#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnu s GLN 93 N 0.00 3.47 -0.56 -0.78 1.11 -1.26 -5.00 119.66 116.65 2wnu s GLN 93 Ca 0.00 -2.09 -0.20 0.00 0.01 0.00 0.00 55.36 53.08 2wnu s GLN 93 Cb 0.00 -4.51 0.07 0.00 -1.01 0.00 0.00 33.01 27.57 2wnu s GLN 93 CO 0.00 -1.44 0.73 0.15 0.01 0.00 0.00 175.29 174.74 2wnu s LYS 94 N 1.19 3.12 -0.20 2.91 1.02 -1.26 -4.97 119.74 121.55 2wnu s LYS 94 Ca 0.19 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.23 2wnu s LYS 94 Cb -0.13 -4.16 0.05 0.00 -0.52 0.00 0.00 37.83 33.07 2wnu s LYS 94 CO -0.06 -1.43 -0.06 0.42 -0.92 0.00 0.00 175.35 173.30 2wnu s ILE 95 N 2.98 1.35 -0.09 2.17 1.01 -1.26 -4.00 121.20 123.35 2wnu s ILE 95 Ca 0.16 -0.91 -0.22 0.00 0.00 0.00 0.00 60.65 59.68 2wnu s ILE 95 Cb -0.20 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 40.78 2wnu s ILE 95 CO 0.11 0.04 0.53 0.00 0.00 0.00 0.00 174.94 175.62 2wnu s ALA 96 N 1.51 -1.35 -0.07 9.38 0.00 -1.15 -1.44 121.76 128.64 2wnu s ALA 96 Ca -0.02 1.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.94 2wnu s ALA 96 Cb -0.17 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.70 2wnu s ALA 96 CO -0.07 -0.30 0.27 -0.59 0.00 0.00 0.00 175.76 175.06 2wnu s PHE 97 N -0.74 -0.23 -0.07 0.00 -0.12 -0.17 -0.92 117.98 115.72 2wnu s PHE 97 Ca -0.08 0.53 -0.01 0.00 -0.05 0.00 0.00 56.93 57.31 2wnu s PHE 97 Cb -0.03 0.08 0.03 0.00 -0.63 0.00 0.00 43.02 42.47 2wnu s PHE 97 CO 0.05 -0.22 0.01 -1.12 -0.05 0.00 0.00 175.22 173.89 2wnu s SER 98 N -0.37 1.54 -0.01 1.98 0.01 0.13 -0.81 113.70 116.16 2wnu s SER 98 Ca -0.05 -0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.17 2wnu s SER 98 Cb -0.03 -0.41 -0.00 0.00 0.21 0.00 0.00 66.02 65.78 2wnu s SER 98 CO 0.01 -0.20 -0.09 0.00 0.41 0.00 0.00 173.24 173.38 2wnu s ALA 99 N 1.99 0.75 0.20 1.44 0.00 0.09 -0.17 121.76 126.05 2wnu s ALA 99 Ca 0.05 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2wnu s ALA 99 Cb -0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 2wnu s ALA 99 CO -0.05 0.16 0.30 0.95 0.00 0.00 0.00 175.76 177.12 2wnu s THR 100 N -0.08 5.14 -0.26 0.00 -4.23 0.12 -0.92 115.64 115.41 2wnu s THR 100 Ca 0.01 -0.92 -0.12 0.00 -1.18 0.00 0.00 61.69 59.48 2wnu s THR 100 Cb -0.05 -3.72 -0.05 0.00 1.34 0.00 0.00 72.50 70.02 2wnu s THR 100 CO -0.00 -0.22 0.23 -0.60 -0.54 0.00 0.00 174.62 173.49 2wnu s ARG 101 N -3.61 4.01 -0.00 3.99 3.52 -0.57 -1.07 118.95 125.21 2wnu s ARG 101 Ca 0.34 -0.19 0.04 0.00 -0.13 0.00 0.00 55.73 55.78 2wnu s ARG 101 Cb -0.10 -3.62 -0.06 0.00 -1.56 0.00 0.00 34.95 29.62 2wnu s ARG 101 CO 0.28 -0.12 0.09 0.25 -0.81 0.00 0.00 175.30 174.99 2wnu n THR 102 N 4.80 0.00 -1.66 4.11 -2.24 -1.26 -4.04 114.28 114.00 2wnu n THR 102 Ca -0.13 -0.12 -0.57 0.00 -2.27 0.00 0.00 64.05 60.96 2wnu n THR 102 Cb 0.52 0.47 -0.07 0.00 -2.10 0.00 0.00 70.33 69.15 2wnu n THR 102 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2wnu n ILE 103 N -1.58 0.16 -2.93 2.28 2.08 -1.26 -4.83 119.36 113.27 2wnu n ILE 103 Ca -0.01 -0.03 -0.42 0.00 0.56 0.00 0.00 62.75 62.86 2wnu n ILE 103 Cb 0.10 -0.94 0.01 0.00 -0.75 0.00 0.00 39.64 38.05 2wnu n ILE 103 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 2wnu n ASN 104 N 4.04 6.54 -3.70 4.38 5.15 -1.26 -4.78 115.26 125.63 2wnu n ASN 104 Ca 0.24 -3.48 -0.13 0.00 -0.60 0.00 0.00 54.58 50.60 2wnu n ASN 104 Cb 0.13 -1.22 -0.13 0.00 -0.53 0.00 0.00 39.78 38.03 2wnu n ASN 104 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2wnu s VAL 105 N -3.16 -0.21 0.81 3.44 1.01 -1.26 -5.16 120.40 115.86 2wnu s VAL 105 Ca 0.33 0.22 -0.14 0.00 0.00 0.00 0.00 61.98 62.40 2wnu s VAL 105 Cb 0.09 -0.39 0.05 0.00 0.00 0.00 0.00 36.38 36.12 2wnu s VAL 105 CO 0.05 0.09 0.96 -2.65 0.00 0.00 0.00 175.10 173.55 2wnu n PRO 106 N 4.78 0.16 -3.69 2.72 -0.02 -1.26 -4.99 135.00 132.70 2wnu n PRO 106 Ca -0.16 0.12 -0.37 0.00 -2.02 0.00 0.00 63.50 61.07 2wnu n PRO 106 Cb 0.51 -2.24 -0.06 0.00 -0.02 0.00 0.00 33.50 31.70 2wnu n PRO 106 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2wnu s LEU 107 N -3.90 4.43 0.11 2.45 1.43 -1.26 -5.10 118.68 116.83 2wnu s LEU 107 Ca 0.70 0.71 -0.01 0.00 -1.03 0.00 0.00 54.13 54.49 2wnu s LEU 107 Cb -0.29 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 2wnu s LEU 107 CO 0.54 0.36 0.28 0.00 0.23 0.00 0.00 176.35 177.76 2wnu s ARG 108 N -1.00 3.50 0.13 1.70 1.04 -1.26 -4.89 118.95 118.16 2wnu s ARG 108 Ca 0.19 -0.35 -0.35 0.00 -1.04 0.00 0.00 55.73 54.19 2wnu s ARG 108 Cb -0.14 -2.96 -0.16 0.00 -2.04 0.00 0.00 34.95 29.64 2wnu s ARG 108 CO 0.08 0.54 1.22 -2.13 -0.04 0.00 0.00 175.30 174.97 2wnu n ARG 109 N 0.06 1.07 -0.95 3.89 0.63 -1.25 -1.72 116.66 118.38 2wnu n ARG 109 Ca -0.04 0.38 0.00 0.00 -0.92 0.00 0.00 57.85 57.27 2wnu n ARG 109 Cb 0.52 -1.93 0.00 0.00 0.45 0.00 0.00 32.46 31.50 2wnu n ARG 109 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2wnu n ASP 110 N 2.19 -3.11 -4.73 6.15 8.00 -0.54 -4.95 116.55 119.56 2wnu n ASP 110 Ca 0.17 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.26 2wnu n ASP 110 Cb 0.21 -1.48 -0.05 0.00 -0.02 0.00 0.00 41.12 39.79 2wnu n ASP 110 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2wnu s GLN 111 N -0.67 4.72 0.08 -1.24 0.74 -0.70 -4.80 119.66 117.79 2wnu s GLN 111 Ca 0.00 1.50 -0.31 0.00 0.05 0.00 0.00 55.36 56.60 2wnu s GLN 111 Cb 0.00 -3.34 -0.08 0.00 1.10 0.00 0.00 33.01 30.69 2wnu s GLN 111 CO 0.00 0.27 1.59 0.99 -0.55 0.00 0.00 175.29 177.58 2wnu s THR 112 N -0.31 3.08 -0.38 -0.34 2.01 -1.26 -0.64 115.64 117.80 2wnu s THR 112 Ca 0.46 0.59 -0.29 0.00 0.31 0.00 0.00 61.69 62.76 2wnu s THR 112 Cb -0.25 -3.38 0.02 0.00 0.01 0.00 0.00 72.50 68.90 2wnu s THR 112 CO 0.31 0.01 1.14 -0.63 -0.69 0.00 0.00 174.62 174.76 2wnu s ILE 113 N 2.28 4.33 -0.08 1.82 1.01 0.41 -4.90 121.20 126.07 2wnu s ILE 113 Ca 0.71 1.46 -0.22 0.00 0.00 0.00 0.00 60.65 62.61 2wnu s ILE 113 Cb -0.39 -4.45 -0.04 0.00 0.01 0.00 0.00 42.46 37.59 2wnu s ILE 113 CO 0.31 -0.69 0.64 -0.60 0.00 0.00 0.00 174.94 174.60 2wnu s ARG 114 N 4.07 4.41 -0.54 2.79 3.52 -1.26 -4.63 118.95 127.30 2wnu s ARG 114 Ca 0.48 0.76 -0.07 0.00 -0.13 0.00 0.00 55.73 56.77 2wnu s ARG 114 Cb -0.11 -3.44 0.14 0.00 -1.56 0.00 0.00 34.95 29.98 2wnu s ARG 114 CO 0.23 0.09 0.39 -0.06 -0.81 0.00 0.00 175.30 175.14 2wnu s PHE 115 N 0.75 3.49 -0.31 5.12 0.40 -1.26 -4.66 117.98 121.51 2wnu s PHE 115 Ca 0.34 -2.24 0.20 0.00 -0.60 0.00 0.00 56.93 54.63 2wnu s PHE 115 Cb -0.17 -3.40 0.21 0.00 0.51 0.00 0.00 43.02 40.17 2wnu s PHE 115 CO 0.16 -0.95 1.52 0.38 0.70 0.00 0.00 175.22 177.03 2wnu h ASP 116 N 7.89 0.00 -3.61 1.36 2.03 -1.51 -3.42 116.42 119.16 2wnu h ASP 116 Ca -0.10 0.00 -0.70 0.00 -0.73 0.00 0.00 57.03 55.50 2wnu h ASP 116 Cb 1.03 0.00 -0.25 0.00 -0.83 0.00 0.00 39.33 39.28 2wnu h ASP 116 CO 0.78 0.22 -0.55 -2.28 -1.03 0.00 0.00 179.24 176.38 2wnu s HIS 117 N -3.10 3.23 -0.18 4.15 5.04 -0.23 -4.87 115.29 119.32 2wnu s HIS 117 Ca 0.05 -0.99 -0.21 0.00 -1.54 0.00 0.00 55.06 52.37 2wnu s HIS 117 Cb 0.06 -2.38 -0.03 0.00 0.04 0.00 0.00 32.58 30.27 2wnu s HIS 117 CO 0.71 -0.63 0.65 0.54 -2.34 0.00 0.00 174.74 173.67 2wnu s VAL 118 N 1.53 5.01 -0.17 0.89 0.11 -1.26 0.14 120.40 126.65 2wnu s VAL 118 Ca 0.02 1.25 -0.16 0.00 -2.93 0.00 0.00 61.98 60.16 2wnu s VAL 118 Cb -0.19 -3.97 -0.22 0.00 -1.53 0.00 0.00 36.38 30.48 2wnu s VAL 118 CO 0.06 0.12 0.27 -0.38 -3.33 0.00 0.00 175.10 171.84 2wnu n ILE 119 N 4.57 1.63 -3.89 7.04 5.41 0.76 -4.97 119.36 129.91 2wnu n ILE 119 Ca -0.01 -0.27 -0.11 0.00 1.00 0.00 0.00 62.75 63.36 2wnu n ILE 119 Cb 0.50 -1.93 -0.13 0.00 -0.71 0.00 0.00 39.64 37.37 2wnu n ILE 119 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2wnu s THR 120 N -2.44 0.03 -0.43 1.39 2.01 -0.69 -4.94 115.64 110.56 2wnu s THR 120 Ca -0.26 -0.24 0.07 0.00 0.31 0.00 0.00 61.69 61.57 2wnu s THR 120 Cb 0.06 -0.11 0.34 0.00 0.01 0.00 0.00 72.50 72.81 2wnu s THR 120 CO 0.66 -0.13 1.21 -3.20 -0.69 0.00 0.00 174.62 172.47 2wnu n ASN 121 N 2.67 -2.16 -4.71 3.53 2.85 -1.23 -0.69 115.26 115.52 2wnu n ASN 121 Ca -0.15 -3.21 -0.42 0.00 -0.11 0.00 0.00 54.58 50.69 2wnu n ASN 121 Cb 0.59 1.58 -0.03 0.00 1.24 0.00 0.00 39.78 43.16 2wnu n ASN 121 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 2wnu s MET 122 N 0.24 4.21 0.00 1.20 -1.94 -0.10 -1.99 119.30 120.92 2wnu s MET 122 Ca 0.22 2.34 0.00 0.00 -1.71 0.00 0.00 55.69 56.54 2wnu s MET 122 Cb 0.33 -3.35 0.00 0.00 2.01 0.00 0.00 34.83 33.82 2wnu s MET 122 CO -0.07 -0.66 0.00 -1.71 -0.01 0.00 0.00 175.02 172.58 2wnu n ASN 123 N 4.68 0.00 -3.90 3.03 4.05 -1.26 -2.96 115.26 118.91 2wnu n ASN 123 Ca 0.15 0.00 -0.27 0.00 0.45 0.00 0.00 54.58 54.91 2wnu n ASN 123 Cb 0.39 0.00 0.01 0.00 1.23 0.00 0.00 39.78 41.41 2wnu n ASN 123 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2wnu n ASN 124 N 0.00 -2.19 0.00 1.20 5.15 -0.84 -4.89 115.26 113.69 2wnu n ASN 124 Ca 0.00 -0.89 0.12 0.00 -0.60 0.00 0.00 54.58 53.21 2wnu n ASN 124 Cb 0.00 -3.56 0.19 0.00 -0.53 0.00 0.00 39.78 35.88 2wnu n ASN 124 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2wnu n ASN 125 N -2.93 0.57 -4.81 1.20 3.02 -1.26 -4.82 115.26 106.23 2wnu n ASN 125 Ca -0.16 -0.33 -0.36 0.00 -0.03 0.00 0.00 54.58 53.70 2wnu n ASN 125 Cb 0.61 0.36 -0.07 0.00 -0.61 0.00 0.00 39.78 40.08 2wnu n ASN 125 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2wnu s TYR 126 N -3.01 3.50 -0.38 3.10 5.04 -1.26 -0.24 117.35 124.10 2wnu s TYR 126 Ca 0.10 0.42 -0.06 0.00 -2.44 0.00 0.00 57.07 55.09 2wnu s TYR 126 Cb 0.17 -2.00 0.07 0.00 0.35 0.00 0.00 41.96 40.55 2wnu s TYR 126 CO 0.73 0.56 0.17 -2.00 -1.34 0.00 0.00 175.55 173.67 2wnu s GLU 127 N -0.55 2.47 0.60 4.97 2.56 -0.06 -4.97 118.70 123.73 2wnu s GLU 127 Ca 0.12 -1.42 0.32 0.00 0.00 0.00 0.00 54.97 53.99 2wnu s GLU 127 Cb -0.12 -3.57 1.93 0.00 2.00 0.00 0.00 34.13 34.37 2wnu s GLU 127 CO 0.02 -0.85 2.28 -1.00 -0.56 0.00 0.00 175.26 175.15 2wnu h PRO 128 N 8.23 0.00 -0.21 4.30 0.13 -1.86 0.39 132.00 142.98 2wnu h PRO 128 Ca -0.21 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.77 2wnu h PRO 128 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2wnu h PRO 128 CO 0.67 0.00 -0.50 0.00 -0.23 0.00 0.00 178.00 177.94 2wnu h ARG 129 N 0.00 0.57 0.01 0.86 3.08 -1.89 -3.36 114.38 113.65 2wnu h ARG 129 Ca -0.00 -0.34 -0.39 0.00 0.07 0.00 0.00 59.98 59.32 2wnu h ARG 129 Cb 0.01 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.02 2wnu h ARG 129 CO 0.00 0.94 -2.44 -1.13 -1.07 0.00 0.00 179.97 176.28 2wnu n SER 130 N -3.98 1.99 0.00 7.04 3.41 -0.90 -5.01 113.62 116.17 2wnu n SER 130 Ca -0.03 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2wnu n SER 130 Cb 0.58 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2wnu n SER 130 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wnu n GLY 131 N 2.16 0.84 3.80 5.00 0.00 0.13 -4.33 105.19 112.80 2wnu n GLY 131 Ca -0.45 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 2wnu n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu s LYS 132 N -0.88 3.20 -0.12 1.61 1.02 -1.21 -4.58 119.74 118.78 2wnu s LYS 132 Ca 0.00 -0.34 -0.12 0.00 0.02 0.00 0.00 55.97 55.54 2wnu s LYS 132 Cb 0.00 -2.97 -0.05 0.00 -0.52 0.00 0.00 37.83 34.29 2wnu s LYS 132 CO 0.00 0.71 0.26 0.12 -0.92 0.00 0.00 175.35 175.51 2wnu s PHE 133 N -1.08 3.55 -0.19 3.18 5.36 -0.04 -0.88 117.98 127.89 2wnu s PHE 133 Ca 0.18 0.63 0.01 0.00 -0.96 0.00 0.00 56.93 56.80 2wnu s PHE 133 Cb -0.12 -2.20 0.03 0.00 -0.34 0.00 0.00 43.02 40.39 2wnu s PHE 133 CO 0.08 0.47 -0.16 0.99 -1.46 0.00 0.00 175.22 175.15 2wnu s THR 134 N -0.29 1.89 0.11 0.12 2.01 0.67 -0.73 115.64 119.43 2wnu s THR 134 Ca 0.17 -0.98 -0.31 0.00 0.31 0.00 0.00 61.69 60.88 2wnu s THR 134 Cb -0.13 -1.80 -0.09 0.00 0.01 0.00 0.00 72.50 70.48 2wnu s THR 134 CO 0.05 0.38 1.69 0.00 -0.69 0.00 0.00 174.62 176.05 2wnu n LYS 136 N 5.18 0.50 -3.52 0.00 5.02 -1.26 -0.66 118.16 123.41 2wnu n LYS 136 Ca 0.16 0.15 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 2wnu n LYS 136 Cb 0.39 -1.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.94 2wnu n LYS 136 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wnu s VAL 137 N -2.41 4.55 0.69 -0.18 1.01 -1.26 -4.71 120.40 118.09 2wnu s VAL 137 Ca -0.29 -1.35 -0.17 0.00 0.00 0.00 0.00 61.98 60.17 2wnu s VAL 137 Cb 0.09 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2wnu s VAL 137 CO 0.45 -0.57 0.85 -0.81 0.00 0.00 0.00 175.10 175.02 2wnu n PRO 138 N 5.01 0.55 -0.73 2.72 -0.04 -1.26 -4.87 135.00 136.38 2wnu n PRO 138 Ca -0.11 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2wnu n PRO 138 Cb 0.43 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.78 2wnu n PRO 138 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wnu n GLY 139 N 1.29 0.63 3.69 0.55 0.00 -0.06 -1.06 105.19 110.24 2wnu n GLY 139 Ca 0.13 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 2wnu n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wnu s LEU 140 N 0.00 4.19 0.06 0.99 1.43 0.12 0.22 118.68 125.70 2wnu s LEU 140 Ca 0.00 0.58 0.07 0.00 -1.03 0.00 0.00 54.13 53.75 2wnu s LEU 140 Cb 0.00 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 2wnu s LEU 140 CO 0.00 -0.04 -0.20 -0.31 0.23 0.00 0.00 176.35 176.03 2wnu s TYR 141 N 1.08 1.71 -0.18 0.29 1.51 0.14 0.64 117.35 122.53 2wnu s TYR 141 Ca 0.20 -0.39 -0.05 0.00 -1.01 0.00 0.00 57.07 55.83 2wnu s TYR 141 Cb -0.15 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 2wnu s TYR 141 CO 0.08 0.12 -0.01 -0.47 -1.11 0.00 0.00 175.55 174.16 2wnu s TYR 142 N -0.94 3.07 0.00 2.71 5.04 -0.19 -0.24 117.35 126.80 2wnu s TYR 142 Ca 0.06 -0.29 0.08 0.00 -2.44 0.00 0.00 57.07 54.48 2wnu s TYR 142 Cb -0.09 -2.02 -0.03 0.00 0.35 0.00 0.00 41.96 40.17 2wnu s TYR 142 CO 0.03 -0.08 -0.24 -0.06 -1.34 0.00 0.00 175.55 173.86 2wnu s PHE 143 N 0.59 2.41 0.12 4.97 0.40 0.42 -1.10 117.98 125.80 2wnu s PHE 143 Ca -0.01 -0.37 -0.19 0.00 -0.60 0.00 0.00 56.93 55.76 2wnu s PHE 143 Cb -0.14 -1.48 0.05 0.00 0.51 0.00 0.00 43.02 41.96 2wnu s PHE 143 CO 0.02 0.08 0.48 -0.08 0.70 0.00 0.00 175.22 176.42 2wnu s THR 144 N -0.73 0.04 0.11 0.64 -1.32 -0.35 -0.61 115.64 113.43 2wnu s THR 144 Ca 0.11 -0.34 -0.21 0.00 -1.21 0.00 0.00 61.69 60.04 2wnu s THR 144 Cb -0.10 -1.08 0.06 0.00 -1.51 0.00 0.00 72.50 69.87 2wnu s THR 144 CO 0.01 -0.19 0.53 -0.72 -2.21 0.00 0.00 174.62 172.05 2wnu s TYR 145 N -3.53 -0.43 -0.06 9.09 -0.85 -0.88 -1.03 117.35 119.65 2wnu s TYR 145 Ca 0.01 0.29 0.01 0.00 -0.52 0.00 0.00 57.07 56.86 2wnu s TYR 145 Cb 0.01 0.43 0.02 0.00 0.38 0.00 0.00 41.96 42.79 2wnu s TYR 145 CO -0.10 -0.75 -0.07 -1.01 -1.52 0.00 0.00 175.55 172.10 2wnu s HIS 146 N -3.33 1.05 -0.17 -3.49 3.76 -0.67 -2.84 115.29 109.61 2wnu s HIS 146 Ca -0.01 -0.38 0.01 0.00 -0.15 0.00 0.00 55.06 54.54 2wnu s HIS 146 Cb -0.00 -0.88 0.01 0.00 1.11 0.00 0.00 32.58 32.82 2wnu s HIS 146 CO -0.09 -0.28 -0.19 0.00 -0.85 0.00 0.00 174.74 173.33 2wnu s ALA 147 N 1.06 2.35 0.30 -1.40 0.00 0.18 -0.77 121.76 123.47 2wnu s ALA 147 Ca -0.08 -1.15 -0.27 0.00 0.00 0.00 0.00 51.96 50.46 2wnu s ALA 147 Cb -0.14 -1.15 -0.10 0.00 0.00 0.00 0.00 23.12 21.73 2wnu s ALA 147 CO -0.01 -0.20 0.94 -1.12 0.00 0.00 0.00 175.76 175.37 2wnu s SER 148 N 1.07 7.43 0.18 0.00 0.01 -1.20 -1.01 113.70 120.18 2wnu s SER 148 Ca -0.01 1.86 -0.13 0.00 1.31 0.00 0.00 55.95 58.99 2wnu s SER 148 Cb -0.14 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.51 2wnu s SER 148 CO -0.07 0.01 0.40 -0.55 0.41 0.00 0.00 173.24 173.43 2wnu s SER 149 N -1.48 -0.10 0.00 2.44 0.15 0.10 -0.75 113.70 114.06 2wnu s SER 149 Ca 0.47 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2wnu s SER 149 Cb -0.21 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2wnu s SER 149 CO 0.26 -0.97 0.00 -1.14 1.20 0.00 0.00 173.24 172.59 2wnu n ARG 150 N -0.27 5.02 0.00 5.44 0.63 -1.26 -1.18 116.66 125.03 2wnu n ARG 150 Ca -0.09 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.84 2wnu n ARG 150 Cb 0.63 -0.59 0.00 0.00 0.45 0.00 0.00 32.46 32.95 2wnu n ARG 150 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wnu n GLY 151 N 1.27 3.74 3.74 5.14 0.00 -1.26 -4.04 105.19 113.77 2wnu n GLY 151 Ca 0.00 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 2wnu n GLY 151 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wnu s ASN 152 N 1.82 6.95 -0.03 1.61 0.01 -1.23 -3.91 114.94 120.15 2wnu s ASN 152 Ca 0.00 2.37 -0.01 0.00 -0.71 0.00 0.00 52.86 54.51 2wnu s ASN 152 Cb 0.00 -2.61 0.03 0.00 0.41 0.00 0.00 41.25 39.08 2wnu s ASN 152 CO 0.00 -0.47 0.03 -0.22 -1.51 0.00 0.00 177.10 174.93 2wnu s LEU 153 N -0.29 0.79 -0.06 0.60 2.96 -1.13 -2.54 118.68 119.01 2wnu s LEU 153 Ca 0.55 0.04 0.04 0.00 -0.22 0.00 0.00 54.13 54.54 2wnu s LEU 153 Cb -0.35 -0.13 -0.00 0.00 0.50 0.00 0.00 46.19 46.21 2wnu s LEU 153 CO 0.39 -0.16 -0.19 0.00 -1.32 0.00 0.00 176.35 175.07 2wnu s VAL 155 N 0.15 1.76 -0.19 0.00 0.11 -0.22 -3.60 120.40 118.42 2wnu s VAL 155 Ca -0.08 -1.13 -0.08 0.00 -2.93 0.00 0.00 61.98 57.77 2wnu s VAL 155 Cb -0.13 -1.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.17 2wnu s VAL 155 CO 0.04 0.34 0.07 0.20 -3.33 0.00 0.00 175.10 172.41 2wnu s ASN 156 N -0.94 5.66 -0.22 3.54 0.01 -0.14 -0.89 114.94 121.95 2wnu s ASN 156 Ca 0.09 0.07 -0.22 0.00 -0.71 0.00 0.00 52.86 52.09 2wnu s ASN 156 Cb -0.09 -1.98 -0.02 0.00 0.41 0.00 0.00 41.25 39.58 2wnu s ASN 156 CO 0.01 0.16 0.69 -0.22 -1.51 0.00 0.00 177.10 176.23 2wnu s LEU 157 N 0.48 4.11 0.00 0.60 2.96 -0.53 -0.40 118.68 125.90 2wnu s LEU 157 Ca 0.04 0.87 0.04 0.00 -0.22 0.00 0.00 54.13 54.86 2wnu s LEU 157 Cb -0.13 -2.98 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 2wnu s LEU 157 CO 0.01 -0.37 -0.10 -0.04 -1.32 0.00 0.00 176.35 174.52 2wnu s MET 158 N 2.33 2.44 0.05 1.98 -1.94 0.61 -0.35 119.30 124.43 2wnu s MET 158 Ca 0.30 -0.78 0.02 0.00 -1.71 0.00 0.00 55.69 53.53 2wnu s MET 158 Cb -0.16 -2.42 -0.03 0.00 2.01 0.00 0.00 34.83 34.24 2wnu s MET 158 CO 0.09 0.59 -0.07 0.50 -0.01 0.00 0.00 175.02 176.12 2wnu s ARG 159 N -1.33 0.59 0.00 2.03 3.52 -0.48 -2.27 118.95 121.02 2wnu s ARG 159 Ca 0.16 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 54.87 2wnu s ARG 159 Cb -0.11 -0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.02 2wnu s ARG 159 CO 0.06 0.03 0.00 0.41 -0.81 0.00 0.00 175.30 174.99 2wnu n GLY 160 N 1.13 4.33 0.00 8.12 0.00 -0.92 -0.27 105.19 117.57 2wnu n GLY 160 Ca -0.20 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.71 2wnu n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu n ARG 161 N -1.73 0.00 -0.06 1.61 1.74 -1.26 -1.94 116.66 115.02 2wnu n ARG 161 Ca 0.00 0.33 -0.17 0.00 -0.77 0.00 0.00 57.85 57.24 2wnu n ARG 161 Cb 0.00 -0.93 -0.14 0.00 -1.02 0.00 0.00 32.46 30.38 2wnu n ARG 161 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2wnu n GLU 162 N -1.49 0.70 -4.18 5.56 -0.58 -1.26 -4.78 120.64 114.61 2wnu n GLU 162 Ca 0.00 0.20 -0.30 0.00 -0.42 0.00 0.00 57.16 56.63 2wnu n GLU 162 Cb 0.00 -1.64 -0.16 0.00 -0.57 0.00 0.00 31.44 29.07 2wnu n GLU 162 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2wnu s ARG 163 N -2.54 2.39 0.23 3.49 3.52 -1.26 -5.11 118.95 119.66 2wnu s ARG 163 Ca -0.22 -0.60 -0.30 0.00 -0.13 0.00 0.00 55.73 54.48 2wnu s ARG 163 Cb 0.08 -2.12 -0.09 0.00 -1.56 0.00 0.00 34.95 31.26 2wnu s ARG 163 CO 0.73 -0.18 1.02 0.00 -0.81 0.00 0.00 175.30 176.06 2wnu s ALA 164 N 1.30 3.36 0.02 6.12 0.00 -1.26 -4.55 121.76 126.75 2wnu s ALA 164 Ca 0.01 0.74 0.06 0.00 0.00 0.00 0.00 51.96 52.77 2wnu s ALA 164 Cb -0.13 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 2wnu s ALA 164 CO -0.08 0.00 -0.18 -0.65 0.00 0.00 0.00 175.76 174.85 2wnu s GLN 165 N -1.03 1.35 0.13 0.00 -0.21 0.63 -4.93 119.66 115.60 2wnu s GLN 165 Ca 0.44 -0.77 -0.30 0.00 0.02 0.00 0.00 55.36 54.75 2wnu s GLN 165 Cb -0.28 -1.37 -0.07 0.00 1.00 0.00 0.00 33.01 32.29 2wnu s GLN 165 CO 0.35 0.36 1.11 -1.59 -2.12 0.00 0.00 175.29 173.40 2wnu s LYS 166 N -0.81 4.56 -0.17 2.91 -2.85 -1.26 -1.38 119.74 120.74 2wnu s LYS 166 Ca 0.06 1.69 -0.17 0.00 -1.00 0.00 0.00 55.97 56.55 2wnu s LYS 166 Cb -0.08 -3.31 -0.14 0.00 -2.06 0.00 0.00 37.83 32.24 2wnu s LYS 166 CO 0.01 -0.00 0.16 0.28 0.10 0.00 0.00 175.35 175.89 2wnu h VAL 167 N 4.01 0.69 -4.36 1.79 2.07 -1.05 -3.48 116.25 115.92 2wnu h VAL 167 Ca -0.43 -1.75 -0.17 0.00 0.82 0.00 0.00 66.70 65.16 2wnu h VAL 167 Cb 1.21 1.54 -0.15 0.00 -1.52 0.00 0.00 31.29 32.37 2wnu h VAL 167 CO 0.75 0.23 -0.60 0.68 0.02 0.00 0.00 177.57 178.65 2wnu s VAL 168 N -2.23 0.09 -0.07 2.57 -7.23 -1.24 -5.03 120.40 107.27 2wnu s VAL 168 Ca -0.21 -1.84 0.04 0.00 -1.81 0.00 0.00 61.98 58.16 2wnu s VAL 168 Cb 0.03 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.94 2wnu s VAL 168 CO 0.44 -0.43 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.72 2wnu s THR 169 N -4.04 1.61 -0.19 5.32 2.01 -1.26 -1.45 115.64 117.64 2wnu s THR 169 Ca 0.23 -0.79 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 2wnu s THR 169 Cb 0.07 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.17 2wnu s THR 169 CO 0.02 0.46 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.98 2wnu s PHE 170 N 0.26 2.93 -0.07 4.92 0.08 -0.07 -4.96 117.98 121.07 2wnu s PHE 170 Ca -0.11 -0.79 0.04 0.00 0.12 0.00 0.00 56.93 56.19 2wnu s PHE 170 Cb -0.15 -2.03 -0.01 0.00 -0.57 0.00 0.00 43.02 40.26 2wnu s PHE 170 CO 0.05 -0.41 -0.21 0.00 -0.10 0.00 0.00 175.22 174.55 2wnu s ASP 172 N -0.18 1.23 0.17 0.00 3.68 -0.40 -5.01 116.67 116.15 2wnu s ASP 172 Ca -0.02 -0.03 -0.06 0.00 2.13 0.00 0.00 52.55 54.57 2wnu s ASP 172 Cb -0.14 0.27 -0.06 0.00 -1.45 0.00 0.00 42.92 41.55 2wnu s ASP 172 CO 0.03 -0.30 0.42 -0.31 0.13 0.00 0.00 175.17 175.15 2wnu s TYR 173 N 2.29 3.46 -0.10 -5.34 1.51 -1.26 -2.82 117.35 115.10 2wnu s TYR 173 Ca 0.04 0.62 -0.06 0.00 -1.01 0.00 0.00 57.07 56.67 2wnu s TYR 173 Cb -0.14 -2.05 0.04 0.00 -0.11 0.00 0.00 41.96 39.69 2wnu s TYR 173 CO -0.09 0.39 0.24 0.00 -1.11 0.00 0.00 175.55 174.97 2wnu s ALA 174 N -1.71 -0.54 -0.33 3.71 0.00 -1.25 -4.94 121.76 116.70 2wnu s ALA 174 Ca 0.42 0.91 -0.05 0.00 0.00 0.00 0.00 51.96 53.25 2wnu s ALA 174 Cb -0.12 -0.57 0.05 0.00 0.00 0.00 0.00 23.12 22.48 2wnu s ALA 174 CO 0.24 -0.18 0.08 -0.47 0.00 0.00 0.00 175.76 175.43 2wnu s TYR 175 N 1.05 3.28 -1.31 0.00 5.04 -1.26 -3.56 117.35 120.58 2wnu s TYR 175 Ca -0.08 -1.63 -0.09 0.00 -2.44 0.00 0.00 57.07 52.84 2wnu s TYR 175 Cb -0.09 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 39.93 2wnu s TYR 175 CO -0.07 -0.77 0.55 -1.71 -1.34 0.00 0.00 175.55 172.21 2wnu n ASN 176 N 4.74 -2.10 -3.61 4.32 5.15 -1.26 -4.96 115.26 117.54 2wnu n ASN 176 Ca -0.12 -1.03 -0.07 0.00 -0.60 0.00 0.00 54.58 52.76 2wnu n ASN 176 Cb 0.44 -3.06 -0.01 0.00 -0.53 0.00 0.00 39.78 36.62 2wnu n ASN 176 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2wnu s THR 177 N -3.78 0.00 -0.09 -0.44 -1.32 -1.26 -5.15 115.64 103.61 2wnu s THR 177 Ca 0.18 -0.98 -0.01 0.00 -1.21 0.00 0.00 61.69 59.68 2wnu s THR 177 Cb -0.07 -2.24 -0.03 0.00 -1.51 0.00 0.00 72.50 68.65 2wnu s THR 177 CO 0.89 0.00 -0.03 -0.36 -2.21 0.00 0.00 174.62 172.91 2wnu s PHE 178 N -3.45 3.06 0.11 9.09 0.40 -1.26 -4.29 117.98 121.64 2wnu s PHE 178 Ca 0.12 0.08 0.03 0.00 -0.60 0.00 0.00 56.93 56.56 2wnu s PHE 178 Cb -0.05 -1.78 -0.04 0.00 0.51 0.00 0.00 43.02 41.66 2wnu s PHE 178 CO 0.08 0.36 -0.09 1.14 0.70 0.00 0.00 175.22 177.41 2wnu s GLN 179 N -0.71 0.87 -0.06 0.44 -2.07 -0.32 -5.00 119.66 112.81 2wnu s GLN 179 Ca 0.11 -1.27 0.03 0.00 -1.82 0.00 0.00 55.36 52.42 2wnu s GLN 179 Cb -0.11 -0.41 0.00 0.00 -1.09 0.00 0.00 33.01 31.39 2wnu s GLN 179 CO 0.02 0.04 -0.16 0.54 -1.32 0.00 0.00 175.29 174.41 2wnu s VAL 180 N -3.03 1.40 0.30 3.63 0.11 -1.26 -0.73 120.40 120.83 2wnu s VAL 180 Ca 0.09 -0.67 0.04 0.00 -2.93 0.00 0.00 61.98 58.52 2wnu s VAL 180 Cb 0.01 -1.22 -0.06 0.00 -1.53 0.00 0.00 36.38 33.58 2wnu s VAL 180 CO -0.02 0.41 0.05 0.28 -3.33 0.00 0.00 175.10 172.49 2wnu s THR 181 N 0.30 1.15 0.03 5.04 -1.32 -0.18 -4.95 115.64 115.71 2wnu s THR 181 Ca -0.10 -2.01 -0.13 0.00 -1.21 0.00 0.00 61.69 58.24 2wnu s THR 181 Cb -0.14 -2.70 0.02 0.00 -1.51 0.00 0.00 72.50 68.17 2wnu s THR 181 CO 0.04 -0.06 0.27 0.28 -2.21 0.00 0.00 174.62 172.93 2wnu s THR 182 N -3.33 0.09 0.13 5.08 -1.32 -1.26 -0.65 115.64 114.37 2wnu s THR 182 Ca 0.35 -0.71 -0.07 0.00 -1.21 0.00 0.00 61.69 60.05 2wnu s THR 182 Cb 0.08 -0.88 -0.01 0.00 -1.51 0.00 0.00 72.50 70.18 2wnu s THR 182 CO 0.14 -0.39 0.20 -0.83 -2.21 0.00 0.00 174.62 171.53 2wnu s GLY 183 N -1.96 0.44 -0.10 6.08 0.00 -1.13 -5.02 107.32 105.63 2wnu s GLY 183 Ca -0.06 -0.91 -0.30 0.00 0.00 0.00 0.00 44.72 43.44 2wnu s GLY 183 CO -0.02 -0.93 0.90 -0.32 0.00 0.00 0.00 173.10 172.72 2wnu s GLY 184 N -2.95 -0.38 -0.28 0.20 0.00 -1.26 -2.08 107.32 100.57 2wnu s GLY 184 Ca 0.14 1.67 -0.20 0.00 0.00 0.00 0.00 44.72 46.33 2wnu s GLY 184 CO -0.04 0.88 0.81 -0.29 0.00 0.00 0.00 173.10 174.46 2wnu s MET 185 N -1.51 0.65 -0.20 2.90 1.75 0.22 -4.98 119.30 118.12 2wnu s MET 185 Ca -0.03 0.96 -0.22 0.00 -1.25 0.00 0.00 55.69 55.15 2wnu s MET 185 Cb -0.00 0.22 -0.02 0.00 2.84 0.00 0.00 34.83 37.86 2wnu s MET 185 CO 0.01 -0.11 0.69 0.08 -0.65 0.00 0.00 175.02 175.05 2wnu s VAL 186 N 1.02 4.97 -0.04 10.11 1.01 -1.26 -0.43 120.40 135.77 2wnu s VAL 186 Ca -0.05 1.31 0.05 0.00 0.00 0.00 0.00 61.98 63.29 2wnu s VAL 186 Cb -0.05 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2wnu s VAL 186 CO -0.11 0.06 -0.18 -0.76 0.00 0.00 0.00 175.10 174.11 2wnu s LEU 187 N 2.12 1.95 -0.04 3.92 1.43 0.66 -4.98 118.68 123.74 2wnu s LEU 187 Ca 0.31 -0.37 -0.27 0.00 -1.03 0.00 0.00 54.13 52.76 2wnu s LEU 187 Cb -0.16 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.00 2wnu s LEU 187 CO 0.10 0.17 0.88 -0.75 0.23 0.00 0.00 176.35 176.98 2wnu s LYS 188 N -0.03 4.50 -0.03 1.70 2.20 -1.26 -0.68 119.74 126.14 2wnu s LYS 188 Ca -0.03 1.21 0.06 0.00 -0.36 0.00 0.00 55.97 56.85 2wnu s LYS 188 Cb -0.11 -3.47 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2wnu s LYS 188 CO 0.02 -0.04 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.24 2wnu s LEU 189 N 1.05 2.03 0.19 5.43 1.02 0.13 -4.97 118.68 123.57 2wnu s LEU 189 Ca 0.46 -0.42 0.00 0.00 0.02 0.00 0.00 54.13 54.19 2wnu s LEU 189 Cb -0.19 -1.18 -0.04 0.00 0.02 0.00 0.00 46.19 44.79 2wnu s LEU 189 CO 0.23 0.25 0.37 -1.61 0.02 0.00 0.00 176.35 175.61 2wnu s GLU 190 N -0.33 3.50 0.23 1.70 2.02 -1.26 -0.88 118.70 123.68 2wnu s GLU 190 Ca 0.03 -0.42 -0.32 0.00 0.02 0.00 0.00 54.97 54.29 2wnu s GLU 190 Cb -0.11 -2.87 -0.13 0.00 0.10 0.00 0.00 34.13 31.13 2wnu s GLU 190 CO 0.01 0.42 1.49 0.94 0.02 0.00 0.00 175.26 178.14 2wnu n GLN 191 N -0.69 2.21 0.00 1.61 7.27 -1.26 -2.02 117.38 124.49 2wnu n GLN 191 Ca -0.05 0.79 0.00 0.00 0.07 0.00 0.00 57.00 57.81 2wnu n GLN 191 Cb 0.54 -2.50 0.00 0.00 2.41 0.00 0.00 30.24 30.69 2wnu n GLN 191 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wnu n GLY 192 N 2.49 2.00 3.73 1.69 0.00 0.17 -5.01 105.19 110.25 2wnu n GLY 192 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2wnu n GLY 192 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wnu s GLU 193 N -0.68 4.63 0.10 1.61 2.02 -0.86 -4.50 118.70 121.03 2wnu s GLU 193 Ca 0.00 1.59 0.04 0.00 0.02 0.00 0.00 54.97 56.62 2wnu s GLU 193 Cb 0.00 -3.33 -0.04 0.00 0.10 0.00 0.00 34.13 30.86 2wnu s GLU 193 CO 0.00 0.12 0.06 0.54 0.02 0.00 0.00 175.26 176.00 2wnu s ASN 194 N 0.04 5.33 -0.06 -0.19 2.20 -0.82 -0.53 114.94 120.90 2wnu s ASN 194 Ca 0.49 -0.10 0.03 0.00 -0.94 0.00 0.00 52.86 52.33 2wnu s ASN 194 Cb -0.26 -1.36 0.01 0.00 -2.00 0.00 0.00 41.25 37.63 2wnu s ASN 194 CO 0.32 0.15 -0.14 -0.69 -2.94 0.00 0.00 177.10 173.80 2wnu s VAL 195 N -1.45 1.24 0.25 3.54 1.01 0.09 -2.18 120.40 122.91 2wnu s VAL 195 Ca 0.28 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.54 2wnu s VAL 195 Cb -0.11 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 35.16 2wnu s VAL 195 CO 0.21 0.38 0.58 0.72 0.00 0.00 0.00 175.10 176.98 2wnu s PHE 196 N 0.51 0.07 -0.12 5.22 -0.12 -0.96 -0.86 117.98 121.72 2wnu s PHE 196 Ca -0.13 -0.46 -0.06 0.00 -0.05 0.00 0.00 56.93 56.23 2wnu s PHE 196 Cb -0.15 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 2wnu s PHE 196 CO 0.04 -1.07 0.09 -0.51 -0.05 0.00 0.00 175.22 173.72 2wnu s LEU 197 N -2.95 4.09 -0.08 -1.99 1.43 -1.26 -0.29 118.68 117.63 2wnu s LEU 197 Ca 0.16 0.33 0.03 0.00 -1.03 0.00 0.00 54.13 53.61 2wnu s LEU 197 Cb -0.03 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.22 2wnu s LEU 197 CO 0.06 0.37 -0.16 -1.58 0.23 0.00 0.00 176.35 175.27 2wnu s GLN 198 N -0.78 2.15 0.80 1.70 0.74 0.46 -0.44 119.66 124.29 2wnu s GLN 198 Ca 0.13 -0.56 -0.10 0.00 0.05 0.00 0.00 55.36 54.88 2wnu s GLN 198 Cb -0.12 -1.73 0.08 0.00 1.10 0.00 0.00 33.01 32.34 2wnu s GLN 198 CO 0.03 0.05 1.10 0.00 -0.55 0.00 0.00 175.29 175.92 2wnu s ALA 199 N 0.66 2.08 0.00 1.58 0.00 0.19 -0.97 121.76 125.30 2wnu s ALA 199 Ca -0.14 0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.15 2wnu s ALA 199 Cb -0.16 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.65 2wnu s ALA 199 CO 0.04 -1.99 0.00 0.25 0.00 0.00 0.00 175.76 174.06 2wnu n THR 200 N -3.68 0.00 -0.21 0.00 -2.24 -1.24 -1.46 114.28 105.45 2wnu n THR 200 Ca 0.10 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.89 2wnu n THR 200 Cb 0.53 0.00 0.11 0.00 -2.10 0.00 0.00 70.33 68.86 2wnu n THR 200 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2wnu h ASP 201 N 0.00 -0.23 -2.97 3.42 3.58 -1.94 -3.34 116.42 114.94 2wnu h ASP 201 Ca 0.00 0.15 -0.66 0.00 0.42 0.00 0.00 57.03 56.94 2wnu h ASP 201 Cb 0.00 0.25 -0.16 0.00 1.72 0.00 0.00 39.33 41.14 2wnu h ASP 201 CO 0.00 -0.10 0.32 -0.54 -2.88 0.00 0.00 179.24 176.05 2wnu s LYS 202 N -6.14 3.14 -0.10 0.28 3.01 -1.26 -4.88 119.74 113.79 2wnu s LYS 202 Ca -0.13 -0.84 0.14 0.00 -1.01 0.00 0.00 55.97 54.12 2wnu s LYS 202 Cb 0.19 -4.17 0.27 0.00 -1.01 0.00 0.00 37.83 33.11 2wnu s LYS 202 CO 0.74 -1.54 1.14 0.27 0.51 0.00 0.00 175.35 176.47 2wnu n ASN 203 N 6.96 1.47 -4.55 2.83 6.94 -1.20 -1.79 115.26 125.93 2wnu n ASN 203 Ca -0.05 -2.89 -0.40 0.00 -0.02 0.00 0.00 54.58 51.23 2wnu n ASN 203 Cb 0.45 -0.38 -0.03 0.00 -2.36 0.00 0.00 39.78 37.46 2wnu n ASN 203 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2wnu s SER 204 N -2.42 5.62 -0.03 0.53 0.15 -1.05 -4.49 113.70 112.01 2wnu s SER 204 Ca 0.26 0.13 -0.00 0.00 0.70 0.00 0.00 55.95 57.05 2wnu s SER 204 Cb 0.25 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 62.05 2wnu s SER 204 CO -0.03 -2.15 0.02 -0.22 1.20 0.00 0.00 173.24 172.07 2wnu s LEU 205 N 7.79 0.98 -0.08 3.45 0.20 -1.26 -4.29 118.68 125.46 2wnu s LEU 205 Ca 0.57 0.02 -0.04 0.00 0.69 0.00 0.00 54.13 55.37 2wnu s LEU 205 Cb -0.11 -0.15 -0.04 0.00 -0.43 0.00 0.00 46.19 45.46 2wnu s LEU 205 CO 0.20 -0.13 0.07 -0.76 -0.29 0.00 0.00 176.35 175.43 2wnu s LEU 206 N 1.21 3.95 -0.32 -0.68 1.43 0.07 -4.97 118.68 119.37 2wnu s LEU 206 Ca -0.07 0.27 -0.02 0.00 -1.03 0.00 0.00 54.13 53.28 2wnu s LEU 206 Cb -0.13 -2.00 0.12 0.00 0.03 0.00 0.00 46.19 44.21 2wnu s LEU 206 CO -0.03 0.37 0.19 -0.83 0.23 0.00 0.00 176.35 176.29 2wnu s GLY 207 N -1.09 0.56 0.15 -3.19 0.00 -1.25 -3.67 107.32 98.82 2wnu s GLY 207 Ca 0.16 -1.36 -0.24 0.00 0.00 0.00 0.00 44.72 43.28 2wnu s GLY 207 CO 0.05 2.17 0.75 -3.16 0.00 0.00 0.00 173.10 172.90 2wnu s MET 208 N 1.63 1.27 -0.04 2.90 0.23 -0.96 -4.38 119.30 119.96 2wnu s MET 208 Ca 0.13 -0.57 -0.34 0.00 -1.03 0.00 0.00 55.69 53.89 2wnu s MET 208 Cb -0.19 0.52 -0.12 0.00 -1.53 0.00 0.00 34.83 33.51 2wnu s MET 208 CO -0.18 -0.57 1.85 -1.91 -2.03 0.00 0.00 175.02 172.18 2wnu n GLU 209 N -0.38 2.24 -0.10 3.16 2.13 -1.26 -1.34 120.64 125.09 2wnu n GLU 209 Ca -0.11 0.82 0.00 0.00 0.66 0.00 0.00 57.16 58.53 2wnu n GLU 209 Cb 0.62 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.67 2wnu n GLU 209 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wnu n GLY 210 N 4.29 0.63 2.75 8.31 0.00 -1.26 -4.94 105.19 114.97 2wnu n GLY 210 Ca 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.19 2wnu n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wnu n ALA 211 N -1.46 -1.93 -2.14 4.61 0.00 -0.45 -5.16 120.51 113.98 2wnu n ALA 211 Ca 0.00 -1.04 -0.32 0.00 0.00 0.00 0.00 53.44 52.08 2wnu n ALA 211 Cb 0.00 -1.61 -0.06 0.00 0.00 0.00 0.00 19.45 17.79 2wnu n ALA 211 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wnu s ASN 212 N 0.20 6.75 -0.16 0.00 -0.87 -1.19 -2.26 114.94 117.41 2wnu s ASN 212 Ca 0.30 1.26 0.02 0.00 -1.57 0.00 0.00 52.86 52.87 2wnu s ASN 212 Cb 0.07 -2.37 0.02 0.00 -0.02 0.00 0.00 41.25 38.95 2wnu s ASN 212 CO -0.10 -0.22 -0.20 -0.44 -2.57 0.00 0.00 177.10 173.56 2wnu s SER 213 N -2.36 3.09 0.11 -1.22 0.01 -1.24 -3.27 113.70 108.82 2wnu s SER 213 Ca 0.54 -0.62 0.10 0.00 1.31 0.00 0.00 55.95 57.27 2wnu s SER 213 Cb -0.10 -1.45 -0.04 0.00 0.21 0.00 0.00 66.02 64.65 2wnu s SER 213 CO 0.19 0.03 -0.24 -0.51 0.41 0.00 0.00 173.24 173.11 2wnu s ILE 214 N 1.11 2.02 -0.09 1.44 2.07 0.05 -1.51 121.20 126.29 2wnu s ILE 214 Ca 0.00 -1.63 -0.00 0.00 -1.41 0.00 0.00 60.65 57.61 2wnu s ILE 214 Cb -0.14 -1.80 0.02 0.00 0.13 0.00 0.00 42.46 40.68 2wnu s ILE 214 CO -0.09 0.06 -0.05 0.12 -1.91 0.00 0.00 174.94 173.07 2wnu s PHE 215 N -1.06 1.15 0.12 3.50 5.36 -0.10 -1.67 117.98 125.28 2wnu s PHE 215 Ca 0.11 -0.48 0.04 0.00 -0.96 0.00 0.00 56.93 55.64 2wnu s PHE 215 Cb -0.10 -1.02 -0.04 0.00 -0.34 0.00 0.00 43.02 41.52 2wnu s PHE 215 CO 0.05 -0.40 -0.11 -1.12 -1.46 0.00 0.00 175.22 172.19 2wnu s SER 216 N 1.59 1.69 -0.00 6.13 0.01 -0.20 -0.73 113.70 122.18 2wnu s SER 216 Ca 0.01 -0.90 -0.28 0.00 1.31 0.00 0.00 55.95 56.08 2wnu s SER 216 Cb -0.13 -0.01 0.08 0.00 0.21 0.00 0.00 66.02 66.17 2wnu s SER 216 CO -0.05 -0.28 0.72 -0.83 0.41 0.00 0.00 173.24 173.21 2wnu s GLY 217 N -2.78 -0.54 0.02 3.44 0.00 0.01 -1.22 107.32 106.25 2wnu s GLY 217 Ca 0.11 1.15 -0.20 0.00 0.00 0.00 0.00 44.72 45.78 2wnu s GLY 217 CO 0.01 0.69 0.45 -0.11 0.00 0.00 0.00 173.10 174.13 2wnu s PHE 218 N -2.07 -0.33 0.09 1.90 -0.12 -0.26 -1.00 117.98 116.20 2wnu s PHE 218 Ca -0.05 0.40 -0.31 0.00 -0.05 0.00 0.00 56.93 56.92 2wnu s PHE 218 Cb -0.00 0.24 -0.07 0.00 -0.63 0.00 0.00 43.02 42.56 2wnu s PHE 218 CO 0.01 -0.55 1.27 -1.17 -0.05 0.00 0.00 175.22 174.72 2wnu s LEU 219 N -1.75 4.38 -0.17 -1.99 2.96 -0.52 -1.02 118.68 120.57 2wnu s LEU 219 Ca -0.08 2.14 -0.13 0.00 -0.22 0.00 0.00 54.13 55.84 2wnu s LEU 219 Cb -0.02 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.03 2wnu s LEU 219 CO 0.01 -0.53 -0.20 0.18 -1.32 0.00 0.00 176.35 174.49 2wnu n LEU 220 N 3.82 1.86 -3.78 -0.68 4.77 0.21 -4.92 117.00 118.28 2wnu n LEU 220 Ca 0.09 0.50 -0.13 0.00 -0.03 0.00 0.00 56.01 56.45 2wnu n LEU 220 Cb 0.45 -0.84 -0.13 0.00 -2.33 0.00 0.00 43.42 40.57 2wnu n LEU 220 CO 0.57 -0.26 -0.19 -0.36 -1.33 0.00 0.00 177.39 175.81 2wnu s PHE 221 N -2.47 -0.20 0.61 -1.77 0.40 -1.07 -5.00 117.98 108.47 2wnu s PHE 221 Ca -0.22 0.51 -0.10 0.00 -0.60 0.00 0.00 56.93 56.52 2wnu s PHE 221 Cb 0.04 0.01 -0.04 0.00 0.51 0.00 0.00 43.02 43.54 2wnu s PHE 221 CO 0.34 -0.14 1.01 -1.25 0.70 0.00 0.00 175.22 175.88 2wnu s PRO 222 N 0.66 3.54 0.00 0.24 0.05 -1.26 0.15 135.00 138.39 2wnu s PRO 222 Ca -0.05 0.67 0.00 0.00 0.05 0.00 0.00 61.00 61.68 2wnu s PRO 222 Cb -0.06 -2.11 0.00 0.00 0.05 0.00 0.00 34.50 32.38 2wnu s PRO 222 CO -0.03 -0.57 0.00 -0.25 0.05 0.00 0.00 177.00 176.20 2wnu n ASP 223 N -2.72 0.00 0.00 6.66 8.00 -0.22 -4.84 116.55 123.43 2wnu n ASP 223 Ca 0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.56 2wnu n ASP 223 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 2wnu n ASP 223 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61