#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnu n PHE 90 N 0.00 1.93 -4.58 2.13 3.72 -1.26 -4.93 117.46 114.47 2wnu n PHE 90 Ca 0.00 -0.72 -0.26 0.00 -0.05 0.00 0.00 57.45 56.42 2wnu n PHE 90 Cb 0.00 -0.46 -0.11 0.00 -0.94 0.00 0.00 39.48 37.97 2wnu n PHE 90 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 2wnu s GLN 91 N -2.63 1.89 -0.11 -1.08 -1.52 -1.26 -5.00 119.66 109.95 2wnu s GLN 91 Ca 0.54 -2.06 -0.04 0.00 -1.95 0.00 0.00 55.36 51.84 2wnu s GLN 91 Cb 0.40 -1.45 0.05 0.00 -0.22 0.00 0.00 33.01 31.80 2wnu s GLN 91 CO 0.17 -0.09 0.22 0.45 -0.25 0.00 0.00 175.29 175.80 2wnu s SER 92 N -3.66 0.29 -0.04 5.90 0.15 -1.26 -4.92 113.70 110.16 2wnu s SER 92 Ca 0.35 0.49 -0.15 0.00 0.70 0.00 0.00 55.95 57.34 2wnu s SER 92 Cb 0.10 0.48 0.03 0.00 -1.71 0.00 0.00 66.02 64.92 2wnu s SER 92 CO 0.17 -0.22 0.33 0.54 1.20 0.00 0.00 173.24 175.27 2wnu s VAL 93 N 2.04 0.05 -0.12 4.45 0.11 -1.26 -0.20 120.40 125.47 2wnu s VAL 93 Ca -0.01 -0.38 -0.29 0.00 -2.93 0.00 0.00 61.98 58.37 2wnu s VAL 93 Cb -0.12 -0.61 0.07 0.00 -1.53 0.00 0.00 36.38 34.20 2wnu s VAL 93 CO -0.08 -0.21 0.71 0.72 -3.33 0.00 0.00 175.10 172.92 2wnu s PHE 94 N -1.06 -0.68 -0.10 1.54 -0.12 -0.42 -4.08 117.98 113.06 2wnu s PHE 94 Ca -0.11 1.34 -0.02 0.00 -0.05 0.00 0.00 56.93 58.09 2wnu s PHE 94 Cb -0.05 0.37 0.04 0.00 -0.63 0.00 0.00 43.02 42.75 2wnu s PHE 94 CO 0.04 -0.52 0.02 0.99 -0.05 0.00 0.00 175.22 175.69 2wnu s THR 95 N -0.70 0.34 0.17 -4.49 2.01 0.07 -1.57 115.64 111.47 2wnu s THR 95 Ca -0.07 0.01 0.10 0.00 0.31 0.00 0.00 61.69 62.04 2wnu s THR 95 Cb -0.02 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 2wnu s THR 95 CO 0.07 0.14 -0.21 0.68 -0.69 0.00 0.00 174.62 174.61 2wnu s VAL 96 N 1.98 2.03 0.14 3.82 -7.23 -0.06 -1.05 120.40 120.03 2wnu s VAL 96 Ca 0.04 -1.94 0.02 0.00 -1.81 0.00 0.00 61.98 58.29 2wnu s VAL 96 Cb -0.13 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 2wnu s VAL 96 CO -0.06 -0.21 -0.03 0.28 -0.31 0.00 0.00 175.10 174.76 2wnu s THR 97 N -1.83 0.73 -0.50 5.32 -1.32 0.19 -1.20 115.64 117.03 2wnu s THR 97 Ca 0.17 -1.97 -0.06 0.00 -1.21 0.00 0.00 61.69 58.62 2wnu s THR 97 Cb -0.07 -1.92 0.13 0.00 -1.51 0.00 0.00 72.50 69.13 2wnu s THR 97 CO 0.08 -0.66 0.34 -0.60 -2.21 0.00 0.00 174.62 171.57 2wnu s ARG 98 N -3.87 2.40 -0.97 7.08 3.52 -0.87 -1.74 118.95 124.50 2wnu s ARG 98 Ca 0.18 -1.95 -0.11 0.00 -0.13 0.00 0.00 55.73 53.72 2wnu s ARG 98 Cb 0.05 -3.81 0.25 0.00 -1.56 0.00 0.00 34.95 29.88 2wnu s ARG 98 CO 0.00 -1.16 0.94 -1.14 -0.81 0.00 0.00 175.30 173.13 2wnu s GLN 99 N 0.98 3.90 -0.10 5.12 0.74 -1.26 -4.65 119.66 124.39 2wnu s GLN 99 Ca 0.09 -2.86 -0.30 0.00 0.05 0.00 0.00 55.36 52.34 2wnu s GLN 99 Cb -0.23 -4.49 0.10 0.00 1.10 0.00 0.00 33.01 29.50 2wnu s GLN 99 CO -0.03 -1.26 0.87 -0.08 -0.55 0.00 0.00 175.29 174.24 2wnu s THR 100 N -0.58 0.00 -0.98 -0.34 -1.32 -1.26 -4.98 115.64 106.18 2wnu s THR 100 Ca 0.24 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.95 2wnu s THR 100 Cb -0.10 -1.00 -0.16 0.00 -1.51 0.00 0.00 72.50 69.73 2wnu s THR 100 CO -0.08 0.00 1.05 1.57 -2.21 0.00 0.00 174.62 174.95 2wnu n HIS 101 N 0.64 0.01 -3.12 9.09 -0.00 -1.26 -4.85 115.22 115.72 2wnu n HIS 101 Ca -0.13 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.66 2wnu n HIS 101 Cb 0.58 -0.09 -0.05 0.00 -0.12 0.00 0.00 29.99 30.31 2wnu n HIS 101 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 2wnu s GLN 102 N -3.01 4.40 0.78 1.57 -0.21 -1.26 -4.83 119.66 117.10 2wnu s GLN 102 Ca 0.09 0.75 -0.12 0.00 0.02 0.00 0.00 55.36 56.10 2wnu s GLN 102 Cb 0.16 -3.45 0.06 0.00 1.00 0.00 0.00 33.01 30.78 2wnu s GLN 102 CO 0.82 0.07 1.12 -1.25 -2.12 0.00 0.00 175.29 173.92 2wnu s PRO 103 N 0.82 2.23 0.83 2.91 0.04 -1.26 -5.00 135.00 135.58 2wnu s PRO 103 Ca 0.34 0.44 -0.13 0.00 0.04 0.00 0.00 61.00 61.69 2wnu s PRO 103 Cb -0.17 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.48 2wnu s PRO 103 CO 0.16 -1.47 0.97 -2.30 0.04 0.00 0.00 177.00 174.39 2wnu n PRO 104 N -3.30 0.05 -2.01 0.56 -0.02 -1.26 -4.98 135.00 124.05 2wnu n PRO 104 Ca 0.07 0.09 -0.37 0.00 -2.02 0.00 0.00 63.50 61.27 2wnu n PRO 104 Cb 0.58 -2.25 0.03 0.00 -0.02 0.00 0.00 33.50 31.84 2wnu n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wnu s ALA 105 N -2.19 2.73 0.63 3.55 0.00 -1.26 -4.86 121.76 120.36 2wnu s ALA 105 Ca 0.69 1.09 -0.18 0.00 0.00 0.00 0.00 51.96 53.56 2wnu s ALA 105 Cb -0.28 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 2wnu s ALA 105 CO 0.55 -1.10 1.26 -2.14 0.00 0.00 0.00 175.76 174.34 2wnu s PRO 106 N -3.04 2.68 -1.39 0.00 0.02 -1.26 -3.46 135.00 128.55 2wnu s PRO 106 Ca 0.72 1.98 -0.03 0.00 0.02 0.00 0.00 61.00 63.69 2wnu s PRO 106 Cb -0.33 -1.87 0.02 0.00 0.02 0.00 0.00 34.50 32.34 2wnu s PRO 106 CO 0.38 -1.48 0.67 0.09 -0.33 0.00 0.00 177.00 176.33 2wnu n ASN 107 N -1.83 -1.59 -4.13 2.53 3.02 0.88 -4.98 115.26 109.17 2wnu n ASN 107 Ca 0.15 -0.88 -0.09 0.00 -0.03 0.00 0.00 54.58 53.74 2wnu n ASN 107 Cb 0.49 -3.68 -0.10 0.00 -0.61 0.00 0.00 39.78 35.87 2wnu n ASN 107 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wnu s SER 108 N -4.15 0.53 0.28 6.41 1.04 -1.16 -4.97 113.70 111.69 2wnu s SER 108 Ca 0.14 -1.08 -0.29 0.00 0.48 0.00 0.00 55.95 55.20 2wnu s SER 108 Cb -0.07 0.22 -0.10 0.00 0.10 0.00 0.00 66.02 66.17 2wnu s SER 108 CO 0.84 -0.63 1.31 -0.22 0.98 0.00 0.00 173.24 175.52 2wnu s LEU 109 N -2.99 4.43 -0.27 2.42 0.20 -1.26 -1.56 118.68 119.64 2wnu s LEU 109 Ca 0.14 2.58 -0.20 0.00 0.69 0.00 0.00 54.13 57.34 2wnu s LEU 109 Cb 0.07 -3.63 -0.02 0.00 -0.43 0.00 0.00 46.19 42.19 2wnu s LEU 109 CO -0.05 -0.52 0.62 -0.63 -0.29 0.00 0.00 176.35 175.49 2wnu s ILE 110 N -0.67 4.97 -0.27 6.68 1.01 -0.38 -4.90 121.20 127.64 2wnu s ILE 110 Ca 0.52 1.02 -0.15 0.00 0.00 0.00 0.00 60.65 62.04 2wnu s ILE 110 Cb -0.38 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.09 2wnu s ILE 110 CO 0.47 -0.03 0.37 -0.13 0.00 0.00 0.00 174.94 175.61 2wnu s ARG 111 N 2.54 4.02 -0.45 2.79 0.52 -1.26 -4.69 118.95 122.42 2wnu s ARG 111 Ca 0.26 0.04 -0.18 0.00 -0.52 0.00 0.00 55.73 55.32 2wnu s ARG 111 Cb -0.15 -3.65 0.04 0.00 0.52 0.00 0.00 34.95 31.71 2wnu s ARG 111 CO 0.10 -0.26 0.50 -0.06 0.02 0.00 0.00 175.30 175.60 2wnu s PHE 112 N 2.01 3.14 -0.65 -0.53 0.40 -1.26 -4.83 117.98 116.26 2wnu s PHE 112 Ca 0.15 -0.47 0.24 0.00 -0.60 0.00 0.00 56.93 56.26 2wnu s PHE 112 Cb -0.16 -3.14 0.41 0.00 0.51 0.00 0.00 43.02 40.65 2wnu s PHE 112 CO 0.10 -0.82 1.39 -2.95 0.70 0.00 0.00 175.22 173.64 2wnu h ASN 113 N 8.82 0.00 -3.73 1.36 -1.07 -1.75 -3.43 115.58 115.78 2wnu h ASN 113 Ca -0.27 -0.17 -0.68 0.00 0.07 0.00 0.00 56.30 55.25 2wnu h ASN 113 Cb 1.10 0.00 -0.30 0.00 -2.07 0.00 0.00 38.32 37.05 2wnu h ASN 113 CO 0.86 0.09 -0.85 0.00 0.07 0.00 0.00 177.43 177.60 2wnu s ALA 114 N -3.16 2.30 -0.18 4.14 0.00 -0.71 -4.95 121.76 119.20 2wnu s ALA 114 Ca 0.07 -0.99 -0.11 0.00 0.00 0.00 0.00 51.96 50.93 2wnu s ALA 114 Cb 0.13 -0.84 -0.05 0.00 0.00 0.00 0.00 23.12 22.37 2wnu s ALA 114 CO 0.70 0.37 0.17 0.08 0.00 0.00 0.00 175.76 177.08 2wnu s VAL 115 N -0.01 5.39 -0.23 0.00 1.01 -1.26 0.54 120.40 125.85 2wnu s VAL 115 Ca -0.07 0.28 -0.11 0.00 0.00 0.00 0.00 61.98 62.07 2wnu s VAL 115 Cb -0.15 -3.50 -0.18 0.00 0.00 0.00 0.00 36.38 32.55 2wnu s VAL 115 CO 0.05 0.45 -0.04 0.18 0.00 0.00 0.00 175.10 175.73 2wnu n LEU 116 N 3.37 2.28 -3.74 3.92 4.77 -0.21 -4.95 117.00 122.44 2wnu n LEU 116 Ca -0.15 0.23 -0.13 0.00 -0.03 0.00 0.00 56.01 55.93 2wnu n LEU 116 Cb 0.52 -0.94 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 2wnu n LEU 116 CO 0.37 0.63 0.06 0.28 -1.33 0.00 0.00 177.39 177.40 2wnu s THR 117 N -2.48 0.01 -0.37 -5.08 -1.32 -0.95 -4.98 115.64 100.46 2wnu s THR 117 Ca -0.32 -0.05 0.05 0.00 -1.21 0.00 0.00 61.69 60.15 2wnu s THR 117 Cb 0.10 -0.56 0.31 0.00 -1.51 0.00 0.00 72.50 70.84 2wnu s THR 117 CO 0.59 -0.03 1.28 -3.20 -2.21 0.00 0.00 174.62 171.05 2wnu n ASN 118 N 2.66 -1.64 0.24 8.08 5.15 -1.26 -0.75 115.26 127.74 2wnu n ASN 118 Ca -0.14 -2.51 0.11 0.00 -0.60 0.00 0.00 54.58 51.43 2wnu n ASN 118 Cb 0.57 1.41 0.61 0.00 -0.53 0.00 0.00 39.78 41.84 2wnu n ASN 118 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2wnu h PRO 119 N 2.38 0.00 -0.01 1.20 0.13 -2.00 -2.26 132.00 131.44 2wnu h PRO 119 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2wnu h PRO 119 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wnu h PRO 119 CO 0.03 0.18 -0.57 1.04 -0.23 0.00 0.00 178.00 178.45 2wnu n GLN 120 N -3.63 0.66 -2.23 0.86 3.00 -1.26 -4.96 117.38 109.83 2wnu n GLN 120 Ca -0.01 -0.50 -0.15 0.00 -0.01 0.00 0.00 57.00 56.33 2wnu n GLN 120 Cb 0.31 -1.49 -0.01 0.00 0.00 0.00 0.00 30.24 29.05 2wnu n GLN 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2wnu n GLY 121 N 1.43 -0.13 0.26 1.08 0.00 -0.85 -4.93 105.19 102.05 2wnu n GLY 121 Ca 0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2wnu n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wnu h ASP 122 N 0.00 0.81 -3.36 1.61 3.32 -1.87 -3.40 116.42 113.53 2wnu h ASP 122 Ca -0.35 -0.31 -0.56 0.00 0.02 0.00 0.00 57.03 55.83 2wnu h ASP 122 Cb 1.24 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 40.52 2wnu h ASP 122 CO 0.41 1.03 0.08 -0.47 -1.72 0.00 0.00 179.24 178.57 2wnu s TYR 123 N -4.54 3.60 -0.27 4.55 5.04 -1.26 -1.21 117.35 123.25 2wnu s TYR 123 Ca -0.09 1.26 -0.07 0.00 -2.44 0.00 0.00 57.07 55.72 2wnu s TYR 123 Cb 0.13 -2.78 -0.01 0.00 0.35 0.00 0.00 41.96 39.64 2wnu s TYR 123 CO 0.84 0.13 0.08 0.34 -1.34 0.00 0.00 175.55 175.60 2wnu s ASP 124 N 0.63 5.14 0.40 4.32 -1.08 0.44 -4.96 116.67 121.56 2wnu s ASP 124 Ca 0.37 -0.45 0.22 0.00 -0.52 0.00 0.00 52.55 52.16 2wnu s ASP 124 Cb -0.18 -1.91 0.72 0.00 -1.46 0.00 0.00 42.92 40.09 2wnu s ASP 124 CO 0.18 -0.12 1.74 0.71 0.52 0.00 0.00 175.17 178.21 2wnu h THR 125 N 5.69 0.64 0.00 1.71 1.35 -1.87 0.24 112.91 120.67 2wnu h THR 125 Ca -0.35 -1.36 -0.08 0.00 -0.55 0.00 0.00 66.41 64.07 2wnu h THR 125 Cb 1.15 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 69.47 2wnu h THR 125 CO 0.60 0.28 -0.36 0.77 -0.25 0.00 0.00 175.52 176.56 2wnu h SER 126 N 0.00 0.00 0.00 5.36 4.64 -1.93 -3.34 113.55 118.28 2wnu h SER 126 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2wnu h SER 126 Cb 0.89 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 2wnu h SER 126 CO 0.04 0.36 -1.49 0.35 -0.87 0.00 0.00 176.83 175.21 2wnu n THR 127 N -3.31 0.12 -0.80 2.95 -2.24 -1.14 -5.02 114.28 104.83 2wnu n THR 127 Ca 0.01 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2wnu n THR 127 Cb 0.59 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 2wnu n THR 127 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wnu n GLY 128 N 2.02 0.57 3.39 3.38 0.00 0.84 -4.96 105.19 110.42 2wnu n GLY 128 Ca -0.04 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 2wnu n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu s LYS 129 N -0.60 2.18 0.04 1.61 1.02 -1.13 -4.67 119.74 118.18 2wnu s LYS 129 Ca 0.00 -0.89 -0.24 0.00 0.02 0.00 0.00 55.97 54.85 2wnu s LYS 129 Cb 0.00 -2.15 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 2wnu s LYS 129 CO 0.00 0.57 0.75 0.12 -0.92 0.00 0.00 175.35 175.86 2wnu s PHE 130 N -0.72 3.73 -0.12 3.18 5.36 -0.03 -0.42 117.98 128.96 2wnu s PHE 130 Ca 0.11 1.44 0.01 0.00 -0.96 0.00 0.00 56.93 57.54 2wnu s PHE 130 Cb -0.10 -2.80 0.02 0.00 -0.34 0.00 0.00 43.02 39.80 2wnu s PHE 130 CO 0.01 0.28 -0.15 0.99 -1.46 0.00 0.00 175.22 174.89 2wnu s THR 131 N -0.08 1.50 0.00 0.12 2.01 -0.35 -0.60 115.64 118.25 2wnu s THR 131 Ca 0.38 -0.63 -0.30 0.00 0.31 0.00 0.00 61.69 61.44 2wnu s THR 131 Cb -0.20 -1.38 -0.07 0.00 0.01 0.00 0.00 72.50 70.86 2wnu s THR 131 CO 0.22 0.44 1.69 0.00 -0.69 0.00 0.00 174.62 176.28 2wnu n LYS 133 N 6.61 0.65 -3.75 0.00 5.02 -1.26 0.36 118.16 125.79 2wnu n LYS 133 Ca 0.17 0.25 -0.38 0.00 -2.02 0.00 0.00 58.31 56.33 2wnu n LYS 133 Cb 0.42 -1.58 -0.12 0.00 -0.02 0.00 0.00 35.03 33.72 2wnu n LYS 133 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wnu s VAL 134 N -2.51 3.93 0.63 -0.18 1.01 -1.26 -4.82 120.40 117.20 2wnu s VAL 134 Ca -0.33 -0.84 -0.16 0.00 0.00 0.00 0.00 61.98 60.66 2wnu s VAL 134 Cb 0.10 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 2wnu s VAL 134 CO 0.61 -0.02 1.10 -2.16 0.00 0.00 0.00 175.10 174.63 2wnu s PRO 135 N 1.47 3.00 0.00 2.72 0.04 -1.26 -4.94 135.00 136.03 2wnu s PRO 135 Ca 0.01 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.41 2wnu s PRO 135 Cb -0.18 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2wnu s PRO 135 CO 0.03 -1.09 0.00 0.41 0.04 0.00 0.00 177.00 176.39 2wnu n GLY 136 N -0.58 0.84 3.68 0.56 0.00 -0.30 -1.84 105.19 107.55 2wnu n GLY 136 Ca 0.10 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 2wnu n GLY 136 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wnu s LEU 137 N 0.00 4.19 0.05 0.99 0.20 -0.26 -0.46 118.68 123.39 2wnu s LEU 137 Ca 0.00 0.93 0.08 0.00 0.69 0.00 0.00 54.13 55.83 2wnu s LEU 137 Cb 0.00 -2.94 -0.03 0.00 -0.43 0.00 0.00 46.19 42.79 2wnu s LEU 137 CO 0.00 -0.23 -0.21 -0.31 -0.29 0.00 0.00 176.35 175.31 2wnu s TYR 138 N 1.60 2.47 -0.16 5.38 1.51 0.84 -0.46 117.35 128.53 2wnu s TYR 138 Ca 0.31 -0.31 -0.05 0.00 -1.01 0.00 0.00 57.07 56.00 2wnu s TYR 138 Cb -0.16 -1.43 -0.03 0.00 -0.11 0.00 0.00 41.96 40.22 2wnu s TYR 138 CO 0.12 0.22 0.02 -0.47 -1.11 0.00 0.00 175.55 174.32 2wnu s TYR 139 N -0.89 3.15 -0.05 2.71 5.04 -0.58 -0.78 117.35 125.95 2wnu s TYR 139 Ca 0.14 -0.07 0.05 0.00 -2.44 0.00 0.00 57.07 54.75 2wnu s TYR 139 Cb -0.10 -2.00 -0.01 0.00 0.35 0.00 0.00 41.96 40.20 2wnu s TYR 139 CO 0.04 0.11 -0.21 -0.06 -1.34 0.00 0.00 175.55 174.10 2wnu s PHE 140 N 0.23 2.05 -0.08 4.97 0.40 -0.30 -1.20 117.98 124.05 2wnu s PHE 140 Ca 0.01 -0.61 -0.15 0.00 -0.60 0.00 0.00 56.93 55.58 2wnu s PHE 140 Cb -0.13 -1.36 0.03 0.00 0.51 0.00 0.00 43.02 42.07 2wnu s PHE 140 CO 0.02 -0.20 0.37 0.54 0.70 0.00 0.00 175.22 176.65 2wnu s VAL 141 N -0.04 0.02 0.08 -0.44 0.11 -0.50 -0.66 120.40 118.98 2wnu s VAL 141 Ca -0.04 -0.21 0.01 0.00 -2.93 0.00 0.00 61.98 58.82 2wnu s VAL 141 Cb -0.13 -0.60 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 2wnu s VAL 141 CO 0.03 -0.11 -0.06 -0.72 -3.33 0.00 0.00 175.10 170.90 2wnu s TYR 142 N -0.55 0.77 -0.16 1.54 -0.85 -0.67 -0.54 117.35 116.90 2wnu s TYR 142 Ca -0.07 -0.82 -0.02 0.00 -0.52 0.00 0.00 57.07 55.64 2wnu s TYR 142 Cb -0.04 -0.46 0.05 0.00 0.38 0.00 0.00 41.96 41.89 2wnu s TYR 142 CO 0.03 -0.16 0.02 -1.01 -1.52 0.00 0.00 175.55 172.90 2wnu s HIS 143 N -3.03 1.01 -0.19 -3.49 3.76 0.17 -2.80 115.29 110.72 2wnu s HIS 143 Ca 0.05 -0.71 -0.01 0.00 -0.15 0.00 0.00 55.06 54.24 2wnu s HIS 143 Cb 0.01 -1.00 0.01 0.00 1.11 0.00 0.00 32.58 32.71 2wnu s HIS 143 CO -0.04 -0.54 -0.15 0.00 -0.85 0.00 0.00 174.74 173.16 2wnu s ALA 144 N 1.86 2.49 0.11 -1.40 0.00 0.12 -0.68 121.76 124.26 2wnu s ALA 144 Ca 0.01 -1.21 -0.27 0.00 0.00 0.00 0.00 51.96 50.49 2wnu s ALA 144 Cb -0.16 -1.35 -0.07 0.00 0.00 0.00 0.00 23.12 21.55 2wnu s ALA 144 CO -0.07 -0.38 0.85 -1.12 0.00 0.00 0.00 175.76 175.03 2wnu s SER 145 N 1.35 7.39 -0.07 0.00 0.01 -1.18 0.10 113.70 121.30 2wnu s SER 145 Ca 0.05 1.66 -0.15 0.00 1.31 0.00 0.00 55.95 58.81 2wnu s SER 145 Cb -0.13 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.60 2wnu s SER 145 CO -0.10 0.05 0.37 -1.38 0.41 0.00 0.00 173.24 172.59 2wnu s HIS 146 N -0.41 -0.32 -0.95 2.43 -3.43 -0.69 -3.75 115.29 108.17 2wnu s HIS 146 Ca 0.41 0.65 0.09 0.00 -0.80 0.00 0.00 55.06 55.41 2wnu s HIS 146 Cb -0.23 0.14 0.17 0.00 -1.43 0.00 0.00 32.58 31.23 2wnu s HIS 146 CO 0.27 -0.33 1.01 0.25 -2.00 0.00 0.00 174.74 173.94 2wnu n THR 147 N 1.92 0.51 -4.08 -5.38 -2.24 -0.99 -1.73 114.28 102.29 2wnu n THR 147 Ca -0.18 -0.76 -0.12 0.00 -2.27 0.00 0.00 64.05 60.73 2wnu n THR 147 Cb 0.57 0.84 -0.04 0.00 -2.10 0.00 0.00 70.33 69.59 2wnu n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wnu n ALA 148 N 0.43 0.24 -1.66 6.98 0.00 -1.26 -2.28 120.51 122.95 2wnu n ALA 148 Ca 0.08 -1.19 -0.43 0.00 0.00 0.00 0.00 53.44 51.90 2wnu n ALA 148 Cb 0.32 0.96 -0.01 0.00 0.00 0.00 0.00 19.45 20.72 2wnu n ALA 148 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wnu n ASN 149 N -2.04 2.25 -3.67 0.00 3.02 -1.25 -4.42 115.26 109.16 2wnu n ASN 149 Ca 0.03 1.20 -0.13 0.00 -0.03 0.00 0.00 54.58 55.65 2wnu n ASN 149 Cb 0.39 -1.42 -0.13 0.00 -0.61 0.00 0.00 39.78 38.01 2wnu n ASN 149 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wnu s LEU 150 N -0.50 -0.30 -0.16 3.41 2.96 -0.03 -2.59 118.68 121.48 2wnu s LEU 150 Ca 0.57 0.63 -0.02 0.00 -0.22 0.00 0.00 54.13 55.08 2wnu s LEU 150 Cb -0.62 0.76 -0.02 0.00 0.50 0.00 0.00 46.19 46.82 2wnu s LEU 150 CO 0.61 -0.24 -0.08 0.00 -1.32 0.00 0.00 176.35 175.33 2wnu s VAL 152 N 0.64 3.09 -0.10 0.00 1.01 0.11 -3.88 120.40 121.27 2wnu s VAL 152 Ca -0.04 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2wnu s VAL 152 Cb -0.15 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 2wnu s VAL 152 CO 0.02 0.52 -0.12 -0.76 0.00 0.00 0.00 175.10 174.76 2wnu s LEU 153 N 0.39 2.80 -0.22 3.92 1.02 0.20 -1.58 118.68 125.21 2wnu s LEU 153 Ca -0.10 -0.25 -0.11 0.00 0.02 0.00 0.00 54.13 53.69 2wnu s LEU 153 Cb -0.16 -1.61 -0.05 0.00 0.02 0.00 0.00 46.19 44.39 2wnu s LEU 153 CO 0.05 0.23 0.18 -0.22 0.02 0.00 0.00 176.35 176.61 2wnu s LEU 154 N -0.03 4.16 -0.12 1.79 0.20 -0.20 -0.28 118.68 124.20 2wnu s LEU 154 Ca -0.03 0.22 -0.02 0.00 0.69 0.00 0.00 54.13 54.99 2wnu s LEU 154 Cb -0.14 -2.15 -0.03 0.00 -0.43 0.00 0.00 46.19 43.44 2wnu s LEU 154 CO 0.04 0.10 -0.03 -0.31 -0.29 0.00 0.00 176.35 175.86 2wnu s TYR 155 N 0.77 3.05 -0.19 5.38 1.51 0.11 -0.16 117.35 127.82 2wnu s TYR 155 Ca 0.09 -0.09 0.01 0.00 -1.01 0.00 0.00 57.07 56.08 2wnu s TYR 155 Cb -0.13 -1.87 0.03 0.00 -0.11 0.00 0.00 41.96 39.89 2wnu s TYR 155 CO 0.02 0.18 -0.14 0.50 -1.11 0.00 0.00 175.55 175.01 2wnu s ARG 156 N -0.21 2.36 -1.51 -0.62 3.52 0.20 -1.44 118.95 121.26 2wnu s ARG 156 Ca 0.04 -0.83 -0.11 0.00 -0.13 0.00 0.00 55.73 54.70 2wnu s ARG 156 Cb -0.13 -2.43 0.07 0.00 -1.56 0.00 0.00 34.95 30.91 2wnu s ARG 156 CO 0.02 -0.34 0.87 0.43 -0.81 0.00 0.00 175.30 175.47 2wnu n SER 157 N 4.66 -3.67 0.00 -2.12 7.64 0.44 -1.35 113.62 119.22 2wnu n SER 157 Ca -0.17 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 58.88 2wnu n SER 157 Cb 0.48 -3.72 0.00 0.00 -1.01 0.00 0.00 64.21 59.96 2wnu n SER 157 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wnu n GLY 158 N -1.66 0.92 3.29 0.23 0.00 -1.26 -5.03 105.19 101.68 2wnu n GLY 158 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2wnu n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wnu s VAL 159 N -2.62 3.01 -0.00 1.61 1.01 -0.46 -5.09 120.40 117.86 2wnu s VAL 159 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 2wnu s VAL 159 Cb 0.00 -2.32 -0.08 0.00 0.00 0.00 0.00 36.38 33.98 2wnu s VAL 159 CO 0.00 0.48 1.95 -0.75 0.00 0.00 0.00 175.10 176.77 2wnu s LYS 160 N 1.06 4.05 -0.22 2.72 2.20 -1.26 -0.62 119.74 127.66 2wnu s LYS 160 Ca -0.00 2.49 -0.08 0.00 -0.36 0.00 0.00 55.97 58.02 2wnu s LYS 160 Cb -0.15 -4.16 -0.18 0.00 -1.51 0.00 0.00 37.83 31.83 2wnu s LYS 160 CO -0.02 -1.05 -0.05 0.28 -0.36 0.00 0.00 175.35 174.15 2wnu n VAL 161 N 5.76 1.58 -3.65 4.02 0.31 0.77 -4.95 118.33 122.17 2wnu n VAL 161 Ca 0.20 -0.45 -0.15 0.00 -0.01 0.00 0.00 64.34 63.93 2wnu n VAL 161 Cb 0.42 -1.72 -0.08 0.00 -0.91 0.00 0.00 33.84 31.55 2wnu n VAL 161 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2wnu s VAL 162 N -2.50 0.02 -0.02 2.52 -7.23 -1.23 -5.01 120.40 106.95 2wnu s VAL 162 Ca -0.32 -0.16 0.03 0.00 -1.81 0.00 0.00 61.98 59.73 2wnu s VAL 162 Cb 0.09 -0.80 -0.00 0.00 0.56 0.00 0.00 36.38 36.24 2wnu s VAL 162 CO 0.61 -0.09 -0.12 -0.89 -0.31 0.00 0.00 175.10 174.30 2wnu s THR 163 N -0.79 1.01 -0.05 5.32 2.01 -1.26 -1.04 115.64 120.84 2wnu s THR 163 Ca -0.09 -0.51 -0.00 0.00 0.31 0.00 0.00 61.69 61.40 2wnu s THR 163 Cb -0.03 -0.87 0.03 0.00 0.01 0.00 0.00 72.50 71.64 2wnu s THR 163 CO 0.05 0.30 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.91 2wnu s PHE 164 N -0.02 0.60 -0.06 4.92 0.40 -0.61 -4.99 117.98 118.22 2wnu s PHE 164 Ca -0.00 -0.13 0.05 0.00 -0.60 0.00 0.00 56.93 56.25 2wnu s PHE 164 Cb -0.08 -0.67 -0.02 0.00 0.51 0.00 0.00 43.02 42.76 2wnu s PHE 164 CO 0.00 -0.24 -0.21 0.00 0.70 0.00 0.00 175.22 175.47 2wnu s GLY 166 N -0.35 1.28 -0.15 0.00 0.00 0.13 -4.96 107.32 103.25 2wnu s GLY 166 Ca 0.03 -0.97 -0.06 0.00 0.00 0.00 0.00 44.72 43.71 2wnu s GLY 166 CO 0.02 -0.47 0.04 0.30 0.00 0.00 0.00 173.10 172.99 2wnu s HIS 167 N 0.10 3.22 0.04 1.90 3.76 -1.26 -0.85 115.29 122.19 2wnu s HIS 167 Ca -0.11 0.06 -0.14 0.00 -0.15 0.00 0.00 55.06 54.72 2wnu s HIS 167 Cb -0.16 -1.99 0.02 0.00 1.11 0.00 0.00 32.58 31.57 2wnu s HIS 167 CO 0.06 0.22 0.30 -0.08 -0.85 0.00 0.00 174.74 174.39 2wnu s THR 168 N 0.02 0.08 -0.24 1.30 -1.32 -1.26 -4.96 115.64 109.25 2wnu s THR 168 Ca 0.04 -0.68 0.01 0.00 -1.21 0.00 0.00 61.69 59.85 2wnu s THR 168 Cb -0.12 -0.93 0.06 0.00 -1.51 0.00 0.00 72.50 70.00 2wnu s THR 168 CO 0.01 -0.37 -0.03 -0.55 -2.21 0.00 0.00 174.62 171.47 2wnu s SER 169 N -2.04 3.83 0.00 8.08 0.15 -1.26 -3.76 113.70 118.70 2wnu s SER 169 Ca -0.05 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.37 2wnu s SER 169 Cb -0.01 -1.13 0.00 0.00 -1.71 0.00 0.00 66.02 63.17 2wnu s SER 169 CO -0.03 -0.26 0.00 0.29 1.20 0.00 0.00 173.24 174.44 2wnu n LYS 170 N 4.69 0.00 -1.95 5.44 5.02 -0.97 -4.91 118.16 125.48 2wnu n LYS 170 Ca -0.10 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.89 2wnu n LYS 170 Cb 0.44 -0.02 0.03 0.00 -0.02 0.00 0.00 35.03 35.46 2wnu n LYS 170 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wnu s THR 171 N 0.00 3.94 -0.09 -0.18 -4.23 -1.26 -4.82 115.64 109.00 2wnu s THR 171 Ca 0.00 0.56 -0.15 0.00 -1.18 0.00 0.00 61.69 60.92 2wnu s THR 171 Cb 0.00 -3.61 -0.05 0.00 1.34 0.00 0.00 72.50 70.18 2wnu s THR 171 CO 0.00 -0.79 0.38 0.21 -0.54 0.00 0.00 174.62 173.88 2wnu s ASN 172 N -4.29 6.64 0.32 3.99 2.47 -1.26 -4.37 114.94 118.44 2wnu s ASN 172 Ca 0.56 0.76 0.03 0.00 0.42 0.00 0.00 52.86 54.63 2wnu s ASN 172 Cb -0.11 -2.23 -0.04 0.00 -1.45 0.00 0.00 41.25 37.42 2wnu s ASN 172 CO 0.52 0.17 0.12 -1.10 -3.72 0.00 0.00 177.10 173.09 2wnu s GLN 173 N -0.14 1.65 -0.16 0.43 -0.21 -0.70 -4.99 119.66 115.54 2wnu s GLN 173 Ca 0.22 -1.95 0.01 0.00 0.02 0.00 0.00 55.36 53.66 2wnu s GLN 173 Cb -0.15 -0.40 0.01 0.00 1.00 0.00 0.00 33.01 33.47 2wnu s GLN 173 CO 0.09 -0.38 -0.19 0.08 -2.12 0.00 0.00 175.29 172.78 2wnu s VAL 174 N -3.48 2.30 -0.17 1.09 1.01 -1.26 -1.70 120.40 118.19 2wnu s VAL 174 Ca 0.33 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.26 2wnu s VAL 174 Cb 0.06 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2wnu s VAL 174 CO 0.16 0.53 0.43 0.21 0.00 0.00 0.00 175.10 176.42 2wnu s ASN 175 N 0.98 6.54 0.05 3.32 3.84 0.12 -4.89 114.94 124.89 2wnu s ASN 175 Ca -0.03 0.64 0.06 0.00 0.21 0.00 0.00 52.86 53.74 2wnu s ASN 175 Cb -0.15 -2.25 -0.03 0.00 -0.55 0.00 0.00 41.25 38.28 2wnu s ASN 175 CO -0.04 -0.04 -0.17 -0.55 -2.79 0.00 0.00 177.10 173.50 2wnu s SER 176 N 0.83 2.08 0.25 -4.21 0.15 -1.26 0.12 113.70 111.65 2wnu s SER 176 Ca 0.22 -0.53 -0.20 0.00 0.70 0.00 0.00 55.95 56.13 2wnu s SER 176 Cb -0.15 -0.14 0.03 0.00 -1.71 0.00 0.00 66.02 64.05 2wnu s SER 176 CO 0.08 0.07 0.65 -0.83 1.20 0.00 0.00 173.24 174.41 2wnu s GLY 177 N -1.34 -0.09 0.00 9.45 0.00 -1.12 -4.91 107.32 109.31 2wnu s GLY 177 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.51 2wnu s GLY 177 CO 0.02 -0.14 0.00 0.61 0.00 0.00 0.00 173.10 173.59 2wnu n GLY 178 N -0.43 1.11 3.58 0.20 0.00 -1.26 -1.67 105.19 106.72 2wnu n GLY 178 Ca -0.06 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.10 2wnu n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wnu s VAL 179 N -2.00 0.00 -0.23 1.61 0.11 0.17 -4.99 120.40 115.07 2wnu s VAL 179 Ca 0.00 0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 58.95 2wnu s VAL 179 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2wnu s VAL 179 CO 0.00 0.00 0.13 -0.76 -3.33 0.00 0.00 175.10 171.14 2wnu s LEU 180 N -0.94 3.99 -0.03 2.54 1.43 -1.26 -1.15 118.68 123.27 2wnu s LEU 180 Ca -0.03 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.17 2wnu s LEU 180 Cb -0.01 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.16 2wnu s LEU 180 CO 0.02 0.08 -0.08 -0.76 0.23 0.00 0.00 176.35 175.84 2wnu s LEU 181 N 0.94 1.73 -0.43 1.79 1.43 0.04 -4.95 118.68 119.22 2wnu s LEU 181 Ca 0.06 -0.17 -0.20 0.00 -1.03 0.00 0.00 54.13 52.79 2wnu s LEU 181 Cb -0.13 -0.52 0.02 0.00 0.03 0.00 0.00 46.19 45.59 2wnu s LEU 181 CO 0.03 0.05 0.62 -0.60 0.23 0.00 0.00 176.35 176.68 2wnu s ARG 182 N 0.30 3.27 0.05 1.70 3.52 -1.26 -0.11 118.95 126.41 2wnu s ARG 182 Ca -0.05 -0.40 0.03 0.00 -0.13 0.00 0.00 55.73 55.18 2wnu s ARG 182 Cb -0.09 -3.95 -0.04 0.00 -1.56 0.00 0.00 34.95 29.31 2wnu s ARG 182 CO 0.00 -0.99 0.02 -0.51 -0.81 0.00 0.00 175.30 173.01 2wnu s LEU 183 N 2.75 3.55 0.30 -0.88 1.43 0.40 -4.92 118.68 121.30 2wnu s LEU 183 Ca 0.22 -0.07 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 2wnu s LEU 183 Cb -0.14 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.88 2wnu s LEU 183 CO 0.18 0.22 0.46 -1.10 0.23 0.00 0.00 176.35 176.34 2wnu s GLN 184 N -2.01 3.34 0.18 1.70 -0.21 -1.26 -1.15 119.66 120.25 2wnu s GLN 184 Ca 0.24 -0.69 -0.32 0.00 0.02 0.00 0.00 55.36 54.61 2wnu s GLN 184 Cb -0.12 -2.79 -0.11 0.00 1.00 0.00 0.00 33.01 30.99 2wnu s GLN 184 CO 0.16 0.22 1.74 0.08 -2.12 0.00 0.00 175.29 175.36 2wnu s VAL 185 N -2.15 2.20 0.00 1.09 1.01 -1.26 -2.28 120.40 119.00 2wnu s VAL 185 Ca 0.39 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.43 2wnu s VAL 185 Cb -0.09 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2wnu s VAL 185 CO 0.32 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.03 2wnu n GLY 186 N 4.02 0.99 3.73 4.51 0.00 0.16 -5.00 105.19 113.61 2wnu n GLY 186 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2wnu n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wnu s GLU 187 N -0.46 4.42 -0.08 1.61 2.02 -0.97 -4.68 118.70 120.57 2wnu s GLU 187 Ca 0.00 1.97 -0.12 0.00 0.02 0.00 0.00 54.97 56.84 2wnu s GLU 187 Cb 0.00 -3.22 -0.05 0.00 0.10 0.00 0.00 34.13 30.96 2wnu s GLU 187 CO 0.00 -0.20 0.30 -1.21 0.02 0.00 0.00 175.26 174.17 2wnu s GLU 188 N -0.02 3.90 -0.06 1.61 2.02 -1.26 -0.96 118.70 123.93 2wnu s GLU 188 Ca 0.56 0.17 0.03 0.00 0.02 0.00 0.00 54.97 55.74 2wnu s GLU 188 Cb -0.35 -3.28 0.01 0.00 0.10 0.00 0.00 34.13 30.61 2wnu s GLU 188 CO 0.37 0.56 -0.13 0.08 0.02 0.00 0.00 175.26 176.16 2wnu s VAL 189 N -0.55 1.18 0.13 2.63 1.01 0.23 -0.42 120.40 124.61 2wnu s VAL 189 Ca 0.19 -0.52 -0.10 0.00 0.00 0.00 0.00 61.98 61.55 2wnu s VAL 189 Cb -0.14 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2wnu s VAL 189 CO 0.08 0.36 0.27 -1.66 0.00 0.00 0.00 175.10 174.15 2wnu s TRP 190 N 0.52 0.17 0.07 5.22 -2.14 -0.52 -0.85 118.94 121.42 2wnu s TRP 190 Ca -0.12 -0.56 -0.00 0.00 2.66 0.00 0.00 56.10 58.08 2wnu s TRP 190 Cb -0.15 0.01 -0.04 0.00 -3.10 0.00 0.00 33.47 30.19 2wnu s TRP 190 CO 0.03 -0.65 0.23 -0.51 -2.66 0.00 0.00 176.95 173.40 2wnu s LEU 191 N -2.89 4.35 0.15 -4.66 1.43 -1.26 0.08 118.68 115.87 2wnu s LEU 191 Ca 0.09 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.47 2wnu s LEU 191 Cb 0.04 -2.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.23 2wnu s LEU 191 CO -0.07 0.15 0.10 0.00 0.23 0.00 0.00 176.35 176.76 2wnu s ALA 192 N -1.54 0.81 0.28 4.21 0.00 0.62 -1.25 121.76 124.89 2wnu s ALA 192 Ca 0.36 -1.45 0.10 0.00 0.00 0.00 0.00 51.96 50.97 2wnu s ALA 192 Cb -0.13 0.98 -0.05 0.00 0.00 0.00 0.00 23.12 23.92 2wnu s ALA 192 CO 0.28 -0.53 -0.07 0.14 0.00 0.00 0.00 175.76 175.58 2wnu s VAL 193 N -4.06 3.00 0.00 0.00 -7.23 -0.60 -0.63 120.40 110.87 2wnu s VAL 193 Ca 0.26 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2wnu s VAL 193 Cb 0.07 -2.66 0.00 0.00 0.56 0.00 0.00 36.38 34.35 2wnu s VAL 193 CO 0.04 -0.36 0.00 -0.46 -0.31 0.00 0.00 175.10 174.01 2wnu n ASN 194 N -0.81 0.00 0.19 4.85 0.23 -1.25 -2.98 115.26 115.49 2wnu n ASN 194 Ca -0.06 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.07 2wnu n ASN 194 Cb 0.60 0.00 0.24 0.00 -2.08 0.00 0.00 39.78 38.54 2wnu n ASN 194 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2wnu h ASP 195 N 0.00 0.00 -3.25 0.53 3.32 -1.94 0.25 116.42 115.34 2wnu h ASP 195 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 2wnu h ASP 195 Cb 0.00 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 39.38 2wnu h ASP 195 CO 0.00 0.27 0.12 -0.31 -1.72 0.00 0.00 179.24 177.59 2wnu s TYR 196 N -3.28 3.01 0.00 4.55 4.12 -1.26 -4.90 117.35 119.59 2wnu s TYR 196 Ca 0.03 -0.47 0.00 0.00 0.02 0.00 0.00 57.07 56.66 2wnu s TYR 196 Cb 0.08 -3.61 0.00 0.00 -1.52 0.00 0.00 41.96 36.91 2wnu s TYR 196 CO 0.68 -1.08 0.48 2.48 0.02 0.00 0.00 175.55 178.14 2wnu n TYR 197 N 6.35 0.00 -2.20 2.71 0.18 -1.21 -2.07 117.16 120.91 2wnu n TYR 197 Ca -0.05 -0.09 -0.42 0.00 1.88 0.00 0.00 57.90 59.22 2wnu n TYR 197 Cb 0.46 -0.01 -0.03 0.00 -0.38 0.00 0.00 39.34 39.38 2wnu n TYR 197 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2wnu s ASP 198 N -0.18 6.84 -0.17 9.48 -1.08 -1.07 -3.99 116.67 126.52 2wnu s ASP 198 Ca 0.00 2.19 0.19 0.00 -0.52 0.00 0.00 52.55 54.41 2wnu s ASP 198 Cb 0.00 -2.57 0.46 0.00 -1.46 0.00 0.00 42.92 39.35 2wnu s ASP 198 CO 0.00 -0.69 1.16 0.23 0.52 0.00 0.00 175.17 176.39 2wnu n MET 199 N 4.88 1.46 -2.97 4.34 2.81 -1.26 -4.64 117.12 121.73 2wnu n MET 199 Ca 0.12 -3.09 -0.44 0.00 -1.81 0.00 0.00 57.70 52.49 2wnu n MET 199 Cb 0.43 -1.19 -0.03 0.00 -0.71 0.00 0.00 33.22 31.71 2wnu n MET 199 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2wnu s VAL 200 N -2.59 4.66 0.52 2.03 -7.23 -1.25 -4.80 120.40 111.74 2wnu s VAL 200 Ca 0.35 -1.05 -0.17 0.00 -1.81 0.00 0.00 61.98 59.30 2wnu s VAL 200 Cb 0.37 -4.66 -0.07 0.00 0.56 0.00 0.00 36.38 32.58 2wnu s VAL 200 CO -0.07 -1.37 1.00 -0.83 -0.31 0.00 0.00 175.10 173.52 2wnu s GLY 201 N 3.57 2.14 1.06 2.32 0.00 -1.25 -2.35 107.32 112.81 2wnu s GLY 201 Ca 0.23 0.28 -0.13 0.00 0.00 0.00 0.00 44.72 45.10 2wnu s GLY 201 CO 0.01 0.56 1.07 -0.26 0.00 0.00 0.00 173.10 174.49 2wnu s ILE 202 N -2.51 2.05 -0.19 0.90 -4.36 -1.26 -4.82 121.20 111.01 2wnu s ILE 202 Ca 0.61 0.02 -0.37 0.00 -0.26 0.00 0.00 60.65 60.64 2wnu s ILE 202 Cb -0.12 -2.37 -0.14 0.00 1.25 0.00 0.00 42.46 41.08 2wnu s ILE 202 CO 0.30 -0.02 1.81 1.67 0.24 0.00 0.00 174.94 178.94 2wnu n GLN 203 N -4.42 1.61 -0.25 0.37 7.27 -1.26 -1.23 117.38 119.47 2wnu n GLN 203 Ca 0.04 0.59 0.00 0.00 0.07 0.00 0.00 57.00 57.71 2wnu n GLN 203 Cb 0.56 -2.35 0.00 0.00 2.41 0.00 0.00 30.24 30.87 2wnu n GLN 203 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wnu n GLY 204 N 4.29 0.65 3.16 1.69 0.00 -1.26 -5.05 105.19 108.66 2wnu n GLY 204 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 2wnu n GLY 204 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wnu s SER 205 N -2.90 3.32 0.47 1.61 0.15 -0.37 -5.12 113.70 110.86 2wnu s SER 205 Ca 0.00 -0.60 0.04 0.00 0.70 0.00 0.00 55.95 56.09 2wnu s SER 205 Cb 0.00 -1.51 -0.04 0.00 -1.71 0.00 0.00 66.02 62.76 2wnu s SER 205 CO 0.00 0.02 0.03 -1.81 1.20 0.00 0.00 173.24 172.68 2wnu s ASP 206 N 1.20 4.07 -0.08 5.45 1.11 -1.26 -4.34 116.67 122.83 2wnu s ASP 206 Ca 0.02 -1.49 0.03 0.00 0.18 0.00 0.00 52.55 51.30 2wnu s ASP 206 Cb -0.14 0.09 0.01 0.00 1.07 0.00 0.00 42.92 43.95 2wnu s ASP 206 CO -0.09 -0.69 -0.17 -0.44 1.18 0.00 0.00 175.17 174.97 2wnu s SER 207 N -3.83 2.31 -0.01 0.27 0.01 -1.26 -3.12 113.70 108.07 2wnu s SER 207 Ca 0.21 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 57.08 2wnu s SER 207 Cb 0.05 -1.06 -0.00 0.00 0.21 0.00 0.00 66.02 65.22 2wnu s SER 207 CO 0.11 0.08 -0.05 -0.69 0.41 0.00 0.00 173.24 173.10 2wnu s VAL 208 N 0.56 0.37 -0.09 3.43 1.01 0.14 -2.04 120.40 123.78 2wnu s VAL 208 Ca -0.16 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2wnu s VAL 208 Cb -0.17 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.90 2wnu s VAL 208 CO 0.05 0.11 -0.15 0.12 0.00 0.00 0.00 175.10 175.24 2wnu s PHE 209 N -0.01 1.80 0.05 5.22 5.36 -0.34 -0.65 117.98 129.41 2wnu s PHE 209 Ca 0.01 -0.75 0.05 0.00 -0.96 0.00 0.00 56.93 55.28 2wnu s PHE 209 Cb -0.03 -1.29 -0.02 0.00 -0.34 0.00 0.00 43.02 41.33 2wnu s PHE 209 CO -0.00 -0.37 -0.15 -1.12 -1.46 0.00 0.00 175.22 172.12 2wnu s SER 210 N 0.74 1.78 -0.10 6.13 0.01 0.30 -0.89 113.70 121.68 2wnu s SER 210 Ca -0.12 -0.51 -0.14 0.00 1.31 0.00 0.00 55.95 56.49 2wnu s SER 210 Cb -0.16 -0.10 0.03 0.00 0.21 0.00 0.00 66.02 66.00 2wnu s SER 210 CO 0.03 0.02 0.36 -0.83 0.41 0.00 0.00 173.24 173.23 2wnu s GLY 211 N -1.32 -0.25 -0.10 3.44 0.00 -0.61 -1.40 107.32 107.07 2wnu s GLY 211 Ca 0.02 0.84 -0.09 0.00 0.00 0.00 0.00 44.72 45.49 2wnu s GLY 211 CO 0.02 0.67 0.27 -0.11 0.00 0.00 0.00 173.10 173.94 2wnu s PHE 212 N -0.32 -0.31 0.13 1.90 -0.12 -0.34 -1.31 117.98 117.62 2wnu s PHE 212 Ca -0.05 0.74 -0.31 0.00 -0.05 0.00 0.00 56.93 57.26 2wnu s PHE 212 Cb -0.03 0.10 -0.10 0.00 -0.63 0.00 0.00 43.02 42.36 2wnu s PHE 212 CO 0.02 -0.16 1.63 -1.17 -0.05 0.00 0.00 175.22 175.50 2wnu s LEU 213 N 0.28 4.37 -0.18 -1.99 2.96 0.72 -1.53 118.68 123.32 2wnu s LEU 213 Ca -0.01 2.60 -0.10 0.00 -0.22 0.00 0.00 54.13 56.40 2wnu s LEU 213 Cb -0.03 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.01 2wnu s LEU 213 CO -0.01 -0.87 -0.25 0.18 -1.32 0.00 0.00 176.35 174.08 2wnu n LEU 214 N 4.72 1.41 -3.89 -0.68 4.77 0.39 -4.75 117.00 118.98 2wnu n LEU 214 Ca 0.15 0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 56.07 2wnu n LEU 214 Cb 0.39 -0.57 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2wnu n LEU 214 CO 0.62 0.26 -0.38 -0.36 -1.33 0.00 0.00 177.39 176.20 2wnu s PHE 215 N -2.40 2.33 0.38 -1.77 0.08 -1.16 -4.99 117.98 110.45 2wnu s PHE 215 Ca -0.26 -1.85 -0.25 0.00 0.12 0.00 0.00 56.93 54.68 2wnu s PHE 215 Cb 0.09 -1.76 -0.09 0.00 -0.57 0.00 0.00 43.02 40.70 2wnu s PHE 215 CO 0.33 -0.81 1.13 -2.14 -0.10 0.00 0.00 175.22 173.63 2wnu s PRO 216 N 1.41 4.16 0.00 0.24 0.02 -1.26 -1.10 135.00 138.47 2wnu s PRO 216 Ca 0.00 1.74 0.00 0.00 0.02 0.00 0.00 61.00 62.76 2wnu s PRO 216 Cb -0.18 -2.70 0.00 0.00 0.02 0.00 0.00 34.50 31.63 2wnu s PRO 216 CO -0.11 -0.20 0.00 -0.40 -0.33 0.00 0.00 177.00 175.97