#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnv s LYS 94 N 0.00 3.22 -0.18 2.61 1.02 -1.26 -4.97 119.74 120.18 2wnv s LYS 94 Ca 0.00 -2.10 0.01 0.00 0.02 0.00 0.00 55.97 53.90 2wnv s LYS 94 Cb 0.00 -4.31 0.04 0.00 -0.52 0.00 0.00 37.83 33.04 2wnv s LYS 94 CO 0.00 -1.30 -0.11 0.42 -0.92 0.00 0.00 175.35 173.45 2wnv s ILE 95 N 0.85 1.56 -0.24 2.17 1.01 -1.26 -3.74 121.20 121.54 2wnv s ILE 95 Ca 0.11 -0.87 -0.26 0.00 0.00 0.00 0.00 60.65 59.63 2wnv s ILE 95 Cb -0.20 -1.61 0.08 0.00 0.01 0.00 0.00 42.46 40.74 2wnv s ILE 95 CO -0.03 0.23 0.76 0.00 0.00 0.00 0.00 174.94 175.91 2wnv s ALA 96 N 1.45 -1.81 0.00 9.38 0.00 -1.07 -1.33 121.76 128.38 2wnv s ALA 96 Ca 0.00 1.92 -0.02 0.00 0.00 0.00 0.00 51.96 53.86 2wnv s ALA 96 Cb -0.15 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 21.89 2wnv s ALA 96 CO -0.09 -0.33 0.03 -0.59 0.00 0.00 0.00 175.76 174.78 2wnv s PHE 97 N 0.14 0.11 -0.04 0.00 -0.12 -0.07 -0.12 117.98 117.88 2wnv s PHE 97 Ca -0.01 -0.24 -0.00 0.00 -0.05 0.00 0.00 56.93 56.63 2wnv s PHE 97 Cb -0.04 -0.09 0.03 0.00 -0.63 0.00 0.00 43.02 42.28 2wnv s PHE 97 CO 0.01 -0.16 0.00 -1.12 -0.05 0.00 0.00 175.22 173.91 2wnv s SER 98 N -0.96 0.77 -0.01 1.98 0.01 0.09 -1.21 113.70 114.37 2wnv s SER 98 Ca -0.11 -0.03 -0.01 0.00 1.31 0.00 0.00 55.95 57.11 2wnv s SER 98 Cb -0.06 -0.27 0.01 0.00 0.21 0.00 0.00 66.02 65.90 2wnv s SER 98 CO -0.00 -0.13 0.03 0.00 0.41 0.00 0.00 173.24 173.55 2wnv s ALA 99 N 1.32 -0.04 0.26 1.44 0.00 -0.19 -0.64 121.76 123.91 2wnv s ALA 99 Ca -0.05 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.11 2wnv s ALA 99 Cb -0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 23.12 22.86 2wnv s ALA 99 CO -0.02 -0.04 0.36 0.95 0.00 0.00 0.00 175.76 177.01 2wnv s THR 100 N 0.30 4.85 -0.21 0.00 -4.23 0.56 -1.07 115.64 115.84 2wnv s THR 100 Ca -0.02 -1.05 -0.07 0.00 -1.18 0.00 0.00 61.69 59.36 2wnv s THR 100 Cb -0.03 -3.69 -0.04 0.00 1.34 0.00 0.00 72.50 70.08 2wnv s THR 100 CO -0.01 -0.29 0.06 -0.60 -0.54 0.00 0.00 174.62 173.25 2wnv s ARG 101 N -4.01 3.84 0.00 3.99 3.52 -0.56 -0.96 118.95 124.77 2wnv s ARG 101 Ca 0.36 -0.40 0.05 0.00 -0.13 0.00 0.00 55.73 55.62 2wnv s ARG 101 Cb -0.09 -3.25 0.07 0.00 -1.56 0.00 0.00 34.95 30.12 2wnv s ARG 101 CO 0.29 0.09 0.81 0.25 -0.81 0.00 0.00 175.30 175.93 2wnv n THR 102 N 4.08 0.30 -0.16 4.11 -2.24 -1.26 -4.00 114.28 115.10 2wnv n THR 102 Ca -0.16 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 2wnv n THR 102 Cb 0.52 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 2wnv n THR 102 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2wnv n ILE 103 N 0.21 0.00 -2.99 2.28 2.08 -1.26 -4.90 119.36 114.79 2wnv n ILE 103 Ca 0.04 0.00 -0.40 0.00 0.56 0.00 0.00 62.75 62.95 2wnv n ILE 103 Cb 0.19 -1.29 -0.06 0.00 -0.75 0.00 0.00 39.64 37.73 2wnv n ILE 103 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 2wnv s PRO 106 N 0.32 4.53 0.31 0.38 0.02 -1.26 -4.63 135.00 134.67 2wnv s PRO 106 Ca 0.00 1.12 -0.24 0.00 0.02 0.00 0.00 61.00 61.89 2wnv s PRO 106 Cb 0.00 -3.30 -0.10 0.00 0.02 0.00 0.00 34.50 31.13 2wnv s PRO 106 CO 0.00 0.47 0.90 -0.51 -0.33 0.00 0.00 177.00 177.53 2wnv s LEU 107 N -0.77 4.32 0.21 -5.54 1.43 -1.26 -5.08 118.68 111.99 2wnv s LEU 107 Ca 0.37 1.74 0.05 0.00 -1.03 0.00 0.00 54.13 55.26 2wnv s LEU 107 Cb -0.22 -3.95 -0.03 0.00 0.03 0.00 0.00 46.19 42.01 2wnv s LEU 107 CO 0.25 -0.06 0.27 0.00 0.23 0.00 0.00 176.35 177.03 2wnv s ARG 108 N -2.10 3.21 0.28 1.70 1.04 -1.26 -4.90 118.95 116.93 2wnv s ARG 108 Ca 0.49 -0.83 -0.30 0.00 -1.04 0.00 0.00 55.73 54.06 2wnv s ARG 108 Cb -0.18 -2.78 -0.13 0.00 -2.04 0.00 0.00 34.95 29.83 2wnv s ARG 108 CO 0.23 0.45 1.31 -2.13 -0.04 0.00 0.00 175.30 175.12 2wnv n ARG 109 N -1.02 1.98 -0.87 3.89 0.63 -1.26 -2.17 116.66 117.84 2wnv n ARG 109 Ca -0.08 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.55 2wnv n ARG 109 Cb 0.56 -2.29 0.00 0.00 0.45 0.00 0.00 32.46 31.18 2wnv n ARG 109 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2wnv n ASP 110 N 1.52 -0.43 -4.73 6.15 8.00 -0.24 -4.95 116.55 121.87 2wnv n ASP 110 Ca 0.09 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.18 2wnv n ASP 110 Cb 0.33 -0.81 -0.04 0.00 -0.02 0.00 0.00 41.12 40.58 2wnv n ASP 110 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2wnv s GLN 111 N -0.33 4.57 0.18 -1.24 0.74 -0.92 -4.75 119.66 117.90 2wnv s GLN 111 Ca 0.00 1.70 -0.31 0.00 0.05 0.00 0.00 55.36 56.80 2wnv s GLN 111 Cb 0.00 -3.30 -0.09 0.00 1.10 0.00 0.00 33.01 30.71 2wnv s GLN 111 CO 0.00 0.01 1.45 0.99 -0.55 0.00 0.00 175.29 177.19 2wnv s THR 112 N 0.09 2.90 -0.40 -0.34 2.01 -1.26 -0.46 115.64 118.18 2wnv s THR 112 Ca 0.51 0.68 -0.25 0.00 0.31 0.00 0.00 61.69 62.95 2wnv s THR 112 Cb -0.29 -3.44 0.02 0.00 0.01 0.00 0.00 72.50 68.80 2wnv s THR 112 CO 0.33 0.07 0.87 -0.63 -0.69 0.00 0.00 174.62 174.58 2wnv s ILE 113 N 0.70 4.60 -0.07 1.82 1.01 0.14 -4.89 121.20 124.51 2wnv s ILE 113 Ca 0.64 0.92 -0.27 0.00 0.00 0.00 0.00 60.65 61.94 2wnv s ILE 113 Cb -0.40 -4.32 -0.03 0.00 0.01 0.00 0.00 42.46 37.72 2wnv s ILE 113 CO 0.35 -0.60 0.86 -0.60 0.00 0.00 0.00 174.94 174.95 2wnv s ARG 114 N 3.43 4.45 -0.52 2.79 3.52 -1.25 -4.54 118.95 126.83 2wnv s ARG 114 Ca 0.35 1.16 -0.06 0.00 -0.13 0.00 0.00 55.73 57.06 2wnv s ARG 114 Cb -0.12 -3.49 0.14 0.00 -1.56 0.00 0.00 34.95 29.92 2wnv s ARG 114 CO 0.21 -0.10 0.36 -0.06 -0.81 0.00 0.00 175.30 174.89 2wnv s PHE 115 N 1.31 3.50 -0.22 5.12 0.40 -1.26 -4.69 117.98 122.14 2wnv s PHE 115 Ca 0.44 -2.29 0.17 0.00 -0.60 0.00 0.00 56.93 54.65 2wnv s PHE 115 Cb -0.19 -3.36 0.12 0.00 0.51 0.00 0.00 43.02 40.11 2wnv s PHE 115 CO 0.20 -0.95 1.48 0.38 0.70 0.00 0.00 175.22 177.04 2wnv h ASP 116 N 7.88 0.00 -3.57 1.36 2.03 -1.47 -3.43 116.42 119.23 2wnv h ASP 116 Ca -0.11 0.00 -0.71 0.00 -0.73 0.00 0.00 57.03 55.48 2wnv h ASP 116 Cb 1.03 0.00 -0.23 0.00 -0.83 0.00 0.00 39.33 39.30 2wnv h ASP 116 CO 0.76 0.40 -0.49 -2.28 -1.03 0.00 0.00 179.24 176.60 2wnv s HIS 117 N -3.01 3.24 -0.19 4.15 5.04 -0.14 -4.87 115.29 119.52 2wnv s HIS 117 Ca 0.05 -0.82 -0.27 0.00 -1.54 0.00 0.00 55.06 52.47 2wnv s HIS 117 Cb 0.07 -2.48 -0.00 0.00 0.04 0.00 0.00 32.58 30.20 2wnv s HIS 117 CO 0.73 -0.62 0.94 0.08 -2.34 0.00 0.00 174.74 173.53 2wnv s VAL 118 N 1.60 4.79 -0.19 0.89 1.01 -1.26 -0.32 120.40 126.91 2wnv s VAL 118 Ca 0.03 1.84 -0.15 0.00 0.00 0.00 0.00 61.98 63.70 2wnv s VAL 118 Cb -0.19 -4.23 -0.20 0.00 0.00 0.00 0.00 36.38 31.76 2wnv s VAL 118 CO 0.08 -0.06 0.17 -0.38 0.00 0.00 0.00 175.10 174.90 2wnv n ILE 119 N 4.98 1.61 -3.85 2.22 5.41 0.18 -4.98 119.36 124.93 2wnv n ILE 119 Ca 0.08 -0.28 -0.13 0.00 1.00 0.00 0.00 62.75 63.43 2wnv n ILE 119 Cb 0.48 -1.90 -0.14 0.00 -0.71 0.00 0.00 39.64 37.36 2wnv n ILE 119 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2wnv s THR 120 N -2.45 -0.01 -0.44 1.39 2.01 -0.78 -4.95 115.64 110.42 2wnv s THR 120 Ca -0.28 0.04 0.08 0.00 0.31 0.00 0.00 61.69 61.83 2wnv s THR 120 Cb 0.07 -0.05 0.32 0.00 0.01 0.00 0.00 72.50 72.86 2wnv s THR 120 CO 0.63 0.01 1.00 -3.20 -0.69 0.00 0.00 174.62 172.38 2wnv n ASN 121 N 3.26 -1.51 -4.69 3.53 5.15 -1.23 -0.73 115.26 119.03 2wnv n ASN 121 Ca -0.15 -3.50 -0.42 0.00 -0.60 0.00 0.00 54.58 49.91 2wnv n ASN 121 Cb 0.58 1.24 -0.03 0.00 -0.53 0.00 0.00 39.78 41.04 2wnv n ASN 121 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 2wnv s MET 122 N -0.44 4.27 0.00 1.20 -1.94 0.82 -1.97 119.30 121.24 2wnv s MET 122 Ca 0.27 2.07 0.00 0.00 -1.71 0.00 0.00 55.69 56.32 2wnv s MET 122 Cb 0.30 -3.52 0.00 0.00 2.01 0.00 0.00 34.83 33.62 2wnv s MET 122 CO -0.07 -0.59 0.00 -1.71 -0.01 0.00 0.00 175.02 172.65 2wnv n ASN 123 N 5.16 0.00 -3.93 3.03 4.05 -1.25 -2.61 115.26 119.72 2wnv n ASN 123 Ca 0.13 0.00 -0.26 0.00 0.45 0.00 0.00 54.58 54.90 2wnv n ASN 123 Cb 0.43 0.00 -0.01 0.00 1.23 0.00 0.00 39.78 41.42 2wnv n ASN 123 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2wnv n ASN 124 N 0.00 -0.92 -0.26 1.20 5.15 -0.83 -4.88 115.26 114.71 2wnv n ASN 124 Ca 0.00 -1.02 0.09 0.00 -0.60 0.00 0.00 54.58 53.06 2wnv n ASN 124 Cb 0.00 -3.05 -0.04 0.00 -0.53 0.00 0.00 39.78 36.15 2wnv n ASN 124 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2wnv n ASN 125 N -2.93 1.45 -4.83 1.20 3.02 -1.26 -4.90 115.26 107.01 2wnv n ASN 125 Ca -0.28 -1.22 -0.36 0.00 -0.03 0.00 0.00 54.58 52.68 2wnv n ASN 125 Cb 0.67 0.69 -0.07 0.00 -0.61 0.00 0.00 39.78 40.46 2wnv n ASN 125 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wnv s TYR 126 N -2.41 3.53 -0.41 3.10 5.04 -1.26 -1.13 117.35 123.80 2wnv s TYR 126 Ca 0.12 0.45 -0.05 0.00 -2.44 0.00 0.00 57.07 55.16 2wnv s TYR 126 Cb 0.15 -1.99 0.10 0.00 0.35 0.00 0.00 41.96 40.57 2wnv s TYR 126 CO 0.60 0.60 0.22 -2.00 -1.34 0.00 0.00 175.55 173.62 2wnv s GLU 127 N -0.64 2.23 0.22 4.97 2.56 -0.34 -4.97 118.70 122.73 2wnv s GLU 127 Ca 0.13 -1.69 0.20 0.00 0.00 0.00 0.00 54.97 53.61 2wnv s GLU 127 Cb -0.12 -3.63 0.90 0.00 2.00 0.00 0.00 34.13 33.29 2wnv s GLU 127 CO 0.02 -1.02 1.60 -0.35 -0.56 0.00 0.00 175.26 174.95 2wnv n PRO 128 N 4.70 0.13 0.23 4.30 -0.04 -1.26 -0.63 135.00 142.44 2wnv n PRO 128 Ca -0.06 0.48 0.11 0.00 -0.04 0.00 0.00 63.50 64.00 2wnv n PRO 128 Cb 0.42 -1.82 0.40 0.00 -0.04 0.00 0.00 33.50 32.46 2wnv n PRO 128 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wnv h ARG 129 N 0.00 0.00 0.00 0.54 3.08 -1.89 -3.37 114.38 112.74 2wnv h ARG 129 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 2wnv h ARG 129 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 2wnv h ARG 129 CO 0.00 0.15 -1.11 -1.13 -1.07 0.00 0.00 179.97 176.81 2wnv n SER 130 N -3.22 4.06 0.00 7.04 3.41 -0.80 -5.02 113.62 119.09 2wnv n SER 130 Ca 0.01 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2wnv n SER 130 Cb 0.46 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 2wnv n SER 130 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wnv n GLY 131 N 3.27 0.80 3.80 5.00 0.00 0.20 -3.96 105.19 114.30 2wnv n GLY 131 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 2wnv n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnv s LYS 132 N -0.95 3.72 -0.09 1.61 1.02 -1.22 -4.58 119.74 119.24 2wnv s LYS 132 Ca 0.00 -0.19 -0.17 0.00 0.02 0.00 0.00 55.97 55.63 2wnv s LYS 132 Cb 0.00 -3.26 -0.05 0.00 -0.52 0.00 0.00 37.83 34.01 2wnv s LYS 132 CO 0.00 0.57 0.45 0.12 -0.92 0.00 0.00 175.35 175.57 2wnv s PHE 133 N -0.44 3.56 -0.19 3.18 5.36 -0.07 -1.20 117.98 128.18 2wnv s PHE 133 Ca 0.12 0.90 -0.00 0.00 -0.96 0.00 0.00 56.93 56.98 2wnv s PHE 133 Cb -0.12 -2.48 0.01 0.00 -0.34 0.00 0.00 43.02 40.10 2wnv s PHE 133 CO 0.02 0.28 -0.16 0.99 -1.46 0.00 0.00 175.22 174.88 2wnv s THR 134 N 0.21 2.36 -0.09 0.12 2.01 -0.28 -0.47 115.64 119.50 2wnv s THR 134 Ca 0.25 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 2wnv s THR 134 Cb -0.15 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 2wnv s THR 134 CO 0.11 0.51 1.53 0.00 -0.69 0.00 0.00 174.62 176.08 2wnv n LYS 136 N 6.98 1.30 -3.95 0.00 5.02 -1.26 -0.78 118.16 125.47 2wnv n LYS 136 Ca 0.16 -0.05 -0.34 0.00 -2.02 0.00 0.00 58.31 56.06 2wnv n LYS 136 Cb 0.43 -1.35 -0.14 0.00 -0.02 0.00 0.00 35.03 33.96 2wnv n LYS 136 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wnv s VAL 137 N -2.58 2.67 0.55 -0.18 1.01 -1.26 -4.91 120.40 115.70 2wnv s VAL 137 Ca -0.06 -1.76 -0.21 0.00 0.00 0.00 0.00 61.98 59.94 2wnv s VAL 137 Cb 0.06 -2.68 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 2wnv s VAL 137 CO 0.57 -0.28 1.34 -2.84 0.00 0.00 0.00 175.10 173.90 2wnv s PRO 138 N 1.12 3.12 0.00 2.72 0.02 -1.26 -4.91 135.00 135.81 2wnv s PRO 138 Ca -0.01 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.21 2wnv s PRO 138 Cb -0.20 -2.23 0.00 0.00 0.02 0.00 0.00 34.50 32.09 2wnv s PRO 138 CO -0.04 -1.20 0.00 0.41 -0.33 0.00 0.00 177.00 175.84 2wnv n GLY 139 N 0.72 -0.81 3.72 0.52 0.00 -0.84 -1.32 105.19 107.19 2wnv n GLY 139 Ca 0.11 -1.34 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 2wnv n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wnv s LEU 140 N 0.00 4.29 0.08 0.99 1.43 0.06 -0.65 118.68 124.88 2wnv s LEU 140 Ca 0.00 0.97 0.06 0.00 -1.03 0.00 0.00 54.13 54.13 2wnv s LEU 140 Cb 0.00 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.33 2wnv s LEU 140 CO 0.00 -0.05 -0.15 -0.31 0.23 0.00 0.00 176.35 176.06 2wnv s TYR 141 N 0.73 1.34 -0.16 0.29 1.51 0.00 0.22 117.35 121.28 2wnv s TYR 141 Ca 0.31 -0.46 -0.02 0.00 -1.01 0.00 0.00 57.07 55.88 2wnv s TYR 141 Cb -0.16 -0.74 -0.02 0.00 -0.11 0.00 0.00 41.96 40.92 2wnv s TYR 141 CO 0.14 0.09 -0.07 -0.47 -1.11 0.00 0.00 175.55 174.13 2wnv s TYR 142 N -1.33 2.93 0.06 2.71 5.04 -0.51 -0.82 117.35 125.43 2wnv s TYR 142 Ca 0.01 -0.52 0.07 0.00 -2.44 0.00 0.00 57.07 54.18 2wnv s TYR 142 Cb -0.10 -1.94 -0.04 0.00 0.35 0.00 0.00 41.96 40.24 2wnv s TYR 142 CO 0.03 -0.18 -0.14 -0.06 -1.34 0.00 0.00 175.55 173.86 2wnv s PHE 143 N 0.52 2.65 0.03 4.97 0.40 0.08 -1.38 117.98 125.25 2wnv s PHE 143 Ca -0.05 -0.20 -0.26 0.00 -0.60 0.00 0.00 56.93 55.81 2wnv s PHE 143 Cb -0.15 -1.46 0.06 0.00 0.51 0.00 0.00 43.02 41.99 2wnv s PHE 143 CO 0.03 0.34 0.61 -0.08 0.70 0.00 0.00 175.22 176.82 2wnv s THR 144 N -1.04 0.01 0.07 0.64 -1.32 -0.37 -0.70 115.64 112.93 2wnv s THR 144 Ca 0.17 -0.08 -0.10 0.00 -1.21 0.00 0.00 61.69 60.47 2wnv s THR 144 Cb -0.11 -0.98 0.01 0.00 -1.51 0.00 0.00 72.50 69.91 2wnv s THR 144 CO 0.08 -0.04 0.22 -0.72 -2.21 0.00 0.00 174.62 171.95 2wnv s TYR 145 N -2.12 0.07 -0.07 9.09 -0.85 -0.73 -0.72 117.35 122.02 2wnv s TYR 145 Ca -0.07 -0.40 0.01 0.00 -0.52 0.00 0.00 57.07 56.09 2wnv s TYR 145 Cb -0.01 -0.01 0.02 0.00 0.38 0.00 0.00 41.96 42.35 2wnv s TYR 145 CO 0.01 -0.52 -0.07 -1.01 -1.52 0.00 0.00 175.55 172.45 2wnv s HIS 146 N -3.34 1.13 -0.15 -3.49 3.76 -0.64 -2.71 115.29 109.86 2wnv s HIS 146 Ca 0.01 -0.44 0.02 0.00 -0.15 0.00 0.00 55.06 54.50 2wnv s HIS 146 Cb 0.02 -0.95 0.01 0.00 1.11 0.00 0.00 32.58 32.78 2wnv s HIS 146 CO -0.08 -0.32 -0.20 0.00 -0.85 0.00 0.00 174.74 173.28 2wnv s ALA 147 N 1.22 2.18 0.40 -1.40 0.00 -0.02 -0.58 121.76 123.55 2wnv s ALA 147 Ca -0.05 -1.07 -0.21 0.00 0.00 0.00 0.00 51.96 50.63 2wnv s ALA 147 Cb -0.14 -1.02 -0.11 0.00 0.00 0.00 0.00 23.12 21.85 2wnv s ALA 147 CO -0.02 -0.13 0.92 -1.12 0.00 0.00 0.00 175.76 175.41 2wnv s SER 148 N 0.98 6.98 -0.02 0.00 0.01 -1.13 -1.12 113.70 119.40 2wnv s SER 148 Ca -0.04 1.65 -0.29 0.00 1.31 0.00 0.00 55.95 58.59 2wnv s SER 148 Cb -0.15 -2.52 0.08 0.00 0.21 0.00 0.00 66.02 63.64 2wnv s SER 148 CO -0.05 -0.29 0.74 -0.55 0.41 0.00 0.00 173.24 173.50 2wnv s SER 149 N -2.10 -0.56 0.00 2.44 0.15 -0.61 -0.45 113.70 112.57 2wnv s SER 149 Ca 0.59 0.43 0.04 0.00 0.70 0.00 0.00 55.95 57.71 2wnv s SER 149 Cb -0.11 0.50 0.06 0.00 -1.71 0.00 0.00 66.02 64.76 2wnv s SER 149 CO 0.15 -0.64 0.84 0.54 1.20 0.00 0.00 173.24 175.33 2wnv n ARG 150 N 0.48 1.18 0.00 5.44 1.74 -1.26 -0.88 116.66 123.36 2wnv n ARG 150 Ca -0.16 -1.19 0.00 0.00 -0.77 0.00 0.00 57.85 55.73 2wnv n ARG 150 Cb 0.59 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.95 2wnv n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wnv n GLY 151 N 0.03 1.84 3.71 -0.13 0.00 -1.26 -4.30 105.19 105.07 2wnv n GLY 151 Ca 0.03 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 2wnv n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wnv s ASN 152 N 2.00 6.85 -0.07 1.61 0.01 -1.25 -3.93 114.94 120.16 2wnv s ASN 152 Ca 0.00 2.25 0.00 0.00 -0.71 0.00 0.00 52.86 54.40 2wnv s ASN 152 Cb 0.00 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 39.10 2wnv s ASN 152 CO 0.00 -0.65 -0.05 -0.22 -1.51 0.00 0.00 177.10 174.67 2wnv s LEU 153 N 1.42 1.14 -0.02 0.60 2.96 -0.92 -2.47 118.68 121.40 2wnv s LEU 153 Ca 0.64 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 54.42 2wnv s LEU 153 Cb -0.35 -0.60 -0.02 0.00 0.50 0.00 0.00 46.19 45.72 2wnv s LEU 153 CO 0.29 -0.09 -0.20 0.00 -1.32 0.00 0.00 176.35 175.03 2wnv s VAL 155 N -0.46 0.39 -0.13 0.00 1.01 0.04 -3.64 120.40 117.59 2wnv s VAL 155 Ca 0.08 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.78 2wnv s VAL 155 Cb -0.08 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 2wnv s VAL 155 CO -0.01 0.15 0.40 0.20 0.00 0.00 0.00 175.10 175.85 2wnv s ASN 156 N 0.45 6.59 -0.21 3.32 0.01 -0.25 -1.02 114.94 123.83 2wnv s ASN 156 Ca -0.05 0.69 -0.21 0.00 -0.71 0.00 0.00 52.86 52.58 2wnv s ASN 156 Cb -0.09 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.31 2wnv s ASN 156 CO -0.00 0.05 0.67 -0.22 -1.51 0.00 0.00 177.10 176.08 2wnv s LEU 157 N 0.53 4.12 0.05 0.60 2.96 -0.34 -0.54 118.68 126.06 2wnv s LEU 157 Ca 0.22 0.86 0.05 0.00 -0.22 0.00 0.00 54.13 55.04 2wnv s LEU 157 Cb -0.14 -2.94 -0.04 0.00 0.50 0.00 0.00 46.19 43.57 2wnv s LEU 157 CO 0.08 -0.33 -0.10 -0.04 -1.32 0.00 0.00 176.35 174.64 2wnv s MET 158 N 2.16 2.30 0.12 1.98 -1.94 -0.13 -0.30 119.30 123.49 2wnv s MET 158 Ca 0.30 -0.89 0.02 0.00 -1.71 0.00 0.00 55.69 53.41 2wnv s MET 158 Cb -0.16 -2.37 -0.01 0.00 2.01 0.00 0.00 34.83 34.31 2wnv s MET 158 CO 0.10 0.55 0.07 2.89 -0.01 0.00 0.00 175.02 178.62 2wnv n ARG 159 N 1.22 0.47 0.00 2.03 1.85 0.09 -2.38 116.66 119.94 2wnv n ARG 159 Ca -0.15 -1.14 0.00 0.00 -1.00 0.00 0.00 57.85 55.56 2wnv n ARG 159 Cb 0.52 0.78 0.00 0.00 -1.05 0.00 0.00 32.46 32.71 2wnv n ARG 159 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wnv n GLY 160 N 0.52 2.96 0.13 2.89 0.00 -1.20 -0.15 105.19 110.33 2wnv n GLY 160 Ca 0.00 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.26 2wnv n GLY 160 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wnv n ARG 161 N 0.83 0.70 0.10 1.61 0.63 -1.26 -1.53 116.66 117.74 2wnv n ARG 161 Ca 0.00 0.31 -0.03 0.00 -0.92 0.00 0.00 57.85 57.21 2wnv n ARG 161 Cb 0.00 -1.68 -0.01 0.00 0.45 0.00 0.00 32.46 31.22 2wnv n ARG 161 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2wnv h GLU 162 N -0.22 0.00 -1.36 -0.14 4.39 -1.94 -3.47 114.58 111.84 2wnv h GLU 162 Ca -0.45 0.00 0.27 0.00 0.34 0.00 0.00 59.36 59.52 2wnv h GLU 162 Cb 1.84 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 30.30 2wnv h GLU 162 CO -0.03 0.80 0.85 1.03 -1.16 0.00 0.00 179.01 180.51 2wnv s ARG 163 N -2.98 0.23 0.16 2.33 1.81 -1.26 -5.14 118.95 114.10 2wnv s ARG 163 Ca 0.01 -0.08 -0.31 0.00 -1.72 0.00 0.00 55.73 53.63 2wnv s ARG 163 Cb 0.10 0.11 -0.09 0.00 -0.45 0.00 0.00 34.95 34.62 2wnv s ARG 163 CO 0.79 -0.10 1.40 0.00 -0.68 0.00 0.00 175.30 176.71 2wnv s ALA 164 N -2.26 3.61 -0.07 2.13 0.00 -1.26 -4.42 121.76 119.48 2wnv s ALA 164 Ca 0.10 1.19 0.04 0.00 0.00 0.00 0.00 51.96 53.29 2wnv s ALA 164 Cb -0.01 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.57 2wnv s ALA 164 CO -0.04 -0.64 -0.21 -0.65 0.00 0.00 0.00 175.76 174.22 2wnv s GLN 165 N 0.56 2.47 0.10 0.00 -0.21 0.79 -4.96 119.66 118.41 2wnv s GLN 165 Ca 0.62 -0.76 -0.31 0.00 0.02 0.00 0.00 55.36 54.93 2wnv s GLN 165 Cb -0.39 -1.98 -0.07 0.00 1.00 0.00 0.00 33.01 31.58 2wnv s GLN 165 CO 0.34 0.22 1.24 0.21 -2.12 0.00 0.00 175.29 175.19 2wnv s LYS 166 N 0.19 4.42 -0.17 2.91 2.20 -1.26 -0.73 119.74 127.30 2wnv s LYS 166 Ca -0.11 1.86 -0.13 0.00 -0.36 0.00 0.00 55.97 57.23 2wnv s LYS 166 Cb -0.15 -3.30 -0.07 0.00 -1.51 0.00 0.00 37.83 32.80 2wnv s LYS 166 CO 0.05 -0.27 -0.14 0.28 -0.36 0.00 0.00 175.35 174.91 2wnv n VAL 167 N 3.67 1.46 -3.95 4.02 0.31 0.59 -4.92 118.33 119.51 2wnv n VAL 167 Ca 0.09 0.13 -0.10 0.00 -0.01 0.00 0.00 64.34 64.45 2wnv n VAL 167 Cb 0.45 -2.29 -0.07 0.00 -0.91 0.00 0.00 33.84 31.02 2wnv n VAL 167 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2wnv s VAL 168 N -2.38 0.06 -0.10 2.52 -7.23 -1.23 -5.02 120.40 107.02 2wnv s VAL 168 Ca -0.21 -1.35 0.04 0.00 -1.81 0.00 0.00 61.98 58.65 2wnv s VAL 168 Cb 0.04 -1.85 -0.00 0.00 0.56 0.00 0.00 36.38 35.12 2wnv s VAL 168 CO 0.33 -0.26 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.75 2wnv s THR 169 N -3.97 2.22 -0.19 5.32 2.01 -1.26 -1.20 115.64 118.57 2wnv s THR 169 Ca 0.17 -0.97 -0.05 0.00 0.31 0.00 0.00 61.69 61.15 2wnv s THR 169 Cb 0.03 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 2wnv s THR 169 CO 0.01 0.56 0.00 -0.36 -0.69 0.00 0.00 174.62 174.13 2wnv s PHE 170 N 0.28 3.07 0.01 4.92 0.08 -0.19 -4.95 117.98 121.21 2wnv s PHE 170 Ca -0.16 -0.31 0.09 0.00 0.12 0.00 0.00 56.93 56.66 2wnv s PHE 170 Cb -0.17 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.20 2wnv s PHE 170 CO 0.08 -0.12 -0.26 0.00 -0.10 0.00 0.00 175.22 174.82 2wnv s ASP 172 N -0.90 0.40 0.19 0.00 3.68 0.19 -4.99 116.67 115.24 2wnv s ASP 172 Ca 0.11 0.54 0.01 0.00 2.13 0.00 0.00 52.55 55.35 2wnv s ASP 172 Cb -0.10 0.70 -0.04 0.00 -1.45 0.00 0.00 42.92 42.03 2wnv s ASP 172 CO 0.00 -0.25 0.35 -0.31 0.13 0.00 0.00 175.17 175.09 2wnv s TYR 173 N 2.42 3.48 -0.19 -5.34 1.51 -1.26 -2.15 117.35 115.82 2wnv s TYR 173 Ca 0.02 0.20 -0.09 0.00 -1.01 0.00 0.00 57.07 56.18 2wnv s TYR 173 Cb -0.12 -1.74 0.07 0.00 -0.11 0.00 0.00 41.96 40.06 2wnv s TYR 173 CO -0.09 0.44 0.44 0.00 -1.11 0.00 0.00 175.55 175.23 2wnv s ALA 174 N -1.85 -1.17 -0.25 3.71 0.00 -1.25 -4.92 121.76 116.03 2wnv s ALA 174 Ca 0.36 1.62 -0.04 0.00 0.00 0.00 0.00 51.96 53.90 2wnv s ALA 174 Cb -0.11 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.93 2wnv s ALA 174 CO 0.29 -0.41 -0.00 -0.47 0.00 0.00 0.00 175.76 175.18 2wnv s TYR 175 N 1.74 3.05 -1.42 0.00 5.04 -1.26 -3.86 117.35 120.64 2wnv s TYR 175 Ca -0.08 -1.05 -0.00 0.00 -2.44 0.00 0.00 57.07 53.50 2wnv s TYR 175 Cb -0.09 -2.15 0.00 0.00 0.35 0.00 0.00 41.96 40.07 2wnv s TYR 175 CO -0.14 -0.58 0.36 -1.71 -1.34 0.00 0.00 175.55 172.14 2wnv n ASN 176 N 4.80 -0.16 -2.98 4.32 5.15 -1.26 -4.95 115.26 120.17 2wnv n ASN 176 Ca -0.16 -1.04 -0.10 0.00 -0.60 0.00 0.00 54.58 52.67 2wnv n ASN 176 Cb 0.49 -2.86 0.01 0.00 -0.53 0.00 0.00 39.78 36.90 2wnv n ASN 176 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2wnv s THR 177 N -4.02 0.00 -0.04 -0.44 -1.32 -1.26 -5.15 115.64 103.41 2wnv s THR 177 Ca 0.01 -1.13 0.03 0.00 -1.21 0.00 0.00 61.69 59.38 2wnv s THR 177 Cb -0.00 -2.83 -0.03 0.00 -1.51 0.00 0.00 72.50 68.13 2wnv s THR 177 CO 0.90 0.00 -0.12 -0.36 -2.21 0.00 0.00 174.62 172.83 2wnv s PHE 178 N -2.46 2.76 0.07 9.09 0.40 -1.26 -4.29 117.98 122.29 2wnv s PHE 178 Ca 0.19 -0.12 -0.01 0.00 -0.60 0.00 0.00 56.93 56.40 2wnv s PHE 178 Cb -0.04 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.81 2wnv s PHE 178 CO 0.14 0.24 -0.02 1.14 0.70 0.00 0.00 175.22 177.41 2wnv s GLN 179 N -0.85 0.70 -0.06 0.44 -2.07 -0.06 -5.01 119.66 112.75 2wnv s GLN 179 Ca 0.12 -1.28 0.03 0.00 -1.82 0.00 0.00 55.36 52.41 2wnv s GLN 179 Cb -0.11 0.15 0.01 0.00 -1.09 0.00 0.00 33.01 31.98 2wnv s GLN 179 CO 0.02 -0.12 -0.13 0.54 -1.32 0.00 0.00 175.29 174.27 2wnv s VAL 180 N -3.90 1.20 0.36 3.63 0.11 -1.26 -1.58 120.40 118.96 2wnv s VAL 180 Ca 0.11 -0.53 0.07 0.00 -2.93 0.00 0.00 61.98 58.69 2wnv s VAL 180 Cb 0.08 -1.08 -0.07 0.00 -1.53 0.00 0.00 36.38 33.77 2wnv s VAL 180 CO -0.07 0.37 -0.01 0.28 -3.33 0.00 0.00 175.10 172.34 2wnv s THR 181 N 0.53 1.82 0.04 5.04 -1.32 -0.28 -4.95 115.64 116.53 2wnv s THR 181 Ca -0.13 -2.06 -0.14 0.00 -1.21 0.00 0.00 61.69 58.16 2wnv s THR 181 Cb -0.15 -2.80 0.02 0.00 -1.51 0.00 0.00 72.50 68.06 2wnv s THR 181 CO 0.04 -0.09 0.30 0.28 -2.21 0.00 0.00 174.62 172.94 2wnv s THR 182 N -2.86 0.08 0.10 5.08 -1.32 -1.26 -0.84 115.64 114.62 2wnv s THR 182 Ca 0.34 -0.68 -0.13 0.00 -1.21 0.00 0.00 61.69 60.01 2wnv s THR 182 Cb 0.07 -0.93 0.02 0.00 -1.51 0.00 0.00 72.50 70.15 2wnv s THR 182 CO 0.16 -0.37 0.32 -0.83 -2.21 0.00 0.00 174.62 171.69 2wnv s GLY 183 N -2.05 -0.14 0.13 6.08 0.00 -1.10 -5.01 107.32 105.24 2wnv s GLY 183 Ca -0.05 -0.21 -0.20 0.00 0.00 0.00 0.00 44.72 44.25 2wnv s GLY 183 CO -0.03 -0.44 0.51 -0.32 0.00 0.00 0.00 173.10 172.81 2wnv s GLY 184 N -2.70 -0.45 -0.28 0.20 0.00 -1.26 -1.77 107.32 101.06 2wnv s GLY 184 Ca 0.02 0.29 -0.18 0.00 0.00 0.00 0.00 44.72 44.85 2wnv s GLY 184 CO -0.10 -0.01 0.82 -0.29 0.00 0.00 0.00 173.10 173.52 2wnv s MET 185 N -3.59 0.60 -0.12 2.90 0.00 0.13 -4.98 119.30 114.24 2wnv s MET 185 Ca 0.01 0.95 -0.23 0.00 0.00 0.00 0.00 55.69 56.42 2wnv s MET 185 Cb 0.00 0.17 -0.03 0.00 0.00 0.00 0.00 34.83 34.97 2wnv s MET 185 CO -0.11 -0.11 0.71 0.08 0.00 0.00 0.00 175.02 175.59 2wnv s VAL 186 N 1.22 5.00 -0.03 10.11 1.01 -1.26 -0.74 120.40 135.71 2wnv s VAL 186 Ca -0.07 1.43 0.04 0.00 0.00 0.00 0.00 61.98 63.39 2wnv s VAL 186 Cb -0.05 -4.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 2wnv s VAL 186 CO -0.14 0.17 -0.16 -0.76 0.00 0.00 0.00 175.10 174.21 2wnv s LEU 187 N 1.33 1.93 -0.69 3.92 1.43 -0.00 -4.98 118.68 121.62 2wnv s LEU 187 Ca 0.36 -0.31 -0.19 0.00 -1.03 0.00 0.00 54.13 52.96 2wnv s LEU 187 Cb -0.17 -0.87 0.12 0.00 0.03 0.00 0.00 46.19 45.30 2wnv s LEU 187 CO 0.15 0.16 0.81 -0.75 0.23 0.00 0.00 176.35 176.95 2wnv s LYS 188 N -0.08 3.22 0.14 1.70 2.47 -1.26 -0.82 119.74 125.11 2wnv s LYS 188 Ca -0.00 -1.50 -0.23 0.00 -1.56 0.00 0.00 55.97 52.67 2wnv s LYS 188 Cb -0.09 -4.40 -0.08 0.00 -1.46 0.00 0.00 37.83 31.80 2wnv s LYS 188 CO 0.01 -1.58 0.70 -0.51 0.16 0.00 0.00 175.35 174.14 2wnv s LEU 189 N 2.48 4.56 0.35 5.43 1.43 0.18 -4.91 118.68 128.20 2wnv s LEU 189 Ca 0.17 1.51 0.03 0.00 -1.03 0.00 0.00 54.13 54.81 2wnv s LEU 189 Cb -0.18 -3.18 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 2wnv s LEU 189 CO 0.02 0.22 0.52 -0.70 0.23 0.00 0.00 176.35 176.64 2wnv s GLU 190 N -1.18 3.23 0.15 1.70 2.56 -1.26 -1.98 118.70 121.92 2wnv s GLU 190 Ca 0.34 -0.70 -0.34 0.00 0.00 0.00 0.00 54.97 54.26 2wnv s GLU 190 Cb -0.22 -2.73 -0.15 0.00 2.00 0.00 0.00 34.13 33.03 2wnv s GLU 190 CO 0.24 0.05 1.34 0.94 -0.56 0.00 0.00 175.26 177.28 2wnv n GLN 191 N -1.74 1.47 -0.89 4.30 -0.06 -1.26 -2.38 117.38 116.82 2wnv n GLN 191 Ca -0.02 0.53 0.00 0.00 -2.00 0.00 0.00 57.00 55.51 2wnv n GLN 191 Cb 0.57 -2.16 0.00 0.00 -4.06 0.00 0.00 30.24 24.60 2wnv n GLN 191 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2wnv n GLY 192 N 2.49 0.94 3.75 1.69 0.00 0.04 -4.87 105.19 109.23 2wnv n GLY 192 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2wnv n GLY 192 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wnv s GLU 193 N -0.11 4.30 -0.23 1.61 2.02 -1.00 -4.39 118.70 120.90 2wnv s GLU 193 Ca 0.00 2.25 -0.11 0.00 0.02 0.00 0.00 54.97 57.13 2wnv s GLU 193 Cb 0.00 -3.11 -0.05 0.00 0.10 0.00 0.00 34.13 31.07 2wnv s GLU 193 CO 0.00 -0.34 0.19 -0.80 0.02 0.00 0.00 175.26 174.33 2wnv s ASN 194 N 0.13 6.16 -0.12 -0.19 0.01 -0.58 -0.99 114.94 119.36 2wnv s ASN 194 Ca 0.56 0.16 0.01 0.00 -0.71 0.00 0.00 52.86 52.89 2wnv s ASN 194 Cb -0.41 -2.12 -0.01 0.00 0.41 0.00 0.00 41.25 39.12 2wnv s ASN 194 CO 0.46 0.05 -0.17 -0.69 -1.51 0.00 0.00 177.10 175.23 2wnv s VAL 195 N 1.07 2.65 0.25 1.60 1.01 0.38 -3.26 120.40 124.10 2wnv s VAL 195 Ca 0.09 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 61.05 2wnv s VAL 195 Cb -0.14 -2.08 0.03 0.00 0.00 0.00 0.00 36.38 34.19 2wnv s VAL 195 CO 0.05 0.54 0.77 0.72 0.00 0.00 0.00 175.10 177.17 2wnv s PHE 196 N 0.36 -0.18 -0.12 5.22 -0.12 -1.00 -0.89 117.98 121.25 2wnv s PHE 196 Ca -0.14 -0.24 -0.06 0.00 -0.05 0.00 0.00 56.93 56.44 2wnv s PHE 196 Cb -0.17 0.69 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 2wnv s PHE 196 CO 0.07 -1.15 0.09 -0.51 -0.05 0.00 0.00 175.22 173.67 2wnv s LEU 197 N -2.92 4.10 -0.06 -1.99 1.43 -1.26 -0.96 118.68 117.02 2wnv s LEU 197 Ca 0.11 0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.59 2wnv s LEU 197 Cb -0.05 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.17 2wnv s LEU 197 CO 0.06 0.37 -0.21 -1.58 0.23 0.00 0.00 176.35 175.22 2wnv s GLN 198 N -0.80 2.28 0.63 1.70 0.74 0.29 -0.69 119.66 123.83 2wnv s GLN 198 Ca 0.13 -0.76 -0.14 0.00 0.05 0.00 0.00 55.36 54.64 2wnv s GLN 198 Cb -0.12 -1.90 -0.02 0.00 1.10 0.00 0.00 33.01 32.07 2wnv s GLN 198 CO 0.03 0.28 1.06 0.00 -0.55 0.00 0.00 175.29 176.10 2wnv s ALA 199 N 0.04 2.71 0.10 1.58 0.00 0.40 -1.09 121.76 125.50 2wnv s ALA 199 Ca -0.07 0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.18 2wnv s ALA 199 Cb -0.14 -3.21 -0.00 0.00 0.00 0.00 0.00 23.12 19.77 2wnv s ALA 199 CO 0.04 -0.98 0.02 0.25 0.00 0.00 0.00 175.76 175.10 2wnv n THR 200 N -2.46 0.00 0.25 0.00 -2.24 -1.24 -1.07 114.28 107.52 2wnv n THR 200 Ca 0.08 -0.57 0.10 0.00 -2.27 0.00 0.00 64.05 61.39 2wnv n THR 200 Cb 0.53 0.17 0.67 0.00 -2.10 0.00 0.00 70.33 69.61 2wnv n THR 200 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2wnv h ASP 201 N 0.36 0.00 -2.42 3.42 3.32 -1.92 -3.35 116.42 115.82 2wnv h ASP 201 Ca -0.08 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.30 2wnv h ASP 201 Cb 0.29 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.68 2wnv h ASP 201 CO 0.13 0.11 0.75 -0.54 -1.72 0.00 0.00 179.24 177.98 2wnv s LYS 202 N -4.53 3.41 -0.14 3.56 3.01 -1.26 -4.87 119.74 118.92 2wnv s LYS 202 Ca -0.04 -1.38 0.19 0.00 -1.01 0.00 0.00 55.97 53.73 2wnv s LYS 202 Cb 0.15 -4.68 0.31 0.00 -1.01 0.00 0.00 37.83 32.60 2wnv s LYS 202 CO 0.63 -1.81 1.17 0.27 0.51 0.00 0.00 175.35 176.12 2wnv n ASN 203 N 7.11 2.44 -4.55 2.83 6.94 -1.18 -1.72 115.26 127.13 2wnv n ASN 203 Ca 0.14 -3.11 -0.38 0.00 -0.02 0.00 0.00 54.58 51.21 2wnv n ASN 203 Cb 0.48 -0.44 -0.03 0.00 -2.36 0.00 0.00 39.78 37.42 2wnv n ASN 203 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2wnv s SER 204 N -2.82 5.59 -0.06 0.53 0.15 -1.03 -4.63 113.70 111.43 2wnv s SER 204 Ca 0.33 -0.18 -0.00 0.00 0.70 0.00 0.00 55.95 56.80 2wnv s SER 204 Cb 0.29 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 62.08 2wnv s SER 204 CO 0.03 -2.21 -0.02 -0.22 1.20 0.00 0.00 173.24 172.02 2wnv s LEU 205 N 7.98 0.90 -0.07 3.45 2.96 -1.26 -4.38 118.68 128.26 2wnv s LEU 205 Ca 0.57 -0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.35 2wnv s LEU 205 Cb -0.09 -0.46 -0.04 0.00 0.50 0.00 0.00 46.19 46.10 2wnv s LEU 205 CO 0.13 -0.14 0.04 -0.76 -1.32 0.00 0.00 176.35 174.31 2wnv s LEU 206 N 1.55 3.78 -0.28 -0.68 1.43 0.40 -4.96 118.68 119.92 2wnv s LEU 206 Ca -0.01 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.26 2wnv s LEU 206 Cb -0.13 -1.96 0.12 0.00 0.03 0.00 0.00 46.19 44.26 2wnv s LEU 206 CO -0.03 0.36 0.25 -0.83 0.23 0.00 0.00 176.35 176.32 2wnv s GLY 207 N -1.11 0.02 0.14 -3.19 0.00 -1.25 -3.74 107.32 98.19 2wnv s GLY 207 Ca 0.16 -0.41 -0.24 0.00 0.00 0.00 0.00 44.72 44.23 2wnv s GLY 207 CO 0.05 2.45 0.64 -3.16 0.00 0.00 0.00 173.10 173.08 2wnv s MET 208 N 2.30 1.21 0.14 2.90 0.23 -0.90 -4.34 119.30 120.84 2wnv s MET 208 Ca 0.09 -0.44 -0.32 0.00 -1.03 0.00 0.00 55.69 53.99 2wnv s MET 208 Cb -0.15 0.56 -0.12 0.00 -1.53 0.00 0.00 34.83 33.60 2wnv s MET 208 CO -0.31 -0.53 1.77 -1.91 -2.03 0.00 0.00 175.02 172.01 2wnv n GLU 209 N -0.35 2.65 0.00 3.16 2.13 -1.26 -1.53 120.64 125.43 2wnv n GLU 209 Ca -0.16 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.62 2wnv n GLU 209 Cb 0.64 -2.82 0.00 0.00 0.27 0.00 0.00 31.44 29.54 2wnv n GLU 209 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wnv n GLY 210 N 4.04 1.30 2.73 8.31 0.00 -1.26 -4.90 105.19 115.42 2wnv n GLY 210 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 2wnv n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wnv n ALA 211 N -1.43 -1.50 -1.99 4.61 0.00 -0.58 -5.16 120.51 114.45 2wnv n ALA 211 Ca 0.00 -1.23 -0.30 0.00 0.00 0.00 0.00 53.44 51.91 2wnv n ALA 211 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.02 2wnv n ALA 211 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wnv s ASN 212 N 0.37 6.37 -0.06 0.00 0.01 -1.10 -2.13 114.94 118.41 2wnv s ASN 212 Ca 0.31 1.31 0.03 0.00 -0.71 0.00 0.00 52.86 53.80 2wnv s ASN 212 Cb 0.04 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.30 2wnv s ASN 212 CO -0.09 -0.67 -0.14 -0.44 -1.51 0.00 0.00 177.10 174.24 2wnv s SER 213 N -3.75 1.89 0.02 -1.22 0.01 -1.25 -2.83 113.70 106.58 2wnv s SER 213 Ca 0.54 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 57.50 2wnv s SER 213 Cb -0.10 -0.73 -0.01 0.00 0.21 0.00 0.00 66.02 65.38 2wnv s SER 213 CO 0.43 0.08 -0.07 -0.51 0.41 0.00 0.00 173.24 173.59 2wnv s ILE 214 N 0.41 0.49 -0.06 1.44 2.07 0.25 -1.50 121.20 124.30 2wnv s ILE 214 Ca -0.10 -0.68 0.02 0.00 -1.41 0.00 0.00 60.65 58.48 2wnv s ILE 214 Cb -0.14 -0.50 0.01 0.00 0.13 0.00 0.00 42.46 41.97 2wnv s ILE 214 CO 0.03 -0.14 -0.13 0.12 -1.91 0.00 0.00 174.94 172.91 2wnv s PHE 215 N -0.79 1.48 0.06 3.50 5.36 -0.23 -1.61 117.98 125.74 2wnv s PHE 215 Ca -0.04 -0.54 0.01 0.00 -0.96 0.00 0.00 56.93 55.39 2wnv s PHE 215 Cb -0.06 -1.08 -0.03 0.00 -0.34 0.00 0.00 43.02 41.50 2wnv s PHE 215 CO 0.00 -0.27 -0.05 -1.12 -1.46 0.00 0.00 175.22 172.31 2wnv s SER 216 N 0.63 0.75 -0.00 6.13 0.01 0.10 -1.02 113.70 120.30 2wnv s SER 216 Ca -0.14 -0.79 -0.29 0.00 1.31 0.00 0.00 55.95 56.03 2wnv s SER 216 Cb -0.16 0.11 0.07 0.00 0.21 0.00 0.00 66.02 66.25 2wnv s SER 216 CO 0.04 -0.40 0.66 -0.83 0.41 0.00 0.00 173.24 173.12 2wnv s GLY 217 N -2.34 -0.59 -0.04 3.44 0.00 -0.35 -1.24 107.32 106.20 2wnv s GLY 217 Ca -0.00 1.14 -0.15 0.00 0.00 0.00 0.00 44.72 45.70 2wnv s GLY 217 CO -0.04 0.78 0.34 -0.11 0.00 0.00 0.00 173.10 174.07 2wnv s PHE 218 N -1.77 -0.25 0.12 1.90 -0.12 -0.48 -0.90 117.98 116.48 2wnv s PHE 218 Ca -0.08 0.45 -0.31 0.00 -0.05 0.00 0.00 56.93 56.94 2wnv s PHE 218 Cb -0.00 0.12 -0.07 0.00 -0.63 0.00 0.00 43.02 42.44 2wnv s PHE 218 CO 0.05 -0.36 1.28 -1.17 -0.05 0.00 0.00 175.22 174.96 2wnv s LEU 219 N -1.02 4.39 -0.22 -1.99 2.96 -0.44 -1.43 118.68 120.92 2wnv s LEU 219 Ca -0.11 2.21 -0.16 0.00 -0.22 0.00 0.00 54.13 55.85 2wnv s LEU 219 Cb -0.04 -3.59 -0.12 0.00 0.50 0.00 0.00 46.19 42.94 2wnv s LEU 219 CO 0.04 -0.53 -0.16 0.18 -1.32 0.00 0.00 176.35 174.56 2wnv n LEU 220 N 3.53 1.91 -3.65 -0.68 4.77 0.13 -4.89 117.00 118.12 2wnv n LEU 220 Ca 0.09 0.40 -0.13 0.00 -0.03 0.00 0.00 56.01 56.34 2wnv n LEU 220 Cb 0.44 -0.86 -0.13 0.00 -2.33 0.00 0.00 43.42 40.55 2wnv n LEU 220 CO 0.57 0.20 -0.13 -0.36 -1.33 0.00 0.00 177.39 176.34 2wnv s PHE 221 N -2.50 -0.45 -0.06 -1.77 0.40 -1.14 -5.00 117.98 107.46 2wnv s PHE 221 Ca -0.31 0.96 -0.30 0.00 -0.60 0.00 0.00 56.93 56.68 2wnv s PHE 221 Cb 0.09 -0.04 -0.02 0.00 0.51 0.00 0.00 43.02 43.56 2wnv s PHE 221 CO 0.47 -0.38 1.09 -1.25 0.70 0.00 0.00 175.22 175.85 2wnv s PRO 222 N 2.43 4.41 0.00 0.24 0.04 -1.26 -0.76 135.00 140.10 2wnv s PRO 222 Ca 0.02 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.59 2wnv s PRO 222 Cb -0.12 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.89 2wnv s PRO 222 CO -0.09 -0.34 0.00 -0.25 0.04 0.00 0.00 177.00 176.36 2wnv n ASP 223 N 4.89 0.00 0.00 6.66 9.92 -0.44 -4.95 116.55 132.64 2wnv n ASP 223 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 2wnv n ASP 223 Cb 0.48 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.96 2wnv n ASP 223 CO 0.00 0.00 0.00 1.15 0.13 0.00 0.00 177.20 178.48