N -2.49 1.23 1.13 -1.24 1.02 -1.00 -4.74 119.74 113.65 1dww s LYS 126 Ca -0.04 -1.55 -0.13 0.00 0.02 0.00 0.00 55.97 54.27 1dww s LYS 126 Cb 0.05 -0.85 0.26 0.00 -0.52 0.00 0.00 37.83 36.77 1dww s LYS 126 CO 0.40 0.10 1.05 -2.14 -0.92 0.00 0.00 175.35 173.83 1dww s PRO 127 N -3.72 -0.65 0.03 -1.68 0.02 -1.25 -4.63 135.00 123.12 1dww s PRO 127 Ca 0.21 0.63 -0.30 0.00 0.02 0.00 0.00 61.00 61.56 1dww s PRO 127 Cb 0.02 -1.60 -0.05 0.00 0.02 0.00 0.00 34.50 32.89 1dww s PRO 127 CO 0.05 -3.49 1.19 0.99 -0.33 0.00 0.00 177.00 175.41 1dww s THR 128 N -2.65 4.12 0.16 0.99 2.01 -1.26 -4.97 115.64 114.04 1dww s THR 128 Ca 0.68 1.51 -0.34 0.00 0.31 0.00 0.00 61.69 63.85 1dww s THR 128 Cb -0.22 -3.97 -0.15 0.00 0.01 0.00 0.00 72.50 68.17 1dww s THR 128 CO 0.62 0.09 1.39 -2.65 -0.69 0.00 0.00 174.62 173.38 1dww n PRO 129 N 4.27 1.64 -0.33 4.92 -0.02 -1.26 -4.76 135.00 139.46 1dww n PRO 129 Ca 0.09 0.59 0.03 0.00 -2.02 0.00 0.00 63.50 62.19 1dww n PRO 129 Cb 0.46 -2.24 0.17 0.00 -0.02 0.00 0.00 33.50 31.87 1dww n PRO 129 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1dww h LEU 130 N 4.67 0.86 -2.21 2.45 -0.00 -1.93 -0.04 115.31 119.10 1dww h LEU 130 Ca -0.45 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.45 1dww h LEU 130 Cb 1.30 -0.15 -0.00 0.00 -0.00 0.00 0.00 40.66 41.81 1dww h LEU 130 CO 0.79 0.52 -0.03 1.05 -0.00 0.00 0.00 178.44 180.77 1dww h GLU 131 N 0.98 0.00 0.09 1.13 9.09 -2.01 -0.98 114.58 122.87 1dww h GLU 131 Ca 0.41 0.00 -0.26 0.00 0.05 0.00 0.00 59.36 59.56 1dww h GLU 131 Cb 0.27 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.36 1dww h GLU 131 CO -0.21 0.03 -1.36 0.93 0.05 0.00 0.00 179.01 178.46 1dww h GLU 132 N 0.00 0.18 0.33 1.06 5.08 -1.56 -3.39 114.58 116.28 1dww h GLU 132 Ca -0.00 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 1dww h GLU 132 Cb 0.07 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1dww h GLU 132 CO 0.00 1.15 -0.20 1.25 -1.00 0.00 0.00 179.01 180.22 1dww h LEU 133 N -0.44 -0.50 -0.18 1.33 6.46 -0.62 -3.21 115.31 118.16 1dww h LEU 133 Ca -0.31 0.03 0.05 0.00 -0.12 0.00 0.00 57.88 57.53 1dww h LEU 133 Cb 1.66 0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 41.66 1dww h LEU 133 CO 0.01 -0.32 -0.35 0.25 -0.62 0.00 0.00 178.44 177.40 1dww h LEU 134 N -0.51 -1.11 -0.63 2.25 5.85 -1.41 0.56 115.31 120.32 1dww h LEU 134 Ca -0.03 0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.90 1dww h LEU 134 Cb 0.42 0.47 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 1dww h LEU 134 CO 0.04 -0.37 0.35 -0.65 -0.34 0.00 0.00 178.44 177.46 1dww h PRO 135 N -0.40 0.64 -0.74 5.25 0.11 -1.75 -0.44 132.00 134.67 1dww h PRO 135 Ca 0.10 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1dww h PRO 135 Cb 0.57 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.50 1dww h PRO 135 CO -0.40 0.42 0.47 0.45 -0.21 0.00 0.00 178.00 178.73 1dww h HIS 136 N 0.65 0.94 -0.16 0.65 3.86 -1.45 -0.18 115.15 119.47 1dww h HIS 136 Ca 0.28 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 1dww h HIS 136 Cb 0.15 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 1dww h HIS 136 CO -0.08 0.61 0.07 0.00 0.86 0.00 0.00 177.93 179.39 1dww h ALA 137 N 1.25 0.20 -0.77 2.45 0.00 -0.13 -2.12 119.26 120.14 1dww h ALA 137 Ca 0.27 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1dww h ALA 137 Cb -0.08 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1dww h ALA 137 CO -0.05 -0.22 0.40 0.82 0.00 0.00 0.00 179.25 180.20 1dww h ILE 138 N 0.11 1.24 -0.85 0.00 1.08 -0.83 -1.78 117.51 116.47 1dww h ILE 138 Ca 0.05 -0.63 0.02 0.00 -0.39 0.00 0.00 64.86 63.91 1dww h ILE 138 Cb 0.15 0.23 -0.04 0.00 -3.07 0.00 0.00 36.82 34.09 1dww h ILE 138 CO -0.01 0.27 0.56 -0.33 -0.69 0.00 0.00 178.15 177.96 1dww h GLU 139 N 1.08 1.10 -0.31 2.37 5.08 -0.86 -1.36 114.58 121.67 1dww h GLU 139 Ca 0.27 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 1dww h GLU 139 Cb 0.07 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1dww h GLU 139 CO -0.04 0.73 -0.03 0.35 -1.00 0.00 0.00 179.01 179.02 1dww h PHE 140 N 1.13 0.63 -0.80 4.33 3.57 -0.94 -1.43 116.94 123.44 1dww h PHE 140 Ca 0.32 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 1dww h PHE 140 Cb -0.10 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.44 1dww h PHE 140 CO -0.01 0.72 0.48 0.82 -2.23 0.00 0.00 178.31 178.09 1dww h ILE 141 N 0.36 1.22 -0.21 1.41 2.04 -1.06 0.17 117.51 121.44 1dww h ILE 141 Ca 0.08 -0.49 -0.11 0.00 1.00 0.00 0.00 64.86 65.34 1dww h ILE 141 Cb 0.49 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.65 1dww h ILE 141 CO 0.02 0.23 -0.35 0.78 0.00 0.00 0.00 178.15 178.84 1dww h ASN 142 N 1.10 0.46 -0.10 1.72 2.35 -1.11 0.04 115.58 120.04 1dww h ASN 142 Ca 0.29 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1dww h ASN 142 Cb -0.05 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.19 1dww h ASN 142 CO -0.05 0.78 -0.04 -0.61 -1.65 0.00 0.00 177.43 175.86 1dww h GLN 143 N 0.38 0.21 -0.36 0.81 4.15 -0.31 -0.78 115.11 119.22 1dww h GLN 143 Ca 0.04 -0.09 0.02 0.00 0.77 0.00 0.00 58.65 59.39 1dww h GLN 143 Cb 0.80 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.45 1dww h GLN 143 CO 0.06 0.54 0.20 -0.92 -1.93 0.00 0.00 178.83 176.79 1dww h TYR 144 N -0.13 0.38 0.00 3.99 3.20 -0.54 -2.74 116.97 121.12 1dww h TYR 144 Ca 0.02 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 1dww h TYR 144 Cb 0.48 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 1dww h TYR 144 CO 0.06 0.22 -0.55 1.88 -1.64 0.00 0.00 178.16 178.13 1dww h TYR 145 N 0.42 0.00 -0.07 -3.82 0.05 -1.01 -2.83 116.97 109.70 1dww h TYR 145 Ca 0.14 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.92 1dww h TYR 145 Cb 0.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.75 1dww h TYR 145 CO -0.08 0.55 0.00 0.41 -1.05 0.00 0.00 178.16 177.99 1dww n GLY 146 N 0.59 -0.23 0.13 3.88 0.00 -0.30 -3.83 105.19 105.42 1dww n GLY 146 Ca 0.00 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1dww n GLY 146 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1dww n SER 147 N -0.22 2.02 -4.79 1.61 2.88 -1.07 -4.95 113.62 109.11 1dww n SER 147 Ca 0.03 0.28 -0.34 0.00 -1.33 0.00 0.00 58.87 57.50 1dww n SER 147 Cb 0.11 -0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 62.67 1dww n SER 147 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1dww s PHE 148 N -2.49 2.83 0.13 0.66 0.08 -1.25 -4.97 117.98 112.97 1dww s PHE 148 Ca -0.26 1.56 -0.32 0.00 0.12 0.00 0.00 56.93 58.04 1dww s PHE 148 Cb 0.07 -3.18 -0.09 0.00 -0.57 0.00 0.00 43.02 39.26 1dww s PHE 148 CO 0.69 -1.21 1.56 -0.22 -0.10 0.00 0.00 175.22 175.94 1dww h LYS 149 N 1.33 -0.45 -3.31 0.44 3.64 -1.93 -3.24 116.57 113.05 1dww h LYS 149 Ca -0.50 0.03 -0.70 0.00 -1.27 0.00 0.00 60.65 58.21 1dww h LYS 149 Cb 1.24 0.10 -0.36 0.00 -0.41 0.00 0.00 32.23 32.81 1dww h LYS 149 CO 0.58 -0.30 -0.12 -1.83 -2.27 0.00 0.00 179.45 175.51 1dww s GLU 150 N -5.74 3.23 -0.07 1.90 -1.05 -1.26 -5.06 118.70 110.65 1dww s GLU 150 Ca -0.15 -3.26 -0.26 0.00 -0.15 0.00 0.00 54.97 51.14 1dww s GLU 150 Cb 0.09 -3.93 -0.13 0.00 -0.44 0.00 0.00 34.13 29.72 1dww s GLU 150 CO 0.63 -1.26 0.76 0.00 0.95 0.00 0.00 175.26 176.33 1dww n ALA 151 N 2.35 -2.13 -2.61 -0.84 0.00 -1.23 -4.84 120.51 111.21 1dww n ALA 151 Ca 0.21 0.37 -0.43 0.00 0.00 0.00 0.00 53.44 53.58 1dww n ALA 151 Cb 0.37 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.68 1dww n ALA 151 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1dww n LYS 152 N 1.31 3.46 -0.22 0.00 5.02 -1.26 -4.87 118.16 121.60 1dww n LYS 152 Ca 0.14 -3.63 -0.00 0.00 -2.02 0.00 0.00 58.31 52.80 1dww n LYS 152 Cb 0.03 -3.02 0.07 0.00 -0.02 0.00 0.00 35.03 32.09 1dww n LYS 152 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1dww h ILE 153 N 4.24 0.36 -0.76 -0.18 2.04 -1.95 0.24 117.51 121.50 1dww h ILE 153 Ca 0.37 -0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.24 1dww h ILE 153 Cb 0.75 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 1dww h ILE 153 CO 1.45 0.00 0.51 1.05 0.00 0.00 0.00 178.15 181.16 1dww h GLU 154 N 0.00 0.97 0.05 2.37 4.11 -1.99 0.69 114.58 120.78 1dww h GLU 154 Ca 0.31 -0.06 -0.24 0.00 0.07 0.00 0.00 59.36 59.44 1dww h GLU 154 Cb 0.47 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1dww h GLU 154 CO -0.66 0.65 -1.04 0.93 0.07 0.00 0.00 179.01 178.95 1dww h GLU 155 N 1.00 0.37 0.01 1.06 5.08 -1.64 -1.92 114.58 118.54 1dww h GLU 155 Ca 0.29 -0.46 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1dww h GLU 155 Cb -0.07 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1dww h GLU 155 CO -0.07 1.15 -0.03 1.25 -1.00 0.00 0.00 179.01 180.31 1dww h HIS 156 N 0.18 -0.07 -0.51 4.33 2.76 0.05 0.38 115.15 122.27 1dww h HIS 156 Ca -0.10 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.06 1dww h HIS 156 Cb 1.71 0.03 -0.02 0.00 1.55 0.00 0.00 27.41 30.67 1dww h HIS 156 CO 0.06 -0.04 0.27 -0.07 -1.30 0.00 0.00 177.93 176.85 1dww h LEU 157 N -0.05 0.65 -1.11 0.26 4.07 -0.92 -2.40 115.31 115.81 1dww h LEU 157 Ca 0.01 -0.10 -0.03 0.00 0.08 0.00 0.00 57.88 57.83 1dww h LEU 157 Cb 0.06 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 1dww h LEU 157 CO -0.02 0.56 0.25 0.00 -1.08 0.00 0.00 178.44 178.15 1dww h ALA 158 N 1.11 1.30 -0.31 1.53 0.00 -0.97 -2.45 119.26 119.47 1dww h ALA 158 Ca 0.18 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 1dww h ALA 158 Cb 0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1dww h ALA 158 CO -0.03 0.53 -0.45 -0.09 0.00 0.00 0.00 179.25 179.21 1dww h ARG 159 N 0.87 0.85 -0.70 0.00 9.65 -0.73 -1.28 114.38 123.04 1dww h ARG 159 Ca 0.21 -0.50 0.07 0.00 -1.10 0.00 0.00 59.98 58.66 1dww h ARG 159 Cb 0.16 0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.72 1dww h ARG 159 CO -0.02 1.14 0.38 -0.07 2.80 0.00 0.00 179.97 184.20 1dww h LEU 160 N 0.63 0.54 -0.00 3.80 3.38 -1.16 0.85 115.31 123.36 1dww h LEU 160 Ca 0.03 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1dww h LEU 160 Cb 1.05 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 1dww h LEU 160 CO 0.10 0.33 -0.00 -0.08 0.09 0.00 0.00 178.44 178.89 1dww h GLU 161 N 0.67 0.01 -0.44 1.13 4.22 -1.30 -2.50 114.58 116.38 1dww h GLU 161 Ca 0.33 -0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.75 1dww h GLU 161 Cb 0.26 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1dww h GLU 161 CO -0.22 0.33 0.21 0.00 -2.18 0.00 0.00 179.01 177.16 1dww h ALA 162 N 0.68 1.55 -0.22 2.92 0.00 -0.80 -1.34 119.26 122.05 1dww h ALA 162 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1dww h ALA 162 Cb 0.33 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1dww h ALA 162 CO 0.00 0.36 -0.66 0.28 0.00 0.00 0.00 179.25 179.23 1dww h VAL 163 N 0.61 1.28 -0.26 0.00 2.07 -0.79 -1.33 116.25 117.83 1dww h VAL 163 Ca 0.15 -1.85 -0.01 0.00 0.82 0.00 0.00 66.70 65.81 1dww h VAL 163 Cb 0.07 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1dww h VAL 163 CO -0.02 0.59 0.11 0.74 0.02 0.00 0.00 177.57 179.01 1dww h THR 164 N 0.60 1.16 -0.86 2.57 2.02 -1.18 -0.31 112.91 116.90 1dww h THR 164 Ca -0.02 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.69 1dww h THR 164 Cb 1.28 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 68.66 1dww h THR 164 CO 0.14 0.17 0.57 0.50 0.37 0.00 0.00 175.52 177.27 1dww h LYS 165 N 0.27 1.12 -0.37 6.66 3.64 -1.24 -0.89 116.57 125.77 1dww h LYS 165 Ca 0.09 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 1dww h LYS 165 Cb 0.16 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1dww h LYS 165 CO -0.01 0.74 -0.41 1.49 -2.27 0.00 0.00 179.45 178.99 1dww h GLU 166 N 1.15 0.92 -0.33 1.90 4.81 -0.84 -2.26 114.58 119.94 1dww h GLU 166 Ca 0.32 -0.50 -0.02 0.00 -0.13 0.00 0.00 59.36 59.03 1dww h GLU 166 Cb -0.11 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1dww h GLU 166 CO -0.07 1.15 0.13 0.82 -0.73 0.00 0.00 179.01 180.31 1dww h ILE 167 N 0.73 1.19 0.00 2.32 2.04 -0.42 0.16 117.51 123.52 1dww h ILE 167 Ca 0.05 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1dww h ILE 167 Cb 1.01 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1dww h ILE 167 CO 0.10 0.20 0.00 -1.84 0.00 0.00 0.00 178.15 176.61 1dww n GLU 168 N -4.70 0.10 -0.11 2.37 0.28 -0.40 -0.75 120.64 117.43 1dww n GLU 168 Ca -0.01 0.21 -0.13 0.00 -0.16 0.00 0.00 57.16 57.07 1dww n GLU 168 Cb 0.14 -1.65 -0.15 0.00 1.43 0.00 0.00 31.44 31.21 1dww n GLU 168 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1dww n THR 169 N -1.83 1.43 0.21 3.84 -1.04 -0.85 -4.68 114.28 111.34 1dww n THR 169 Ca 0.05 -0.76 0.03 0.00 -2.04 0.00 0.00 64.05 61.32 1dww n THR 169 Cb 0.29 -0.79 -0.04 0.00 -1.82 0.00 0.00 70.33 67.97 1dww n THR 169 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1dww n THR 170 N -2.93 0.00 -0.40 12.58 -2.24 0.51 -4.99 114.28 116.82 1dww n THR 170 Ca -0.37 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 1dww n THR 170 Cb 1.10 0.85 0.00 0.00 -2.10 0.00 0.00 70.33 70.18 1dww n THR 170 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dww n GLY 171 N 1.37 1.05 0.00 3.38 0.00 0.07 -4.95 105.19 106.11 1dww n GLY 171 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1dww n GLY 171 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1dww n THR 172 N -2.00 0.00 -3.70 2.61 5.66 -1.24 -4.87 114.28 110.74 1dww n THR 172 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1dww n THR 172 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 1dww n THR 172 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1dww s TYR 173 N -7.25 -0.17 -0.07 1.09 1.13 -1.26 -3.13 117.35 107.68 1dww s TYR 173 Ca 0.00 -0.16 0.01 0.00 -1.41 0.00 0.00 57.07 55.51 1dww s TYR 173 Cb 0.00 0.41 -0.03 0.00 -1.10 0.00 0.00 41.96 41.24 1dww s TYR 173 CO 0.00 -0.90 -0.09 -0.65 -2.51 0.00 0.00 175.55 171.40 1dww s GLN 174 N -3.86 2.78 0.45 -3.49 -1.52 -1.26 -5.07 119.66 107.69 1dww s GLN 174 Ca 0.08 -0.59 -0.17 0.00 -1.95 0.00 0.00 55.36 52.73 1dww s GLN 174 Cb -0.01 -2.56 -0.09 0.00 -0.22 0.00 0.00 33.01 30.13 1dww s GLN 174 CO -0.04 0.61 0.92 -0.51 -0.25 0.00 0.00 175.29 176.02 1dww s LEU 175 N -0.67 3.80 0.58 2.90 1.43 -1.26 -5.05 118.68 120.41 1dww s LEU 175 Ca 0.10 1.52 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 1dww s LEU 175 Cb -0.11 -4.41 -0.05 0.00 0.03 0.00 0.00 46.19 41.65 1dww s LEU 175 CO 0.01 -0.45 1.02 0.42 0.23 0.00 0.00 176.35 177.58 1dww s THR 176 N -2.38 4.59 0.29 5.49 -4.23 -1.26 -4.87 115.64 113.27 1dww s THR 176 Ca 0.58 1.00 0.01 0.00 -1.18 0.00 0.00 61.69 62.11 1dww s THR 176 Cb -0.10 -3.78 0.29 0.00 1.34 0.00 0.00 72.50 70.25 1dww s THR 176 CO 0.24 -0.95 1.86 0.25 -0.54 0.00 0.00 174.62 175.48 1dww h LEU 177 N 0.15 0.92 -0.54 4.79 5.85 -1.99 -0.71 115.31 123.77 1dww h LEU 177 Ca -0.45 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.31 1dww h LEU 177 Cb 1.19 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 1dww h LEU 177 CO 0.61 0.51 0.36 -0.78 -0.34 0.00 0.00 178.44 178.81 1dww h ASP 178 N 1.00 0.62 -0.26 1.25 1.82 -1.99 -1.05 116.42 117.80 1dww h ASP 178 Ca 0.47 -0.01 -0.08 0.00 -0.39 0.00 0.00 57.03 57.01 1dww h ASP 178 Cb 0.43 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 40.27 1dww h ASP 178 CO -0.23 0.45 -0.11 -0.33 -1.61 0.00 0.00 179.24 177.41 1dww h GLU 179 N 0.73 0.66 -0.03 0.28 5.08 -1.66 -1.65 114.58 117.99 1dww h GLU 179 Ca 0.20 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1dww h GLU 179 Cb -0.08 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1dww h GLU 179 CO -0.05 0.76 0.01 1.25 -1.00 0.00 0.00 179.01 179.98 1dww h LEU 180 N 0.61 0.04 -0.56 1.33 6.46 -0.58 0.15 115.31 122.76 1dww h LEU 180 Ca 0.11 -0.15 0.06 0.00 -0.12 0.00 0.00 57.88 57.77 1dww h LEU 180 Cb 0.55 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.41 1dww h LEU 180 CO 0.03 0.19 0.26 0.40 -0.62 0.00 0.00 178.44 178.70 1dww h ILE 181 N -0.10 0.91 -0.48 4.05 2.04 -1.04 0.23 117.51 123.12 1dww h ILE 181 Ca 0.01 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1dww h ILE 181 Cb 0.16 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1dww h ILE 181 CO -0.00 0.09 0.19 0.15 0.00 0.00 0.00 178.15 178.58 1dww h PHE 182 N 0.50 0.73 -0.49 1.37 3.57 -1.11 -2.34 116.94 119.18 1dww h PHE 182 Ca 0.26 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1dww h PHE 182 Cb 0.21 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1dww h PHE 182 CO -0.12 0.61 0.27 0.00 -2.23 0.00 0.00 178.31 176.85 1dww h ALA 183 N 1.04 0.62 -0.26 2.41 0.00 0.45 0.91 119.26 124.43 1dww h ALA 183 Ca 0.16 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1dww h ALA 183 Cb 0.19 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1dww h ALA 183 CO -0.01 0.13 -0.35 1.79 0.00 0.00 0.00 179.25 180.80 1dww h THR 184 N 0.64 1.29 -0.20 0.00 1.35 -0.50 -0.67 112.91 114.82 1dww h THR 184 Ca 0.17 -1.49 -0.11 0.00 -0.55 0.00 0.00 66.41 64.43 1dww h THR 184 Cb 0.03 1.47 -0.00 0.00 -1.73 0.00 0.00 68.15 67.92 1dww h THR 184 CO -0.03 0.47 -0.31 0.11 -0.25 0.00 0.00 175.52 175.51 1dww h LYS 185 N 0.49 0.57 -0.55 4.72 1.57 -1.16 -2.19 116.57 120.02 1dww h LYS 185 Ca 0.05 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 1dww h LYS 185 Cb 0.84 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.16 1dww h LYS 185 CO 0.07 0.95 -0.00 0.52 -0.57 0.00 0.00 179.45 180.41 1dww h MET 186 N 0.24 0.94 -0.49 3.15 2.86 -0.77 0.22 114.93 121.08 1dww h MET 186 Ca 0.02 -0.28 -0.07 0.00 -2.06 0.00 0.00 59.70 57.31 1dww h MET 186 Cb 0.89 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 1dww h MET 186 CO 0.07 0.93 0.02 0.00 1.06 0.00 0.00 176.91 178.99 1dww h ALA 187 N 1.12 1.12 -0.19 6.32 0.00 -1.11 0.46 119.26 126.98 1dww h ALA 187 Ca 0.16 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1dww h ALA 187 Cb 0.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1dww h ALA 187 CO 0.03 0.57 -0.06 2.35 0.00 0.00 0.00 179.25 182.13 1dww h TRP 188 N 0.75 0.42 -0.92 0.00 7.01 -1.01 -1.96 115.95 120.25 1dww h TRP 188 Ca 0.15 -0.10 0.12 0.00 2.11 0.00 0.00 58.89 61.18 1dww h TRP 188 Cb 0.43 -0.10 -0.07 0.00 -2.10 0.00 0.00 29.16 27.31 1dww h TRP 188 CO 0.02 0.65 0.59 -0.09 -2.79 0.00 0.00 178.44 176.82 1dww h ARG 189 N 0.08 0.80 -0.04 2.65 2.43 0.27 -0.29 114.38 120.28 1dww h ARG 189 Ca 0.05 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1dww h ARG 189 Cb 0.52 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1dww h ARG 189 CO 0.02 0.53 0.00 0.09 -1.51 0.00 0.00 179.97 179.10 1dww n ASN 190 N -4.57 0.70 -4.57 -3.80 3.02 0.15 -4.79 115.26 101.41 1dww n ASN 190 Ca 0.17 -1.38 -0.42 0.00 -0.03 0.00 0.00 54.58 52.93 1dww n ASN 190 Cb 0.40 -0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1dww n ASN 190 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dww s ALA 191 N -1.96 2.84 -0.27 5.41 0.00 -0.12 -4.73 121.76 122.92 1dww s ALA 191 Ca 0.37 -0.85 0.26 0.00 0.00 0.00 0.00 51.96 51.74 1dww s ALA 191 Cb 0.18 -4.12 1.16 0.00 0.00 0.00 0.00 23.12 20.34 1dww s ALA 191 CO 0.30 -2.94 1.78 -1.00 0.00 0.00 0.00 175.76 173.89 1dww h PRO 192 N 10.52 0.00 -0.70 0.00 0.13 -1.87 -2.84 132.00 137.24 1dww h PRO 192 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1dww h PRO 192 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1dww h PRO 192 CO 1.20 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.51 1dww n ARG 193 N -2.41 2.70 -3.85 0.86 1.74 -1.26 -0.08 116.66 114.36 1dww n ARG 193 Ca 0.01 -2.64 -0.36 0.00 -0.77 0.00 0.00 57.85 54.10 1dww n ARG 193 Cb 0.19 -1.57 -0.13 0.00 -1.02 0.00 0.00 32.46 29.93 1dww n ARG 193 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dww n ILE 195 N 4.79 0.39 1.40 0.00 3.06 -1.26 -3.87 119.36 123.87 1dww n ILE 195 Ca -0.17 -0.24 0.10 0.00 -2.50 0.00 0.00 62.75 59.94 1dww n ILE 195 Cb 0.51 -0.30 0.41 0.00 0.54 0.00 0.00 39.64 40.81 1dww n ILE 195 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1dww n GLY 196 N 1.35 -0.01 0.00 4.50 0.00 -1.26 -4.39 105.19 105.38 1dww n GLY 196 Ca 0.05 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1dww n GLY 196 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dww n ARG 197 N 0.07 0.00 0.19 1.61 1.74 -1.25 -1.64 116.66 117.38 1dww n ARG 197 Ca 0.16 0.17 0.14 0.00 -0.77 0.00 0.00 57.85 57.54 1dww n ARG 197 Cb 0.27 -1.60 0.50 0.00 -1.02 0.00 0.00 32.46 30.61 1dww n ARG 197 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1dww h ILE 198 N 0.00 0.00 -0.16 0.55 2.10 -1.87 -2.69 117.51 115.44 1dww h ILE 198 Ca 0.00 -0.49 0.00 0.00 1.08 0.00 0.00 64.86 65.45 1dww h ILE 198 Cb 0.19 1.40 0.00 0.00 -1.09 0.00 0.00 36.82 37.32 1dww h ILE 198 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.07 1dww n GLN 199 N -2.67 1.73 -0.41 2.19 1.13 -0.65 -4.59 117.38 114.12 1dww n GLN 199 Ca 0.02 -1.10 0.37 0.00 -1.94 0.00 0.00 57.00 54.35 1dww n GLN 199 Cb 0.34 -1.40 0.71 0.00 0.11 0.00 0.00 30.24 29.99 1dww n GLN 199 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 1dww h TRP 200 N 2.25 0.19 -0.01 1.08 5.08 -1.69 0.79 115.95 123.64 1dww h TRP 200 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 1dww h TRP 200 Cb 0.49 -0.05 0.00 0.00 -3.00 0.00 0.00 29.16 26.60 1dww h TRP 200 CO 0.10 -0.02 -0.03 -1.13 -1.28 0.00 0.00 178.44 176.08 1dww n SER 201 N -4.29 1.07 -4.09 0.11 3.41 -1.26 -4.57 113.62 104.00 1dww n SER 201 Ca 0.30 -1.26 -0.36 0.00 -0.26 0.00 0.00 58.87 57.29 1dww n SER 201 Cb 1.34 0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 65.20 1dww n SER 201 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1dww s ASN 202 N -2.09 5.19 -0.18 4.04 0.02 0.27 -5.04 114.94 117.15 1dww s ASN 202 Ca 0.38 -2.80 -0.08 0.00 -1.02 0.00 0.00 52.86 49.33 1dww s ASN 202 Cb 0.21 -1.84 0.07 0.00 0.02 0.00 0.00 41.25 39.71 1dww s ASN 202 CO 0.37 -0.37 0.41 -0.22 0.02 0.00 0.00 177.10 177.30 1dww s LEU 203 N 0.01 -0.30 0.02 0.60 2.96 -1.26 -4.65 118.68 116.05 1dww s LEU 203 Ca 0.16 0.91 -0.24 0.00 -0.22 0.00 0.00 54.13 54.74 1dww s LEU 203 Cb -0.21 1.31 -0.05 0.00 0.50 0.00 0.00 46.19 47.75 1dww s LEU 203 CO -0.03 -0.21 0.74 -1.58 -1.32 0.00 0.00 176.35 173.95 1dww s GLN 204 N 1.89 4.47 -0.20 1.98 2.00 -0.82 -4.98 119.66 124.00 1dww s GLN 204 Ca -0.06 1.00 -0.02 0.00 -2.00 0.00 0.00 55.36 54.28 1dww s GLN 204 Cb -0.10 -3.38 0.00 0.00 0.80 0.00 0.00 33.01 30.33 1dww s GLN 204 CO -0.13 0.24 -0.11 0.08 -0.50 0.00 0.00 175.29 174.87 1dww s VAL 205 N 0.13 2.83 -0.35 1.34 1.01 -1.26 -1.20 120.40 122.90 1dww s VAL 205 Ca 0.38 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 1dww s VAL 205 Cb -0.20 -2.25 -0.00 0.00 0.00 0.00 0.00 36.38 33.93 1dww s VAL 205 CO 0.21 0.48 0.22 -0.36 0.00 0.00 0.00 175.10 175.65 1dww s PHE 206 N 1.31 3.22 -0.82 5.22 0.08 0.94 -4.99 117.98 122.94 1dww s PHE 206 Ca 0.04 -0.46 -0.23 0.00 0.12 0.00 0.00 56.93 56.41 1dww s PHE 206 Cb -0.14 -2.45 0.07 0.00 -0.57 0.00 0.00 43.02 39.93 1dww s PHE 206 CO -0.06 -0.45 1.19 0.34 -0.10 0.00 0.00 175.22 176.13 1dww s ASP 207 N 1.67 6.34 -0.38 1.36 2.15 -1.26 -0.28 116.67 126.27 1dww s ASP 207 Ca 0.05 -1.20 0.06 0.00 0.43 0.00 0.00 52.55 51.89 1dww s ASP 207 Cb -0.18 -2.48 0.51 0.00 -0.30 0.00 0.00 42.92 40.47 1dww s ASP 207 CO 0.09 -1.47 1.57 0.00 -0.17 0.00 0.00 175.17 175.19 1dww n ALA 208 N 8.12 5.02 0.61 3.66 0.00 0.98 -4.67 120.51 134.23 1dww n ALA 208 Ca 0.12 -3.33 0.08 0.00 0.00 0.00 0.00 53.44 50.31 1dww n ALA 208 Cb 0.48 -0.93 0.36 0.00 0.00 0.00 0.00 19.45 19.36 1dww n ALA 208 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1dww n ARG 209 N -1.00 0.05 -0.27 0.00 1.74 -0.94 -2.45 116.66 113.78 1dww n ARG 209 Ca 0.44 0.20 0.11 0.00 -0.77 0.00 0.00 57.85 57.83 1dww n ARG 209 Cb 1.02 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 31.21 1dww n ARG 209 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1dww n ASN 210 N -1.45 3.56 -4.77 0.55 0.23 -1.26 -4.19 115.26 107.92 1dww n ASN 210 Ca 0.05 -1.98 -0.38 0.00 -0.53 0.00 0.00 54.58 51.74 1dww n ASN 210 Cb 0.18 -0.35 -0.02 0.00 -2.08 0.00 0.00 39.78 37.50 1dww n ASN 210 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1dww n SER 212 N -0.01 0.94 -4.55 0.00 3.41 -1.26 -4.72 113.62 107.42 1dww n SER 212 Ca 0.05 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.42 1dww n SER 212 Cb 0.47 0.17 -0.09 0.00 -0.26 0.00 0.00 64.21 64.51 1dww n SER 212 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1dww s THR 213 N -0.48 2.97 0.25 6.66 -4.23 -1.26 -4.52 115.64 115.03 1dww s THR 213 Ca 0.00 -2.10 -0.06 0.00 -1.18 0.00 0.00 61.69 58.36 1dww s THR 213 Cb 0.00 -2.56 0.25 0.00 1.34 0.00 0.00 72.50 71.53 1dww s THR 213 CO 0.00 -0.35 1.92 0.00 -0.54 0.00 0.00 174.62 175.66 1dww h ALA 214 N 2.21 1.28 -0.64 3.99 0.00 -1.91 -1.31 119.26 122.88 1dww h ALA 214 Ca -0.43 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1dww h ALA 214 Cb 1.25 -0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1dww h ALA 214 CO 0.59 0.66 0.29 0.37 0.00 0.00 0.00 179.25 181.15 1dww h GLN 215 N 1.33 0.92 -0.11 0.00 5.75 -1.96 -0.90 115.11 120.13 1dww h GLN 215 Ca 0.36 -0.13 -0.14 0.00 -0.15 0.00 0.00 58.65 58.58 1dww h GLN 215 Cb -0.13 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.24 1dww h GLN 215 CO -0.07 0.73 -0.56 0.93 -2.65 0.00 0.00 178.83 177.20 1dww h GLU 216 N 0.91 0.34 0.13 1.69 5.08 -1.73 -2.27 114.58 118.72 1dww h GLU 216 Ca 0.22 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1dww h GLU 216 Cb 0.13 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1dww h GLU 216 CO -0.03 0.81 -0.06 0.52 -1.00 0.00 0.00 179.01 179.25 1dww h MET 217 N 0.26 -0.16 -0.96 2.33 2.86 -0.51 -1.46 114.93 117.28 1dww h MET 217 Ca 0.00 0.01 0.15 0.00 -2.06 0.00 0.00 59.70 57.81 1dww h MET 217 Cb 1.06 0.04 -0.09 0.00 0.06 0.00 0.00 31.60 32.66 1dww h MET 217 CO 0.09 0.04 0.58 0.35 1.06 0.00 0.00 176.91 179.02 1dww h PHE 218 N -0.34 1.02 -0.33 -0.22 3.57 -1.14 0.14 116.94 119.65 1dww h PHE 218 Ca -0.02 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1dww h PHE 218 Cb 0.28 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1dww h PHE 218 CO -0.02 0.31 -0.04 1.96 -2.23 0.00 0.00 178.31 178.29 1dww h GLN 219 N 0.82 0.61 -0.77 1.11 4.20 -1.19 -1.74 115.11 118.15 1dww h GLN 219 Ca 0.52 -0.22 -0.03 0.00 0.06 0.00 0.00 58.65 58.98 1dww h GLN 219 Cb 0.68 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.38 1dww h GLN 219 CO -0.33 0.76 0.35 0.45 -0.67 0.00 0.00 178.83 179.39 1dww h HIS 220 N 0.40 1.12 -0.80 2.96 3.86 -0.08 -2.07 115.15 120.54 1dww h HIS 220 Ca 0.09 -0.07 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1dww h HIS 220 Cb 0.52 -0.34 -0.04 0.00 1.06 0.00 0.00 27.41 28.61 1dww h HIS 220 CO 0.04 0.83 0.43 0.82 0.86 0.00 0.00 177.93 180.92 1dww h ILE 221 N 1.09 1.24 -0.39 2.45 2.04 -0.66 -1.58 117.51 121.71 1dww h ILE 221 Ca 0.26 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1dww h ILE 221 Cb 0.15 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1dww h ILE 221 CO -0.03 0.27 0.19 0.00 0.00 0.00 0.00 178.15 178.58 1dww h ARG 223 N 0.48 0.63 0.53 0.00 2.43 -1.09 -0.96 114.38 116.41 1dww h ARG 223 Ca 0.13 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1dww h ARG 223 Cb 0.12 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1dww h ARG 223 CO -0.02 0.46 -0.26 1.25 -1.51 0.00 0.00 179.97 179.90 1dww h HIS 224 N 0.64 -0.66 -0.71 2.20 2.76 -0.66 -1.36 115.15 117.37 1dww h HIS 224 Ca 0.17 -0.02 0.15 0.00 -2.20 0.00 0.00 60.37 58.47 1dww h HIS 224 Cb 0.01 0.22 -0.10 0.00 1.55 0.00 0.00 27.41 29.09 1dww h HIS 224 CO 0.00 -0.34 0.17 0.82 -1.30 0.00 0.00 177.93 177.28 1dww h ILE 225 N -1.00 0.54 -0.46 6.26 2.04 -0.97 0.17 117.51 124.09 1dww h ILE 225 Ca -0.07 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1dww h ILE 225 Cb 0.62 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1dww h ILE 225 CO 0.12 0.05 0.17 0.25 0.00 0.00 0.00 178.15 178.74 1dww h LEU 226 N 0.27 0.64 -0.03 1.44 5.85 -1.15 -1.55 115.31 120.78 1dww h LEU 226 Ca 0.39 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 1dww h LEU 226 Cb 0.65 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 1dww h LEU 226 CO -0.49 0.65 -0.02 0.22 -0.34 0.00 0.00 178.44 178.46 1dww h TYR 227 N 0.60 0.07 -0.13 1.25 5.03 -0.25 -2.70 116.97 120.84 1dww h TYR 227 Ca 0.15 -0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.47 1dww h TYR 227 Cb 0.21 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.44 1dww h TYR 227 CO 0.01 0.50 -0.07 0.00 -1.32 0.00 0.00 178.16 177.27 1dww h ALA 228 N 0.56 0.05 -0.20 1.82 0.00 -0.69 -3.04 119.26 117.76 1dww h ALA 228 Ca 0.01 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1dww h ALA 228 Cb 0.48 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 1dww h ALA 228 CO 0.01 -0.52 -0.14 1.15 0.00 0.00 0.00 179.25 179.75 1dww h THR 229 N -0.06 0.60 -5.88 0.00 2.02 -1.35 -1.17 112.91 107.07 1dww h THR 229 Ca 0.08 0.00 -0.38 0.00 0.77 0.00 0.00 66.41 66.88 1dww h THR 229 Cb 0.17 0.60 -0.15 0.00 -1.74 0.00 0.00 68.15 67.03 1dww h THR 229 CO -0.17 0.00 -0.55 -3.20 0.37 0.00 0.00 175.52 171.97 1dww n ASN 230 N -5.30 -2.66 -3.43 4.18 5.15 -1.02 -1.30 115.26 110.88 1dww n ASN 230 Ca -0.02 -0.47 -0.20 0.00 -0.60 0.00 0.00 54.58 53.30 1dww n ASN 230 Cb 0.21 -2.26 0.06 0.00 -0.53 0.00 0.00 39.78 37.26 1dww n ASN 230 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1dww n ASN 231 N -2.19 -4.91 0.00 1.20 4.05 -1.26 -3.03 115.26 109.12 1dww n ASN 231 Ca 0.03 -0.77 0.00 0.00 0.45 0.00 0.00 54.58 54.28 1dww n ASN 231 Cb 0.51 -4.67 0.00 0.00 1.23 0.00 0.00 39.78 36.84 1dww n ASN 231 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1dww n GLY 232 N -1.35 2.20 2.65 8.20 0.00 -0.42 -4.91 105.19 111.57 1dww n GLY 232 Ca -0.14 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1dww n GLY 232 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dww n ASN 233 N 1.16 5.11 -4.45 1.61 4.05 -1.17 -0.47 115.26 121.10 1dww n ASN 233 Ca 0.00 -2.83 -0.50 0.00 0.45 0.00 0.00 54.58 51.70 1dww n ASN 233 Cb 0.00 -1.61 -0.04 0.00 1.23 0.00 0.00 39.78 39.36 1dww n ASN 233 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 177.26 173.83 1dww n ILE 234 N 4.48 1.54 -4.60 -1.44 2.08 -1.24 -4.63 119.36 115.56 1dww n ILE 234 Ca 0.56 -0.38 -0.24 0.00 0.56 0.00 0.00 62.75 63.25 1dww n ILE 234 Cb 0.35 -0.16 -0.16 0.00 -0.75 0.00 0.00 39.64 38.92 1dww n ILE 234 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1dww s ARG 235 N -0.82 1.45 0.20 0.38 0.52 -0.44 -5.00 118.95 115.25 1dww s ARG 235 Ca 0.69 -0.44 -0.30 0.00 -0.52 0.00 0.00 55.73 55.16 1dww s ARG 235 Cb -0.97 -1.27 -0.09 0.00 0.52 0.00 0.00 34.95 33.15 1dww s ARG 235 CO 0.56 0.13 1.35 -1.12 0.02 0.00 0.00 175.30 176.25 1dww s SER 236 N 0.28 6.83 0.10 0.23 0.01 -1.26 -4.50 113.70 115.39 1dww s SER 236 Ca -0.07 2.46 -0.18 0.00 1.31 0.00 0.00 55.95 59.47 1dww s SER 236 Cb -0.12 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.54 1dww s SER 236 CO 0.02 -0.58 0.44 0.00 0.41 0.00 0.00 173.24 173.52 1dww s ALA 237 N 0.20 -1.06 -0.05 1.44 0.00 -0.31 -1.94 121.76 120.04 1dww s ALA 237 Ca 0.58 0.16 -0.08 0.00 0.00 0.00 0.00 51.96 52.62 1dww s ALA 237 Cb -0.38 0.60 0.01 0.00 0.00 0.00 0.00 23.12 23.35 1dww s ALA 237 CO 0.38 -0.60 0.19 -1.50 0.00 0.00 0.00 175.76 174.24 1dww s ILE 238 N -3.34 0.03 -0.12 0.00 2.07 -0.34 -0.97 121.20 118.52 1dww s ILE 238 Ca -0.00 -0.24 0.02 0.00 -1.41 0.00 0.00 60.65 59.02 1dww s ILE 238 Cb 0.01 -0.36 0.01 0.00 0.13 0.00 0.00 42.46 42.25 1dww s ILE 238 CO -0.09 -0.13 -0.19 0.42 -1.91 0.00 0.00 174.94 173.04 1dww s THR 239 N -0.45 1.75 -0.25 4.00 -4.23 -0.71 -0.04 115.64 115.72 1dww s THR 239 Ca -0.05 -0.80 -0.10 0.00 -1.18 0.00 0.00 61.69 59.55 1dww s THR 239 Cb -0.04 -1.57 -0.05 0.00 1.34 0.00 0.00 72.50 72.19 1dww s THR 239 CO 0.01 0.49 0.16 -0.69 -0.54 0.00 0.00 174.62 174.05 1dww s VAL 240 N 0.83 5.27 0.60 2.29 1.01 0.62 -3.43 120.40 127.58 1dww s VAL 240 Ca -0.09 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.09 1dww s VAL 240 Cb -0.16 -3.47 0.08 0.00 0.00 0.00 0.00 36.38 32.84 1dww s VAL 240 CO -0.00 0.33 0.83 -0.36 0.00 0.00 0.00 175.10 175.89 1dww s PHE 241 N 1.23 1.90 0.21 5.22 0.08 -0.91 -0.02 117.98 125.68 1dww s PHE 241 Ca 0.07 -0.41 -0.32 0.00 0.12 0.00 0.00 56.93 56.39 1dww s PHE 241 Cb -0.14 -2.59 -0.14 0.00 -0.57 0.00 0.00 43.02 39.58 1dww s PHE 241 CO 0.06 -1.19 1.37 -2.30 -0.10 0.00 0.00 175.22 173.06 1dww n PRO 242 N -2.40 1.82 -1.62 0.24 -0.02 -1.23 -4.59 135.00 127.20 1dww n PRO 242 Ca 0.13 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.92 1dww n PRO 242 Cb 0.61 -2.29 0.07 0.00 -0.02 0.00 0.00 33.50 31.87 1dww n PRO 242 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1dww s GLN 243 N -0.22 2.45 0.10 -0.52 -2.07 -1.26 -4.64 119.66 113.50 1dww s GLN 243 Ca 0.71 1.68 -0.31 0.00 -1.82 0.00 0.00 55.36 55.62 1dww s GLN 243 Cb -0.71 -1.88 -0.10 0.00 -1.09 0.00 0.00 33.01 29.24 1dww s GLN 243 CO 0.49 -1.58 1.79 0.50 -1.32 0.00 0.00 175.29 175.17 1dww s ARG 244 N -3.85 4.15 0.00 9.60 3.52 0.42 -4.95 118.95 127.84 1dww s ARG 244 Ca 0.73 2.53 0.00 0.00 -0.13 0.00 0.00 55.73 58.86 1dww s ARG 244 Cb -0.27 -3.64 0.00 0.00 -1.56 0.00 0.00 34.95 29.47 1dww s ARG 244 CO 0.42 -0.83 0.00 -1.13 -0.81 0.00 0.00 175.30 172.96 1dww n SER 245 N 5.82 0.00 -0.53 -2.12 3.41 -1.26 -4.79 113.62 114.15 1dww n SER 245 Ca 0.17 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.88 1dww n SER 245 Cb 0.39 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.36 1dww n SER 245 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1dww n ASP 246 N -0.48 2.05 0.00 4.04 5.68 -1.26 -4.40 116.55 122.18 1dww n ASP 246 Ca 0.00 -1.52 0.00 0.00 -0.50 0.00 0.00 54.79 52.77 1dww n ASP 246 Cb 0.00 0.33 0.00 0.00 -1.14 0.00 0.00 41.12 40.31 1dww n ASP 246 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dww n GLY 247 N 1.21 0.76 0.48 6.12 0.00 -1.26 -2.38 105.19 110.12 1dww n GLY 247 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.16 1dww n GLY 247 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dww n LYS 248 N -2.00 1.51 -1.36 1.61 5.02 -1.26 -4.40 118.16 117.29 1dww n LYS 248 Ca 0.00 -1.50 0.01 0.00 -2.02 0.00 0.00 58.31 54.80 1dww n LYS 248 Cb 0.00 -1.21 0.10 0.00 -0.02 0.00 0.00 35.03 33.90 1dww n LYS 248 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1dww n HIS 249 N 0.49 0.51 -2.14 2.13 8.25 -1.26 -4.29 115.22 118.90 1dww n HIS 249 Ca 0.08 -1.32 -0.41 0.00 -0.26 0.00 0.00 57.72 55.81 1dww n HIS 249 Cb 0.32 -0.22 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 1dww n HIS 249 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1dww s ASP 250 N -2.92 6.81 -0.19 0.41 1.01 -1.26 -3.38 116.67 117.15 1dww s ASP 250 Ca 0.37 2.64 -0.17 0.00 0.71 0.00 0.00 52.55 56.10 1dww s ASP 250 Cb 0.38 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.62 1dww s ASP 250 CO -0.09 -0.52 0.44 -0.36 0.21 0.00 0.00 175.17 174.85 1dww s PHE 251 N -0.99 3.40 -0.01 4.23 0.40 -1.26 -2.04 117.98 121.71 1dww s PHE 251 Ca 0.50 0.70 -0.01 0.00 -0.60 0.00 0.00 56.93 57.52 1dww s PHE 251 Cb -0.39 -2.56 0.00 0.00 0.51 0.00 0.00 43.02 40.58 1dww s PHE 251 CO 0.51 0.01 0.02 1.03 0.70 0.00 0.00 175.22 177.48 1dww s ARG 252 N 1.25 0.04 -0.26 0.44 1.81 0.09 -3.59 118.95 118.72 1dww s ARG 252 Ca 0.21 -0.01 -0.10 0.00 -1.72 0.00 0.00 55.73 54.11 1dww s ARG 252 Cb -0.15 0.02 -0.05 0.00 -0.45 0.00 0.00 34.95 34.32 1dww s ARG 252 CO 0.09 -0.01 0.16 -0.51 -0.68 0.00 0.00 175.30 174.35 1dww s LEU 253 N -0.08 3.90 0.03 2.53 1.02 -1.26 -0.89 118.68 123.93 1dww s LEU 253 Ca -0.01 -0.03 0.25 0.00 0.02 0.00 0.00 54.13 54.36 1dww s LEU 253 Cb -0.01 -2.07 1.04 0.00 0.02 0.00 0.00 46.19 45.17 1dww s LEU 253 CO -0.00 -0.02 1.79 0.79 0.02 0.00 0.00 176.35 178.93 1dww n TRP 254 N 4.88 0.12 -2.64 0.29 7.02 -0.17 -4.58 117.44 122.36 1dww n TRP 254 Ca -0.15 0.04 -0.33 0.00 -1.02 0.00 0.00 57.50 56.04 1dww n TRP 254 Cb 0.52 -0.56 -0.05 0.00 -2.42 0.00 0.00 31.31 28.80 1dww n TRP 254 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1dww s ASN 255 N -3.19 6.63 -0.00 -0.99 -0.87 -1.26 -4.98 114.94 110.28 1dww s ASN 255 Ca 0.12 1.78 -0.24 0.00 -1.57 0.00 0.00 52.86 52.94 1dww s ASN 255 Cb 0.16 -2.54 -0.17 0.00 -0.02 0.00 0.00 41.25 38.67 1dww s ASN 255 CO 0.46 -0.58 1.20 0.28 -2.57 0.00 0.00 177.10 175.89 1dww h SER 256 N 1.62 -0.26 -4.00 -1.22 0.02 -1.93 -3.27 113.55 104.50 1dww h SER 256 Ca -0.49 -0.24 -0.35 0.00 -0.84 0.00 0.00 61.79 59.87 1dww h SER 256 Cb 1.20 0.07 -0.14 0.00 0.14 0.00 0.00 62.40 63.66 1dww h SER 256 CO 0.60 0.14 -0.67 -1.10 -1.14 0.00 0.00 176.83 174.66 1dww s GLN 257 N -4.46 1.23 0.13 3.45 -0.21 -1.26 -0.93 119.66 117.61 1dww s GLN 257 Ca -0.14 -1.60 -0.26 0.00 0.02 0.00 0.00 55.36 53.38 1dww s GLN 257 Cb 0.02 -0.56 -0.04 0.00 1.00 0.00 0.00 33.01 33.43 1dww s GLN 257 CO 0.56 -0.06 1.63 -0.07 -2.12 0.00 0.00 175.29 175.22 1dww h LEU 258 N 2.58 -0.83 -8.59 2.90 4.07 -1.43 -3.39 115.31 110.62 1dww h LEU 258 Ca -0.38 0.12 -0.65 0.00 0.08 0.00 0.00 57.88 57.05 1dww h LEU 258 Cb 1.21 0.35 -0.25 0.00 1.08 0.00 0.00 40.66 43.05 1dww h LEU 258 CO 0.64 -0.34 -0.69 -0.63 -1.08 0.00 0.00 178.44 176.34 1dww s ILE 259 N -6.04 3.64 -0.13 1.22 1.01 -1.26 -4.85 121.20 114.78 1dww s ILE 259 Ca -0.15 -0.42 -0.20 0.00 0.00 0.00 0.00 60.65 59.88 1dww s ILE 259 Cb 0.10 -2.63 0.05 0.00 0.01 0.00 0.00 42.46 39.98 1dww s ILE 259 CO 0.66 0.44 0.51 -0.60 0.00 0.00 0.00 174.94 175.95 1dww s ARG 260 N 1.04 0.71 0.29 2.79 6.06 -1.26 -4.90 118.95 123.68 1dww s ARG 260 Ca 0.01 0.45 -0.14 0.00 -2.50 0.00 0.00 55.73 53.55 1dww s ARG 260 Cb -0.15 0.34 -0.08 0.00 0.06 0.00 0.00 34.95 35.12 1dww s ARG 260 CO 0.01 -0.14 0.69 0.71 -2.50 0.00 0.00 175.30 174.06 1dww s TYR 261 N -0.33 3.42 0.64 5.12 2.02 -1.26 0.05 117.35 127.00 1dww s TYR 261 Ca -0.05 1.16 -0.11 0.00 -0.37 0.00 0.00 57.07 57.69 1dww s TYR 261 Cb -0.03 -2.48 -0.03 0.00 -0.40 0.00 0.00 41.96 39.02 1dww s TYR 261 CO 0.03 0.16 1.04 0.00 -1.57 0.00 0.00 175.55 175.21 1dww s ALA 262 N -1.89 2.96 -0.06 3.71 0.00 -0.46 -4.46 121.76 121.56 1dww s ALA 262 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1dww s ALA 262 Cb -0.11 -3.12 0.02 0.00 0.00 0.00 0.00 23.12 19.91 1dww s ALA 262 CO 0.19 -0.84 -0.05 0.20 0.00 0.00 0.00 175.76 175.26 1dww s GLY 263 N -3.97 0.56 -0.03 0.00 0.00 -1.23 -1.08 107.32 101.58 1dww s GLY 263 Ca 0.56 -0.20 0.07 0.00 0.00 0.00 0.00 44.72 45.16 1dww s GLY 263 CO 0.53 0.61 -0.24 -0.19 0.00 0.00 0.00 173.10 173.80 1dww s TYR 264 N 1.23 2.38 -1.27 1.90 2.02 -0.31 -4.48 117.35 118.82 1dww s TYR 264 Ca -0.06 -0.43 -0.11 0.00 -0.37 0.00 0.00 57.07 56.10 1dww s TYR 264 Cb -0.14 -1.52 0.16 0.00 -0.40 0.00 0.00 41.96 40.06 1dww s TYR 264 CO -0.02 -0.03 1.76 0.94 -1.57 0.00 0.00 175.55 176.64 1dww n GLN 265 N 2.47 3.51 -0.99 -0.62 -0.06 -1.26 -1.28 117.38 119.14 1dww n GLN 265 Ca -0.16 -3.58 -0.34 0.00 -2.00 0.00 0.00 57.00 50.92 1dww n GLN 265 Cb 0.51 -2.99 0.10 0.00 -4.06 0.00 0.00 30.24 23.81 1dww n GLN 265 CO 0.00 0.00 0.00 -1.33 -0.20 0.00 0.00 177.06 175.53 1dww n MET 266 N 4.56 -0.04 -0.27 3.69 2.81 -1.22 -4.93 117.12 121.71 1dww n MET 266 Ca 0.40 0.04 0.04 0.00 -1.81 0.00 0.00 57.70 56.37 1dww n MET 266 Cb 0.38 -1.86 0.18 0.00 -0.71 0.00 0.00 33.22 31.22 1dww n MET 266 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1dww h PRO 267 N -1.07 0.60 -1.02 0.03 0.13 -1.95 -2.90 132.00 125.81 1dww h PRO 267 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1dww h PRO 267 Cb 1.31 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1dww h PRO 267 CO 0.38 0.40 0.00 -0.40 -0.23 0.00 0.00 178.00 178.14 1dww n ASP 268 N -4.87 1.75 0.00 1.44 5.75 -1.26 -4.82 116.55 114.54 1dww n ASP 268 Ca 0.14 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.27 1dww n ASP 268 Cb 0.35 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1dww n ASP 268 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1dww n GLY 269 N 0.37 2.59 0.00 6.12 0.00 -1.10 -4.99 105.19 108.18 1dww n GLY 269 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1dww n GLY 269 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dww n THR 270 N -1.93 0.00 -3.67 2.61 -2.24 -1.26 -4.92 114.28 102.88 1dww n THR 270 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 1dww n THR 270 Cb 0.00 -1.71 -0.10 0.00 -2.10 0.00 0.00 70.33 66.42 1dww n THR 270 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1dww s ILE 271 N -0.20 -0.49 0.02 2.28 1.01 -1.26 -3.45 121.20 119.10 1dww s ILE 271 Ca 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.80 1dww s ILE 271 Cb 0.00 -0.65 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1dww s ILE 271 CO 0.00 0.06 0.14 -0.13 0.00 0.00 0.00 174.94 175.02 1dww s ARG 272 N 2.32 3.24 4.16 2.79 0.52 -0.41 -4.91 118.95 126.66 1dww s ARG 272 Ca -0.03 -0.46 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 1dww s ARG 272 Cb -0.11 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.40 1dww s ARG 272 CO -0.13 0.63 0.00 0.41 0.02 0.00 0.00 175.30 176.24 1dww n GLY 273 N 0.79 0.50 3.21 -3.53 0.00 -1.19 -1.16 105.19 103.81 1dww n GLY 273 Ca -0.10 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 1dww n GLY 273 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dww s ASP 274 N -4.00 5.44 0.62 1.61 -1.08 -0.24 -4.61 116.67 114.41 1dww s ASP 274 Ca 0.00 -1.63 0.40 0.00 -0.52 0.00 0.00 52.55 50.81 1dww s ASP 274 Cb 0.00 -1.91 2.20 0.00 -1.46 0.00 0.00 42.92 41.75 1dww s ASP 274 CO 0.00 -0.51 2.24 0.00 0.52 0.00 0.00 175.17 177.42 1dww h ALA 275 N 8.26 1.03 -0.18 3.66 0.00 -1.76 -2.05 119.26 128.21 1dww h ALA 275 Ca -0.20 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1dww h ALA 275 Cb 1.07 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1dww h ALA 275 CO 0.72 -0.03 -0.42 0.00 0.00 0.00 0.00 179.25 179.52 1dww h ALA 276 N 1.94 0.95 -0.74 0.00 0.00 -1.90 -3.12 119.26 116.40 1dww h ALA 276 Ca 0.00 -0.43 -0.46 0.00 0.00 0.00 0.00 54.91 54.01 1dww h ALA 276 Cb 0.06 -0.10 -0.22 0.00 0.00 0.00 0.00 17.79 17.53 1dww h ALA 276 CO 0.00 0.63 0.60 0.25 0.00 0.00 0.00 179.25 180.73 1dww n THR 277 N -4.02 3.03 0.18 0.00 -2.24 -0.77 -4.64 114.28 105.82 1dww n THR 277 Ca -0.02 -2.02 -0.08 0.00 -2.27 0.00 0.00 64.05 59.67 1dww n THR 277 Cb 0.51 -1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 67.65 1dww n THR 277 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1dww h LEU 278 N 1.87 -0.44 -1.67 3.22 3.38 -1.68 -2.27 115.31 117.72 1dww h LEU 278 Ca 0.46 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.52 1dww h LEU 278 Cb 1.33 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.16 1dww h LEU 278 CO 1.07 -0.06 0.36 -0.08 0.09 0.00 0.00 178.44 179.82 1dww h GLU 279 N -1.03 0.38 0.03 1.13 4.81 -1.87 -1.86 114.58 116.16 1dww h GLU 279 Ca -0.05 -0.02 -0.22 0.00 -0.13 0.00 0.00 59.36 58.94 1dww h GLU 279 Cb 0.40 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1dww h GLU 279 CO 0.09 0.25 -1.00 0.35 -0.73 0.00 0.00 179.01 177.97 1dww h PHE 280 N 0.39 0.27 -0.49 0.92 3.57 -1.89 -2.91 116.94 116.81 1dww h PHE 280 Ca 0.24 -0.17 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1dww h PHE 280 Cb 0.45 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1dww h PHE 280 CO -0.00 1.06 0.20 1.15 -2.23 0.00 0.00 178.31 178.49 1dww h THR 281 N 0.07 1.21 -0.58 4.41 2.02 -0.73 -1.51 112.91 117.80 1dww h THR 281 Ca -0.06 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 1dww h THR 281 Cb 1.68 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.78 1dww h THR 281 CO 0.15 0.24 0.36 -0.61 0.37 0.00 0.00 175.52 176.03 1dww h GLN 282 N 0.64 0.79 -0.76 6.66 5.75 -1.50 -1.26 115.11 125.44 1dww h GLN 282 Ca 0.16 -0.06 0.08 0.00 -0.15 0.00 0.00 58.65 58.68 1dww h GLN 282 Cb 0.18 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 28.50 1dww h GLN 282 CO -0.01 0.55 0.42 1.25 -2.65 0.00 0.00 178.83 178.38 1dww h LEU 283 N 0.79 0.59 -1.14 -2.39 5.85 -1.26 0.29 115.31 118.04 1dww h LEU 283 Ca 0.21 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.93 1dww h LEU 283 Cb -0.04 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 1dww h LEU 283 CO -0.04 0.35 0.12 0.00 -0.34 0.00 0.00 178.44 178.53 1dww h ILE 285 N 0.71 0.88 -0.38 0.00 1.08 0.56 0.31 117.51 120.67 1dww h ILE 285 Ca 0.16 -0.56 0.11 0.00 -0.39 0.00 0.00 64.86 64.18 1dww h ILE 285 Cb 0.26 1.20 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 1dww h ILE 285 CO -0.00 0.12 0.35 0.44 -0.69 0.00 0.00 178.15 178.37 1dww h ASP 286 N -0.56 0.00 -0.39 1.72 5.19 -0.55 0.24 116.42 122.07 1dww h ASP 286 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1dww h ASP 286 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 1dww h ASP 286 CO 0.05 0.00 0.00 0.18 -3.12 0.00 0.00 179.24 176.35 1dww n LEU 287 N -3.97 2.67 0.00 1.55 4.77 -0.88 -4.91 117.00 116.23 1dww n LEU 287 Ca 0.06 -1.34 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 1dww n LEU 287 Cb 0.52 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1dww n LEU 287 CO 0.31 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1dww n GLY 288 N 0.90 0.67 3.78 -0.72 0.00 0.83 -4.86 105.19 105.79 1dww n GLY 288 Ca 0.14 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.37 1dww n GLY 288 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1dww s TRP 289 N -2.00 3.51 -0.62 1.61 -0.00 0.07 -4.99 118.94 116.52 1dww s TRP 289 Ca 0.00 1.72 -0.22 0.00 -0.00 0.00 0.00 56.10 57.60 1dww s TRP 289 Cb 0.00 -3.00 0.07 0.00 -0.00 0.00 0.00 33.47 30.54 1dww s TRP 289 CO 0.00 -0.13 0.89 0.15 -0.00 0.00 0.00 176.95 177.86 1dww s LYS 290 N -2.28 3.13 -0.09 5.86 -0.14 -1.26 -4.56 119.74 120.40 1dww s LYS 290 Ca 0.54 -0.84 -0.29 0.00 -1.36 0.00 0.00 55.97 54.01 1dww s LYS 290 Cb -0.19 -4.20 -0.06 0.00 -1.68 0.00 0.00 37.83 31.69 1dww s LYS 290 CO 0.25 -1.67 1.96 -1.25 -0.76 0.00 0.00 175.35 173.88 1dww s PRO 291 N 3.68 3.78 0.00 -1.68 0.04 -1.26 -4.88 135.00 134.68 1dww s PRO 291 Ca 0.21 2.25 0.19 0.00 0.04 0.00 0.00 61.00 63.68 1dww s PRO 291 Cb -0.18 -4.19 0.68 0.00 0.04 0.00 0.00 34.50 30.84 1dww s PRO 291 CO 0.11 -1.36 1.50 -2.13 0.04 0.00 0.00 177.00 175.16 1dww n ARG 292 N 7.90 1.71 -3.06 4.56 0.63 -1.26 -5.00 116.66 122.15 1dww n ARG 292 Ca 0.23 -1.08 -0.24 0.00 -0.92 0.00 0.00 57.85 55.84 1dww n ARG 292 Cb 0.43 -1.36 0.02 0.00 0.45 0.00 0.00 32.46 31.99 1dww n ARG 292 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1dww n TYR 293 N 0.31 -1.70 -2.38 -0.14 4.01 -1.26 -4.97 117.16 111.04 1dww n TYR 293 Ca 0.15 0.71 0.00 0.00 -0.16 0.00 0.00 57.90 58.60 1dww n TYR 293 Cb 0.31 -1.53 0.00 0.00 -0.31 0.00 0.00 39.34 37.81 1dww n TYR 293 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dww n GLY 294 N -0.64 4.69 0.05 2.72 0.00 -1.26 -5.09 105.19 105.67 1dww n GLY 294 Ca -0.14 -1.14 -0.05 0.00 0.00 0.00 0.00 46.02 44.69 1dww n GLY 294 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dww n ARG 295 N 0.00 2.27 -2.50 1.61 1.74 -1.26 -3.16 116.66 115.35 1dww n ARG 295 Ca 0.00 -0.01 -0.18 0.00 -0.77 0.00 0.00 57.85 56.90 1dww n ARG 295 Cb 0.00 -1.27 0.02 0.00 -1.02 0.00 0.00 32.46 30.19 1dww n ARG 295 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1dww n PHE 296 N -2.38 2.35 -2.63 -1.55 3.72 -1.26 -3.97 117.46 111.74 1dww n PHE 296 Ca -0.17 -2.73 -0.42 0.00 -0.05 0.00 0.00 57.45 54.08 1dww n PHE 296 Cb 0.83 -0.23 -0.03 0.00 -0.94 0.00 0.00 39.48 39.11 1dww n PHE 296 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1dww s ASP 297 N -3.46 6.23 -0.23 4.37 1.01 -1.26 -4.93 116.67 118.39 1dww s ASP 297 Ca 0.40 -0.44 -0.33 0.00 0.71 0.00 0.00 52.55 52.89 1dww s ASP 297 Cb 0.41 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.72 1dww s ASP 297 CO -0.06 -1.66 2.11 0.52 0.21 0.00 0.00 175.17 176.29 1dww n VAL 298 N 6.33 0.36 -0.85 -1.27 0.31 -1.26 -1.35 118.33 120.59 1dww n VAL 298 Ca 0.03 -0.28 -0.30 0.00 -0.01 0.00 0.00 64.34 63.78 1dww n VAL 298 Cb 0.48 -2.01 0.16 0.00 -0.91 0.00 0.00 33.84 31.57 1dww n VAL 298 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1dww s LEU 299 N 6.66 2.45 0.16 7.52 1.43 0.11 -4.86 118.68 132.15 1dww s LEU 299 Ca 1.02 1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 55.90 1dww s LEU 299 Cb -0.64 -4.27 -0.07 0.00 0.03 0.00 0.00 46.19 41.24 1dww s LEU 299 CO 0.46 -3.02 0.53 -2.16 0.23 0.00 0.00 176.35 172.38 1dww s PRO 300 N -4.71 3.90 0.10 1.29 0.04 -1.26 -4.56 135.00 129.80 1dww s PRO 300 Ca 0.65 0.39 -0.31 0.00 0.04 0.00 0.00 61.00 61.78 1dww s PRO 300 Cb -0.21 -2.86 -0.09 0.00 0.04 0.00 0.00 34.50 31.38 1dww s PRO 300 CO 0.59 0.44 1.55 -0.51 0.04 0.00 0.00 177.00 179.11 1dww s LEU 301 N -2.20 4.36 -0.55 -3.56 1.02 0.92 -4.82 118.68 113.86 1dww s LEU 301 Ca 0.40 2.46 -0.02 0.00 0.02 0.00 0.00 54.13 56.99 1dww s LEU 301 Cb -0.14 -3.58 0.14 0.00 0.02 0.00 0.00 46.19 42.64 1dww s LEU 301 CO 0.20 -0.81 0.35 -0.69 0.02 0.00 0.00 176.35 175.42 1dww s VAL 302 N 1.83 3.48 -0.19 -1.59 1.01 -1.26 -0.92 120.40 122.76 1dww s VAL 302 Ca 0.70 -2.73 -0.09 0.00 0.00 0.00 0.00 61.98 59.86 1dww s VAL 302 Cb -0.40 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 1dww s VAL 302 CO 0.31 -0.81 0.13 -0.76 0.00 0.00 0.00 175.10 173.96 1dww s LEU 303 N 0.27 4.23 -0.18 3.92 1.02 -0.86 -1.00 118.68 126.08 1dww s LEU 303 Ca 0.14 0.27 -0.01 0.00 0.02 0.00 0.00 54.13 54.55 1dww s LEU 303 Cb -0.21 -2.08 -0.00 0.00 0.02 0.00 0.00 46.19 43.91 1dww s LEU 303 CO -0.03 0.22 -0.12 0.00 0.02 0.00 0.00 176.35 176.44 1dww s GLN 304 N 0.13 3.27 -0.01 1.70 -2.07 -0.07 -0.33 119.66 122.27 1dww s GLN 304 Ca 0.09 -0.71 0.08 0.00 -1.82 0.00 0.00 55.36 53.00 1dww s GLN 304 Cb -0.11 -2.76 -0.02 0.00 -1.09 0.00 0.00 33.01 29.02 1dww s GLN 304 CO -0.01 -0.07 -0.24 0.00 -1.32 0.00 0.00 175.29 173.65 1dww s ALA 305 N 1.07 2.25 -1.26 2.60 0.00 -1.26 -0.73 121.76 124.43 1dww s ALA 305 Ca -0.00 -1.12 -0.09 0.00 0.00 0.00 0.00 51.96 50.74 1dww s ALA 305 Cb -0.15 -0.60 0.08 0.00 0.00 0.00 0.00 23.12 22.45 1dww s ALA 305 CO -0.03 0.54 0.47 -3.47 0.00 0.00 0.00 175.76 173.27 1dww n ASP 306 N 2.30 -3.55 0.00 0.00 2.03 -1.25 -0.84 116.55 115.25 1dww n ASP 306 Ca -0.16 -0.39 0.00 0.00 0.52 0.00 0.00 54.79 54.76 1dww n ASP 306 Cb 0.51 -2.95 0.00 0.00 -0.72 0.00 0.00 41.12 37.96 1dww n ASP 306 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dww n GLY 307 N -1.14 0.52 3.87 0.27 0.00 -0.87 -4.57 105.19 103.28 1dww n GLY 307 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1dww n GLY 307 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dww s GLN 308 N -0.47 1.17 0.44 1.61 1.11 -0.02 -4.90 119.66 118.61 1dww s GLN 308 Ca 0.00 -0.05 -0.25 0.00 0.01 0.00 0.00 55.36 55.07 1dww s GLN 308 Cb 0.00 -1.87 -0.08 0.00 -1.01 0.00 0.00 33.01 30.05 1dww s GLN 308 CO 0.00 -2.11 1.36 -0.51 0.01 0.00 0.00 175.29 174.04 1dww s ASP 309 N -4.55 5.99 0.36 5.90 1.11 -1.26 -4.33 116.67 119.89 1dww s ASP 309 Ca 0.67 2.78 -0.28 0.00 0.18 0.00 0.00 52.55 55.90 1dww s ASP 309 Cb -0.09 -2.64 -0.10 0.00 1.07 0.00 0.00 42.92 41.15 1dww s ASP 309 CO 0.52 -1.08 1.39 -2.16 1.18 0.00 0.00 175.17 175.02 1dww s PRO 310 N -2.42 4.19 -0.10 8.23 0.04 -1.26 -4.70 135.00 138.98 1dww s PRO 310 Ca 0.61 2.38 -0.01 0.00 0.04 0.00 0.00 61.00 64.01 1dww s PRO 310 Cb -0.41 -2.99 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 1dww s PRO 310 CO 0.52 -0.38 -0.05 -1.21 0.04 0.00 0.00 177.00 175.91 1dww s GLU 311 N -1.98 3.08 0.09 4.56 2.02 0.55 -4.89 118.70 122.12 1dww s GLU 311 Ca 0.52 -0.53 -0.27 0.00 0.02 0.00 0.00 54.97 54.71 1dww s GLU 311 Cb -0.43 -2.71 -0.06 0.00 0.10 0.00 0.00 34.13 31.03 1dww s GLU 311 CO 0.57 0.52 0.83 0.08 0.02 0.00 0.00 175.26 177.29 1dww s VAL 312 N -0.42 4.59 -0.04 2.63 1.01 -1.26 -2.02 120.40 124.88 1dww s VAL 312 Ca 0.06 1.79 -0.02 0.00 0.00 0.00 0.00 61.98 63.82 1dww s VAL 312 Cb -0.12 -4.19 0.03 0.00 0.00 0.00 0.00 36.38 32.10 1dww s VAL 312 CO 0.02 0.37 0.08 -0.36 0.00 0.00 0.00 175.10 175.21 1dww s PHE 313 N -0.21 -0.02 0.15 5.22 0.08 -0.10 -5.01 117.98 118.09 1dww s PHE 313 Ca 0.41 0.30 -0.26 0.00 0.12 0.00 0.00 56.93 57.49 1dww s PHE 313 Cb -0.22 -0.31 -0.07 0.00 -0.57 0.00 0.00 43.02 41.85 1dww s PHE 313 CO 0.26 -0.16 0.82 -2.00 -0.10 0.00 0.00 175.22 174.03 1dww s GLU 314 N 1.66 4.62 0.03 0.44 2.12 -1.26 -0.05 118.70 126.26 1dww s GLU 314 Ca -0.02 1.23 -0.29 0.00 0.36 0.00 0.00 54.97 56.25 1dww s GLU 314 Cb -0.12 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 30.93 1dww s GLU 314 CO -0.04 0.48 0.93 0.42 -0.54 0.00 0.00 175.26 176.51 1dww s ILE 315 N -0.85 4.77 -0.24 -3.70 1.01 -1.26 -4.89 121.20 116.03 1dww s ILE 315 Ca 0.38 1.96 -0.28 0.00 0.00 0.00 0.00 60.65 62.71 1dww s ILE 315 Cb -0.23 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 37.93 1dww s ILE 315 CO 0.27 0.23 2.01 -2.84 0.00 0.00 0.00 174.94 174.61 1dww s PRO 316 N 0.60 3.31 0.49 2.79 0.02 -1.26 -4.86 135.00 136.09 1dww s PRO 316 Ca 0.48 1.82 0.38 0.00 0.02 0.00 0.00 61.00 63.70 1dww s PRO 316 Cb -0.21 -4.27 1.55 0.00 0.02 0.00 0.00 34.50 31.58 1dww s PRO 316 CO 0.27 -1.89 1.61 -1.35 -0.33 0.00 0.00 177.00 175.32 1dww h PRO 317 N 13.69 0.04 0.00 5.54 0.11 -1.94 0.48 132.00 149.91 1dww h PRO 317 Ca -0.38 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1dww h PRO 317 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1dww h PRO 317 CO 0.99 0.03 -0.05 -0.44 -0.21 0.00 0.00 178.00 178.31 1dww h ASP 318 N 0.04 0.00 0.66 -2.05 3.32 -2.04 -2.53 116.42 113.82 1dww h ASP 318 Ca 0.85 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.63 1dww h ASP 318 Cb 2.98 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 42.52 1dww h ASP 318 CO -0.26 0.05 -1.31 -0.07 -1.72 0.00 0.00 179.24 175.93 1dww h LEU 319 N 0.00 0.26 -8.31 1.55 3.38 -0.41 -3.44 115.31 108.34 1dww h LEU 319 Ca -0.00 -0.32 -0.53 0.00 0.09 0.00 0.00 57.88 57.12 1dww h LEU 319 Cb 0.12 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 40.71 1dww h LEU 319 CO 0.01 1.26 1.19 -0.69 0.09 0.00 0.00 178.44 180.29 1dww s VAL 320 N -2.65 3.68 -0.14 1.22 1.01 -0.95 -4.82 120.40 117.75 1dww s VAL 320 Ca -0.04 0.04 -0.25 0.00 0.00 0.00 0.00 61.98 61.73 1dww s VAL 320 Cb 0.08 -4.71 -0.02 0.00 0.00 0.00 0.00 36.38 31.72 1dww s VAL 320 CO 0.85 -1.65 0.81 -0.22 0.00 0.00 0.00 175.10 174.90 1dww s LEU 321 N 6.47 4.21 0.31 3.92 2.96 -1.26 -4.99 118.68 130.31 1dww s LEU 321 Ca 0.46 1.20 0.10 0.00 -0.22 0.00 0.00 54.13 55.67 1dww s LEU 321 Cb -0.07 -3.22 -0.06 0.00 0.50 0.00 0.00 46.19 43.35 1dww s LEU 321 CO 0.09 -0.33 -0.12 -1.61 -1.32 0.00 0.00 176.35 173.06 1dww s GLU 322 N 1.80 1.82 -0.19 1.98 2.02 -1.26 -1.06 118.70 123.81 1dww s GLU 322 Ca 0.39 -1.81 -0.00 0.00 0.02 0.00 0.00 54.97 53.57 1dww s GLU 322 Cb -0.17 -1.79 0.05 0.00 0.10 0.00 0.00 34.13 32.32 1dww s GLU 322 CO 0.15 0.23 -0.05 0.08 0.02 0.00 0.00 175.26 175.69 1dww s VAL 323 N -2.54 1.24 0.07 2.63 1.01 0.42 -4.84 120.40 118.39 1dww s VAL 323 Ca 0.32 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 1dww s VAL 323 Cb -0.02 -1.45 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 1dww s VAL 323 CO 0.16 0.05 1.07 0.42 0.00 0.00 0.00 175.10 176.81 1dww s THR 324 N 1.56 4.34 0.09 3.92 -4.23 -1.26 -1.94 115.64 118.11 1dww s THR 324 Ca -0.01 1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 61.98 1dww s THR 324 Cb -0.16 -4.14 -0.06 0.00 1.34 0.00 0.00 72.50 69.48 1dww s THR 324 CO -0.07 0.20 1.09 -0.04 -0.54 0.00 0.00 174.62 175.25 1dww s MET 325 N 0.56 4.54 -0.17 3.99 -1.94 0.18 -4.88 119.30 121.58 1dww s MET 325 Ca 0.53 1.63 -0.08 0.00 -1.71 0.00 0.00 55.69 56.06 1dww s MET 325 Cb -0.26 -3.36 0.07 0.00 2.01 0.00 0.00 34.83 33.29 1dww s MET 325 CO 0.30 -0.05 0.38 -1.83 -0.01 0.00 0.00 175.02 173.81 1dww s GLU 326 N 0.48 0.33 0.22 2.03 -1.05 -1.26 -4.10 118.70 115.35 1dww s GLU 326 Ca 0.53 0.82 -0.30 0.00 -0.15 0.00 0.00 54.97 55.87 1dww s GLU 326 Cb -0.27 0.05 -0.09 0.00 -0.44 0.00 0.00 34.13 33.39 1dww s GLU 326 CO 0.31 -0.19 0.97 -1.58 0.95 0.00 0.00 175.26 175.71 1dww s HIS 327 N 1.79 3.90 -2.00 4.83 5.65 -1.26 -4.22 115.29 123.97 1dww s HIS 327 Ca -0.07 1.86 0.13 0.00 0.25 0.00 0.00 55.06 57.24 1dww s HIS 327 Cb -0.10 -3.04 0.77 0.00 -1.18 0.00 0.00 32.58 29.03 1dww s HIS 327 CO -0.12 0.26 1.19 -0.35 -0.65 0.00 0.00 174.74 175.07 1dww n PRO 328 N 1.67 0.46 0.08 2.88 -0.04 -1.26 -4.03 135.00 134.76 1dww n PRO 328 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1dww n PRO 328 Cb 0.47 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 1dww n PRO 328 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1dww n LYS 329 N -0.94 0.00 -2.35 0.54 4.01 -1.26 -4.99 118.16 113.18 1dww n LYS 329 Ca 0.10 0.00 -0.36 0.00 -0.51 0.00 0.00 58.31 57.54 1dww n LYS 329 Cb 0.04 -0.07 -0.03 0.00 -0.51 0.00 0.00 35.03 34.46 1dww n LYS 329 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1dww s TYR 330 N -2.00 2.35 -0.17 2.13 1.51 -1.26 -4.80 117.35 115.12 1dww s TYR 330 Ca 0.00 -0.55 0.20 0.00 -1.01 0.00 0.00 57.07 55.71 1dww s TYR 330 Cb 0.00 -4.42 1.08 0.00 -0.11 0.00 0.00 41.96 38.51 1dww s TYR 330 CO 0.00 -1.64 1.59 0.39 -1.11 0.00 0.00 175.55 174.78 1dww n GLU 331 N 8.51 0.13 0.00 -0.62 1.02 -1.26 -0.68 120.64 127.74 1dww n GLU 331 Ca 0.44 0.62 0.14 0.00 -0.02 0.00 0.00 57.16 58.34 1dww n GLU 331 Cb 0.47 -1.98 0.62 0.00 -0.02 0.00 0.00 31.44 30.54 1dww n GLU 331 CO 0.00 0.00 0.00 -2.67 1.18 0.00 0.00 177.13 175.64 1dww n TRP 332 N -2.21 0.00 -0.29 -0.32 4.27 -1.26 -3.88 117.44 113.76 1dww n TRP 332 Ca -0.01 0.00 -0.06 0.00 -3.89 0.00 0.00 57.50 53.54 1dww n TRP 332 Cb 0.09 -0.49 0.06 0.00 -1.36 0.00 0.00 31.31 29.61 1dww n TRP 332 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 1dww h PHE 333 N 0.00 1.20 0.00 -2.67 3.57 -1.28 -2.63 116.94 115.14 1dww h PHE 333 Ca 0.00 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.40 1dww h PHE 333 Cb 0.49 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1dww h PHE 333 CO 0.00 0.92 0.00 0.00 -2.23 0.00 0.00 178.31 177.00 1dww n GLN 334 N -4.28 0.11 0.00 1.11 10.64 -1.25 -2.06 117.38 121.65 1dww n GLN 334 Ca 0.07 0.29 0.10 0.00 -1.83 0.00 0.00 57.00 55.63 1dww n GLN 334 Cb 0.20 -1.69 0.50 0.00 -0.86 0.00 0.00 30.24 28.39 1dww n GLN 334 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1dww n GLU 335 N -1.89 0.28 0.21 2.61 1.02 -0.99 -1.74 120.64 120.14 1dww n GLU 335 Ca 0.04 0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.39 1dww n GLU 335 Cb 0.24 -1.50 0.17 0.00 -0.02 0.00 0.00 31.44 30.33 1dww n GLU 335 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1dww h LEU 336 N 0.00 0.00 -1.96 -4.62 4.07 -1.56 -3.48 115.31 107.77 1dww h LEU 336 Ca 0.00 -0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.73 1dww h LEU 336 Cb 0.19 0.00 0.13 0.00 1.08 0.00 0.00 40.66 42.06 1dww h LEU 336 CO 0.00 0.00 -0.58 0.61 -1.08 0.00 0.00 178.44 177.39 1dww n GLY 337 N 1.11 -0.26 3.59 0.83 0.00 -0.71 -5.02 105.19 104.73 1dww n GLY 337 Ca 0.04 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1dww n GLY 337 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dww s LEU 338 N -5.06 3.21 0.30 0.99 1.02 -1.26 -5.05 118.68 112.82 1dww s LEU 338 Ca 0.08 -0.01 -0.15 0.00 0.02 0.00 0.00 54.13 54.08 1dww s LEU 338 Cb -0.01 -1.71 0.02 0.00 0.02 0.00 0.00 46.19 44.50 1dww s LEU 338 CO 0.53 0.36 0.62 -1.59 0.02 0.00 0.00 176.35 176.29 1dww s LYS 339 N -0.87 1.81 -0.10 1.70 -2.85 -1.26 0.47 119.74 118.64 1dww s LYS 339 Ca 0.13 -1.27 -0.30 0.00 -1.00 0.00 0.00 55.97 53.53 1dww s LYS 339 Cb -0.11 0.54 0.08 0.00 -2.06 0.00 0.00 37.83 36.28 1dww s LYS 339 CO 0.02 -0.80 0.74 -0.46 0.10 0.00 0.00 175.35 174.95 1dww s TRP 340 N -3.52 -0.64 0.53 1.78 -0.11 -0.82 -4.94 118.94 111.23 1dww s TRP 340 Ca 0.18 1.18 -0.20 0.00 1.22 0.00 0.00 56.10 58.48 1dww s TRP 340 Cb -0.03 0.39 -0.06 0.00 -1.50 0.00 0.00 33.47 32.27 1dww s TRP 340 CO 0.10 -0.53 1.16 1.52 -4.62 0.00 0.00 176.95 174.58 1dww s TYR 341 N -0.92 2.66 -2.14 5.86 1.13 -1.26 -0.44 117.35 122.24 1dww s TYR 341 Ca -0.08 1.53 0.29 0.00 -1.41 0.00 0.00 57.07 57.40 1dww s TYR 341 Cb -0.01 -3.36 1.30 0.00 -1.10 0.00 0.00 41.96 38.79 1dww s TYR 341 CO 0.07 -1.71 1.89 0.00 -2.51 0.00 0.00 175.55 173.28 1dww n ALA 342 N -1.15 2.68 -3.80 9.51 0.00 -0.23 -4.81 120.51 122.72 1dww n ALA 342 Ca 0.11 -0.34 -0.34 0.00 0.00 0.00 0.00 53.44 52.86 1dww n ALA 342 Cb 0.50 -1.29 -0.13 0.00 0.00 0.00 0.00 19.45 18.52 1dww n ALA 342 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1dww s LEU 343 N -2.13 4.59 -0.58 0.00 2.96 -1.26 -4.72 118.68 117.54 1dww s LEU 343 Ca 0.38 -1.76 -0.25 0.00 -0.22 0.00 0.00 54.13 52.27 1dww s LEU 343 Cb 0.21 -1.73 0.04 0.00 0.50 0.00 0.00 46.19 45.21 1dww s LEU 343 CO 0.39 -0.39 1.02 -2.16 -1.32 0.00 0.00 176.35 173.88 1dww s PRO 344 N 1.13 3.35 -0.32 0.98 0.04 -1.26 -4.67 135.00 134.24 1dww s PRO 344 Ca 0.03 -0.19 -0.01 0.00 0.04 0.00 0.00 61.00 60.87 1dww s PRO 344 Cb -0.21 -4.07 0.11 0.00 0.04 0.00 0.00 34.50 30.37 1dww s PRO 344 CO -0.04 -1.60 0.12 0.00 0.04 0.00 0.00 177.00 175.52 1dww s ALA 345 N 4.29 1.54 0.06 8.56 0.00 -1.26 -3.77 121.76 131.19 1dww s ALA 345 Ca 0.33 -1.75 -0.31 0.00 0.00 0.00 0.00 51.96 50.23 1dww s ALA 345 Cb -0.11 -1.64 -0.08 0.00 0.00 0.00 0.00 23.12 21.28 1dww s ALA 345 CO 0.20 -1.72 1.63 0.08 0.00 0.00 0.00 175.76 175.94 1dww s VAL 346 N 1.49 3.09 -0.03 0.00 1.01 -0.01 -1.09 120.40 124.86 1dww s VAL 346 Ca 0.11 0.54 0.09 0.00 0.00 0.00 0.00 61.98 62.72 1dww s VAL 346 Cb -0.18 -3.35 -0.14 0.00 0.00 0.00 0.00 36.38 32.71 1dww s VAL 346 CO -0.22 -0.00 0.21 0.00 0.00 0.00 0.00 175.10 175.08 1dww n ALA 347 N 5.57 2.37 -0.80 5.51 0.00 -0.11 -1.28 120.51 131.77 1dww n ALA 347 Ca 0.16 -0.22 0.08 0.00 0.00 0.00 0.00 53.44 53.46 1dww n ALA 347 Cb 0.41 -0.31 0.33 0.00 0.00 0.00 0.00 19.45 19.87 1dww n ALA 347 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1dww n ASN 348 N -1.79 4.68 -4.96 0.00 2.04 -1.16 -4.47 115.26 109.59 1dww n ASN 348 Ca -0.02 -2.76 -0.22 0.00 -0.44 0.00 0.00 54.58 51.15 1dww n ASN 348 Cb 0.23 -0.58 0.02 0.00 -2.53 0.00 0.00 39.78 36.93 1dww n ASN 348 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 1dww s MET 349 N -2.40 2.88 -0.07 -3.83 -1.94 -1.26 -4.24 119.30 108.44 1dww s MET 349 Ca 0.47 -0.66 0.05 0.00 -1.71 0.00 0.00 55.69 53.84 1dww s MET 349 Cb 0.35 -2.56 -0.01 0.00 2.01 0.00 0.00 34.83 34.61 1dww s MET 349 CO 0.16 -0.40 -0.21 -1.17 -0.01 0.00 0.00 175.02 173.39 1dww s LEU 350 N -4.59 2.28 -0.23 -0.03 0.20 0.46 -4.02 118.68 112.76 1dww s LEU 350 Ca 0.51 -0.43 -0.14 0.00 0.69 0.00 0.00 54.13 54.76 1dww s LEU 350 Cb -0.10 -1.44 -0.04 0.00 -0.43 0.00 0.00 46.19 44.18 1dww s LEU 350 CO 0.37 0.25 0.32 -0.22 -0.29 0.00 0.00 176.35 176.78 1dww s LEU 351 N -0.16 4.12 -0.14 -0.68 2.96 -0.42 -0.37 118.68 123.98 1dww s LEU 351 Ca -0.03 0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 54.21 1dww s LEU 351 Cb -0.14 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.17 1dww s LEU 351 CO 0.04 -0.05 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.23 1dww s GLU 352 N 1.36 3.50 -0.25 1.98 -6.30 -0.37 -0.35 118.70 118.26 1dww s GLU 352 Ca 0.15 -0.62 -0.13 0.00 -2.50 0.00 0.00 54.97 51.87 1dww s GLU 352 Cb -0.15 -2.76 0.08 0.00 0.00 0.00 0.00 34.13 31.31 1dww s GLU 352 CO 0.07 0.21 0.60 0.54 0.02 0.00 0.00 175.26 176.71 1dww s VAL 353 N 0.39 -0.23 -1.46 3.70 0.11 -0.57 -1.64 120.40 120.71 1dww s VAL 353 Ca -0.08 0.03 -0.13 0.00 -2.93 0.00 0.00 61.98 58.88 1dww s VAL 353 Cb -0.15 -0.89 0.09 0.00 -1.53 0.00 0.00 36.38 33.90 1dww s VAL 353 CO 0.04 0.01 0.70 0.61 -3.33 0.00 0.00 175.10 173.14 1dww n GLY 354 N 4.59 -0.48 1.79 6.54 0.00 -1.26 -0.24 105.19 116.13 1dww n GLY 354 Ca -0.18 0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1dww n GLY 354 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dww n GLY 355 N -1.38 1.85 3.95 -0.02 0.00 -1.26 -2.99 105.19 105.34 1dww n GLY 355 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1dww n GLY 355 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dww s LEU 356 N 0.00 4.02 -0.02 0.99 1.43 0.66 -4.91 118.68 120.85 1dww s LEU 356 Ca 0.00 0.34 -0.00 0.00 -1.03 0.00 0.00 54.13 53.44 1dww s LEU 356 Cb 0.00 -3.20 0.03 0.00 0.03 0.00 0.00 46.19 43.05 1dww s LEU 356 CO 0.00 -0.31 0.03 -1.83 0.23 0.00 0.00 176.35 174.47 1dww s GLU 357 N -4.28 -0.03 -0.47 1.70 -1.05 -1.26 -1.51 118.70 111.80 1dww s GLU 357 Ca 0.40 0.17 -0.01 0.00 -0.15 0.00 0.00 54.97 55.38 1dww s GLU 357 Cb -0.10 -0.21 0.12 0.00 -0.44 0.00 0.00 34.13 33.51 1dww s GLU 357 CO 0.35 -0.15 0.25 -0.06 0.95 0.00 0.00 175.26 176.60 1dww s PHE 358 N 0.93 3.52 -2.00 4.83 0.40 0.52 -0.44 117.98 125.74 1dww s PHE 358 Ca -0.08 -2.69 0.14 0.00 -0.60 0.00 0.00 56.93 53.70 1dww s PHE 358 Cb -0.11 -3.12 0.82 0.00 0.51 0.00 0.00 43.02 41.12 1dww s PHE 358 CO -0.03 -0.91 1.26 -0.35 0.70 0.00 0.00 175.22 175.89 1dww n PRO 359 N 4.06 0.55 -3.57 0.24 -0.04 -1.26 -1.31 135.00 133.68 1dww n PRO 359 Ca 0.02 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.23 1dww n PRO 359 Cb 0.39 -1.39 -0.16 0.00 -0.04 0.00 0.00 33.50 32.31 1dww n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dww s ALA 360 N -2.00 0.38 -0.48 0.55 0.00 -1.24 -4.67 121.76 114.30 1dww s ALA 360 Ca 0.21 -0.51 0.06 0.00 0.00 0.00 0.00 51.96 51.71 1dww s ALA 360 Cb 0.09 -1.21 0.25 0.00 0.00 0.00 0.00 23.12 22.25 1dww s ALA 360 CO 0.16 -1.36 0.92 0.00 0.00 0.00 0.00 175.76 175.48 1dww n PRO 362 N 1.45 1.77 -3.96 0.00 -0.04 -1.22 -4.69 135.00 128.32 1dww n PRO 362 Ca 0.09 0.64 -0.09 0.00 -0.04 0.00 0.00 63.50 64.09 1dww n PRO 362 Cb 0.64 -2.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.55 1dww n PRO 362 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1dww s PHE 363 N -1.27 0.40 0.04 0.54 -0.12 -0.40 -1.75 117.98 115.43 1dww s PHE 363 Ca 0.67 -0.78 -0.25 0.00 -0.05 0.00 0.00 56.93 56.52 1dww s PHE 363 Cb -0.45 -0.09 0.06 0.00 -0.63 0.00 0.00 43.02 41.91 1dww s PHE 363 CO 0.53 -0.68 0.59 0.54 -0.05 0.00 0.00 175.22 176.15 1dww s ASN 364 N -2.96 -0.53 0.00 1.98 4.22 -0.15 -0.83 114.94 116.67 1dww s ASN 364 Ca 0.16 0.32 0.00 0.00 -2.14 0.00 0.00 52.86 51.20 1dww s ASN 364 Cb 0.04 0.53 0.00 0.00 1.28 0.00 0.00 41.25 43.09 1dww s ASN 364 CO -0.01 -0.73 0.00 0.61 -2.04 0.00 0.00 177.10 174.93 1dww n GLY 365 N 0.43 4.22 3.55 0.45 0.00 -1.25 -1.16 105.19 111.44 1dww n GLY 365 Ca -0.18 -0.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.88 1dww n GLY 365 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1dww s TRP 366 N 3.63 2.17 0.54 1.61 -2.14 -1.26 -4.65 118.94 118.84 1dww s TRP 366 Ca 0.00 -0.87 -0.16 0.00 2.66 0.00 0.00 56.10 57.74 1dww s TRP 366 Cb 0.00 -1.50 -0.07 0.00 -3.10 0.00 0.00 33.47 28.80 1dww s TRP 366 CO 0.00 0.18 1.00 0.71 -2.66 0.00 0.00 176.95 176.18 1dww s TYR 367 N -3.02 3.43 -0.20 1.66 2.02 -1.26 -4.92 117.35 115.06 1dww s TYR 367 Ca 0.32 1.45 -0.01 0.00 -0.37 0.00 0.00 57.07 58.46 1dww s TYR 367 Cb 0.08 -2.80 0.01 0.00 -0.40 0.00 0.00 41.96 38.85 1dww s TYR 367 CO 0.15 -0.49 -0.14 1.41 -1.57 0.00 0.00 175.55 174.91 1dww s MET 368 N -4.24 3.08 0.26 -0.62 -2.45 -1.26 -1.88 119.30 112.20 1dww s MET 368 Ca 0.59 -0.79 0.09 0.00 -1.25 0.00 0.00 55.69 54.33 1dww s MET 368 Cb -0.11 -2.74 0.81 0.00 1.25 0.00 0.00 34.83 34.04 1dww s MET 368 CO 0.35 -0.22 1.19 0.41 1.05 0.00 0.00 175.02 177.80 1dww n GLY 369 N 4.67 -0.79 0.30 2.11 0.00 0.00 -0.43 105.19 111.05 1dww n GLY 369 Ca -0.20 0.68 0.08 0.00 0.00 0.00 0.00 46.02 46.58 1dww n GLY 369 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1dww h THR 370 N 0.00 1.01 -0.70 2.61 1.35 -1.94 0.25 112.91 115.50 1dww h THR 370 Ca 0.55 -0.10 0.03 0.00 -0.55 0.00 0.00 66.41 66.35 1dww h THR 370 Cb 1.33 0.69 -0.05 0.00 -1.73 0.00 0.00 68.15 68.40 1dww h THR 370 CO -0.65 0.05 0.43 -0.33 -0.25 0.00 0.00 175.52 174.78 1dww h GLU 371 N 0.30 0.82 0.00 4.72 5.08 -1.16 -0.10 114.58 124.24 1dww h GLU 371 Ca 0.12 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1dww h GLU 371 Cb 0.11 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1dww h GLU 371 CO -0.02 0.54 -0.14 0.82 -1.00 0.00 0.00 179.01 179.21 1dww h ILE 372 N 0.84 0.00 -0.51 3.13 2.04 -1.60 0.95 117.51 122.36 1dww h ILE 372 Ca 0.28 -0.77 0.09 0.00 1.00 0.00 0.00 64.86 65.46 1dww h ILE 372 Cb 0.04 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.04 1dww h ILE 372 CO -0.12 0.00 0.09 1.23 0.00 0.00 0.00 178.15 179.35 1dww h GLY 373 N -0.77 0.61 0.00 5.37 0.00 -1.04 -0.14 103.07 107.10 1dww h GLY 373 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 47.33 47.17 1dww h GLY 373 CO 0.00 -0.09 -1.06 -0.62 0.00 0.00 0.00 176.54 174.77 1dww n VAL 374 N -5.13 1.49 0.01 4.60 0.31 -0.14 -3.77 118.33 115.70 1dww n VAL 374 Ca 0.06 0.05 -0.02 0.00 -0.01 0.00 0.00 64.34 64.42 1dww n VAL 374 Cb 0.26 -2.17 -0.01 0.00 -0.91 0.00 0.00 33.84 31.01 1dww n VAL 374 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1dww h ARG 375 N -1.00 -0.10 -0.16 5.55 2.47 -1.19 -2.71 114.38 117.24 1dww h ARG 375 Ca -0.23 0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.53 1dww h ARG 375 Cb 1.02 0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 29.33 1dww h ARG 375 CO -0.14 -0.07 -0.07 -0.44 0.56 0.00 0.00 179.97 179.81 1dww h ASP 376 N -0.72 -0.23 0.02 7.04 3.32 -0.69 -1.79 116.42 123.38 1dww h ASP 376 Ca -0.01 0.06 -0.18 0.00 0.02 0.00 0.00 57.03 56.92 1dww h ASP 376 Cb 0.08 0.13 0.02 0.00 0.22 0.00 0.00 39.33 39.78 1dww h ASP 376 CO 0.02 -0.09 -0.72 -0.26 -1.72 0.00 0.00 179.24 176.46 1dww h PHE 377 N -0.05 0.69 -0.00 4.55 0.04 -1.19 -2.53 116.94 118.44 1dww h PHE 377 Ca 0.09 -0.39 0.00 0.00 2.80 0.00 0.00 57.97 60.47 1dww h PHE 377 Cb 0.17 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.25 1dww h PHE 377 CO -0.21 1.22 -0.68 0.00 -0.60 0.00 0.00 178.31 178.04 1dww s ASP 379 N -2.99 6.12 0.36 0.00 1.11 -0.68 -4.57 116.67 116.02 1dww s ASP 379 Ca 0.10 2.64 0.05 0.00 0.18 0.00 0.00 52.55 55.52 1dww s ASP 379 Cb 0.17 -2.63 0.69 0.00 1.07 0.00 0.00 42.92 42.22 1dww s ASP 379 CO 0.76 -0.98 1.94 0.74 1.18 0.00 0.00 175.17 178.81 1dww h THR 380 N 2.24 1.17 -0.02 -1.27 2.02 -1.93 -1.93 112.91 113.18 1dww h THR 380 Ca -0.50 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.10 1dww h THR 380 Cb 1.25 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1dww h THR 380 CO 0.61 0.21 0.00 0.00 0.37 0.00 0.00 175.52 176.72 1dww n GLN 381 N -4.35 1.55 0.00 6.66 0.00 -1.26 -4.72 117.38 115.26 1dww n GLN 381 Ca 0.02 -0.80 0.00 0.00 0.00 0.00 0.00 57.00 56.22 1dww n GLN 381 Cb 0.18 -1.48 0.00 0.00 0.00 0.00 0.00 30.24 28.94 1dww n GLN 381 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1dww n ARG 382 N -0.02 0.85 -0.20 2.61 5.12 -0.75 -3.59 116.66 120.67 1dww n ARG 382 Ca 0.20 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 56.03 1dww n ARG 382 Cb 0.31 0.00 0.02 0.00 -1.16 0.00 0.00 32.46 31.63 1dww n ARG 382 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1dww h TYR 383 N 0.00 1.04 -4.80 -1.55 -1.99 -1.57 -3.39 116.97 104.71 1dww h TYR 383 Ca 0.00 -0.15 -0.24 0.00 2.00 0.00 0.00 58.73 60.34 1dww h TYR 383 Cb 0.00 -0.28 0.13 0.00 2.00 0.00 0.00 36.73 38.58 1dww h TYR 383 CO 0.00 0.91 -0.60 -1.71 -0.00 0.00 0.00 178.16 176.76 1dww n ASN 384 N -4.30 -2.70 -0.20 3.88 5.15 -0.02 -4.97 115.26 112.09 1dww n ASN 384 Ca 0.03 -0.49 0.14 0.00 -0.60 0.00 0.00 54.58 53.65 1dww n ASN 384 Cb 0.29 -4.05 0.49 0.00 -0.53 0.00 0.00 39.78 35.98 1dww n ASN 384 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1dww n ILE 385 N -3.28 0.00 -0.04 -1.44 -5.35 -0.56 -4.48 119.36 104.20 1dww n ILE 385 Ca -0.19 -0.11 -0.08 0.00 -0.27 0.00 0.00 62.75 62.11 1dww n ILE 385 Cb 0.62 0.19 -0.02 0.00 -1.74 0.00 0.00 39.64 38.70 1dww n ILE 385 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1dww h LEU 386 N 1.00 -0.57 -0.70 7.28 3.38 -1.85 -2.26 115.31 121.59 1dww h LEU 386 Ca 0.00 0.12 0.12 0.00 0.09 0.00 0.00 57.88 58.21 1dww h LEU 386 Cb 0.44 0.29 -0.13 0.00 0.09 0.00 0.00 40.66 41.35 1dww h LEU 386 CO 0.00 -0.22 -0.32 -0.08 0.09 0.00 0.00 178.44 177.91 1dww h GLU 387 N -0.18 -0.10 0.00 1.13 4.57 -1.98 -1.14 114.58 116.88 1dww h GLU 387 Ca 0.13 0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.24 1dww h GLU 387 Cb 0.37 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 1dww h GLU 387 CO -0.33 -0.07 -0.55 1.05 -1.18 0.00 0.00 179.01 177.93 1dww h GLU 388 N -0.10 0.00 0.00 1.92 4.11 -1.87 -2.77 114.58 115.87 1dww h GLU 388 Ca 0.28 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.63 1dww h GLU 388 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1dww h GLU 388 CO -0.76 0.32 -0.35 0.28 0.07 0.00 0.00 179.01 178.57 1dww h VAL 389 N 0.00 0.85 0.05 -1.06 2.07 -0.84 -0.84 116.25 116.48 1dww h VAL 389 Ca -0.02 -1.42 -0.18 0.00 0.82 0.00 0.00 66.70 65.89 1dww h VAL 389 Cb 1.29 1.87 0.02 0.00 -1.52 0.00 0.00 31.29 32.95 1dww h VAL 389 CO 0.04 0.34 -0.74 1.23 0.02 0.00 0.00 177.57 178.47 1dww h GLY 390 N 1.96 0.47 0.72 2.17 0.00 -1.21 -3.09 103.07 104.08 1dww h GLY 390 Ca -0.00 -0.91 0.01 0.00 0.00 0.00 0.00 47.33 46.43 1dww h GLY 390 CO 0.05 0.80 -0.15 3.21 0.00 0.00 0.00 176.54 180.45 1dww h ARG 391 N -0.11 -0.28 0.00 4.80 3.08 -1.24 -1.38 114.38 119.24 1dww h ARG 391 Ca -0.10 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1dww h ARG 391 Cb 1.47 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.58 1dww h ARG 391 CO 0.14 -0.19 0.00 0.54 -1.07 0.00 0.00 179.97 179.40 1dww n ARG 392 N -5.28 0.10 0.01 0.04 1.74 -0.34 -0.02 116.66 112.91 1dww n ARG 392 Ca -0.06 0.51 0.11 0.00 -0.77 0.00 0.00 57.85 57.64 1dww n ARG 392 Cb 0.20 -1.78 0.06 0.00 -1.02 0.00 0.00 32.46 29.92 1dww n ARG 392 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1dww n MET 393 N -1.98 0.15 -0.74 5.56 2.81 -0.58 -4.96 117.12 117.38 1dww n MET 393 Ca 0.00 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1dww n MET 393 Cb 0.08 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.04 1dww n MET 393 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1dww n GLY 394 N 1.43 0.71 3.74 3.03 0.00 0.97 -5.05 105.19 110.02 1dww n GLY 394 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1dww n GLY 394 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dww s LEU 395 N 0.00 2.90 -1.25 0.99 1.02 -0.98 -4.90 118.68 116.47 1dww s LEU 395 Ca 0.00 1.87 -0.20 0.00 0.02 0.00 0.00 54.13 55.82 1dww s LEU 395 Cb 0.00 -4.47 -0.00 0.00 0.02 0.00 0.00 46.19 41.74 1dww s LEU 395 CO 0.00 -2.34 1.83 -1.61 0.02 0.00 0.00 176.35 174.25 1dww s GLU 396 N -4.85 3.28 0.60 1.70 2.02 -1.26 -4.71 118.70 115.48 1dww s GLU 396 Ca 0.63 -1.62 0.32 0.00 0.02 0.00 0.00 54.97 54.32 1dww s GLU 396 Cb -0.18 -5.40 1.91 0.00 0.10 0.00 0.00 34.13 30.55 1dww s GLU 396 CO 0.57 -3.08 2.27 1.15 0.02 0.00 0.00 175.26 176.19 1dww h THR 397 N 5.85 0.45 -0.51 3.63 2.02 -1.91 -2.60 112.91 119.85 1dww h THR 397 Ca 0.34 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.51 1dww h THR 397 Cb 0.90 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1dww h THR 397 CO 1.35 0.00 0.00 1.41 0.37 0.00 0.00 175.52 178.65 1dww n HIS 398 N -3.73 1.69 -3.59 3.16 8.25 -1.26 -4.76 115.22 114.98 1dww n HIS 398 Ca -0.03 -0.74 -0.29 0.00 -0.26 0.00 0.00 57.72 56.39 1dww n HIS 398 Cb 0.08 -0.42 -0.14 0.00 1.12 0.00 0.00 29.99 30.64 1dww n HIS 398 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1dww s THR 399 N -2.61 0.48 0.20 1.59 2.01 -0.98 -5.02 115.64 111.31 1dww s THR 399 Ca 0.51 -1.51 -0.11 0.00 0.31 0.00 0.00 61.69 60.88 1dww s THR 399 Cb 0.38 -1.36 0.17 0.00 0.01 0.00 0.00 72.50 71.70 1dww s THR 399 CO 0.16 -0.83 1.68 -0.07 -0.69 0.00 0.00 174.62 174.87 1dww h LEU 400 N 7.62 -0.15 -2.14 4.42 -0.00 -1.86 -1.74 115.31 121.46 1dww h LEU 400 Ca -0.07 0.13 0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1dww h LEU 400 Cb 0.98 0.21 -0.00 0.00 -0.00 0.00 0.00 40.66 41.85 1dww h LEU 400 CO 0.40 -0.06 0.29 0.00 -0.00 0.00 0.00 178.44 179.07 1dww h ALA 401 N 1.50 1.33 0.00 1.53 0.00 -1.95 -0.74 119.26 120.93 1dww h ALA 401 Ca 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1dww h ALA 401 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1dww h ALA 401 CO -0.45 -0.30 0.00 -1.13 0.00 0.00 0.00 179.25 177.37 1dww n SER 402 N -2.96 0.27 -2.65 0.00 3.41 -0.66 -4.87 113.62 106.15 1dww n SER 402 Ca -0.02 0.57 -0.19 0.00 -0.26 0.00 0.00 58.87 58.97 1dww n SER 402 Cb 0.35 -0.62 0.03 0.00 -0.26 0.00 0.00 64.21 63.71 1dww n SER 402 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1dww n LEU 403 N -1.80 -2.58 -0.11 1.04 4.77 -0.28 -4.93 117.00 113.11 1dww n LEU 403 Ca 0.03 -0.26 -0.10 0.00 -0.03 0.00 0.00 56.01 55.65 1dww n LEU 403 Cb 0.19 -2.63 -0.02 0.00 -2.33 0.00 0.00 43.42 38.62 1dww n LEU 403 CO 0.16 0.23 0.87 4.11 -1.33 0.00 0.00 177.39 181.42 1dww h TRP 404 N -1.28 0.53 -0.97 -1.77 5.08 -1.83 -2.41 115.95 113.30 1dww h TRP 404 Ca -0.46 -0.05 0.21 0.00 1.08 0.00 0.00 58.89 59.66 1dww h TRP 404 Cb 1.32 -0.15 -0.09 0.00 -3.00 0.00 0.00 29.16 27.23 1dww h TRP 404 CO 0.45 0.53 0.62 0.87 -1.28 0.00 0.00 178.44 179.62 1dww h LYS 405 N 0.38 0.56 -0.61 0.12 1.57 -1.91 0.28 116.57 116.97 1dww h LYS 405 Ca 0.11 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1dww h LYS 405 Cb 0.24 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1dww h LYS 405 CO -0.00 0.37 0.02 -0.44 -0.57 0.00 0.00 179.45 178.82 1dww h ASP 406 N 0.58 1.03 -0.19 0.86 5.19 -1.83 -1.87 116.42 120.19 1dww h ASP 406 Ca 0.54 -0.30 -0.19 0.00 -0.62 0.00 0.00 57.03 56.46 1dww h ASP 406 Cb 1.09 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.32 1dww h ASP 406 CO -0.29 1.08 -0.61 0.03 -3.12 0.00 0.00 179.24 176.33 1dww h ARG 407 N 0.96 0.80 0.58 3.56 3.08 -0.28 -3.15 114.38 119.92 1dww h ARG 407 Ca 0.17 -0.55 -0.03 0.00 0.07 0.00 0.00 59.98 59.65 1dww h ARG 407 Cb 0.54 0.08 0.01 0.00 0.08 0.00 0.00 29.97 30.68 1dww h ARG 407 CO 0.03 1.17 -0.28 0.00 -1.07 0.00 0.00 179.97 179.82 1dww h ALA 408 N 0.70 -0.97 -1.10 0.04 0.00 -0.78 -2.98 119.26 114.17 1dww h ALA 408 Ca -0.00 -0.17 0.31 0.00 0.00 0.00 0.00 54.91 55.04 1dww h ALA 408 Cb 1.22 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 19.21 1dww h ALA 408 CO 0.13 -0.92 0.71 0.28 0.00 0.00 0.00 179.25 179.46 1dww h VAL 409 N -0.95 0.43 -0.52 0.00 2.07 -1.48 0.46 116.25 116.25 1dww h VAL 409 Ca -0.08 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1dww h VAL 409 Cb 0.59 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1dww h VAL 409 CO 0.13 0.06 0.04 0.74 0.02 0.00 0.00 177.57 178.56 1dww h THR 410 N 0.31 1.26 -0.35 2.57 2.02 -1.53 -0.98 112.91 116.21 1dww h THR 410 Ca 0.65 -1.02 -0.14 0.00 0.77 0.00 0.00 66.41 66.66 1dww h THR 410 Cb 1.76 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 69.06 1dww h THR 410 CO -0.32 0.36 -0.35 -0.33 0.37 0.00 0.00 175.52 175.25 1dww h GLU 411 N 0.77 0.79 -0.66 6.66 4.39 0.01 -1.67 114.58 124.87 1dww h GLU 411 Ca 0.15 -0.39 -0.03 0.00 0.34 0.00 0.00 59.36 59.43 1dww h GLU 411 Cb 0.46 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 1dww h GLU 411 CO 0.02 1.02 0.27 0.82 -1.16 0.00 0.00 179.01 179.98 1dww h ILE 412 N 0.66 1.23 -0.44 3.13 2.04 -0.94 -0.22 117.51 122.96 1dww h ILE 412 Ca 0.06 -0.70 -0.11 0.00 1.00 0.00 0.00 64.86 65.11 1dww h ILE 412 Cb 0.90 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1dww h ILE 412 CO 0.08 0.28 -0.15 0.78 0.00 0.00 0.00 178.15 179.14 1dww h ASN 413 N 0.95 0.90 0.77 1.72 2.35 -0.82 -0.29 115.58 121.16 1dww h ASN 413 Ca 0.23 -0.38 -0.08 0.00 -0.55 0.00 0.00 56.30 55.52 1dww h ASN 413 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1dww h ASN 413 CO -0.02 1.08 -0.37 -0.37 -1.65 0.00 0.00 177.43 176.10 1dww h VAL 414 N 0.72 0.91 0.46 2.81 -1.51 -0.99 -1.58 116.25 117.07 1dww h VAL 414 Ca 0.11 -1.46 -0.02 0.00 -1.23 0.00 0.00 66.70 64.09 1dww h VAL 414 Cb 0.71 1.88 0.00 0.00 -2.13 0.00 0.00 31.29 31.75 1dww h VAL 414 CO 0.05 0.36 -0.22 0.00 -1.23 0.00 0.00 177.57 176.53 1dww h ALA 415 N 1.63 -0.62 -0.41 5.19 0.00 -0.68 0.42 119.26 124.79 1dww h ALA 415 Ca -0.00 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.80 1dww h ALA 415 Cb 0.85 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.80 1dww h ALA 415 CO 0.05 -0.69 -0.18 0.28 0.00 0.00 0.00 179.25 178.71 1dww h VAL 416 N -0.94 0.45 0.88 0.00 2.07 -0.96 0.67 116.25 118.41 1dww h VAL 416 Ca -0.06 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1dww h VAL 416 Cb 0.58 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1dww h VAL 416 CO 0.10 0.00 -0.48 -0.07 0.02 0.00 0.00 177.57 177.14 1dww h LEU 417 N -0.09 -1.19 -0.54 2.57 4.07 -1.26 -1.54 115.31 117.33 1dww h LEU 417 Ca 0.20 0.06 0.11 0.00 0.08 0.00 0.00 57.88 58.32 1dww h LEU 417 Cb 0.41 0.33 -0.11 0.00 1.08 0.00 0.00 40.66 42.37 1dww h LEU 417 CO -0.48 -0.77 -0.26 -0.74 -1.08 0.00 0.00 178.44 175.11 1dww h HIS 418 N -1.25 -0.66 0.03 1.13 2.76 0.85 -0.92 115.15 117.08 1dww h HIS 418 Ca -0.12 0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1dww h HIS 418 Cb 0.99 0.37 -0.05 0.00 1.55 0.00 0.00 27.41 30.27 1dww h HIS 418 CO -0.06 -0.33 -0.32 0.77 -1.30 0.00 0.00 177.93 176.68 1dww h SER 419 N -0.12 -0.96 -0.94 3.26 0.02 0.54 0.19 113.55 115.54 1dww h SER 419 Ca 0.24 0.12 0.08 0.00 -0.84 0.00 0.00 61.79 61.39 1dww h SER 419 Cb 0.51 0.38 -0.07 0.00 0.14 0.00 0.00 62.40 63.36 1dww h SER 419 CO -0.62 -0.39 0.59 -0.26 -1.14 0.00 0.00 176.83 175.01 1dww h PHE 420 N -0.49 1.09 -0.31 3.45 -1.00 -0.45 -0.18 116.94 119.05 1dww h PHE 420 Ca 0.05 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.75 1dww h PHE 420 Cb 0.57 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 1dww h PHE 420 CO -0.33 0.52 -0.28 1.96 -1.61 0.00 0.00 178.31 178.57 1dww h GLN 421 N 1.04 0.63 -0.02 1.51 4.20 -0.66 0.42 115.11 122.23 1dww h GLN 421 Ca 0.42 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 1dww h GLN 421 Cb 0.25 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1dww h GLN 421 CO -0.20 0.85 -0.03 -0.22 -0.67 0.00 0.00 178.83 178.55 1dww h LYS 422 N 0.55 0.05 -0.34 1.46 3.64 0.29 -3.00 116.57 119.22 1dww h LYS 422 Ca 0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1dww h LYS 422 Cb 0.76 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 1dww h LYS 422 CO 0.06 0.62 0.00 1.04 -2.27 0.00 0.00 179.45 178.90 1dww n GLN 423 N -4.77 1.06 -2.47 1.90 6.02 -0.17 -4.88 117.38 114.07 1dww n GLN 423 Ca -0.09 -0.07 -0.16 0.00 -0.01 0.00 0.00 57.00 56.68 1dww n GLN 423 Cb 0.31 -1.18 -0.01 0.00 1.02 0.00 0.00 30.24 30.39 1dww n GLN 423 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1dww n ASN 424 N -0.29 -4.64 -4.58 1.08 3.02 -0.59 -4.94 115.26 104.32 1dww n ASN 424 Ca 0.01 0.09 -0.40 0.00 -0.03 0.00 0.00 54.58 54.25 1dww n ASN 424 Cb 0.10 -3.90 -0.10 0.00 -0.61 0.00 0.00 39.78 35.27 1dww n ASN 424 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1dww s VAL 425 N -2.78 5.20 0.19 2.41 1.01 0.14 -4.07 120.40 122.50 1dww s VAL 425 Ca 0.02 0.25 -0.31 0.00 0.00 0.00 0.00 61.98 61.94 1dww s VAL 425 Cb -0.01 -3.71 -0.16 0.00 0.00 0.00 0.00 36.38 32.50 1dww s VAL 425 CO 0.03 0.07 1.01 0.41 0.00 0.00 0.00 175.10 176.62 1dww n THR 426 N 5.15 1.27 -3.67 3.92 -1.04 0.38 -4.29 114.28 116.00 1dww n THR 426 Ca -0.10 -0.32 -0.08 0.00 -2.04 0.00 0.00 64.05 61.51 1dww n THR 426 Cb 0.50 -0.66 -0.02 0.00 -1.82 0.00 0.00 70.33 68.34 1dww n THR 426 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 1dww s ILE 427 N -0.52 0.00 -0.05 12.58 2.07 -1.26 -4.51 121.20 129.51 1dww s ILE 427 Ca 0.70 -0.52 -0.03 0.00 -1.41 0.00 0.00 60.65 59.38 1dww s ILE 427 Cb -0.87 -1.57 0.02 0.00 0.13 0.00 0.00 42.46 40.17 1dww s ILE 427 CO 0.55 0.00 0.12 -0.32 -1.91 0.00 0.00 174.94 173.38 1dww s MET 428 N -3.68 0.11 0.48 3.50 -2.45 -0.79 -5.01 119.30 111.47 1dww s MET 428 Ca 0.07 0.24 -0.15 0.00 -1.25 0.00 0.00 55.69 54.61 1dww s MET 428 Cb -0.03 -0.04 -0.07 0.00 1.25 0.00 0.00 34.83 35.93 1dww s MET 428 CO -0.02 -0.08 0.92 0.16 1.05 0.00 0.00 175.02 177.06 1dww s ASP 429 N 0.53 6.60 0.50 1.11 -4.77 -1.26 -0.82 116.67 118.56 1dww s ASP 429 Ca -0.04 1.45 0.15 0.00 -3.30 0.00 0.00 52.55 50.81 1dww s ASP 429 Cb -0.05 -2.46 1.19 0.00 -1.09 0.00 0.00 42.92 40.51 1dww s ASP 429 CO -0.02 -0.53 2.12 1.12 0.70 0.00 0.00 175.17 178.55 1dww h HIS 430 N 1.02 0.06 -0.09 2.11 2.07 -1.98 -2.33 115.15 116.01 1dww h HIS 430 Ca -0.47 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.02 1dww h HIS 430 Cb 1.19 -0.02 -0.00 0.00 2.57 0.00 0.00 27.41 31.14 1dww h HIS 430 CO 0.63 0.06 -0.05 0.45 -3.07 0.00 0.00 177.93 175.94 1dww h HIS 431 N 0.06 0.23 -0.74 6.12 3.86 -1.98 -1.71 115.15 120.98 1dww h HIS 431 Ca 0.02 -0.06 -0.05 0.00 -1.16 0.00 0.00 60.37 59.11 1dww h HIS 431 Cb 0.03 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 1dww h HIS 431 CO 0.00 0.58 0.27 1.15 0.86 0.00 0.00 177.93 180.79 1dww h THR 432 N -0.18 1.26 -0.36 2.45 2.02 -1.92 -2.31 112.91 113.88 1dww h THR 432 Ca 0.02 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.32 1dww h THR 432 Cb 0.52 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1dww h THR 432 CO 0.02 0.34 0.07 0.00 0.37 0.00 0.00 175.52 176.32 1dww h ALA 433 N 1.20 0.47 -0.75 6.16 0.00 -1.39 -2.07 119.26 122.89 1dww h ALA 433 Ca 0.25 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1dww h ALA 433 Cb 0.25 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1dww h ALA 433 CO -0.02 0.16 0.47 0.77 0.00 0.00 0.00 179.25 180.63 1dww h SER 434 N 0.43 0.78 -0.61 0.00 0.02 -1.15 0.66 113.55 113.67 1dww h SER 434 Ca 0.11 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 1dww h SER 434 Cb 0.33 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1dww h SER 434 CO 0.00 0.54 0.13 -0.33 -1.14 0.00 0.00 176.83 176.04 1dww h GLU 435 N 0.92 0.99 -0.35 3.45 5.08 -1.22 -0.97 114.58 122.49 1dww h GLU 435 Ca 0.30 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 1dww h GLU 435 Cb 0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1dww h GLU 435 CO -0.11 0.91 -0.29 0.66 -1.00 0.00 0.00 179.01 179.18 1dww h SER 436 N 0.91 0.76 -0.67 1.42 4.64 -0.89 -2.22 113.55 117.50 1dww h SER 436 Ca 0.19 -0.30 -0.05 0.00 -0.47 0.00 0.00 61.79 61.16 1dww h SER 436 Cb 0.38 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 1dww h SER 436 CO 0.01 1.00 0.22 0.15 -0.87 0.00 0.00 176.83 177.34 1dww h PHE 437 N 0.63 1.06 -0.96 4.77 3.57 -0.57 0.77 116.94 126.21 1dww h PHE 437 Ca 0.07 -0.10 0.05 0.00 3.53 0.00 0.00 57.97 61.52 1dww h PHE 437 Cb 0.81 -0.31 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 1dww h PHE 437 CO 0.04 0.85 0.62 0.52 -2.23 0.00 0.00 178.31 178.11 1dww h MET 438 N 0.97 1.12 -0.31 1.11 2.86 -0.91 0.35 114.93 120.11 1dww h MET 438 Ca 0.22 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.68 1dww h MET 438 Cb 0.28 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1dww h MET 438 CO -0.01 0.74 -0.25 -0.22 1.06 0.00 0.00 176.91 178.23 1dww h LYS 439 N 1.15 0.61 -0.50 1.72 1.63 -0.85 -2.21 116.57 118.13 1dww h LYS 439 Ca 0.40 -0.24 -0.03 0.00 -0.85 0.00 0.00 60.65 59.92 1dww h LYS 439 Cb 0.10 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.68 1dww h LYS 439 CO -0.15 0.81 0.18 1.25 -3.45 0.00 0.00 179.45 178.08 1dww h HIS 440 N 0.54 0.78 -0.06 1.91 2.76 0.15 -0.68 115.15 120.54 1dww h HIS 440 Ca 0.08 -0.07 0.02 0.00 -2.20 0.00 0.00 60.37 58.19 1dww h HIS 440 Cb 0.71 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 1dww h HIS 440 CO 0.03 0.67 -0.05 0.52 -1.30 0.00 0.00 177.93 177.80 1dww h MET 441 N 0.67 -0.06 -0.36 5.26 2.86 -0.10 0.12 114.93 123.32 1dww h MET 441 Ca 0.16 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.85 1dww h MET 441 Cb 0.23 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.86 1dww h MET 441 CO -0.01 -0.04 0.11 1.96 1.06 0.00 0.00 176.91 179.99 1dww h GLN 442 N -0.06 0.24 -0.74 1.72 4.20 -1.19 0.13 115.11 119.41 1dww h GLN 442 Ca 0.04 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1dww h GLN 442 Cb 0.12 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 1dww h GLN 442 CO -0.09 0.16 0.37 -0.91 -0.67 0.00 0.00 178.83 177.69 1dww h ASN 443 N 0.25 0.94 -0.27 1.46 2.35 -0.82 -2.45 115.58 117.05 1dww h ASN 443 Ca 0.17 -0.10 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 1dww h ASN 443 Cb 0.16 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 1dww h ASN 443 CO -0.19 0.79 -0.25 -0.08 -1.65 0.00 0.00 177.43 176.05 1dww h GLU 444 N 1.05 0.64 -0.51 0.81 4.57 0.26 0.05 114.58 121.45 1dww h GLU 444 Ca 0.26 -0.33 -0.05 0.00 -1.18 0.00 0.00 59.36 58.06 1dww h GLU 444 Cb 0.08 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1dww h GLU 444 CO -0.04 0.94 0.13 1.88 -1.18 0.00 0.00 179.01 180.74 1dww h TYR 445 N 0.37 0.85 -0.42 0.92 -1.99 -0.68 0.23 116.97 116.25 1dww h TYR 445 Ca 0.04 -0.10 -0.09 0.00 2.00 0.00 0.00 58.73 60.59 1dww h TYR 445 Cb 0.81 -0.24 -0.02 0.00 2.00 0.00 0.00 36.73 39.28 1dww h TYR 445 CO 0.07 0.75 -0.10 -0.09 -0.00 0.00 0.00 178.16 178.79 1dww h ARG 446 N 0.71 0.74 0.13 4.88 2.43 -1.44 0.13 114.38 121.96 1dww h ARG 446 Ca 0.16 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1dww h ARG 446 Cb 0.32 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1dww h ARG 446 CO 0.00 0.82 -0.06 0.00 -1.51 0.00 0.00 179.97 179.22 1dww h ALA 447 N 1.22 -0.17 0.00 2.80 0.00 -0.54 -3.41 119.26 119.15 1dww h ALA 447 Ca 0.12 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1dww h ALA 447 Cb 0.56 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1dww h ALA 447 CO 0.03 -0.20 -0.03 2.89 0.00 0.00 0.00 179.25 181.94 1dww n ARG 448 N -4.87 1.93 -2.03 0.00 1.85 0.77 -5.02 116.66 109.29 1dww n ARG 448 Ca -0.06 -1.56 -0.07 0.00 -1.00 0.00 0.00 57.85 55.16 1dww n ARG 448 Cb 0.22 -1.00 -0.01 0.00 -1.05 0.00 0.00 32.46 30.62 1dww n ARG 448 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1dww n GLY 449 N -0.61 0.18 0.00 2.89 0.00 0.46 -4.36 105.19 103.76 1dww n GLY 449 Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1dww n GLY 449 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dww n GLY 450 N -1.13 0.66 3.15 -0.02 0.00 -1.23 -0.11 105.19 106.51 1dww n GLY 450 Ca -0.08 -1.12 0.04 0.00 0.00 0.00 0.00 46.02 44.86 1dww n GLY 450 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dww s PRO 452 N 2.87 4.14 -0.06 0.00 0.04 -1.26 -4.62 135.00 136.12 1dww s PRO 452 Ca 0.16 2.57 -0.03 0.00 0.04 0.00 0.00 61.00 63.74 1dww s PRO 452 Cb -0.13 -3.37 0.03 0.00 0.04 0.00 0.00 34.50 31.07 1dww s PRO 452 CO -0.20 -0.79 0.14 0.00 0.04 0.00 0.00 177.00 176.19 1dww s ALA 453 N 2.04 -0.26 -0.59 8.56 0.00 0.60 -4.16 121.76 127.96 1dww s ALA 453 Ca 0.77 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 1dww s ALA 453 Cb -0.47 -0.38 0.15 0.00 0.00 0.00 0.00 23.12 22.42 1dww s ALA 453 CO 0.34 -0.13 0.50 0.34 0.00 0.00 0.00 175.76 176.81 1dww s ASP 454 N 0.86 6.05 0.23 0.00 -1.08 0.88 -3.34 116.67 120.27 1dww s ASP 454 Ca -0.07 -2.14 -0.07 0.00 -0.52 0.00 0.00 52.55 49.75 1dww s ASP 454 Cb -0.09 -2.10 0.39 0.00 -1.46 0.00 0.00 42.92 39.66 1dww s ASP 454 CO -0.04 -0.69 1.68 -0.25 0.52 0.00 0.00 175.17 176.38 1dww h TRP 455 N 8.31 0.14 -0.17 -5.34 7.01 -1.92 0.56 115.95 124.54 1dww h TRP 455 Ca -0.15 0.04 0.05 0.00 2.11 0.00 0.00 58.89 60.94 1dww h TRP 455 Cb 1.06 0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 28.16 1dww h TRP 455 CO 0.76 -0.12 0.17 0.82 -2.79 0.00 0.00 178.44 177.28 1dww h ILE 456 N 0.20 0.57 0.00 2.65 2.04 -1.92 -1.61 117.51 119.44 1dww h ILE 456 Ca 0.38 0.00 -0.37 0.00 1.00 0.00 0.00 64.86 65.87 1dww h ILE 456 Cb 0.63 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.51 1dww h ILE 456 CO -0.52 0.00 -2.37 0.79 0.00 0.00 0.00 178.15 176.05 1dww n TRP 457 N -3.95 0.05 0.18 1.37 7.02 -0.26 -4.47 117.44 117.38 1dww n TRP 457 Ca 0.01 0.02 0.04 0.00 -1.02 0.00 0.00 57.50 56.55 1dww n TRP 457 Cb 0.29 -1.01 0.28 0.00 -2.42 0.00 0.00 31.31 28.45 1dww n TRP 457 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1dww h LEU 458 N 0.00 0.00 -9.03 -0.99 3.38 -0.46 -3.42 115.31 104.78 1dww h LEU 458 Ca -0.54 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 56.83 1dww h LEU 458 Cb 2.18 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 42.84 1dww h LEU 458 CO 0.01 0.42 0.44 -0.69 0.09 0.00 0.00 178.44 178.72 1dww s VAL 459 N -3.51 4.85 0.55 1.22 1.01 -0.65 -4.94 120.40 118.93 1dww s VAL 459 Ca 0.00 1.53 -0.19 0.00 0.00 0.00 0.00 61.98 63.33 1dww s VAL 459 Cb 0.11 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 1dww s VAL 459 CO 0.70 -0.06 0.50 -2.65 0.00 0.00 0.00 175.10 173.59 1dww n PRO 460 N 5.98 0.51 0.00 2.72 -0.02 -1.26 -4.87 135.00 138.06 1dww n PRO 460 Ca 0.05 0.20 0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1dww n PRO 460 Cb 0.48 -1.65 0.23 0.00 -0.02 0.00 0.00 33.50 32.54 1dww n PRO 460 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1dww n PRO 461 N 0.09 0.13 -3.93 0.52 -0.04 -1.26 -4.47 135.00 126.05 1dww n PRO 461 Ca 0.11 0.21 -0.08 0.00 -0.04 0.00 0.00 63.50 63.70 1dww n PRO 461 Cb 0.47 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.35 1dww n PRO 461 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1dww s VAL 462 N -2.59 0.16 -1.58 0.52 -7.23 -1.26 -4.93 120.40 103.49 1dww s VAL 462 Ca 0.09 -1.37 -0.01 0.00 -1.81 0.00 0.00 61.98 58.88 1dww s VAL 462 Cb 0.06 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.60 1dww s VAL 462 CO 0.14 -0.75 0.11 -1.20 -0.31 0.00 0.00 175.10 173.10 1dww n SER 463 N -0.01 -5.52 0.00 4.85 7.64 -1.26 -4.95 113.62 114.37 1dww n SER 463 Ca -0.15 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.67 1dww n SER 463 Cb 0.62 -4.52 0.00 0.00 -1.01 0.00 0.00 64.21 59.30 1dww n SER 463 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dww n GLY 464 N -1.11 -2.74 0.17 0.23 0.00 -1.26 -1.81 105.19 98.67 1dww n GLY 464 Ca -0.20 0.58 0.13 0.00 0.00 0.00 0.00 46.02 46.53 1dww n GLY 464 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dww h SER 465 N 0.00 0.00 0.75 1.61 4.64 -1.96 -1.33 113.55 117.27 1dww h SER 465 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dww h SER 465 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1dww h SER 465 CO 0.00 0.00 0.00 -0.38 -0.87 0.00 0.00 176.83 175.58 1dww n ILE 466 N -2.42 0.82 -3.61 0.95 2.08 -0.75 -4.67 119.36 111.76 1dww n ILE 466 Ca 0.01 0.21 -0.36 0.00 0.56 0.00 0.00 62.75 63.17 1dww n ILE 466 Cb 0.20 -1.14 -0.06 0.00 -0.75 0.00 0.00 39.64 37.89 1dww n ILE 466 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 1dww s THR 467 N -3.31 5.15 0.39 1.39 2.01 -0.50 -5.01 115.64 115.75 1dww s THR 467 Ca 0.04 0.51 0.12 0.00 0.31 0.00 0.00 61.69 62.67 1dww s THR 467 Cb 0.09 -3.63 0.13 0.00 0.01 0.00 0.00 72.50 69.10 1dww s THR 467 CO 0.40 0.43 1.89 -0.65 -0.69 0.00 0.00 174.62 175.99 1dww h PRO 468 N 4.19 0.07 0.00 4.92 0.11 -1.84 -3.08 132.00 136.37 1dww h PRO 468 Ca -0.51 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 1dww h PRO 468 Cb 1.21 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1dww h PRO 468 CO 0.64 0.33 -0.22 -0.39 -0.21 0.00 0.00 178.00 178.15 1dww h VAL 469 N 0.07 0.80 -0.67 3.15 -1.51 -1.89 -2.89 116.25 113.31 1dww h VAL 469 Ca 0.01 -0.87 -0.01 0.00 -1.23 0.00 0.00 66.70 64.60 1dww h VAL 469 Cb 0.50 1.52 -0.03 0.00 -2.13 0.00 0.00 31.29 31.15 1dww h VAL 469 CO 0.04 0.21 0.36 0.15 -1.23 0.00 0.00 177.57 177.10 1dww h PHE 470 N 0.00 0.90 -0.22 5.19 3.04 -1.75 -2.51 116.94 121.59 1dww h PHE 470 Ca -0.00 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1dww h PHE 470 Cb 0.51 -0.29 0.00 0.00 2.56 0.00 0.00 35.95 38.73 1dww h PHE 470 CO 0.00 0.63 0.00 0.72 -2.02 0.00 0.00 178.31 177.64 1dww n HIS 471 N -4.37 0.28 -3.67 0.41 -0.00 -1.09 -4.82 115.22 101.96 1dww n HIS 471 Ca 0.06 -0.14 -0.38 0.00 -0.00 0.00 0.00 57.72 57.26 1dww n HIS 471 Cb 0.10 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 29.97 1dww n HIS 471 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 1dww s GLN 472 N -1.72 3.21 0.39 -0.41 2.00 -0.95 -0.59 119.66 121.60 1dww s GLN 472 Ca 0.28 -0.80 -0.26 0.00 -2.00 0.00 0.00 55.36 52.58 1dww s GLN 472 Cb 0.15 -3.54 -0.09 0.00 0.80 0.00 0.00 33.01 30.34 1dww s GLN 472 CO 0.22 -0.46 1.20 -1.21 -0.50 0.00 0.00 175.29 174.53 1dww s GLU 473 N 1.58 4.07 0.07 1.67 2.02 -0.76 -5.01 118.70 122.33 1dww s GLU 473 Ca 0.04 1.91 -0.08 0.00 0.02 0.00 0.00 54.97 56.85 1dww s GLU 473 Cb -0.17 -2.73 -0.00 0.00 0.10 0.00 0.00 34.13 31.33 1dww s GLU 473 CO 0.05 -0.33 0.18 0.00 0.02 0.00 0.00 175.26 175.18 1dww s MET 474 N -2.23 0.77 -0.10 1.61 0.23 -1.26 -4.67 119.30 113.64 1dww s MET 474 Ca 0.56 -0.85 -0.02 0.00 -1.03 0.00 0.00 55.69 54.36 1dww s MET 474 Cb -0.32 0.31 -0.03 0.00 -1.53 0.00 0.00 34.83 33.26 1dww s MET 474 CO 0.41 -0.23 -0.04 -0.51 -2.03 0.00 0.00 175.02 172.62 1dww s LEU 475 N -2.56 3.32 -0.21 0.18 1.02 -1.26 -4.95 118.68 114.22 1dww s LEU 475 Ca 0.01 -0.01 -0.03 0.00 0.02 0.00 0.00 54.13 54.13 1dww s LEU 475 Cb 0.03 -1.76 -0.00 0.00 0.02 0.00 0.00 46.19 44.47 1dww s LEU 475 CO -0.08 0.30 -0.08 0.21 0.02 0.00 0.00 176.35 176.72 1dww s ASN 476 N -0.42 4.03 0.06 2.29 2.47 -1.21 -0.29 114.94 121.87 1dww s ASN 476 Ca 0.07 -0.45 -0.16 0.00 0.42 0.00 0.00 52.86 52.74 1dww s ASN 476 Cb -0.12 -1.68 0.03 0.00 -1.45 0.00 0.00 41.25 38.03 1dww s ASN 476 CO 0.02 -0.01 0.37 -0.72 -3.72 0.00 0.00 177.10 173.04 1dww s TYR 477 N 1.40 -0.19 -0.28 0.43 1.13 -1.26 -4.94 117.35 113.63 1dww s TYR 477 Ca 0.05 0.07 -0.15 0.00 -1.41 0.00 0.00 57.07 55.63 1dww s TYR 477 Cb -0.14 0.18 -0.03 0.00 -1.10 0.00 0.00 41.96 40.87 1dww s TYR 477 CO -0.05 -0.57 0.39 0.08 -2.51 0.00 0.00 175.55 172.89 1dww s VAL 478 N -2.75 5.15 0.00 -3.49 1.01 -1.26 -4.80 120.40 114.26 1dww s VAL 478 Ca -0.04 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1dww s VAL 478 Cb -0.00 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1dww s VAL 478 CO -0.04 0.09 0.00 0.18 0.00 0.00 0.00 175.10 175.32 1dww n LEU 479 N 5.39 0.00 -3.72 3.92 4.77 -1.26 -1.64 117.00 124.45 1dww n LEU 479 Ca -0.08 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.78 1dww n LEU 479 Cb 0.50 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.48 1dww n LEU 479 CO 0.38 -0.12 -0.00 -0.55 -1.33 0.00 0.00 177.39 175.77 1dww s SER 480 N -0.60 -0.40 0.83 -1.43 0.15 -1.26 -4.29 113.70 106.70 1dww s SER 480 Ca 0.00 0.74 -0.11 0.00 0.70 0.00 0.00 55.95 57.27 1dww s SER 480 Cb 0.00 0.66 0.10 0.00 -1.71 0.00 0.00 66.02 65.07 1dww s SER 480 CO 0.00 -0.16 1.14 -2.16 1.20 0.00 0.00 173.24 173.26 1dww s PRO 481 N 0.95 1.61 0.10 5.44 0.04 -1.26 -5.01 135.00 136.87 1dww s PRO 481 Ca -0.06 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.34 1dww s PRO 481 Cb -0.07 -1.80 0.01 0.00 0.04 0.00 0.00 34.50 32.69 1dww s PRO 481 CO -0.07 -2.18 0.28 0.12 0.04 0.00 0.00 177.00 175.19 1dww s PHE 482 N -2.59 -0.01 -0.34 0.56 5.36 -0.65 -4.05 117.98 116.26 1dww s PHE 482 Ca 0.67 -0.37 -0.08 0.00 -0.96 0.00 0.00 56.93 56.18 1dww s PHE 482 Cb -0.22 0.08 0.03 0.00 -0.34 0.00 0.00 43.02 42.57 1dww s PHE 482 CO 0.55 -0.61 0.13 0.71 -1.46 0.00 0.00 175.22 174.53 1dww s TYR 483 N -3.83 3.24 0.25 10.12 2.02 -1.26 -1.24 117.35 126.65 1dww s TYR 483 Ca 0.04 -1.26 0.06 0.00 -0.37 0.00 0.00 57.07 55.53 1dww s TYR 483 Cb 0.04 -2.32 -0.03 0.00 -0.40 0.00 0.00 41.96 39.25 1dww s TYR 483 CO -0.11 -0.69 0.32 0.71 -1.57 0.00 0.00 175.55 174.20 1dww s TYR 484 N 1.45 3.34 0.76 2.71 2.02 0.50 -4.89 117.35 123.24 1dww s TYR 484 Ca -0.00 -0.06 -0.08 0.00 -0.37 0.00 0.00 57.07 56.56 1dww s TYR 484 Cb -0.19 -1.55 0.09 0.00 -0.40 0.00 0.00 41.96 39.91 1dww s TYR 484 CO 0.04 0.43 1.09 0.71 -1.57 0.00 0.00 175.55 176.25 1dww s TYR 485 N -2.03 2.55 0.05 2.71 2.02 0.40 -0.41 117.35 122.63 1dww s TYR 485 Ca 0.34 0.38 -0.02 0.00 -0.37 0.00 0.00 57.07 57.41 1dww s TYR 485 Cb -0.09 -3.37 -0.03 0.00 -0.40 0.00 0.00 41.96 38.07 1dww s TYR 485 CO 0.28 -1.70 0.00 -0.65 -1.57 0.00 0.00 175.55 171.91 1dww s GLN 486 N -5.39 0.57 0.20 -0.62 -0.21 -1.26 -0.94 119.66 112.00 1dww s GLN 486 Ca 0.63 -1.03 -0.30 0.00 0.02 0.00 0.00 55.36 54.69 1dww s GLN 486 Cb -0.09 0.20 -0.08 0.00 1.00 0.00 0.00 33.01 34.04 1dww s GLN 486 CO 0.47 -0.11 1.21 0.42 -2.12 0.00 0.00 175.29 175.15 1dww s ILE 487 N -3.29 3.49 -0.13 1.08 1.01 -1.26 -4.90 121.20 117.19 1dww s ILE 487 Ca 0.01 1.27 -0.36 0.00 0.00 0.00 0.00 60.65 61.56 1dww s ILE 487 Cb 0.03 -3.81 -0.13 0.00 0.01 0.00 0.00 42.46 38.56 1dww s ILE 487 CO -0.08 0.21 1.80 -0.62 0.00 0.00 0.00 174.94 176.26 1dww n GLU 488 N 2.40 1.82 -0.31 2.79 1.02 -1.26 -4.87 120.64 122.23 1dww n GLU 488 Ca 0.04 0.66 0.14 0.00 -0.02 0.00 0.00 57.16 57.99 1dww n GLU 488 Cb 0.44 -2.45 0.32 0.00 -0.02 0.00 0.00 31.44 29.74 1dww n GLU 488 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1dww h PRO 489 N 8.24 0.34 0.00 3.49 0.13 -1.93 -1.56 132.00 140.71 1dww h PRO 489 Ca -0.48 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1dww h PRO 489 Cb 1.29 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1dww h PRO 489 CO 0.94 0.23 0.00 0.11 -0.23 0.00 0.00 178.00 179.05 1dww h TRP 490 N 0.35 0.00 0.00 1.56 0.09 -1.97 0.12 115.95 116.11 1dww h TRP 490 Ca 0.58 0.00 -0.08 0.00 0.09 0.00 0.00 58.89 59.48 1dww h TRP 490 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.37 1dww h TRP 490 CO -0.15 0.00 -0.69 0.87 0.09 0.00 0.00 178.44 178.56 1dww h LYS 491 N 0.00 0.00 -0.00 0.12 1.57 -1.64 -3.37 116.57 113.24 1dww h LYS 491 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1dww h LYS 491 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1dww h LYS 491 CO 0.00 0.25 -0.02 0.25 -0.57 0.00 0.00 179.45 179.35 1dww n THR 492 N -3.02 0.00 -1.86 -0.16 -2.24 -0.53 -5.08 114.28 101.39 1dww n THR 492 Ca -0.01 -0.49 -0.37 0.00 -2.27 0.00 0.00 64.05 60.91 1dww n THR 492 Cb 0.68 1.01 0.05 0.00 -2.10 0.00 0.00 70.33 69.96 1dww n THR 492 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1dww s HIS 493 N -0.72 2.26 -0.33 4.78 5.04 0.30 -5.01 115.29 121.62 1dww s HIS 493 Ca 0.01 1.46 -0.13 0.00 -1.54 0.00 0.00 55.06 54.86 1dww s HIS 493 Cb 0.01 -3.65 -0.02 0.00 0.04 0.00 0.00 32.58 28.95 1dww s HIS 493 CO 0.02 -2.65 0.27 0.42 -2.34 0.00 0.00 174.74 170.46 1dww s ILE 494 N -1.43 5.26 -0.55 0.89 1.01 -1.26 -5.05 121.20 120.07 1dww s ILE 494 Ca 0.77 -0.09 -0.19 0.00 0.00 0.00 0.00 60.65 61.14 1dww s ILE 494 Cb -0.36 -3.72 0.08 0.00 0.01 0.00 0.00 42.46 38.48 1dww s ILE 494 CO 0.40 0.00 0.65 0.26 0.00 0.00 0.00 174.94 176.25 1dww s TRP 495 N 1.80 3.04 -2.65 3.97 0.52 -1.26 -4.73 118.94 119.63 1dww s TRP 495 Ca 0.08 -0.80 0.27 0.00 0.02 0.00 0.00 56.10 55.66 1dww s TRP 495 Cb -0.17 -3.78 0.79 0.00 -1.15 0.00 0.00 33.47 29.16 1dww s TRP 495 CO 0.11 -1.16 1.60 0.00 0.02 0.00 0.00 176.95 177.52