#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2agw h VAL 72 N 0.00 0.00 -0.14 3.84 -1.51 -2.01 -2.43 116.25 114.00 2agw h VAL 72 Ca 0.00 -0.44 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2agw h VAL 72 Cb 0.00 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 2agw h VAL 72 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.93 2agw n ASN 73 N -2.98 1.33 -4.88 4.19 3.02 -1.26 -4.86 115.26 109.82 2agw n ASN 73 Ca 0.00 -1.67 -0.37 0.00 -0.03 0.00 0.00 54.58 52.52 2agw n ASN 73 Cb 0.28 -0.09 -0.06 0.00 -0.61 0.00 0.00 39.78 39.30 2agw n ASN 73 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2agw s SER 74 N -1.54 6.41 0.60 6.41 0.15 -0.91 -4.95 113.70 119.87 2agw s SER 74 Ca 0.31 0.49 0.32 0.00 0.70 0.00 0.00 55.95 57.77 2agw s SER 74 Cb 0.16 -2.08 1.92 0.00 -1.71 0.00 0.00 66.02 64.31 2agw s SER 74 CO 0.24 0.41 2.28 0.00 1.20 0.00 0.00 173.24 177.37 2agw n ASP 76 N -3.74 0.62 -4.71 0.00 8.00 -1.26 -4.76 116.55 110.70 2agw n ASP 76 Ca -0.03 -0.91 -0.43 0.00 0.71 0.00 0.00 54.79 54.13 2agw n ASP 76 Cb 0.08 -0.03 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 2agw n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2agw n TYR 77 N -0.68 2.55 -0.16 1.24 -0.00 -0.78 -4.84 117.16 114.48 2agw n TYR 77 Ca 0.18 0.29 0.12 0.00 -0.00 0.00 0.00 57.90 58.49 2agw n TYR 77 Cb 0.26 -2.55 0.45 0.00 -0.00 0.00 0.00 39.34 37.49 2agw n TYR 77 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.86 176.97 2agw h TRP 78 N 4.91 0.59 0.00 2.98 5.08 -1.90 -0.55 115.95 127.07 2agw h TRP 78 Ca -0.46 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.53 2agw h TRP 78 Cb 1.24 -0.19 0.00 0.00 -3.00 0.00 0.00 29.16 27.21 2agw h TRP 78 CO 0.59 0.26 0.00 0.54 -1.28 0.00 0.00 178.44 178.55 2agw n ARG 79 N -4.49 0.16 -0.85 0.12 1.74 -1.26 -3.23 116.66 108.85 2agw n ARG 79 Ca 0.13 0.41 -0.06 0.00 -0.77 0.00 0.00 57.85 57.55 2agw n ARG 79 Cb 0.40 -1.82 0.24 0.00 -1.02 0.00 0.00 32.46 30.26 2agw n ARG 79 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2agw n HIS 80 N -2.12 2.05 0.31 -1.55 8.25 -0.21 -4.68 115.22 117.27 2agw n HIS 80 Ca 0.02 -1.06 0.15 0.00 -0.26 0.00 0.00 57.72 56.57 2agw n HIS 80 Cb 0.21 -0.62 0.67 0.00 1.12 0.00 0.00 29.99 31.37 2agw n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2agw n ALA 82 N -1.91 3.01 -2.51 0.00 0.00 -1.26 -1.23 120.51 116.61 2agw n ALA 82 Ca 0.00 -2.82 -0.42 0.00 0.00 0.00 0.00 53.44 50.21 2agw n ALA 82 Cb 0.20 -0.58 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 2agw n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2agw s VAL 83 N -1.70 4.36 -0.37 0.00 1.01 -0.98 -4.86 120.40 117.86 2agw s VAL 83 Ca 0.36 1.68 0.02 0.00 0.00 0.00 0.00 61.98 64.04 2agw s VAL 83 Cb 0.38 -4.08 0.11 0.00 0.00 0.00 0.00 36.38 32.79 2agw s VAL 83 CO -0.11 0.03 0.12 -0.62 0.00 0.00 0.00 175.10 174.51 2agw s ASP 84 N 1.32 4.30 0.00 3.32 2.15 -1.26 -0.83 116.67 125.68 2agw s ASP 84 Ca 0.55 -2.16 0.00 0.00 0.43 0.00 0.00 52.55 51.37 2agw s ASP 84 Cb -0.24 -1.29 0.00 0.00 -0.30 0.00 0.00 42.92 41.09 2agw s ASP 84 CO 0.23 -0.36 0.00 0.61 -0.17 0.00 0.00 175.17 175.48 2agw n GLY 85 N 4.21 -0.75 3.76 2.66 0.00 -0.47 -4.99 105.19 109.62 2agw n GLY 85 Ca 0.03 -1.34 -0.37 0.00 0.00 0.00 0.00 46.02 44.33 2agw n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2agw s PHE 86 N -2.85 3.54 -0.07 1.61 0.40 -1.26 -0.29 117.98 119.06 2agw s PHE 86 Ca 0.00 0.74 -0.30 0.00 -0.60 0.00 0.00 56.93 56.77 2agw s PHE 86 Cb 0.00 -2.34 -0.04 0.00 0.51 0.00 0.00 43.02 41.14 2agw s PHE 86 CO 0.00 0.35 1.45 -0.51 0.70 0.00 0.00 175.22 177.21 2agw s LEU 87 N 0.05 4.28 0.58 -0.37 1.43 -0.54 -0.08 118.68 124.03 2agw s LEU 87 Ca 0.20 2.04 0.27 0.00 -1.03 0.00 0.00 54.13 55.60 2agw s LEU 87 Cb -0.14 -3.54 1.66 0.00 0.03 0.00 0.00 46.19 44.20 2agw s LEU 87 CO 0.07 -0.80 2.18 0.00 0.23 0.00 0.00 176.35 178.03 2agw h SER 89 N 0.00 0.00 -0.11 0.00 4.64 -1.74 -0.58 113.55 115.76 2agw h SER 89 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2agw h SER 89 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2agw h SER 89 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2agw n GLY 92 N -1.13 0.73 0.00 0.00 0.00 -1.23 -4.70 105.19 98.86 2agw n GLY 92 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2agw n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2agw n GLY 93 N -2.12 4.60 2.81 -0.02 0.00 -0.71 -4.41 105.19 105.34 2agw n GLY 93 Ca 0.00 -2.00 -0.20 0.00 0.00 0.00 0.00 46.02 43.82 2agw n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2agw n THR 94 N 0.00 0.00 0.23 2.61 -2.24 -0.71 -4.26 114.28 109.92 2agw n THR 94 Ca 0.00 -2.03 0.17 0.00 -2.27 0.00 0.00 64.05 59.93 2agw n THR 94 Cb 0.00 0.80 0.87 0.00 -2.10 0.00 0.00 70.33 69.90 2agw n THR 94 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2agw h THR 95 N 1.65 0.40 0.00 4.28 2.02 -1.93 -3.00 112.91 116.34 2agw h THR 95 Ca -0.25 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2agw h THR 95 Cb 1.03 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2agw h THR 95 CO 0.39 0.00 -0.25 0.35 0.37 0.00 0.00 175.52 176.38 2agw n THR 96 N -3.68 0.86 -3.83 3.16 -2.24 -1.26 -1.81 114.28 105.48 2agw n THR 96 Ca 0.01 -1.03 -0.12 0.00 -2.27 0.00 0.00 64.05 60.64 2agw n THR 96 Cb 0.29 0.19 -0.12 0.00 -2.10 0.00 0.00 70.33 68.58 2agw n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2agw s THR 97 N -1.30 0.01 0.42 4.28 -4.23 -1.13 -5.08 115.64 108.61 2agw s THR 97 Ca 0.14 -0.11 -0.23 0.00 -1.18 0.00 0.00 61.69 60.31 2agw s THR 97 Cb 0.12 -0.26 -0.09 0.00 1.34 0.00 0.00 72.50 73.61 2agw s THR 97 CO 0.01 -0.06 1.03 0.00 -0.54 0.00 0.00 174.62 175.06 2agw n PRO 99 N -0.29 0.47 -1.61 0.00 -0.02 -1.26 -4.71 135.00 127.58 2agw n PRO 99 Ca 0.06 0.22 -0.49 0.00 -2.02 0.00 0.00 63.50 61.27 2agw n PRO 99 Cb 0.51 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 2agw n PRO 99 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2agw n PRO 100 N -2.24 1.43 -0.94 0.52 -0.02 -1.26 -1.88 135.00 130.61 2agw n PRO 100 Ca 0.13 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2agw n PRO 100 Cb 0.50 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2agw n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2agw n GLY 101 N 2.47 0.56 3.45 -1.23 0.00 -1.26 -5.03 105.19 104.15 2agw n GLY 101 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2agw n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2agw s SER 102 N -2.08 3.74 -0.12 1.61 1.04 -0.79 -4.68 113.70 112.42 2agw s SER 102 Ca 0.00 -0.47 -0.03 0.00 0.48 0.00 0.00 55.95 55.94 2agw s SER 102 Cb 0.00 -0.56 -0.03 0.00 0.10 0.00 0.00 66.02 65.53 2agw s SER 102 CO 0.00 0.24 -0.02 -0.89 0.98 0.00 0.00 173.24 173.55 2agw s THR 103 N -0.94 4.07 0.39 2.02 2.01 -0.10 -4.70 115.64 118.38 2agw s THR 103 Ca 0.15 -0.32 -0.26 0.00 0.31 0.00 0.00 61.69 61.57 2agw s THR 103 Cb -0.10 -2.75 -0.09 0.00 0.01 0.00 0.00 72.50 69.57 2agw s THR 103 CO 0.06 0.54 1.29 -2.84 -0.69 0.00 0.00 174.62 172.97 2agw s PRO 104 N -0.20 4.06 0.22 4.92 0.02 -1.26 -0.24 135.00 142.51 2agw s PRO 104 Ca 0.04 2.13 -0.30 0.00 0.02 0.00 0.00 61.00 62.90 2agw s PRO 104 Cb -0.13 -2.81 -0.09 0.00 0.02 0.00 0.00 34.50 31.50 2agw s PRO 104 CO 0.02 -0.41 1.15 -1.54 -0.33 0.00 0.00 177.00 175.89 2agw s SER 105 N -0.73 7.17 0.42 2.53 1.04 0.39 -4.88 113.70 119.64 2agw s SER 105 Ca 0.55 2.23 0.22 0.00 0.48 0.00 0.00 55.95 59.43 2agw s SER 105 Cb -0.38 -2.61 0.88 0.00 0.10 0.00 0.00 66.02 64.01 2agw s SER 105 CO 0.49 -0.27 1.82 1.55 0.98 0.00 0.00 173.24 177.80 2agw h PRO 106 N 4.68 0.00 -6.17 4.02 0.13 -1.91 -3.45 132.00 129.30 2agw h PRO 106 Ca -0.45 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.14 2agw h PRO 106 Cb 1.21 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.27 2agw h PRO 106 CO 0.71 0.27 -0.57 0.96 -0.23 0.00 0.00 178.00 179.14 2agw s ILE 107 N -3.71 3.61 0.00 -3.56 -4.36 -1.26 -5.13 121.20 106.78 2agw s ILE 107 Ca -0.00 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.70 2agw s ILE 107 Cb 0.11 -3.05 0.00 0.00 1.25 0.00 0.00 42.46 40.77 2agw s ILE 107 CO 0.65 -0.31 0.00 -1.54 0.24 0.00 0.00 174.94 173.99 2agw n SER 108 N -1.07 1.21 -3.65 4.36 3.41 -1.26 -4.63 113.62 111.98 2agw n SER 108 Ca -0.06 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.41 2agw n SER 108 Cb 0.59 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.46 2agw n SER 108 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2agw s ILE 110 N 0.88 0.00 0.20 -1.33 -1.09 -0.10 -4.88 121.20 114.87 2agw s ILE 110 Ca 0.00 -0.01 0.11 0.00 -2.23 0.00 0.00 60.65 58.52 2agw s ILE 110 Cb 0.00 -0.87 -0.04 0.00 -1.58 0.00 0.00 42.46 39.96 2agw s ILE 110 CO 0.00 -0.01 -0.18 -0.83 -1.23 0.00 0.00 174.94 172.70 2agw s GLY 111 N 0.20 1.73 -0.28 6.18 0.00 0.32 -4.56 107.32 110.92 2agw s GLY 111 Ca -0.01 -1.61 -0.04 0.00 0.00 0.00 0.00 44.72 43.06 2agw s GLY 111 CO 0.01 -1.64 0.02 -1.59 0.00 0.00 0.00 173.10 169.90 2agw s THR 112 N -1.79 3.44 0.07 0.90 2.01 -1.26 -0.46 115.64 118.55 2agw s THR 112 Ca 0.24 -0.93 0.08 0.00 0.31 0.00 0.00 61.69 61.38 2agw s THR 112 Cb -0.08 -2.80 -0.03 0.00 0.01 0.00 0.00 72.50 69.59 2agw s THR 112 CO 0.13 0.08 -0.20 0.00 -0.69 0.00 0.00 174.62 173.93 2agw s HIS 114 N -0.99 3.32 -0.23 0.00 2.46 -1.26 -0.08 115.29 118.50 2agw s HIS 114 Ca 0.15 0.85 -0.29 0.00 0.47 0.00 0.00 55.06 56.24 2agw s HIS 114 Cb -0.10 -2.82 0.01 0.00 -0.13 0.00 0.00 32.58 29.53 2agw s HIS 114 CO 0.06 -0.26 1.10 1.21 -2.47 0.00 0.00 174.74 174.38 2agw s ASN 115 N 1.36 7.03 0.00 9.88 3.84 0.35 -4.89 114.94 132.51 2agw s ASN 115 Ca 0.27 1.39 0.24 0.00 0.21 0.00 0.00 52.86 54.97 2agw s ASN 115 Cb -0.16 -2.54 1.14 0.00 -0.55 0.00 0.00 41.25 39.15 2agw s ASN 115 CO 0.09 -0.74 1.79 -0.81 -2.79 0.00 0.00 177.10 174.64 2agw n PRO 116 N 6.50 0.21 -0.10 0.43 -0.04 -1.26 -1.25 135.00 139.49 2agw n PRO 116 Ca 0.13 0.07 -0.18 0.00 -0.04 0.00 0.00 63.50 63.47 2agw n PRO 116 Cb 0.46 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.33 2agw n PRO 116 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2agw n HIS 117 N -1.37 0.88 1.01 0.54 8.25 -1.26 -4.58 115.22 118.69 2agw n HIS 117 Ca 0.09 0.38 0.11 0.00 -0.26 0.00 0.00 57.72 58.04 2agw n HIS 117 Cb 0.23 -1.00 -0.01 0.00 1.12 0.00 0.00 29.99 30.33 2agw n HIS 117 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2agw n ASP 118 N -4.46 1.86 -0.07 0.41 5.68 -1.25 -4.99 116.55 113.73 2agw n ASP 118 Ca -0.28 -1.43 -0.01 0.00 -0.50 0.00 0.00 54.79 52.57 2agw n ASP 118 Cb 0.60 0.54 -0.00 0.00 -1.14 0.00 0.00 41.12 41.12 2agw n ASP 118 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2agw n GLY 119 N 1.43 0.46 3.72 6.12 0.00 -0.38 -5.01 105.19 111.53 2agw n GLY 119 Ca 0.09 -0.18 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 2agw n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2agw s LYS 120 N -0.85 2.62 0.01 1.61 1.02 -1.24 -4.84 119.74 118.07 2agw s LYS 120 Ca 0.00 -0.94 -0.20 0.00 0.02 0.00 0.00 55.97 54.85 2agw s LYS 120 Cb 0.00 -2.52 -0.06 0.00 -0.52 0.00 0.00 37.83 34.74 2agw s LYS 120 CO 0.00 0.49 0.58 -0.51 -0.92 0.00 0.00 175.35 175.00 2agw s ASP 121 N -2.78 6.99 0.10 2.83 1.11 -1.26 -0.50 116.67 123.17 2agw s ASP 121 Ca 0.28 1.18 0.09 0.00 0.18 0.00 0.00 52.55 54.28 2agw s ASP 121 Cb -0.10 -2.36 -0.04 0.00 1.07 0.00 0.00 42.92 41.49 2agw s ASP 121 CO 0.20 0.15 -0.24 -0.31 1.18 0.00 0.00 175.17 176.15 2agw s TYR 122 N -0.43 2.03 -0.11 4.23 1.51 0.89 -4.62 117.35 120.85 2agw s TYR 122 Ca 0.30 -0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 55.69 2agw s TYR 122 Cb -0.18 -1.13 -0.02 0.00 -0.11 0.00 0.00 41.96 40.52 2agw s TYR 122 CO 0.17 0.24 0.90 -0.51 -1.11 0.00 0.00 175.55 175.25 2agw s LEU 123 N -1.85 4.24 -0.16 -1.29 1.43 0.13 -0.75 118.68 120.44 2agw s LEU 123 Ca 0.10 1.37 0.01 0.00 -1.03 0.00 0.00 54.13 54.58 2agw s LEU 123 Cb -0.10 -3.38 0.01 0.00 0.03 0.00 0.00 46.19 42.75 2agw s LEU 123 CO 0.05 -0.36 -0.19 -0.63 0.23 0.00 0.00 176.35 175.45 2agw s ILE 124 N 1.78 2.29 -0.25 -0.59 -1.09 0.39 -0.54 121.20 123.19 2agw s ILE 124 Ca 0.44 -0.89 -0.15 0.00 -2.23 0.00 0.00 60.65 57.82 2agw s ILE 124 Cb -0.18 -1.95 -0.04 0.00 -1.58 0.00 0.00 42.46 38.71 2agw s ILE 124 CO 0.17 0.53 0.36 -0.55 -1.23 0.00 0.00 174.94 174.23 2agw s SER 125 N 0.99 6.29 -0.91 3.58 0.15 0.86 -0.52 113.70 124.14 2agw s SER 125 Ca -0.02 0.33 -0.13 0.00 0.70 0.00 0.00 55.95 56.82 2agw s SER 125 Cb -0.15 -2.21 0.22 0.00 -1.71 0.00 0.00 66.02 62.18 2agw s SER 125 CO -0.05 -0.14 0.90 -0.31 1.20 0.00 0.00 173.24 174.85 2agw s TYR 126 N 1.80 3.80 -0.07 3.44 1.51 -1.26 -0.91 117.35 125.65 2agw s TYR 126 Ca 0.15 -2.08 -0.23 0.00 -1.01 0.00 0.00 57.07 53.90 2agw s TYR 126 Cb -0.15 -3.89 -0.04 0.00 -0.11 0.00 0.00 41.96 37.77 2agw s TYR 126 CO 0.09 -1.05 0.67 -1.01 -1.11 0.00 0.00 175.55 173.15 2agw s HIS 127 N 0.17 3.57 0.60 2.71 3.76 -1.23 -4.64 115.29 120.24 2agw s HIS 127 Ca 0.23 1.20 -0.12 0.00 -0.15 0.00 0.00 55.06 56.23 2agw s HIS 127 Cb -0.09 -2.78 -0.04 0.00 1.11 0.00 0.00 32.58 30.78 2agw s HIS 127 CO -0.09 0.09 1.02 -0.51 -0.85 0.00 0.00 174.74 174.41 2agw s ASP 128 N 0.78 6.28 -0.11 1.40 1.01 -1.26 -0.82 116.67 123.94 2agw s ASP 128 Ca 0.36 1.43 -0.01 0.00 0.71 0.00 0.00 52.55 55.04 2agw s ASP 128 Cb -0.17 -2.47 -0.03 0.00 1.01 0.00 0.00 42.92 41.26 2agw s ASP 128 CO 0.17 -0.83 -0.06 0.00 0.21 0.00 0.00 175.17 174.66 2agw n GLY 131 N -0.38 0.69 3.08 0.00 0.00 0.02 -0.93 105.19 107.67 2agw n GLY 131 Ca -0.08 -0.06 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 2agw n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2agw s LYS 132 N -0.47 0.57 0.93 1.61 1.02 -1.26 -4.92 119.74 117.23 2agw s LYS 132 Ca 0.00 -0.98 -0.12 0.00 0.02 0.00 0.00 55.97 54.89 2agw s LYS 132 Cb 0.00 -0.04 0.15 0.00 -0.52 0.00 0.00 37.83 37.42 2agw s LYS 132 CO 0.00 -0.03 1.09 0.95 -0.92 0.00 0.00 175.35 176.44 2agw s THR 133 N -2.61 2.49 0.09 2.17 -4.23 -1.26 -3.19 115.64 109.09 2agw s THR 133 Ca -0.02 0.16 -0.35 0.00 -1.18 0.00 0.00 61.69 60.30 2agw s THR 133 Cb -0.02 -2.64 -0.15 0.00 1.34 0.00 0.00 72.50 71.04 2agw s THR 133 CO -0.04 -0.21 1.51 0.00 -0.54 0.00 0.00 174.62 175.34 2agw n ALA 134 N -3.98 0.27 -0.20 3.99 0.00 -1.22 -4.55 120.51 114.83 2agw n ALA 134 Ca 0.06 0.46 -0.08 0.00 0.00 0.00 0.00 53.44 53.89 2agw n ALA 134 Cb 0.56 -2.24 0.02 0.00 0.00 0.00 0.00 19.45 17.79 2agw n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2agw n GLY 136 N -0.81 0.84 3.47 0.00 0.00 -1.26 -5.02 105.19 102.40 2agw n GLY 136 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2agw n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2agw s ARG 137 N -0.27 2.27 -1.23 1.61 0.52 -1.26 -4.75 118.95 115.83 2agw s ARG 137 Ca 0.00 -0.86 -0.06 0.00 -0.52 0.00 0.00 55.73 54.30 2agw s ARG 137 Cb 0.00 -2.28 -0.01 0.00 0.52 0.00 0.00 34.95 33.18 2agw s ARG 137 CO 0.00 0.57 0.75 0.00 0.02 0.00 0.00 175.30 176.64 2agw s GLN 139 N -5.75 4.31 0.09 0.00 0.74 -1.26 -1.47 119.66 116.31 2agw s GLN 139 Ca 0.17 2.06 0.07 0.00 0.05 0.00 0.00 55.36 57.71 2agw s GLN 139 Cb -0.05 -3.33 -0.03 0.00 1.10 0.00 0.00 33.01 30.70 2agw s GLN 139 CO 0.81 -0.47 -0.18 0.00 -0.55 0.00 0.00 175.29 174.90 2agw s ASN 141 N -1.87 1.51 0.11 0.00 2.47 -1.21 -1.37 114.94 114.58 2agw s ASN 141 Ca 0.03 -2.14 0.10 0.00 0.42 0.00 0.00 52.86 51.27 2agw s ASN 141 Cb -0.10 0.16 -0.04 0.00 -1.45 0.00 0.00 41.25 39.82 2agw s ASN 141 CO 0.03 -0.23 -0.23 -0.89 -3.72 0.00 0.00 177.10 172.06 2agw s THR 142 N 0.94 2.47 -0.01 -5.21 2.01 -0.01 -5.01 115.64 110.82 2agw s THR 142 Ca 0.22 -1.59 0.11 0.00 0.31 0.00 0.00 61.69 60.74 2agw s THR 142 Cb -0.12 -2.09 0.20 0.00 0.01 0.00 0.00 72.50 70.50 2agw s THR 142 CO -0.06 0.14 1.08 0.00 -0.69 0.00 0.00 174.62 175.10 2agw n GLN 143 N 1.02 0.12 -1.79 4.92 1.13 -1.06 -3.66 117.38 118.06 2agw n GLN 143 Ca -0.17 -1.55 -0.42 0.00 -1.94 0.00 0.00 57.00 52.92 2agw n GLN 143 Cb 0.53 -0.39 -0.03 0.00 0.11 0.00 0.00 30.24 30.46 2agw n GLN 143 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2agw s THR 144 N -0.25 3.22 -0.20 5.09 2.01 -0.36 -1.99 115.64 123.15 2agw s THR 144 Ca 0.16 0.26 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2agw s THR 144 Cb 0.18 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.50 2agw s THR 144 CO -0.07 -0.05 0.00 0.54 -0.69 0.00 0.00 174.62 174.35 2agw n ARG 145 N 7.64 -1.08 -2.47 4.92 1.74 -1.26 -4.58 116.66 121.57 2agw n ARG 145 Ca 0.21 0.39 -0.39 0.00 -0.77 0.00 0.00 57.85 57.28 2agw n ARG 145 Cb 0.42 -4.26 -0.04 0.00 -1.02 0.00 0.00 32.46 27.57 2agw n ARG 145 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2agw s GLU 146 N -1.44 4.49 0.12 5.56 -6.30 -0.84 -4.94 118.70 115.35 2agw s GLU 146 Ca 0.00 1.76 0.03 0.00 -2.50 0.00 0.00 54.97 54.26 2agw s GLU 146 Cb 0.00 -3.02 -0.04 0.00 0.00 0.00 0.00 34.13 31.07 2agw s GLU 146 CO 0.00 0.09 -0.09 1.03 0.02 0.00 0.00 175.26 176.31 2agw s ARG 147 N -1.73 0.95 1.25 4.30 1.81 -0.88 -5.03 118.95 119.62 2agw s ARG 147 Ca 0.48 -1.36 -0.19 0.00 -1.72 0.00 0.00 55.73 52.93 2agw s ARG 147 Cb -0.30 -0.46 0.30 0.00 -0.45 0.00 0.00 34.95 34.04 2agw s ARG 147 CO 0.38 0.04 1.06 -2.14 -0.68 0.00 0.00 175.30 173.97 2agw s PRO 148 N -3.63 -1.59 0.33 3.54 0.02 -1.26 -3.64 135.00 128.78 2agw s PRO 148 Ca 0.13 0.06 0.25 0.00 0.02 0.00 0.00 61.00 61.46 2agw s PRO 148 Cb 0.03 -1.54 1.17 0.00 0.02 0.00 0.00 34.50 34.17 2agw s PRO 148 CO -0.01 -3.98 1.76 0.78 -0.33 0.00 0.00 177.00 175.22 2agw h GLY 149 N -2.77 0.00 1.95 0.52 0.00 -1.97 0.11 103.07 100.91 2agw h GLY 149 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2agw h GLY 149 CO 0.35 0.00 0.00 1.58 0.00 0.00 0.00 176.54 178.47 2agw n TYR 150 N -2.37 0.00 -3.55 5.60 0.18 -1.26 -2.93 117.16 112.82 2agw n TYR 150 Ca 0.00 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.51 2agw n TYR 150 Cb 0.16 -0.48 -0.09 0.00 -0.38 0.00 0.00 39.34 38.55 2agw n TYR 150 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2agw n GLU 151 N -1.48 2.38 -0.32 -3.48 1.02 0.03 -5.02 120.64 113.77 2agw n GLU 151 Ca 0.04 -4.63 -0.03 0.00 -0.02 0.00 0.00 57.16 52.53 2agw n GLU 151 Cb 0.17 -2.27 0.12 0.00 -0.02 0.00 0.00 31.44 29.44 2agw n GLU 151 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2agw h PHE 152 N 4.55 1.19 -0.12 -0.32 3.57 -1.68 -1.12 116.94 123.01 2agw h PHE 152 Ca 0.19 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2agw h PHE 152 Cb 0.69 -0.39 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2agw h PHE 152 CO 0.72 0.80 0.00 1.19 -2.23 0.00 0.00 178.31 178.78 2agw n PHE 153 N -4.36 0.16 0.07 0.41 3.01 -1.26 -1.97 117.46 113.52 2agw n PHE 153 Ca 0.10 -0.08 0.06 0.00 1.01 0.00 0.00 57.45 58.54 2agw n PHE 153 Cb 0.07 0.00 0.12 0.00 -0.01 0.00 0.00 39.48 39.66 2agw n PHE 153 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2agw n LEU 154 N -0.15 2.64 -4.63 4.37 4.77 -0.43 -0.93 117.00 122.64 2agw n LEU 154 Ca 0.08 -1.63 -0.34 0.00 -0.03 0.00 0.00 56.01 54.09 2agw n LEU 154 Cb 0.14 -0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 40.98 2agw n LEU 154 CO 0.06 0.61 -0.25 -2.28 -1.33 0.00 0.00 177.39 174.21 2agw s HIS 155 N -1.00 3.25 -0.36 -1.77 2.46 -0.83 -2.08 115.29 114.95 2agw s HIS 155 Ca 0.21 0.07 0.09 0.00 0.47 0.00 0.00 55.06 55.90 2agw s HIS 155 Cb 0.12 -2.08 0.23 0.00 -0.13 0.00 0.00 32.58 30.72 2agw s HIS 155 CO 0.16 0.15 1.17 0.27 -2.47 0.00 0.00 174.74 174.03 2agw n ASN 156 N 3.53 2.66 -1.06 9.88 0.23 -1.26 -4.53 115.26 124.71 2agw n ASN 156 Ca -0.17 -2.32 0.07 0.00 -0.53 0.00 0.00 54.58 51.63 2agw n ASN 156 Cb 0.52 -0.23 0.24 0.00 -2.08 0.00 0.00 39.78 38.23 2agw n ASN 156 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2agw n ASP 157 N -0.30 3.08 -4.53 0.53 8.00 -1.26 -4.71 116.55 117.35 2agw n ASP 157 Ca 0.10 -2.15 -0.24 0.00 0.71 0.00 0.00 54.79 53.21 2agw n ASP 157 Cb 0.47 -0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 41.07 2agw n ASP 157 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2agw s VAL 158 N -1.53 2.70 -0.55 2.53 -7.23 -1.26 -5.10 120.40 109.96 2agw s VAL 158 Ca 0.35 -2.24 -0.27 0.00 -1.81 0.00 0.00 61.98 58.00 2agw s VAL 158 Cb 0.20 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.68 2agw s VAL 158 CO 0.20 -0.36 1.12 0.21 -0.31 0.00 0.00 175.10 175.96 2agw s ASN 159 N -3.57 6.47 0.00 4.85 2.47 -1.26 -4.90 114.94 118.99 2agw s ASN 159 Ca 0.31 0.09 0.19 0.00 0.42 0.00 0.00 52.86 53.87 2agw s ASN 159 Cb -0.04 -2.52 1.10 0.00 -1.45 0.00 0.00 41.25 38.33 2agw s ASN 159 CO 0.17 -1.36 1.53 0.79 -3.72 0.00 0.00 177.10 174.50 2agw n TRP 160 N 8.06 0.00 1.52 0.43 7.02 -1.26 -1.45 117.44 131.76 2agw n TRP 160 Ca 0.08 0.00 0.09 0.00 -1.02 0.00 0.00 57.50 56.64 2agw n TRP 160 Cb 0.49 -0.04 0.38 0.00 -2.42 0.00 0.00 31.31 29.71 2agw n TRP 160 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2agw h MET 162 N 1.24 0.00 -0.10 0.00 -0.00 -1.53 -1.52 114.93 113.02 2agw h MET 162 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2agw h MET 162 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.87 2agw h MET 162 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.91 2agw n ALA 163 N -2.15 2.39 -1.42 -3.00 0.00 -1.26 -4.92 120.51 110.15 2agw n ALA 163 Ca -0.01 -0.74 -0.31 0.00 0.00 0.00 0.00 53.44 52.38 2agw n ALA 163 Cb 0.24 -0.37 0.08 0.00 0.00 0.00 0.00 19.45 19.40 2agw n ALA 163 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2agw s ASN 164 N -0.91 4.84 0.27 0.00 0.02 -0.57 -4.94 114.94 113.66 2agw s ASN 164 Ca 0.15 1.66 0.01 0.00 -1.02 0.00 0.00 52.86 53.66 2agw s ASN 164 Cb 0.09 -2.45 0.60 0.00 0.02 0.00 0.00 41.25 39.52 2agw s ASN 164 CO 0.14 -1.79 1.75 -0.08 0.02 0.00 0.00 177.10 177.13 2agw h GLU 165 N -0.96 0.56 -4.82 -0.60 4.81 -1.95 -3.34 114.58 108.27 2agw h GLU 165 Ca -0.44 -0.03 -0.61 0.00 -0.13 0.00 0.00 59.36 58.14 2agw h GLU 165 Cb 1.23 -0.13 -0.35 0.00 0.63 0.00 0.00 28.75 30.13 2agw h GLU 165 CO 0.55 0.37 -0.84 1.21 -0.73 0.00 0.00 179.01 179.56 2agw s ASN 166 N -5.36 2.66 0.00 1.04 3.84 -1.26 -5.03 114.94 110.83 2agw s ASN 166 Ca -0.12 -0.49 0.20 0.00 0.21 0.00 0.00 52.86 52.66 2agw s ASN 166 Cb 0.23 -1.20 0.81 0.00 -0.55 0.00 0.00 41.25 40.54 2agw s ASN 166 CO 0.78 0.01 1.57 -1.54 -2.79 0.00 0.00 177.10 175.13 2agw n SER 167 N 4.36 1.23 -4.72 -4.21 3.41 -1.26 -3.47 113.62 108.96 2agw n SER 167 Ca -0.19 -1.65 -0.42 0.00 -0.26 0.00 0.00 58.87 56.35 2agw n SER 167 Cb 0.51 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 2agw n SER 167 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2agw s THR 168 N -1.84 3.07 -0.17 6.66 2.01 -1.26 -4.69 115.64 119.42 2agw s THR 168 Ca 0.30 0.79 -0.20 0.00 0.31 0.00 0.00 61.69 62.89 2agw s THR 168 Cb 0.16 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 2agw s THR 168 CO 0.24 0.07 0.57 0.12 -0.69 0.00 0.00 174.62 174.93 2agw s PHE 169 N 0.92 3.42 -0.21 4.92 5.36 -1.26 -0.80 117.98 130.33 2agw s PHE 169 Ca 0.65 0.89 -0.15 0.00 -0.96 0.00 0.00 56.93 57.36 2agw s PHE 169 Cb -0.39 -2.70 -0.08 0.00 -0.34 0.00 0.00 43.02 39.50 2agw s PHE 169 CO 0.32 -0.06 -0.33 1.58 -1.46 0.00 0.00 175.22 175.27 2agw n HIS 170 N 4.56 0.00 -3.79 10.12 -0.00 -0.11 -3.37 115.22 122.63 2agw n HIS 170 Ca -0.04 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.64 2agw n HIS 170 Cb 0.50 -0.70 -0.01 0.00 -0.00 0.00 0.00 29.99 29.78 2agw n HIS 170 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2agw s THR 172 N -3.36 2.24 0.32 0.00 2.01 0.89 -0.28 115.64 117.46 2agw s THR 172 Ca 0.13 -1.01 0.03 0.00 0.31 0.00 0.00 61.69 61.15 2agw s THR 172 Cb -0.03 -1.82 -0.02 0.00 0.01 0.00 0.00 72.50 70.64 2agw s THR 172 CO 0.04 0.57 0.49 0.42 -0.69 0.00 0.00 174.62 175.45 2agw s THR 173 N -0.29 4.79 -0.43 -0.82 -4.23 -0.00 -1.77 115.64 112.90 2agw s THR 173 Ca 0.00 -0.75 0.02 0.00 -1.18 0.00 0.00 61.69 59.79 2agw s THR 173 Cb -0.13 -3.72 0.12 0.00 1.34 0.00 0.00 72.50 70.12 2agw s THR 173 CO 0.03 -0.37 0.20 -0.44 -0.54 0.00 0.00 174.62 173.50 2agw s SER 174 N -4.07 4.00 -0.31 3.99 0.01 -0.75 -3.49 113.70 113.08 2agw s SER 174 Ca 0.40 -2.52 -0.11 0.00 1.31 0.00 0.00 55.95 55.03 2agw s SER 174 Cb -0.09 -1.22 -0.03 0.00 0.21 0.00 0.00 66.02 64.88 2agw s SER 174 CO 0.33 -0.29 0.20 -0.69 0.41 0.00 0.00 173.24 173.20 2agw s VAL 175 N 0.45 5.18 -0.05 3.43 1.01 -0.08 -4.69 120.40 125.64 2agw s VAL 175 Ca 0.16 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 2agw s VAL 175 Cb -0.23 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 2agw s VAL 175 CO -0.04 0.13 1.32 -0.22 0.00 0.00 0.00 175.10 176.28 2agw s LEU 176 N 1.72 4.28 -0.17 3.92 1.98 -1.26 -0.10 118.68 129.06 2agw s LEU 176 Ca 0.06 1.94 -0.14 0.00 -2.89 0.00 0.00 54.13 53.11 2agw s LEU 176 Cb -0.17 -3.55 -0.09 0.00 0.66 0.00 0.00 46.19 43.04 2agw s LEU 176 CO 0.10 -0.69 -0.06 0.52 -1.89 0.00 0.00 176.35 174.34 2agw n VAL 177 N 4.80 1.46 -3.81 1.68 0.31 0.30 -4.91 118.33 118.16 2agw n VAL 177 Ca 0.13 0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 2agw n VAL 177 Cb 0.45 -2.26 0.00 0.00 -0.91 0.00 0.00 33.84 31.11 2agw n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2agw n GLY 178 N 1.54 -0.99 0.00 2.92 0.00 -1.17 -5.01 105.19 102.48 2agw n GLY 178 Ca -0.17 -1.09 0.05 0.00 0.00 0.00 0.00 46.02 44.81 2agw n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36