#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnv n PHE 90 N 0.00 0.18 -4.43 2.13 3.72 -1.26 -4.92 117.46 112.89 2wnv n PHE 90 Ca 0.00 -0.10 -0.31 0.00 -0.05 0.00 0.00 57.45 56.99 2wnv n PHE 90 Cb 0.00 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.50 2wnv n PHE 90 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2wnv s GLN 91 N -1.60 2.23 -0.23 -1.08 -1.52 -1.26 -5.01 119.66 111.19 2wnv s GLN 91 Ca 0.29 -2.29 -0.09 0.00 -1.95 0.00 0.00 55.36 51.32 2wnv s GLN 91 Cb 0.19 -1.75 0.09 0.00 -0.22 0.00 0.00 33.01 31.33 2wnv s GLN 91 CO 0.27 -0.51 0.50 0.45 -0.25 0.00 0.00 175.29 175.75 2wnv s SER 92 N -4.06 -0.58 -0.11 5.90 0.15 -1.26 -4.89 113.70 108.86 2wnv s SER 92 Ca 0.14 1.17 -0.18 0.00 0.70 0.00 0.00 55.95 57.78 2wnv s SER 92 Cb -0.01 1.50 0.04 0.00 -1.71 0.00 0.00 66.02 65.84 2wnv s SER 92 CO 0.09 -0.22 0.45 0.54 1.20 0.00 0.00 173.24 175.29 2wnv s VAL 93 N 2.41 0.02 -0.02 4.45 0.11 -1.26 -0.89 120.40 125.21 2wnv s VAL 93 Ca -0.05 -0.15 -0.24 0.00 -2.93 0.00 0.00 61.98 58.61 2wnv s VAL 93 Cb -0.11 -0.69 0.05 0.00 -1.53 0.00 0.00 36.38 34.11 2wnv s VAL 93 CO -0.15 -0.08 0.52 0.72 -3.33 0.00 0.00 175.10 172.78 2wnv s PHE 94 N -0.46 -0.45 -0.08 1.54 -0.12 -0.27 -3.97 117.98 114.17 2wnv s PHE 94 Ca -0.06 0.73 -0.01 0.00 -0.05 0.00 0.00 56.93 57.54 2wnv s PHE 94 Cb -0.03 0.29 0.03 0.00 -0.63 0.00 0.00 43.02 42.67 2wnv s PHE 94 CO 0.03 -0.54 -0.02 0.99 -0.05 0.00 0.00 175.22 175.63 2wnv s THR 95 N -1.41 0.56 0.24 -4.49 2.01 -0.02 -1.59 115.64 110.94 2wnv s THR 95 Ca -0.11 -0.01 0.11 0.00 0.31 0.00 0.00 61.69 61.99 2wnv s THR 95 Cb -0.02 -0.67 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 2wnv s THR 95 CO 0.06 0.28 -0.20 0.68 -0.69 0.00 0.00 174.62 174.76 2wnv s VAL 96 N 1.77 2.29 0.16 3.82 -7.23 0.06 -0.92 120.40 120.34 2wnv s VAL 96 Ca 0.03 -2.26 0.04 0.00 -1.81 0.00 0.00 61.98 57.98 2wnv s VAL 96 Cb -0.13 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 2wnv s VAL 96 CO -0.05 -0.36 -0.07 0.42 -0.31 0.00 0.00 175.10 174.73 2wnv s THR 97 N -2.35 1.02 -0.51 5.32 -4.23 0.46 -0.94 115.64 114.41 2wnv s THR 97 Ca 0.26 -2.03 -0.07 0.00 -1.18 0.00 0.00 61.69 58.67 2wnv s THR 97 Cb -0.05 -1.93 0.13 0.00 1.34 0.00 0.00 72.50 71.99 2wnv s THR 97 CO 0.12 -0.67 0.36 -0.60 -0.54 0.00 0.00 174.62 173.29 2wnv s ARG 98 N -3.80 2.45 -0.77 3.99 3.52 -0.89 -1.68 118.95 121.77 2wnv s ARG 98 Ca 0.19 -1.98 -0.15 0.00 -0.13 0.00 0.00 55.73 53.66 2wnv s ARG 98 Cb 0.04 -3.84 0.19 0.00 -1.56 0.00 0.00 34.95 29.78 2wnv s ARG 98 CO 0.01 -1.17 0.73 -1.14 -0.81 0.00 0.00 175.30 172.93 2wnv s GLN 99 N 0.94 3.46 -0.23 5.12 0.74 -1.26 -4.60 119.66 123.84 2wnv s GLN 99 Ca 0.09 -2.24 -0.30 0.00 0.05 0.00 0.00 55.36 52.97 2wnv s GLN 99 Cb -0.23 -4.42 0.17 0.00 1.10 0.00 0.00 33.01 29.62 2wnv s GLN 99 CO -0.03 -1.33 1.22 -0.08 -0.55 0.00 0.00 175.29 174.52 2wnv s THR 100 N 0.67 0.00 -1.39 -0.34 -1.32 -1.26 -4.96 115.64 107.04 2wnv s THR 100 Ca 0.15 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.88 2wnv s THR 100 Cb -0.14 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.88 2wnv s THR 100 CO -0.06 0.00 1.31 1.57 -2.21 0.00 0.00 174.62 175.23 2wnv n HIS 101 N 0.58 0.00 -3.64 9.09 -0.00 -1.26 -4.87 115.22 115.12 2wnv n HIS 101 Ca -0.04 0.00 -0.36 0.00 0.46 0.00 0.00 57.72 57.78 2wnv n HIS 101 Cb 0.58 -0.12 -0.08 0.00 -0.12 0.00 0.00 29.99 30.26 2wnv n HIS 101 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 2wnv s GLN 102 N -2.77 4.21 0.87 1.57 -0.21 -1.26 -4.83 119.66 117.24 2wnv s GLN 102 Ca 0.16 -0.07 -0.12 0.00 0.02 0.00 0.00 55.36 55.35 2wnv s GLN 102 Cb 0.18 -3.42 0.11 0.00 1.00 0.00 0.00 33.01 30.88 2wnv s GLN 102 CO 0.66 0.28 1.10 -1.25 -2.12 0.00 0.00 175.29 173.96 2wnv s PRO 103 N 0.38 1.48 0.86 2.91 0.04 -1.26 -4.99 135.00 134.41 2wnv s PRO 103 Ca 0.12 0.64 -0.10 0.00 0.04 0.00 0.00 61.00 61.70 2wnv s PRO 103 Cb -0.12 -1.85 0.11 0.00 0.04 0.00 0.00 34.50 32.68 2wnv s PRO 103 CO 0.01 -2.04 1.12 -1.25 0.04 0.00 0.00 177.00 174.88 2wnv s PRO 104 N -5.07 1.51 0.54 0.56 0.04 -1.26 -5.00 135.00 126.32 2wnv s PRO 104 Ca 0.63 1.36 -0.21 0.00 0.04 0.00 0.00 61.00 62.82 2wnv s PRO 104 Cb -0.16 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2wnv s PRO 104 CO 0.55 -2.23 1.22 0.00 0.04 0.00 0.00 177.00 176.59 2wnv s ALA 105 N -2.76 2.75 0.50 8.56 0.00 -1.26 -4.90 121.76 124.64 2wnv s ALA 105 Ca 0.64 1.05 -0.23 0.00 0.00 0.00 0.00 51.96 53.43 2wnv s ALA 105 Cb -0.20 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.40 2wnv s ALA 105 CO 0.57 -1.03 1.28 -2.30 0.00 0.00 0.00 175.76 174.28 2wnv n PRO 106 N -1.11 1.71 -3.67 0.00 -0.02 -1.26 -3.38 135.00 127.27 2wnv n PRO 106 Ca 0.11 0.62 -0.21 0.00 -2.02 0.00 0.00 63.50 62.00 2wnv n PRO 106 Cb 0.48 -2.45 0.04 0.00 -0.02 0.00 0.00 33.50 31.55 2wnv n PRO 106 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2wnv n ASN 107 N -0.48 -1.64 -4.09 2.55 3.02 -0.21 -4.98 115.26 109.42 2wnv n ASN 107 Ca 0.09 -0.78 -0.09 0.00 -0.03 0.00 0.00 54.58 53.77 2wnv n ASN 107 Cb 0.43 -4.24 -0.09 0.00 -0.61 0.00 0.00 39.78 35.26 2wnv n ASN 107 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wnv s SER 108 N -4.27 0.32 0.21 6.41 1.04 -1.12 -4.96 113.70 111.32 2wnv s SER 108 Ca 0.06 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 55.11 2wnv s SER 108 Cb -0.03 0.29 -0.09 0.00 0.10 0.00 0.00 66.02 66.28 2wnv s SER 108 CO 0.80 -0.71 1.39 -0.22 0.98 0.00 0.00 173.24 175.48 2wnv s LEU 109 N -2.99 4.40 -0.28 2.42 0.20 -1.26 -1.16 118.68 120.01 2wnv s LEU 109 Ca 0.17 2.53 -0.25 0.00 0.69 0.00 0.00 54.13 57.27 2wnv s LEU 109 Cb 0.07 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.22 2wnv s LEU 109 CO -0.03 -0.63 0.86 -0.63 -0.29 0.00 0.00 176.35 175.63 2wnv s ILE 110 N 0.19 4.76 -0.17 6.68 1.01 0.53 -4.90 121.20 129.30 2wnv s ILE 110 Ca 0.59 1.44 -0.17 0.00 0.00 0.00 0.00 60.65 62.52 2wnv s ILE 110 Cb -0.39 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 37.86 2wnv s ILE 110 CO 0.40 -0.22 0.43 -0.13 0.00 0.00 0.00 174.94 175.42 2wnv s ARG 111 N 3.03 4.24 -0.40 2.79 0.52 -1.26 -4.62 118.95 123.24 2wnv s ARG 111 Ca 0.36 0.31 -0.15 0.00 -0.52 0.00 0.00 55.73 55.72 2wnv s ARG 111 Cb -0.14 -3.50 0.02 0.00 0.52 0.00 0.00 34.95 31.84 2wnv s ARG 111 CO 0.11 0.03 0.33 -0.06 0.02 0.00 0.00 175.30 175.73 2wnv s PHE 112 N 1.07 3.22 -0.48 -0.53 0.40 -1.26 -4.77 117.98 115.62 2wnv s PHE 112 Ca 0.22 -0.47 0.23 0.00 -0.60 0.00 0.00 56.93 56.31 2wnv s PHE 112 Cb -0.15 -2.67 0.19 0.00 0.51 0.00 0.00 43.02 40.91 2wnv s PHE 112 CO 0.08 -0.59 1.20 -2.95 0.70 0.00 0.00 175.22 173.66 2wnv h ASN 113 N 8.64 0.00 -3.81 1.36 -1.07 -1.63 -3.42 115.58 115.64 2wnv h ASN 113 Ca -0.27 -0.15 -0.68 0.00 0.07 0.00 0.00 56.30 55.27 2wnv h ASN 113 Cb 1.12 0.00 -0.20 0.00 -2.07 0.00 0.00 38.32 37.17 2wnv h ASN 113 CO 0.74 0.07 -0.82 0.00 0.07 0.00 0.00 177.43 177.49 2wnv s ALA 114 N -3.24 2.57 -0.14 4.14 0.00 -0.68 -4.96 121.76 119.45 2wnv s ALA 114 Ca 0.03 -1.38 -0.00 0.00 0.00 0.00 0.00 51.96 50.61 2wnv s ALA 114 Cb 0.12 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 2wnv s ALA 114 CO 0.75 0.57 -0.14 0.08 0.00 0.00 0.00 175.76 177.03 2wnv s VAL 115 N -1.10 2.92 -0.17 0.00 1.01 -1.26 -0.40 120.40 121.40 2wnv s VAL 115 Ca 0.16 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.28 2wnv s VAL 115 Cb -0.10 -2.23 -0.22 0.00 0.00 0.00 0.00 36.38 33.82 2wnv s VAL 115 CO 0.08 0.52 0.30 -0.07 0.00 0.00 0.00 175.10 175.93 2wnv h LEU 116 N 6.97 0.17 -7.31 3.92 3.38 -1.38 -3.48 115.31 117.58 2wnv h LEU 116 Ca -0.28 -0.69 -0.11 0.00 0.09 0.00 0.00 57.88 56.88 2wnv h LEU 116 Cb 1.20 -0.06 -0.23 0.00 0.09 0.00 0.00 40.66 41.67 2wnv h LEU 116 CO 0.56 1.62 -0.20 0.28 0.09 0.00 0.00 178.44 180.79 2wnv s THR 117 N -2.44 0.01 -0.39 0.22 -1.32 -0.93 -4.97 115.64 105.83 2wnv s THR 117 Ca -0.26 -0.08 0.06 0.00 -1.21 0.00 0.00 61.69 60.20 2wnv s THR 117 Cb 0.06 -0.63 0.30 0.00 -1.51 0.00 0.00 72.50 70.71 2wnv s THR 117 CO 0.67 -0.04 1.24 -3.20 -2.21 0.00 0.00 174.62 171.07 2wnv n ASN 118 N 2.47 -1.77 0.26 8.08 5.15 -1.26 -0.84 115.26 127.35 2wnv n ASN 118 Ca -0.15 -2.61 0.09 0.00 -0.60 0.00 0.00 54.58 51.32 2wnv n ASN 118 Cb 0.57 1.36 0.67 0.00 -0.53 0.00 0.00 39.78 41.85 2wnv n ASN 118 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2wnv h PRO 119 N 2.23 0.00 -0.01 1.20 0.13 -1.99 -1.47 132.00 132.09 2wnv h PRO 119 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2wnv h PRO 119 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2wnv h PRO 119 CO -0.01 0.07 -0.36 1.04 -0.23 0.00 0.00 178.00 178.52 2wnv n GLN 120 N -4.19 1.06 -1.75 0.86 3.00 -1.26 -4.95 117.38 110.16 2wnv n GLN 120 Ca -0.03 -0.77 -0.13 0.00 -0.01 0.00 0.00 57.00 56.06 2wnv n GLN 120 Cb 0.16 -1.48 -0.04 0.00 0.00 0.00 0.00 30.24 28.88 2wnv n GLN 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wnv n GLY 121 N 1.38 0.73 0.18 1.08 0.00 -0.55 -4.92 105.19 103.09 2wnv n GLY 121 Ca 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2wnv n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wnv h ASP 122 N 0.00 0.10 -3.32 1.61 3.32 -1.87 -3.39 116.42 112.87 2wnv h ASP 122 Ca -0.29 -0.04 -0.58 0.00 0.02 0.00 0.00 57.03 56.15 2wnv h ASP 122 Cb 1.01 -0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.46 2wnv h ASP 122 CO 0.38 0.50 -0.15 -0.47 -1.72 0.00 0.00 179.24 177.79 2wnv s TYR 123 N -4.11 3.51 -0.35 4.55 5.04 -1.26 -1.36 117.35 123.37 2wnv s TYR 123 Ca -0.03 0.88 -0.09 0.00 -2.44 0.00 0.00 57.07 55.39 2wnv s TYR 123 Cb 0.14 -2.54 0.03 0.00 0.35 0.00 0.00 41.96 39.94 2wnv s TYR 123 CO 0.75 0.17 0.15 0.34 -1.34 0.00 0.00 175.55 175.63 2wnv s ASP 124 N 0.60 5.51 0.34 4.32 -1.08 -0.06 -4.97 116.67 121.34 2wnv s ASP 124 Ca 0.26 -1.01 0.26 0.00 -0.52 0.00 0.00 52.55 51.54 2wnv s ASP 124 Cb -0.15 -1.95 1.08 0.00 -1.46 0.00 0.00 42.92 40.44 2wnv s ASP 124 CO 0.10 -0.34 1.79 0.71 0.52 0.00 0.00 175.17 177.95 2wnv h THR 125 N 5.99 0.00 0.02 1.71 1.35 -1.87 0.21 112.91 120.32 2wnv h THR 125 Ca -0.25 -0.32 -0.22 0.00 -0.55 0.00 0.00 66.41 65.07 2wnv h THR 125 Cb 1.10 1.13 -0.03 0.00 -1.73 0.00 0.00 68.15 68.63 2wnv h THR 125 CO 0.63 0.00 -1.05 0.77 -0.25 0.00 0.00 175.52 175.62 2wnv h SER 126 N 0.00 0.06 0.00 5.36 4.64 -1.93 -3.36 113.55 118.32 2wnv h SER 126 Ca 0.00 -0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.18 2wnv h SER 126 Cb 0.42 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2wnv h SER 126 CO 0.00 1.05 -1.92 0.35 -0.87 0.00 0.00 176.83 175.44 2wnv n THR 127 N -3.37 0.28 -1.02 2.95 -2.24 -1.05 -5.00 114.28 104.82 2wnv n THR 127 Ca -0.02 -0.49 -0.01 0.00 -2.27 0.00 0.00 64.05 61.27 2wnv n THR 127 Cb 0.95 -0.07 -0.00 0.00 -2.10 0.00 0.00 70.33 69.11 2wnv n THR 127 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wnv n GLY 128 N 1.57 0.48 3.42 3.38 0.00 0.70 -4.95 105.19 109.80 2wnv n GLY 128 Ca -0.09 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2wnv n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnv s LYS 129 N -1.10 2.03 0.05 1.61 1.02 -1.19 -4.63 119.74 117.53 2wnv s LYS 129 Ca 0.00 -0.99 -0.22 0.00 0.02 0.00 0.00 55.97 54.78 2wnv s LYS 129 Cb 0.00 -2.14 -0.06 0.00 -0.52 0.00 0.00 37.83 35.11 2wnv s LYS 129 CO 0.00 0.54 0.66 0.12 -0.92 0.00 0.00 175.35 175.75 2wnv s PHE 130 N -0.86 3.76 -0.09 3.18 5.36 -0.00 -0.88 117.98 128.45 2wnv s PHE 130 Ca 0.13 1.36 0.02 0.00 -0.96 0.00 0.00 56.93 57.48 2wnv s PHE 130 Cb -0.10 -2.66 0.01 0.00 -0.34 0.00 0.00 43.02 39.93 2wnv s PHE 130 CO 0.04 0.42 -0.14 0.99 -1.46 0.00 0.00 175.22 175.07 2wnv s THR 131 N -0.54 1.36 0.03 0.12 2.01 -0.46 -0.97 115.64 117.18 2wnv s THR 131 Ca 0.33 -0.57 -0.30 0.00 0.31 0.00 0.00 61.69 61.46 2wnv s THR 131 Cb -0.20 -1.24 -0.07 0.00 0.01 0.00 0.00 72.50 71.00 2wnv s THR 131 CO 0.21 0.41 1.53 0.00 -0.69 0.00 0.00 174.62 176.08 2wnv n LYS 133 N 5.60 0.58 -3.66 0.00 5.02 -1.26 -0.99 118.16 123.45 2wnv n LYS 133 Ca 0.15 0.20 -0.39 0.00 -2.02 0.00 0.00 58.31 56.25 2wnv n LYS 133 Cb 0.42 -1.46 -0.12 0.00 -0.02 0.00 0.00 35.03 33.85 2wnv n LYS 133 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wnv s VAL 134 N -2.49 4.50 0.51 -0.18 1.01 -1.26 -4.81 120.40 117.68 2wnv s VAL 134 Ca -0.35 -0.52 -0.21 0.00 0.00 0.00 0.00 61.98 60.91 2wnv s VAL 134 Cb 0.12 -3.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.10 2wnv s VAL 134 CO 0.51 0.03 1.12 -2.16 0.00 0.00 0.00 175.10 174.59 2wnv s PRO 135 N 1.59 3.56 0.00 2.72 0.04 -1.26 -4.91 135.00 136.74 2wnv s PRO 135 Ca 0.04 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.67 2wnv s PRO 135 Cb -0.17 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.24 2wnv s PRO 135 CO 0.06 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 176.83 2wnv n GLY 136 N 0.15 0.05 3.64 0.56 0.00 -0.67 -1.06 105.19 107.87 2wnv n GLY 136 Ca 0.10 -1.55 -0.40 0.00 0.00 0.00 0.00 46.02 44.17 2wnv n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wnv s LEU 137 N 0.00 4.11 0.08 0.99 1.98 -0.02 -0.70 118.68 125.12 2wnv s LEU 137 Ca 0.00 0.65 0.07 0.00 -2.89 0.00 0.00 54.13 51.96 2wnv s LEU 137 Cb 0.00 -2.73 -0.04 0.00 0.66 0.00 0.00 46.19 44.08 2wnv s LEU 137 CO 0.00 -0.25 -0.14 -0.31 -1.89 0.00 0.00 176.35 173.76 2wnv s TYR 138 N 1.99 2.65 -0.16 5.38 1.51 0.36 -0.46 117.35 128.62 2wnv s TYR 138 Ca 0.24 -0.20 -0.05 0.00 -1.01 0.00 0.00 57.07 56.04 2wnv s TYR 138 Cb -0.16 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.22 2wnv s TYR 138 CO 0.09 0.36 0.03 -0.47 -1.11 0.00 0.00 175.55 174.45 2wnv s TYR 139 N -1.09 3.19 -0.03 2.71 5.04 -0.31 -1.10 117.35 125.76 2wnv s TYR 139 Ca 0.18 0.01 0.06 0.00 -2.44 0.00 0.00 57.07 54.89 2wnv s TYR 139 Cb -0.11 -1.99 -0.01 0.00 0.35 0.00 0.00 41.96 40.20 2wnv s TYR 139 CO 0.10 0.18 -0.22 -0.06 -1.34 0.00 0.00 175.55 174.21 2wnv s PHE 140 N 0.09 2.09 -0.07 4.97 0.40 -0.39 -1.26 117.98 123.82 2wnv s PHE 140 Ca 0.03 -0.50 -0.21 0.00 -0.60 0.00 0.00 56.93 55.65 2wnv s PHE 140 Cb -0.13 -1.37 0.05 0.00 0.51 0.00 0.00 43.02 42.08 2wnv s PHE 140 CO 0.01 -0.11 0.48 0.54 0.70 0.00 0.00 175.22 176.85 2wnv s VAL 141 N -0.33 0.02 0.04 -0.44 0.11 -0.46 -1.14 120.40 118.21 2wnv s VAL 141 Ca 0.03 -0.20 -0.00 0.00 -2.93 0.00 0.00 61.98 58.87 2wnv s VAL 141 Cb -0.11 -0.77 -0.03 0.00 -1.53 0.00 0.00 36.38 33.94 2wnv s VAL 141 CO 0.01 -0.11 -0.03 -0.72 -3.33 0.00 0.00 175.10 170.92 2wnv s TYR 142 N -0.90 0.44 -0.12 1.54 -0.85 -0.29 -0.70 117.35 116.46 2wnv s TYR 142 Ca -0.10 -0.85 -0.03 0.00 -0.52 0.00 0.00 57.07 55.58 2wnv s TYR 142 Cb -0.03 -0.32 0.04 0.00 0.38 0.00 0.00 41.96 42.03 2wnv s TYR 142 CO 0.05 -0.30 0.03 -1.01 -1.52 0.00 0.00 175.55 172.81 2wnv s HIS 143 N -2.94 0.61 -0.14 -3.49 3.76 -0.59 -2.59 115.29 109.91 2wnv s HIS 143 Ca -0.02 -0.34 0.03 0.00 -0.15 0.00 0.00 55.06 54.58 2wnv s HIS 143 Cb 0.01 -0.81 0.01 0.00 1.11 0.00 0.00 32.58 32.90 2wnv s HIS 143 CO -0.06 -0.43 -0.22 0.00 -0.85 0.00 0.00 174.74 173.18 2wnv s ALA 144 N 1.99 2.25 0.17 -1.40 0.00 0.74 -0.64 121.76 124.87 2wnv s ALA 144 Ca 0.03 -1.08 -0.22 0.00 0.00 0.00 0.00 51.96 50.69 2wnv s ALA 144 Cb -0.14 -0.99 -0.08 0.00 0.00 0.00 0.00 23.12 21.91 2wnv s ALA 144 CO -0.06 -0.00 0.71 -1.12 0.00 0.00 0.00 175.76 175.28 2wnv s SER 145 N 0.78 7.19 -0.03 0.00 0.01 -1.15 -0.25 113.70 120.24 2wnv s SER 145 Ca -0.08 1.47 -0.22 0.00 1.31 0.00 0.00 55.95 58.43 2wnv s SER 145 Cb -0.16 -2.44 0.05 0.00 0.21 0.00 0.00 66.02 63.68 2wnv s SER 145 CO -0.01 0.16 0.48 -1.38 0.41 0.00 0.00 173.24 172.90 2wnv s HIS 146 N -1.29 -0.41 0.00 2.43 -3.43 -0.55 -3.76 115.29 108.28 2wnv s HIS 146 Ca 0.37 0.68 0.00 0.00 -0.80 0.00 0.00 55.06 55.31 2wnv s HIS 146 Cb -0.20 0.24 0.00 0.00 -1.43 0.00 0.00 32.58 31.20 2wnv s HIS 146 CO 0.23 -0.49 0.92 0.25 -2.00 0.00 0.00 174.74 173.64 2wnv n THR 147 N 1.12 0.84 -4.08 -5.38 -2.24 -1.14 -1.57 114.28 101.83 2wnv n THR 147 Ca -0.20 -0.86 -0.15 0.00 -2.27 0.00 0.00 64.05 60.57 2wnv n THR 147 Cb 0.56 0.59 -0.04 0.00 -2.10 0.00 0.00 70.33 69.34 2wnv n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wnv n ALA 148 N -0.42 -0.12 -1.74 6.98 0.00 -1.26 -2.41 120.51 121.54 2wnv n ALA 148 Ca 0.00 -1.60 -0.42 0.00 0.00 0.00 0.00 53.44 51.42 2wnv n ALA 148 Cb 0.27 1.29 -0.01 0.00 0.00 0.00 0.00 19.45 20.99 2wnv n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wnv n ASN 149 N -1.67 3.51 -3.72 0.00 4.13 -1.25 -4.46 115.26 111.81 2wnv n ASN 149 Ca 0.02 1.18 -0.17 0.00 1.68 0.00 0.00 54.58 57.29 2wnv n ASN 149 Cb 0.56 -1.56 -0.17 0.00 -1.54 0.00 0.00 39.78 37.08 2wnv n ASN 149 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2wnv s LEU 150 N -0.90 0.52 -0.12 3.41 2.96 -0.51 -2.30 118.68 121.73 2wnv s LEU 150 Ca 0.60 0.13 -0.00 0.00 -0.22 0.00 0.00 54.13 54.64 2wnv s LEU 150 Cb -0.52 0.00 -0.02 0.00 0.50 0.00 0.00 46.19 46.15 2wnv s LEU 150 CO 0.55 -0.19 -0.12 0.00 -1.32 0.00 0.00 176.35 175.27 2wnv s VAL 152 N 0.17 3.39 -0.10 0.00 1.01 -0.20 -3.86 120.40 120.81 2wnv s VAL 152 Ca -0.06 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.39 2wnv s VAL 152 Cb -0.15 -2.44 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2wnv s VAL 152 CO 0.05 0.52 -0.14 -0.76 0.00 0.00 0.00 175.10 174.76 2wnv s LEU 153 N 0.23 2.67 -0.20 3.92 1.02 0.36 -1.41 118.68 125.28 2wnv s LEU 153 Ca -0.06 -0.30 -0.08 0.00 0.02 0.00 0.00 54.13 53.72 2wnv s LEU 153 Cb -0.15 -1.57 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 2wnv s LEU 153 CO 0.04 0.23 0.07 -0.22 0.02 0.00 0.00 176.35 176.50 2wnv s LEU 154 N -0.05 3.77 -0.02 1.79 0.20 -0.15 -0.60 118.68 123.62 2wnv s LEU 154 Ca -0.03 0.03 0.02 0.00 0.69 0.00 0.00 54.13 54.84 2wnv s LEU 154 Cb -0.14 -1.97 -0.03 0.00 -0.43 0.00 0.00 46.19 43.62 2wnv s LEU 154 CO 0.04 0.13 -0.05 -0.31 -0.29 0.00 0.00 176.35 175.87 2wnv s TYR 155 N 0.66 2.96 -0.16 5.38 1.51 0.14 -0.13 117.35 127.72 2wnv s TYR 155 Ca 0.04 0.02 -0.00 0.00 -1.01 0.00 0.00 57.07 56.12 2wnv s TYR 155 Cb -0.13 -1.66 0.04 0.00 -0.11 0.00 0.00 41.96 40.10 2wnv s TYR 155 CO 0.02 0.39 -0.08 0.50 -1.11 0.00 0.00 175.55 175.27 2wnv s ARG 156 N -1.27 1.66 -1.58 -0.62 3.52 -0.10 -2.08 118.95 118.48 2wnv s ARG 156 Ca 0.16 -0.53 -0.11 0.00 -0.13 0.00 0.00 55.73 55.12 2wnv s ARG 156 Cb -0.11 -2.01 0.09 0.00 -1.56 0.00 0.00 34.95 31.36 2wnv s ARG 156 CO 0.06 -0.38 0.68 0.43 -0.81 0.00 0.00 175.30 175.28 2wnv n SER 157 N 4.84 -2.41 0.00 -2.12 7.64 0.34 -1.36 113.62 120.56 2wnv n SER 157 Ca -0.13 -0.99 0.00 0.00 1.01 0.00 0.00 58.87 58.76 2wnv n SER 157 Cb 0.48 -2.98 0.00 0.00 -1.01 0.00 0.00 64.21 60.70 2wnv n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wnv n GLY 158 N -1.65 0.82 3.35 0.23 0.00 -1.26 -5.03 105.19 101.66 2wnv n GLY 158 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 2wnv n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wnv s VAL 159 N -2.97 2.69 -0.11 1.61 1.01 -0.46 -5.09 120.40 117.09 2wnv s VAL 159 Ca 0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.87 2wnv s VAL 159 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 2wnv s VAL 159 CO 0.00 0.56 1.46 -0.75 0.00 0.00 0.00 175.10 176.37 2wnv s LYS 160 N -0.04 4.21 -0.18 2.72 2.20 -1.26 -0.92 119.74 126.46 2wnv s LYS 160 Ca -0.05 1.93 -0.15 0.00 -0.36 0.00 0.00 55.97 57.34 2wnv s LYS 160 Cb -0.14 -3.87 -0.11 0.00 -1.51 0.00 0.00 37.83 32.20 2wnv s LYS 160 CO 0.04 -0.77 -0.03 0.28 -0.36 0.00 0.00 175.35 174.51 2wnv n VAL 161 N 5.41 1.48 -3.88 4.02 0.31 0.81 -4.96 118.33 121.52 2wnv n VAL 161 Ca 0.16 0.07 -0.10 0.00 -0.01 0.00 0.00 64.34 64.45 2wnv n VAL 161 Cb 0.44 -2.21 -0.09 0.00 -0.91 0.00 0.00 33.84 31.07 2wnv n VAL 161 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2wnv s VAL 162 N -2.35 0.12 -0.02 2.52 -7.23 -1.21 -5.01 120.40 107.21 2wnv s VAL 162 Ca -0.23 -0.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.99 2wnv s VAL 162 Cb 0.05 -0.86 0.01 0.00 0.56 0.00 0.00 36.38 36.14 2wnv s VAL 162 CO 0.41 -0.53 -0.04 -0.89 -0.31 0.00 0.00 175.10 173.74 2wnv s THR 163 N -2.48 0.43 -0.02 5.32 2.01 -1.26 -0.97 115.64 118.66 2wnv s THR 163 Ca -0.06 -0.14 0.02 0.00 0.31 0.00 0.00 61.69 61.82 2wnv s THR 163 Cb -0.02 -0.42 0.00 0.00 0.01 0.00 0.00 72.50 72.08 2wnv s THR 163 CO -0.04 0.16 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.62 2wnv s PHE 164 N 0.44 0.80 0.01 4.92 0.40 -0.50 -4.99 117.98 119.06 2wnv s PHE 164 Ca -0.05 -0.19 0.07 0.00 -0.60 0.00 0.00 56.93 56.15 2wnv s PHE 164 Cb -0.09 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.84 2wnv s PHE 164 CO -0.00 -0.09 -0.20 0.00 0.70 0.00 0.00 175.22 175.63 2wnv s GLY 166 N -0.77 0.47 -0.11 0.00 0.00 -0.02 -4.99 107.32 101.89 2wnv s GLY 166 Ca 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 44.72 44.58 2wnv s GLY 166 CO 0.00 0.13 -0.03 0.30 0.00 0.00 0.00 173.10 173.50 2wnv s HIS 167 N 0.47 3.05 0.01 1.90 3.76 -1.26 -1.43 115.29 121.79 2wnv s HIS 167 Ca -0.07 -0.03 -0.18 0.00 -0.15 0.00 0.00 55.06 54.63 2wnv s HIS 167 Cb -0.11 -1.84 0.03 0.00 1.11 0.00 0.00 32.58 31.78 2wnv s HIS 167 CO 0.00 0.24 0.39 -0.08 -0.85 0.00 0.00 174.74 174.44 2wnv s THR 168 N -0.37 0.05 -0.26 1.30 -1.32 -1.26 -4.96 115.64 108.82 2wnv s THR 168 Ca 0.06 -0.44 0.03 0.00 -1.21 0.00 0.00 61.69 60.13 2wnv s THR 168 Cb -0.12 -0.82 0.06 0.00 -1.51 0.00 0.00 72.50 70.11 2wnv s THR 168 CO 0.02 -0.24 -0.10 -0.55 -2.21 0.00 0.00 174.62 171.54 2wnv s SER 169 N -1.64 4.46 0.00 8.08 0.15 -1.26 -3.82 113.70 119.67 2wnv s SER 169 Ca -0.09 -1.43 0.00 0.00 0.70 0.00 0.00 55.95 55.13 2wnv s SER 169 Cb -0.02 -1.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.73 2wnv s SER 169 CO 0.02 -0.20 0.00 0.29 1.20 0.00 0.00 173.24 174.55 2wnv n LYS 170 N 4.42 0.00 -1.87 5.44 5.02 -1.01 -4.90 118.16 125.26 2wnv n LYS 170 Ca -0.13 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.85 2wnv n LYS 170 Cb 0.42 -0.05 0.04 0.00 -0.02 0.00 0.00 35.03 35.41 2wnv n LYS 170 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wnv s THR 171 N 0.00 3.77 -0.13 -0.18 -4.23 -1.26 -4.82 115.64 108.78 2wnv s THR 171 Ca 0.00 0.57 -0.09 0.00 -1.18 0.00 0.00 61.69 60.99 2wnv s THR 171 Cb 0.00 -3.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 2wnv s THR 171 CO 0.00 -0.75 0.18 0.21 -0.54 0.00 0.00 174.62 173.72 2wnv s ASN 172 N -4.30 6.39 0.22 3.99 2.47 -1.26 -4.37 114.94 118.08 2wnv s ASN 172 Ca 0.57 0.47 0.00 0.00 0.42 0.00 0.00 52.86 54.32 2wnv s ASN 172 Cb -0.11 -2.11 -0.04 0.00 -1.45 0.00 0.00 41.25 37.54 2wnv s ASN 172 CO 0.52 0.31 0.15 -1.10 -3.72 0.00 0.00 177.10 173.26 2wnv s GLN 173 N -0.52 1.28 -0.17 0.43 -0.21 -0.61 -4.98 119.66 114.87 2wnv s GLN 173 Ca 0.14 -1.69 0.01 0.00 0.02 0.00 0.00 55.36 53.84 2wnv s GLN 173 Cb -0.12 0.24 0.01 0.00 1.00 0.00 0.00 33.01 34.14 2wnv s GLN 173 CO 0.03 -0.42 -0.18 0.08 -2.12 0.00 0.00 175.29 172.69 2wnv s VAL 174 N -4.05 2.29 -0.21 1.09 1.01 -1.26 -1.49 120.40 117.79 2wnv s VAL 174 Ca 0.39 -0.88 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 2wnv s VAL 174 Cb 0.06 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2wnv s VAL 174 CO 0.14 0.53 0.50 0.21 0.00 0.00 0.00 175.10 176.48 2wnv s ASN 175 N 1.13 6.53 0.09 3.32 3.84 0.65 -4.88 114.94 125.61 2wnv s ASN 175 Ca 0.01 0.63 0.08 0.00 0.21 0.00 0.00 52.86 53.78 2wnv s ASN 175 Cb -0.14 -2.28 -0.03 0.00 -0.55 0.00 0.00 41.25 38.25 2wnv s ASN 175 CO -0.07 -0.18 -0.20 -0.55 -2.79 0.00 0.00 177.10 173.31 2wnv s SER 176 N 1.19 2.39 0.19 -4.21 0.15 -1.26 -0.19 113.70 111.96 2wnv s SER 176 Ca 0.23 -0.64 -0.22 0.00 0.70 0.00 0.00 55.95 56.02 2wnv s SER 176 Cb -0.15 -0.14 0.05 0.00 -1.71 0.00 0.00 66.02 64.07 2wnv s SER 176 CO 0.09 0.06 0.61 -0.83 1.20 0.00 0.00 173.24 174.37 2wnv s GLY 177 N -1.72 -0.45 -0.20 9.45 0.00 -1.07 -4.95 107.32 108.39 2wnv s GLY 177 Ca 0.05 0.24 -0.36 0.00 0.00 0.00 0.00 44.72 44.65 2wnv s GLY 177 CO 0.03 0.04 1.31 -0.32 0.00 0.00 0.00 173.10 174.17 2wnv s GLY 178 N -2.80 -0.29 -0.06 0.20 0.00 -1.26 -1.14 107.32 101.97 2wnv s GLY 178 Ca 0.04 1.56 -0.29 0.00 0.00 0.00 0.00 44.72 46.03 2wnv s GLY 178 CO -0.08 0.49 0.86 0.54 0.00 0.00 0.00 173.10 174.91 2wnv s VAL 179 N -2.22 0.00 -0.18 1.40 0.11 -0.29 -4.99 120.40 114.22 2wnv s VAL 179 Ca 0.11 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.09 2wnv s VAL 179 Cb 0.01 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.82 2wnv s VAL 179 CO -0.04 0.00 0.05 -0.76 -3.33 0.00 0.00 175.10 171.03 2wnv s LEU 180 N -1.69 3.76 -0.02 2.54 1.43 -1.26 -1.26 118.68 122.18 2wnv s LEU 180 Ca -0.02 0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 2wnv s LEU 180 Cb -0.01 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.28 2wnv s LEU 180 CO -0.01 0.17 -0.03 -0.76 0.23 0.00 0.00 176.35 175.95 2wnv s LEU 181 N 0.39 1.58 -0.43 1.79 1.43 -0.26 -4.97 118.68 118.22 2wnv s LEU 181 Ca 0.02 -0.06 -0.20 0.00 -1.03 0.00 0.00 54.13 52.86 2wnv s LEU 181 Cb -0.13 -0.25 0.02 0.00 0.03 0.00 0.00 46.19 45.87 2wnv s LEU 181 CO 0.00 -0.02 0.58 -0.60 0.23 0.00 0.00 176.35 176.54 2wnv s ARG 182 N 0.49 3.26 0.07 1.70 3.52 -1.26 -0.48 118.95 126.24 2wnv s ARG 182 Ca -0.05 -0.45 0.03 0.00 -0.13 0.00 0.00 55.73 55.13 2wnv s ARG 182 Cb -0.08 -3.94 -0.04 0.00 -1.56 0.00 0.00 34.95 29.32 2wnv s ARG 182 CO -0.01 -0.94 0.03 -0.51 -0.81 0.00 0.00 175.30 173.06 2wnv s LEU 183 N 2.62 3.62 0.30 -0.88 1.43 0.12 -4.94 118.68 120.95 2wnv s LEU 183 Ca 0.20 -0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.24 2wnv s LEU 183 Cb -0.15 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2wnv s LEU 183 CO 0.17 0.20 0.48 -1.10 0.23 0.00 0.00 176.35 176.33 2wnv s GLN 184 N -2.19 3.49 0.17 1.70 1.11 -1.26 -1.67 119.66 121.00 2wnv s GLN 184 Ca 0.26 -0.42 -0.33 0.00 0.01 0.00 0.00 55.36 54.87 2wnv s GLN 184 Cb -0.12 -2.74 -0.15 0.00 -1.01 0.00 0.00 33.01 28.99 2wnv s GLN 184 CO 0.18 0.26 1.40 0.28 0.01 0.00 0.00 175.29 177.42 2wnv n VAL 185 N -1.48 0.44 0.00 1.09 0.31 -1.26 -2.13 118.33 115.30 2wnv n VAL 185 Ca -0.06 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2wnv n VAL 185 Cb 0.56 -1.24 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 2wnv n VAL 185 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wnv n GLY 186 N 2.60 1.57 3.77 2.92 0.00 -0.16 -4.98 105.19 110.91 2wnv n GLY 186 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2wnv n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wnv s GLU 187 N -0.69 4.35 -0.08 1.61 2.02 -0.91 -4.65 118.70 120.36 2wnv s GLU 187 Ca 0.00 2.22 -0.03 0.00 0.02 0.00 0.00 54.97 57.18 2wnv s GLU 187 Cb 0.00 -3.07 -0.04 0.00 0.10 0.00 0.00 34.13 31.12 2wnv s GLU 187 CO 0.00 -0.19 0.06 -1.21 0.02 0.00 0.00 175.26 173.94 2wnv s GLU 188 N -1.79 3.15 -0.02 1.61 2.02 -1.26 -0.89 118.70 121.52 2wnv s GLU 188 Ca 0.49 -0.33 0.04 0.00 0.02 0.00 0.00 54.97 55.19 2wnv s GLU 188 Cb -0.40 -2.93 -0.00 0.00 0.10 0.00 0.00 34.13 30.89 2wnv s GLU 188 CO 0.53 0.72 -0.13 0.08 0.02 0.00 0.00 175.26 176.47 2wnv s VAL 189 N -0.99 1.10 0.23 2.63 1.01 -0.14 -0.50 120.40 123.73 2wnv s VAL 189 Ca 0.16 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.42 2wnv s VAL 189 Cb -0.12 -0.94 0.01 0.00 0.00 0.00 0.00 36.38 35.34 2wnv s VAL 189 CO 0.05 0.32 0.52 -1.66 0.00 0.00 0.00 175.10 174.33 2wnv s TRP 190 N -0.08 0.09 0.10 5.22 -2.14 -0.88 -0.82 118.94 120.42 2wnv s TRP 190 Ca 0.01 -0.46 0.05 0.00 2.66 0.00 0.00 56.10 58.36 2wnv s TRP 190 Cb -0.08 0.33 -0.04 0.00 -3.10 0.00 0.00 33.47 30.58 2wnv s TRP 190 CO 0.00 -0.98 -0.00 -0.51 -2.66 0.00 0.00 176.95 172.80 2wnv s LEU 191 N -2.94 3.43 0.10 -4.66 1.43 -1.26 -0.68 118.68 114.10 2wnv s LEU 191 Ca 0.15 -0.22 -0.04 0.00 -1.03 0.00 0.00 54.13 52.99 2wnv s LEU 191 Cb -0.01 -2.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2wnv s LEU 191 CO 0.03 0.16 0.11 0.00 0.23 0.00 0.00 176.35 176.88 2wnv s ALA 192 N -1.37 0.32 0.28 4.21 0.00 0.23 -0.35 121.76 125.08 2wnv s ALA 192 Ca 0.26 -1.07 0.10 0.00 0.00 0.00 0.00 51.96 51.25 2wnv s ALA 192 Cb -0.11 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.56 2wnv s ALA 192 CO 0.18 -0.49 -0.01 0.14 0.00 0.00 0.00 175.76 175.58 2wnv s VAL 193 N -3.95 3.22 0.00 0.00 -7.23 -0.31 -0.48 120.40 111.65 2wnv s VAL 193 Ca 0.13 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2wnv s VAL 193 Cb 0.06 -2.79 0.00 0.00 0.56 0.00 0.00 36.38 34.21 2wnv s VAL 193 CO -0.05 -0.34 0.00 -0.46 -0.31 0.00 0.00 175.10 173.94 2wnv n ASN 194 N -0.89 0.00 0.16 4.85 0.23 -1.25 -2.81 115.26 115.54 2wnv n ASN 194 Ca -0.06 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.12 2wnv n ASN 194 Cb 0.60 0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.76 2wnv n ASN 194 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2wnv h ASP 195 N 0.00 0.00 -3.22 0.53 3.32 -1.94 -0.54 116.42 114.57 2wnv h ASP 195 Ca 0.00 0.00 -0.74 0.00 0.02 0.00 0.00 57.03 56.31 2wnv h ASP 195 Cb 0.00 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 39.30 2wnv h ASP 195 CO 0.00 0.00 -0.30 -0.31 -1.72 0.00 0.00 179.24 176.91 2wnv s TYR 196 N -3.29 3.28 0.00 4.55 4.12 -1.26 -4.91 117.35 119.83 2wnv s TYR 196 Ca 0.06 -1.28 0.00 0.00 0.02 0.00 0.00 57.07 55.87 2wnv s TYR 196 Cb 0.10 -3.48 0.00 0.00 -1.52 0.00 0.00 41.96 37.06 2wnv s TYR 196 CO 0.51 -0.93 0.70 2.48 0.02 0.00 0.00 175.55 178.33 2wnv n TYR 197 N 5.16 0.00 -2.21 2.71 0.18 -1.16 -1.27 117.16 120.58 2wnv n TYR 197 Ca -0.12 -0.24 -0.42 0.00 1.88 0.00 0.00 57.90 58.99 2wnv n TYR 197 Cb 0.42 -0.02 -0.03 0.00 -0.38 0.00 0.00 39.34 39.32 2wnv n TYR 197 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2wnv s ASP 198 N -0.48 6.85 -0.20 9.48 -1.08 -0.97 -4.09 116.67 126.17 2wnv s ASP 198 Ca 0.00 2.16 0.16 0.00 -0.52 0.00 0.00 52.55 54.35 2wnv s ASP 198 Cb 0.00 -2.57 0.46 0.00 -1.46 0.00 0.00 42.92 39.35 2wnv s ASP 198 CO 0.00 -0.70 1.17 0.23 0.52 0.00 0.00 175.17 176.39 2wnv n MET 199 N 5.08 1.85 -3.14 4.34 2.81 -1.26 -4.56 117.12 122.24 2wnv n MET 199 Ca 0.13 -3.32 -0.45 0.00 -1.81 0.00 0.00 57.70 52.24 2wnv n MET 199 Cb 0.43 -1.45 -0.03 0.00 -0.71 0.00 0.00 33.22 31.47 2wnv n MET 199 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2wnv s VAL 200 N -3.07 5.15 0.53 2.03 1.01 -1.25 -4.77 120.40 120.04 2wnv s VAL 200 Ca 0.38 -1.92 -0.17 0.00 0.00 0.00 0.00 61.98 60.27 2wnv s VAL 200 Cb 0.37 -4.60 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 2wnv s VAL 200 CO -0.05 -1.24 1.01 -0.83 0.00 0.00 0.00 175.10 173.99 2wnv s GLY 201 N 2.96 2.13 1.06 4.51 0.00 -1.25 -2.86 107.32 113.86 2wnv s GLY 201 Ca 0.23 0.29 -0.13 0.00 0.00 0.00 0.00 44.72 45.11 2wnv s GLY 201 CO -0.07 0.58 1.08 -0.26 0.00 0.00 0.00 173.10 174.43 2wnv s ILE 202 N -2.50 1.96 -0.03 0.90 -4.36 -1.26 -4.86 121.20 111.05 2wnv s ILE 202 Ca 0.61 0.00 -0.33 0.00 -0.26 0.00 0.00 60.65 60.67 2wnv s ILE 202 Cb -0.12 -2.43 -0.11 0.00 1.25 0.00 0.00 42.46 41.04 2wnv s ILE 202 CO 0.31 0.00 1.87 0.00 0.24 0.00 0.00 174.94 177.36 2wnv n GLN 203 N -4.38 2.35 -0.44 0.37 3.00 -1.26 -1.31 117.38 115.70 2wnv n GLN 203 Ca 0.05 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.90 2wnv n GLN 203 Cb 0.57 -2.72 0.00 0.00 0.00 0.00 0.00 30.24 28.09 2wnv n GLN 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wnv n GLY 204 N 4.33 0.76 2.99 1.08 0.00 -1.26 -5.06 105.19 108.04 2wnv n GLY 204 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2wnv n GLY 204 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wnv s SER 205 N -2.24 3.42 0.52 1.61 0.15 -0.43 -5.13 113.70 111.60 2wnv s SER 205 Ca 0.00 -0.90 0.04 0.00 0.70 0.00 0.00 55.95 55.79 2wnv s SER 205 Cb 0.00 -1.23 0.01 0.00 -1.71 0.00 0.00 66.02 63.09 2wnv s SER 205 CO 0.00 -0.15 0.25 -1.81 1.20 0.00 0.00 173.24 172.73 2wnv s ASP 206 N 1.39 4.44 -0.05 5.45 1.11 -1.26 -4.35 116.67 123.40 2wnv s ASP 206 Ca -0.01 -1.37 0.03 0.00 0.18 0.00 0.00 52.55 51.38 2wnv s ASP 206 Cb -0.16 0.36 0.01 0.00 1.07 0.00 0.00 42.92 44.19 2wnv s ASP 206 CO -0.08 -0.96 -0.14 -0.44 1.18 0.00 0.00 175.17 174.73 2wnv s SER 207 N -4.11 1.91 0.05 0.27 0.01 -1.26 -2.94 113.70 107.63 2wnv s SER 207 Ca 0.25 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 57.22 2wnv s SER 207 Cb -0.00 -0.71 -0.02 0.00 0.21 0.00 0.00 66.02 65.49 2wnv s SER 207 CO 0.15 0.09 -0.08 0.54 0.41 0.00 0.00 173.24 174.35 2wnv s VAL 208 N 0.36 0.58 -0.04 3.43 0.11 0.18 -2.10 120.40 122.91 2wnv s VAL 208 Ca -0.09 -1.12 -0.00 0.00 -2.93 0.00 0.00 61.98 57.83 2wnv s VAL 208 Cb -0.13 -0.67 0.03 0.00 -1.53 0.00 0.00 36.38 34.07 2wnv s VAL 208 CO 0.03 -0.39 0.01 0.12 -3.33 0.00 0.00 175.10 171.54 2wnv s PHE 209 N -1.46 0.36 0.14 1.54 5.36 -0.11 -1.54 117.98 122.27 2wnv s PHE 209 Ca -0.09 0.01 0.08 0.00 -0.96 0.00 0.00 56.93 55.97 2wnv s PHE 209 Cb -0.09 -0.53 -0.04 0.00 -0.34 0.00 0.00 43.02 42.02 2wnv s PHE 209 CO 0.00 -0.19 -0.19 -1.12 -1.46 0.00 0.00 175.22 172.26 2wnv s SER 210 N 1.48 2.61 -0.07 6.13 0.01 0.13 -0.76 113.70 123.23 2wnv s SER 210 Ca -0.03 -0.79 -0.19 0.00 1.31 0.00 0.00 55.95 56.26 2wnv s SER 210 Cb -0.13 -0.15 0.04 0.00 0.21 0.00 0.00 66.02 65.99 2wnv s SER 210 CO -0.03 0.00 0.43 -0.83 0.41 0.00 0.00 173.24 173.23 2wnv s GLY 211 N -2.33 -0.30 -0.07 3.44 0.00 -0.62 -1.35 107.32 106.08 2wnv s GLY 211 Ca 0.12 0.81 -0.23 0.00 0.00 0.00 0.00 44.72 45.42 2wnv s GLY 211 CO 0.05 0.58 0.52 -0.11 0.00 0.00 0.00 173.10 174.14 2wnv s PHE 212 N -0.86 -0.47 -0.03 1.90 -0.12 -0.39 -1.12 117.98 116.89 2wnv s PHE 212 Ca -0.09 0.88 -0.30 0.00 -0.05 0.00 0.00 56.93 57.37 2wnv s PHE 212 Cb -0.04 0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 42.58 2wnv s PHE 212 CO 0.05 -0.46 1.10 -1.17 -0.05 0.00 0.00 175.22 174.68 2wnv s LEU 213 N -0.95 4.31 -0.23 -1.99 2.96 -0.07 -1.16 118.68 121.56 2wnv s LEU 213 Ca -0.10 1.74 -0.06 0.00 -0.22 0.00 0.00 54.13 55.50 2wnv s LEU 213 Cb -0.03 -3.56 -0.12 0.00 0.50 0.00 0.00 46.19 42.98 2wnv s LEU 213 CO 0.06 -0.45 -0.25 0.18 -1.32 0.00 0.00 176.35 174.57 2wnv n LEU 214 N 4.59 2.27 -3.84 -0.68 4.77 0.39 -4.77 117.00 119.73 2wnv n LEU 214 Ca 0.09 0.10 -0.30 0.00 -0.03 0.00 0.00 56.01 55.87 2wnv n LEU 214 Cb 0.48 -0.73 -0.15 0.00 -2.33 0.00 0.00 43.42 40.69 2wnv n LEU 214 CO 0.54 0.67 -0.35 -0.36 -1.33 0.00 0.00 177.39 176.55 2wnv s PHE 215 N -2.43 2.21 0.40 -1.77 0.08 -1.12 -4.99 117.98 110.34 2wnv s PHE 215 Ca -0.31 -1.91 -0.26 0.00 0.12 0.00 0.00 56.93 54.56 2wnv s PHE 215 Cb 0.10 -1.86 -0.09 0.00 -0.57 0.00 0.00 43.02 40.60 2wnv s PHE 215 CO 0.46 -0.84 1.28 -2.14 -0.10 0.00 0.00 175.22 173.88 2wnv s PRO 216 N 1.45 4.02 0.00 0.24 0.02 -1.26 -0.84 135.00 138.63 2wnv s PRO 216 Ca 0.06 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.19 2wnv s PRO 216 Cb -0.18 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.56 2wnv s PRO 216 CO -0.16 -0.43 0.13 -0.40 -0.33 0.00 0.00 177.00 175.81