#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hxc h VAL 72 N 0.00 0.00 -0.09 3.84 -1.51 -2.02 -2.92 116.25 113.55 2hxc h VAL 72 Ca 0.00 -0.59 0.00 0.00 -1.23 0.00 0.00 66.70 64.88 2hxc h VAL 72 Cb 0.00 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.74 2hxc h VAL 72 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.93 2hxc n ASN 73 N -3.06 0.96 -4.86 4.19 3.02 -1.26 -4.82 115.26 109.42 2hxc n ASN 73 Ca 0.01 -1.57 -0.37 0.00 -0.03 0.00 0.00 54.58 52.62 2hxc n ASN 73 Cb 0.34 -0.06 -0.06 0.00 -0.61 0.00 0.00 39.78 39.40 2hxc n ASN 73 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2hxc s SER 74 N -1.60 6.58 0.64 6.41 0.15 -1.10 -4.93 113.70 119.84 2hxc s SER 74 Ca 0.31 0.69 0.42 0.00 0.70 0.00 0.00 55.95 58.07 2hxc s SER 74 Cb 0.16 -2.15 2.23 0.00 -1.71 0.00 0.00 66.02 64.55 2hxc s SER 74 CO 0.25 0.37 2.29 0.00 1.20 0.00 0.00 173.24 177.34 2hxc n ASP 76 N -3.04 0.42 -4.70 0.00 8.00 -1.26 -4.77 116.55 111.19 2hxc n ASP 76 Ca -0.02 -0.24 -0.43 0.00 0.71 0.00 0.00 54.79 54.80 2hxc n ASP 76 Cb 0.10 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.13 2hxc n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hxc n TYR 77 N -1.23 2.45 -0.07 1.24 4.19 -0.81 -4.85 117.16 118.09 2hxc n TYR 77 Ca 0.10 0.38 0.08 0.00 3.31 0.00 0.00 57.90 61.76 2hxc n TYR 77 Cb 0.32 -2.51 0.44 0.00 0.49 0.00 0.00 39.34 38.08 2hxc n TYR 77 CO 0.00 0.00 0.00 0.11 0.91 0.00 0.00 176.86 177.88 2hxc h TRP 78 N 4.21 0.53 0.00 2.98 5.08 -1.90 -0.78 115.95 126.07 2hxc h TRP 78 Ca -0.46 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.52 2hxc h TRP 78 Cb 1.26 -0.17 0.00 0.00 -3.00 0.00 0.00 29.16 27.24 2hxc h TRP 78 CO 0.56 0.29 0.00 0.00 -1.28 0.00 0.00 178.44 178.01 2hxc h ARG 79 N 0.53 0.00 -0.94 0.12 3.08 -1.88 -3.23 114.38 112.06 2hxc h ARG 79 Ca 0.23 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.03 2hxc h ARG 79 Cb 0.24 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 30.14 2hxc h ARG 79 CO -0.06 0.00 0.32 0.72 -1.07 0.00 0.00 179.97 179.88 2hxc n HIS 80 N -2.70 1.81 0.46 3.04 8.25 -0.30 -4.64 115.22 121.14 2hxc n HIS 80 Ca 0.01 -1.14 0.11 0.00 -0.26 0.00 0.00 57.72 56.44 2hxc n HIS 80 Cb 0.28 -0.62 0.46 0.00 1.12 0.00 0.00 29.99 31.23 2hxc n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hxc n ALA 82 N -1.72 3.00 -2.64 0.00 0.00 -1.26 -1.33 120.51 116.56 2hxc n ALA 82 Ca 0.03 -2.81 -0.43 0.00 0.00 0.00 0.00 53.44 50.23 2hxc n ALA 82 Cb 0.25 -0.60 -0.02 0.00 0.00 0.00 0.00 19.45 19.08 2hxc n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2hxc s VAL 83 N -1.81 4.67 -0.42 0.00 1.01 -1.07 -4.83 120.40 117.95 2hxc s VAL 83 Ca 0.36 1.96 0.01 0.00 0.00 0.00 0.00 61.98 64.32 2hxc s VAL 83 Cb 0.38 -4.27 0.11 0.00 0.00 0.00 0.00 36.38 32.61 2hxc s VAL 83 CO -0.11 -0.07 0.16 -0.62 0.00 0.00 0.00 175.10 174.47 2hxc s ASP 84 N 1.22 4.88 0.00 3.32 2.15 -1.26 -0.66 116.67 126.33 2hxc s ASP 84 Ca 0.48 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 51.13 2hxc s ASP 84 Cb -0.18 -1.71 0.00 0.00 -0.30 0.00 0.00 42.92 40.73 2hxc s ASP 84 CO 0.14 -0.40 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 2hxc n GLY 85 N 4.09 -0.49 3.67 2.66 0.00 -0.51 -4.97 105.19 109.65 2hxc n GLY 85 Ca 0.03 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.45 2hxc n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hxc s PHE 86 N -2.96 3.27 -0.01 1.61 0.40 -1.26 -0.39 117.98 118.64 2hxc s PHE 86 Ca 0.00 0.13 -0.30 0.00 -0.60 0.00 0.00 56.93 56.16 2hxc s PHE 86 Cb 0.00 -2.01 -0.06 0.00 0.51 0.00 0.00 43.02 41.45 2hxc s PHE 86 CO 0.00 0.26 1.59 -0.51 0.70 0.00 0.00 175.22 177.26 2hxc s LEU 87 N 0.01 4.33 0.55 -0.37 1.43 -0.46 -0.04 118.68 124.14 2hxc s LEU 87 Ca 0.06 2.28 0.25 0.00 -1.03 0.00 0.00 54.13 55.68 2hxc s LEU 87 Cb -0.12 -3.55 1.57 0.00 0.03 0.00 0.00 46.19 44.12 2hxc s LEU 87 CO 0.01 -0.86 2.19 0.00 0.23 0.00 0.00 176.35 177.91 2hxc h SER 89 N 0.00 0.00 -0.05 0.00 4.64 -1.73 -0.44 113.55 115.97 2hxc h SER 89 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2hxc h SER 89 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2hxc h SER 89 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2hxc n GLY 92 N -1.26 0.75 0.00 0.00 0.00 -1.23 -4.69 105.19 98.75 2hxc n GLY 92 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2hxc n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hxc n GLY 93 N -2.10 4.50 1.94 -0.02 0.00 -0.73 -4.38 105.19 104.41 2hxc n GLY 93 Ca 0.00 -2.01 -0.13 0.00 0.00 0.00 0.00 46.02 43.88 2hxc n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hxc n THR 94 N 0.00 0.00 0.31 2.61 -2.24 -0.67 -4.21 114.28 110.08 2hxc n THR 94 Ca 0.00 -1.42 0.17 0.00 -2.27 0.00 0.00 64.05 60.53 2hxc n THR 94 Cb 0.00 0.61 0.99 0.00 -2.10 0.00 0.00 70.33 69.83 2hxc n THR 94 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2hxc h THR 95 N 1.51 0.34 0.00 4.28 1.35 -1.92 -3.10 112.91 115.38 2hxc h THR 95 Ca -0.16 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2hxc h THR 95 Cb 0.71 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 2hxc h THR 95 CO 0.25 0.01 -0.07 0.35 -0.25 0.00 0.00 175.52 175.82 2hxc n THR 96 N -3.55 0.73 -4.03 6.82 -2.24 -1.26 -1.55 114.28 109.19 2hxc n THR 96 Ca -0.03 -0.80 -0.14 0.00 -2.27 0.00 0.00 64.05 60.81 2hxc n THR 96 Cb 0.10 0.51 -0.14 0.00 -2.10 0.00 0.00 70.33 68.70 2hxc n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2hxc s THR 97 N -0.91 0.23 0.37 4.28 -4.23 -1.17 -5.07 115.64 109.14 2hxc s THR 97 Ca 0.06 -0.11 -0.26 0.00 -1.18 0.00 0.00 61.69 60.20 2hxc s THR 97 Cb 0.05 -0.21 -0.09 0.00 1.34 0.00 0.00 72.50 73.59 2hxc s THR 97 CO 0.01 0.07 1.11 0.00 -0.54 0.00 0.00 174.62 175.27 2hxc n PRO 99 N 0.31 0.30 -1.62 0.00 -0.02 -1.26 -4.70 135.00 128.01 2hxc n PRO 99 Ca 0.03 0.15 -0.49 0.00 -2.02 0.00 0.00 63.50 61.17 2hxc n PRO 99 Cb 0.47 -1.96 -0.05 0.00 -0.02 0.00 0.00 33.50 31.94 2hxc n PRO 99 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2hxc n PRO 100 N -1.22 1.52 -0.89 0.52 -0.02 -1.26 -1.68 135.00 131.97 2hxc n PRO 100 Ca 0.11 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2hxc n PRO 100 Cb 0.50 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2hxc n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hxc n GLY 101 N 2.66 0.68 3.51 -1.23 0.00 -1.26 -5.03 105.19 104.52 2hxc n GLY 101 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2hxc n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hxc s SER 102 N -2.32 4.12 -0.15 1.61 1.04 -0.68 -4.72 113.70 112.60 2hxc s SER 102 Ca 0.00 -0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.05 2hxc s SER 102 Cb 0.00 -0.78 -0.03 0.00 0.10 0.00 0.00 66.02 65.31 2hxc s SER 102 CO 0.00 0.26 0.01 -0.89 0.98 0.00 0.00 173.24 173.59 2hxc s THR 103 N -0.97 4.29 0.41 2.02 2.01 0.17 -4.73 115.64 118.83 2hxc s THR 103 Ca 0.16 -0.22 -0.26 0.00 0.31 0.00 0.00 61.69 61.68 2hxc s THR 103 Cb -0.11 -2.89 -0.09 0.00 0.01 0.00 0.00 72.50 69.43 2hxc s THR 103 CO 0.07 0.50 1.36 -2.84 -0.69 0.00 0.00 174.62 173.02 2hxc s PRO 104 N 0.14 3.93 0.24 4.92 0.02 -1.26 -0.61 135.00 142.38 2hxc s PRO 104 Ca 0.01 2.28 -0.30 0.00 0.02 0.00 0.00 61.00 63.01 2hxc s PRO 104 Cb -0.13 -2.77 -0.09 0.00 0.02 0.00 0.00 34.50 31.53 2hxc s PRO 104 CO 0.02 -0.57 1.01 -1.54 -0.33 0.00 0.00 177.00 175.59 2hxc s SER 105 N -0.59 7.47 0.14 2.53 1.04 0.13 -4.89 113.70 119.53 2hxc s SER 105 Ca 0.57 2.06 0.24 0.00 0.48 0.00 0.00 55.95 59.31 2hxc s SER 105 Cb -0.41 -2.61 0.93 0.00 0.10 0.00 0.00 66.02 64.03 2hxc s SER 105 CO 0.53 0.01 1.75 -0.81 0.98 0.00 0.00 173.24 175.70 2hxc n PRO 106 N 1.55 0.14 -4.50 4.02 -0.04 -1.26 -4.75 135.00 130.17 2hxc n PRO 106 Ca -0.01 0.22 -0.24 0.00 -0.04 0.00 0.00 63.50 63.43 2hxc n PRO 106 Cb 0.46 -1.70 -0.10 0.00 -0.04 0.00 0.00 33.50 32.12 2hxc n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2hxc s ILE 107 N -3.11 2.00 0.00 0.52 -4.36 -1.26 -5.15 121.20 109.84 2hxc s ILE 107 Ca 0.09 -2.18 0.00 0.00 -0.26 0.00 0.00 60.65 58.31 2hxc s ILE 107 Cb 0.13 -2.56 0.00 0.00 1.25 0.00 0.00 42.46 41.28 2hxc s ILE 107 CO 0.48 -0.24 0.00 -1.54 0.24 0.00 0.00 174.94 173.88 2hxc n SER 108 N -0.70 1.14 -3.65 4.36 3.41 -1.26 -4.55 113.62 112.37 2hxc n SER 108 Ca -0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.43 2hxc n SER 108 Cb 0.63 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.51 2hxc n SER 108 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2hxc s ILE 110 N 0.95 -0.00 0.14 -1.33 -1.09 0.17 -3.31 121.20 116.72 2hxc s ILE 110 Ca 0.00 0.00 0.10 0.00 -2.23 0.00 0.00 60.65 58.52 2hxc s ILE 110 Cb 0.00 -0.91 -0.04 0.00 -1.58 0.00 0.00 42.46 39.93 2hxc s ILE 110 CO 0.00 0.00 -0.22 -0.83 -1.23 0.00 0.00 174.94 172.66 2hxc s GLY 111 N 0.60 1.65 -0.32 6.18 0.00 0.57 -4.59 107.32 111.40 2hxc s GLY 111 Ca -0.02 -1.44 -0.08 0.00 0.00 0.00 0.00 44.72 43.18 2hxc s GLY 111 CO -0.03 -1.43 0.12 -1.59 0.00 0.00 0.00 173.10 170.17 2hxc s THR 112 N -1.20 4.10 0.02 0.90 2.01 -1.26 -0.88 115.64 119.33 2hxc s THR 112 Ca 0.17 -0.81 0.09 0.00 0.31 0.00 0.00 61.69 61.45 2hxc s THR 112 Cb -0.10 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.19 2hxc s THR 112 CO 0.09 -0.05 -0.25 0.00 -0.69 0.00 0.00 174.62 173.71 2hxc s HIS 114 N -0.75 3.49 -0.43 0.00 2.46 -1.26 -0.73 115.29 118.06 2hxc s HIS 114 Ca 0.11 1.08 -0.21 0.00 0.47 0.00 0.00 55.06 56.51 2hxc s HIS 114 Cb -0.10 -2.77 0.02 0.00 -0.13 0.00 0.00 32.58 29.60 2hxc s HIS 114 CO 0.01 -0.01 0.67 1.21 -2.47 0.00 0.00 174.74 174.15 2hxc s ASN 115 N 0.93 6.35 0.00 9.88 3.84 0.43 -4.85 114.94 131.52 2hxc s ASN 115 Ca 0.33 -0.26 0.22 0.00 0.21 0.00 0.00 52.86 53.36 2hxc s ASN 115 Cb -0.17 -2.33 1.04 0.00 -0.55 0.00 0.00 41.25 39.24 2hxc s ASN 115 CO 0.14 -0.78 1.72 -0.81 -2.79 0.00 0.00 177.10 174.57 2hxc n PRO 116 N 6.32 0.16 -0.07 0.43 -0.04 -1.26 -0.53 135.00 140.01 2hxc n PRO 116 Ca -0.01 0.10 -0.13 0.00 -0.04 0.00 0.00 63.50 63.42 2hxc n PRO 116 Cb 0.48 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 2hxc n PRO 116 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2hxc h HIS 117 N 0.00 0.00 -0.02 0.54 3.86 -1.95 -3.37 115.15 114.21 2hxc h HIS 117 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2hxc h HIS 117 Cb 0.29 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.76 2hxc h HIS 117 CO 0.00 0.93 -0.46 -0.40 0.86 0.00 0.00 177.93 178.86 2hxc n ASP 118 N -4.61 2.00 -0.06 2.45 5.68 -1.23 -4.98 116.55 115.81 2hxc n ASP 118 Ca -0.11 -1.50 -0.01 0.00 -0.50 0.00 0.00 54.79 52.67 2hxc n ASP 118 Cb 0.45 0.45 -0.00 0.00 -1.14 0.00 0.00 41.12 40.88 2hxc n ASP 118 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2hxc n GLY 119 N 1.42 0.44 3.81 6.12 0.00 0.31 -5.02 105.19 112.27 2hxc n GLY 119 Ca 0.09 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 2hxc n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hxc s LYS 120 N -0.75 2.99 -0.03 1.61 1.02 -1.20 -4.85 119.74 118.54 2hxc s LYS 120 Ca 0.00 -0.75 -0.14 0.00 0.02 0.00 0.00 55.97 55.10 2hxc s LYS 120 Cb 0.00 -2.74 -0.05 0.00 -0.52 0.00 0.00 37.83 34.52 2hxc s LYS 120 CO 0.00 0.53 0.37 -0.51 -0.92 0.00 0.00 175.35 174.82 2hxc s ASP 121 N -2.82 6.74 0.06 2.83 1.01 -1.26 -0.43 116.67 122.80 2hxc s ASP 121 Ca 0.31 0.88 0.06 0.00 0.71 0.00 0.00 52.55 54.51 2hxc s ASP 121 Cb -0.11 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.57 2hxc s ASP 121 CO 0.24 0.31 -0.17 -0.31 0.21 0.00 0.00 175.17 175.45 2hxc s TYR 122 N -0.94 1.49 -0.13 4.23 1.51 0.09 -1.14 117.35 122.46 2hxc s TYR 122 Ca 0.22 -0.39 -0.28 0.00 -1.01 0.00 0.00 57.07 55.61 2hxc s TYR 122 Cb -0.16 -0.86 -0.01 0.00 -0.11 0.00 0.00 41.96 40.82 2hxc s TYR 122 CO 0.12 0.09 0.93 -0.51 -1.11 0.00 0.00 175.55 175.07 2hxc s LEU 123 N -1.45 4.22 -0.11 -1.29 1.43 0.20 -0.88 118.68 120.80 2hxc s LEU 123 Ca 0.03 1.39 0.02 0.00 -1.03 0.00 0.00 54.13 54.54 2hxc s LEU 123 Cb -0.09 -3.42 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 2hxc s LEU 123 CO 0.02 -0.42 -0.17 -0.63 0.23 0.00 0.00 176.35 175.38 2hxc s ILE 124 N 2.04 2.73 -0.26 -0.59 -1.09 -0.06 -1.06 121.20 122.91 2hxc s ILE 124 Ca 0.44 -0.79 -0.09 0.00 -2.23 0.00 0.00 60.65 57.99 2hxc s ILE 124 Cb -0.18 -2.11 -0.04 0.00 -1.58 0.00 0.00 42.46 38.56 2hxc s ILE 124 CO 0.16 0.54 0.12 -0.55 -1.23 0.00 0.00 174.94 173.98 2hxc s SER 125 N 0.25 5.53 -0.94 3.58 0.15 0.84 -0.32 113.70 122.78 2hxc s SER 125 Ca -0.11 -0.12 -0.14 0.00 0.70 0.00 0.00 55.95 56.28 2hxc s SER 125 Cb -0.16 -2.01 0.21 0.00 -1.71 0.00 0.00 66.02 62.35 2hxc s SER 125 CO 0.06 -0.04 0.97 -0.31 1.20 0.00 0.00 173.24 175.12 2hxc s TYR 126 N 1.68 3.75 0.05 3.44 1.51 -1.26 -1.06 117.35 125.46 2hxc s TYR 126 Ca 0.07 -2.06 -0.23 0.00 -1.01 0.00 0.00 57.07 53.83 2hxc s TYR 126 Cb -0.15 -3.95 -0.06 0.00 -0.11 0.00 0.00 41.96 37.69 2hxc s TYR 126 CO 0.07 -1.10 0.71 -1.01 -1.11 0.00 0.00 175.55 173.11 2hxc s HIS 127 N 0.40 3.75 0.46 2.71 3.76 -1.21 -4.56 115.29 120.60 2hxc s HIS 127 Ca 0.26 1.41 -0.08 0.00 -0.15 0.00 0.00 55.06 56.50 2hxc s HIS 127 Cb -0.08 -2.74 -0.05 0.00 1.11 0.00 0.00 32.58 30.82 2hxc s HIS 127 CO -0.08 0.34 0.80 -0.51 -0.85 0.00 0.00 174.74 174.44 2hxc s ASP 128 N -0.29 6.36 -0.11 1.40 1.01 -1.26 -0.70 116.67 123.07 2hxc s ASP 128 Ca 0.36 1.05 -0.02 0.00 0.71 0.00 0.00 52.55 54.64 2hxc s ASP 128 Cb -0.20 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 2hxc s ASP 128 CO 0.22 -0.54 -0.03 0.00 0.21 0.00 0.00 175.17 175.03 2hxc n GLY 131 N -0.33 0.68 3.11 0.00 0.00 -0.06 -0.66 105.19 107.94 2hxc n GLY 131 Ca -0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 2hxc n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hxc s LYS 132 N -0.38 0.67 0.93 1.61 1.02 -1.26 -4.93 119.74 117.40 2hxc s LYS 132 Ca 0.00 -1.06 -0.12 0.00 0.02 0.00 0.00 55.97 54.81 2hxc s LYS 132 Cb 0.00 -0.18 0.15 0.00 -0.52 0.00 0.00 37.83 37.28 2hxc s LYS 132 CO 0.00 -0.00 1.11 0.95 -0.92 0.00 0.00 175.35 176.49 2hxc s THR 133 N -2.67 2.27 0.08 2.17 -4.23 -1.26 -3.38 115.64 108.62 2hxc s THR 133 Ca 0.01 0.09 -0.35 0.00 -1.18 0.00 0.00 61.69 60.26 2hxc s THR 133 Cb -0.01 -2.69 -0.14 0.00 1.34 0.00 0.00 72.50 70.99 2hxc s THR 133 CO -0.03 -0.11 1.57 0.00 -0.54 0.00 0.00 174.62 175.50 2hxc n ALA 134 N -3.91 0.59 -0.20 3.99 0.00 -1.20 -4.56 120.51 115.23 2hxc n ALA 134 Ca 0.06 0.44 -0.06 0.00 0.00 0.00 0.00 53.44 53.88 2hxc n ALA 134 Cb 0.57 -2.29 0.03 0.00 0.00 0.00 0.00 19.45 17.77 2hxc n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hxc n GLY 136 N -1.25 1.55 3.64 0.00 0.00 -1.26 -5.02 105.19 102.84 2hxc n GLY 136 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2hxc n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hxc s ARG 137 N -0.25 2.63 -1.24 1.61 0.52 -1.26 -4.68 118.95 116.29 2hxc s ARG 137 Ca 0.00 -0.69 -0.02 0.00 -0.52 0.00 0.00 55.73 54.49 2hxc s ARG 137 Cb 0.00 -2.57 -0.01 0.00 0.52 0.00 0.00 34.95 32.89 2hxc s ARG 137 CO 0.00 0.60 0.81 0.00 0.02 0.00 0.00 175.30 176.73 2hxc s GLN 139 N -5.64 4.34 0.14 0.00 0.74 -1.26 -1.35 119.66 116.63 2hxc s GLN 139 Ca 0.09 2.03 0.08 0.00 0.05 0.00 0.00 55.36 57.60 2hxc s GLN 139 Cb -0.02 -3.26 -0.04 0.00 1.10 0.00 0.00 33.01 30.79 2hxc s GLN 139 CO 0.79 -0.40 -0.17 0.00 -0.55 0.00 0.00 175.29 174.96 2hxc n ASN 141 N 0.47 0.25 -4.90 0.00 5.15 -1.15 -1.42 115.26 113.66 2hxc n ASN 141 Ca -0.15 -3.05 -0.33 0.00 -0.60 0.00 0.00 54.58 50.45 2hxc n ASN 141 Cb 0.57 -0.25 -0.05 0.00 -0.53 0.00 0.00 39.78 39.52 2hxc n ASN 141 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2hxc s THR 142 N -1.83 5.36 -0.03 -0.44 2.01 0.17 -4.95 115.64 115.92 2hxc s THR 142 Ca 0.37 -0.10 0.07 0.00 0.31 0.00 0.00 61.69 62.34 2hxc s THR 142 Cb 0.31 -3.58 0.13 0.00 0.01 0.00 0.00 72.50 69.37 2hxc s THR 142 CO -0.09 0.26 1.06 0.00 -0.69 0.00 0.00 174.62 175.16 2hxc n GLN 143 N 0.74 0.32 -1.82 4.92 1.13 -1.10 -3.45 117.38 118.12 2hxc n GLN 143 Ca -0.09 -1.53 -0.42 0.00 -1.94 0.00 0.00 57.00 53.02 2hxc n GLN 143 Cb 0.52 -0.68 -0.03 0.00 0.11 0.00 0.00 30.24 30.16 2hxc n GLN 143 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2hxc s THR 144 N -0.70 3.18 -0.48 5.09 2.01 -0.44 -2.00 115.64 122.29 2hxc s THR 144 Ca 0.12 0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.43 2hxc s THR 144 Cb 0.12 -3.20 0.00 0.00 0.01 0.00 0.00 72.50 69.43 2hxc s THR 144 CO -0.02 -0.02 0.00 0.54 -0.69 0.00 0.00 174.62 174.43 2hxc n ARG 145 N 7.06 -1.25 -2.57 4.92 5.12 -1.26 -4.55 116.66 124.13 2hxc n ARG 145 Ca 0.18 0.55 -0.40 0.00 -1.93 0.00 0.00 57.85 56.26 2hxc n ARG 145 Cb 0.41 -4.60 -0.05 0.00 -1.16 0.00 0.00 32.46 27.06 2hxc n ARG 145 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 2hxc s GLU 146 N -1.95 4.65 0.15 5.56 -6.30 -0.85 -4.88 118.70 115.08 2hxc s GLU 146 Ca 0.00 1.67 0.03 0.00 -2.50 0.00 0.00 54.97 54.17 2hxc s GLU 146 Cb 0.00 -3.13 -0.05 0.00 0.00 0.00 0.00 34.13 30.96 2hxc s GLU 146 CO 0.00 0.26 -0.07 1.03 0.02 0.00 0.00 175.26 176.51 2hxc s ARG 147 N -1.51 1.06 1.28 4.30 1.81 -0.79 -5.02 118.95 120.07 2hxc s ARG 147 Ca 0.45 -1.47 -0.21 0.00 -1.72 0.00 0.00 55.73 52.78 2hxc s ARG 147 Cb -0.29 -0.49 0.32 0.00 -0.45 0.00 0.00 34.95 34.04 2hxc s ARG 147 CO 0.36 0.00 1.08 -2.14 -0.68 0.00 0.00 175.30 173.93 2hxc s PRO 148 N -3.80 -1.82 0.09 3.54 0.02 -1.26 -3.63 135.00 128.15 2hxc s PRO 148 Ca 0.18 -0.13 0.17 0.00 0.02 0.00 0.00 61.00 61.24 2hxc s PRO 148 Cb 0.04 -1.53 0.73 0.00 0.02 0.00 0.00 34.50 33.76 2hxc s PRO 148 CO 0.01 -4.09 1.54 0.41 -0.33 0.00 0.00 177.00 174.54 2hxc n GLY 149 N -0.51 -1.08 0.00 0.52 0.00 -1.26 -0.83 105.19 102.03 2hxc n GLY 149 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 2hxc n GLY 149 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2hxc n TYR 150 N -1.77 0.00 -3.44 1.61 0.18 -1.26 -2.74 117.16 109.74 2hxc n TYR 150 Ca 0.03 0.00 -0.27 0.00 1.88 0.00 0.00 57.90 59.54 2hxc n TYR 150 Cb 0.18 -0.31 -0.08 0.00 -0.38 0.00 0.00 39.34 38.75 2hxc n TYR 150 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2hxc n GLU 151 N -1.31 2.32 -0.27 -3.48 1.02 -0.01 -5.02 120.64 113.89 2hxc n GLU 151 Ca 0.10 -4.54 0.01 0.00 -0.02 0.00 0.00 57.16 52.71 2hxc n GLU 151 Cb 0.19 -2.18 0.14 0.00 -0.02 0.00 0.00 31.44 29.58 2hxc n GLU 151 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2hxc h PHE 152 N 4.27 0.78 -0.02 -0.32 3.57 -1.66 -0.56 116.94 123.00 2hxc h PHE 152 Ca 0.19 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2hxc h PHE 152 Cb 0.69 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.19 2hxc h PHE 152 CO 0.69 0.33 0.00 1.19 -2.23 0.00 0.00 178.31 178.29 2hxc n PHE 153 N -4.76 0.03 -0.06 0.41 3.01 -1.26 -2.01 117.46 112.81 2hxc n PHE 153 Ca 0.12 -0.01 0.09 0.00 1.01 0.00 0.00 57.45 58.66 2hxc n PHE 153 Cb 0.24 0.00 0.21 0.00 -0.01 0.00 0.00 39.48 39.92 2hxc n PHE 153 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2hxc n LEU 154 N -0.66 3.31 -4.55 4.37 4.77 -0.22 -0.66 117.00 123.36 2hxc n LEU 154 Ca 0.16 -1.78 -0.34 0.00 -0.03 0.00 0.00 56.01 54.02 2hxc n LEU 154 Cb 0.11 -0.30 -0.11 0.00 -2.33 0.00 0.00 43.42 40.79 2hxc n LEU 154 CO 0.12 0.79 -0.32 -2.28 -1.33 0.00 0.00 177.39 174.37 2hxc s HIS 155 N -1.11 3.10 -0.24 -1.77 2.46 -0.85 -1.89 115.29 114.98 2hxc s HIS 155 Ca 0.34 -0.15 0.12 0.00 0.47 0.00 0.00 55.06 55.84 2hxc s HIS 155 Cb 0.19 -1.98 0.26 0.00 -0.13 0.00 0.00 32.58 30.92 2hxc s HIS 155 CO 0.25 0.06 1.18 0.27 -2.47 0.00 0.00 174.74 174.04 2hxc n ASN 156 N 3.42 2.68 -1.51 9.88 0.23 -1.26 -4.35 115.26 124.34 2hxc n ASN 156 Ca -0.17 -2.58 0.08 0.00 -0.53 0.00 0.00 54.58 51.37 2hxc n ASN 156 Cb 0.52 -0.30 0.32 0.00 -2.08 0.00 0.00 39.78 38.25 2hxc n ASN 156 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2hxc n ASP 157 N -0.64 4.47 -4.47 0.53 8.00 -1.26 -4.70 116.55 118.47 2hxc n ASP 157 Ca 0.12 -2.50 -0.26 0.00 0.71 0.00 0.00 54.79 52.86 2hxc n ASP 157 Cb 0.55 -0.57 -0.11 0.00 -0.02 0.00 0.00 41.12 40.97 2hxc n ASP 157 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2hxc s VAL 158 N -2.00 2.60 -0.50 2.53 -7.23 -1.26 -5.10 120.40 109.44 2hxc s VAL 158 Ca 0.45 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 58.32 2hxc s VAL 158 Cb 0.31 -2.28 0.03 0.00 0.56 0.00 0.00 36.38 34.99 2hxc s VAL 158 CO 0.19 -0.17 1.13 0.21 -0.31 0.00 0.00 175.10 176.15 2hxc s ASN 159 N -2.89 6.58 0.00 4.85 2.47 -1.26 -4.71 114.94 119.98 2hxc s ASN 159 Ca 0.24 0.36 0.24 0.00 0.42 0.00 0.00 52.86 54.11 2hxc s ASN 159 Cb -0.08 -2.54 1.39 0.00 -1.45 0.00 0.00 41.25 38.57 2hxc s ASN 159 CO 0.12 -1.29 1.78 0.79 -3.72 0.00 0.00 177.10 174.78 2hxc n TRP 160 N 7.93 0.00 1.98 0.43 7.02 -1.26 -1.33 117.44 132.22 2hxc n TRP 160 Ca 0.11 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.71 2hxc n TRP 160 Cb 0.49 -0.03 0.72 0.00 -2.42 0.00 0.00 31.31 30.06 2hxc n TRP 160 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2hxc h MET 162 N 0.05 0.00 -0.23 0.00 -0.00 -1.48 -1.71 114.93 111.57 2hxc h MET 162 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2hxc h MET 162 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.61 2hxc h MET 162 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.91 2hxc n ALA 163 N -2.28 2.36 -1.57 -3.00 0.00 -1.26 -4.91 120.51 109.85 2hxc n ALA 163 Ca -0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 53.44 52.24 2hxc n ALA 163 Cb 0.25 -0.52 0.07 0.00 0.00 0.00 0.00 19.45 19.25 2hxc n ALA 163 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2hxc s ASN 164 N -1.10 4.87 0.28 0.00 0.02 -0.64 -4.95 114.94 113.42 2hxc s ASN 164 Ca 0.23 1.43 0.00 0.00 -1.02 0.00 0.00 52.86 53.50 2hxc s ASN 164 Cb 0.14 -2.22 0.53 0.00 0.02 0.00 0.00 41.25 39.71 2hxc s ASN 164 CO 0.19 -1.74 1.84 -0.08 0.02 0.00 0.00 177.10 177.33 2hxc h GLU 165 N -0.93 0.98 -4.62 -0.60 4.81 -1.95 -3.34 114.58 108.93 2hxc h GLU 165 Ca -0.46 -0.06 -0.58 0.00 -0.13 0.00 0.00 59.36 58.13 2hxc h GLU 165 Cb 1.24 -0.22 -0.35 0.00 0.63 0.00 0.00 28.75 30.05 2hxc h GLU 165 CO 0.58 0.65 -0.83 1.21 -0.73 0.00 0.00 179.01 179.90 2hxc s ASN 166 N -5.71 2.47 0.00 1.04 3.84 -1.26 -5.03 114.94 110.28 2hxc s ASN 166 Ca -0.12 -0.43 0.27 0.00 0.21 0.00 0.00 52.86 52.80 2hxc s ASN 166 Cb 0.22 -1.07 1.18 0.00 -0.55 0.00 0.00 41.25 41.03 2hxc s ASN 166 CO 0.81 -0.03 1.81 -1.54 -2.79 0.00 0.00 177.10 175.36 2hxc n SER 167 N 4.53 1.13 -4.72 -4.21 3.41 -1.26 -3.30 113.62 109.21 2hxc n SER 167 Ca -0.17 -1.42 -0.42 0.00 -0.26 0.00 0.00 58.87 56.59 2hxc n SER 167 Cb 0.51 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 2hxc n SER 167 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2hxc s THR 168 N -1.97 2.43 -0.13 6.66 2.01 -1.26 -4.69 115.64 118.69 2hxc s THR 168 Ca 0.39 0.29 -0.21 0.00 0.31 0.00 0.00 61.69 62.46 2hxc s THR 168 Cb 0.20 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 2hxc s THR 168 CO 0.32 0.02 0.64 0.12 -0.69 0.00 0.00 174.62 175.03 2hxc s PHE 169 N 1.26 3.48 -0.12 4.92 5.36 -1.26 -0.88 117.98 130.74 2hxc s PHE 169 Ca 0.72 1.05 -0.12 0.00 -0.96 0.00 0.00 56.93 57.63 2hxc s PHE 169 Cb -0.46 -2.77 -0.05 0.00 -0.34 0.00 0.00 43.02 39.40 2hxc s PHE 169 CO 0.32 -0.02 -0.24 1.58 -1.46 0.00 0.00 175.22 175.39 2hxc n HIS 170 N 4.35 0.00 -3.82 10.12 -0.00 -0.18 -3.22 115.22 122.46 2hxc n HIS 170 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.64 2hxc n HIS 170 Cb 0.51 -0.44 -0.01 0.00 -0.00 0.00 0.00 29.99 30.04 2hxc n HIS 170 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2hxc s THR 172 N -3.56 2.63 0.29 0.00 2.01 0.94 -0.19 115.64 117.77 2hxc s THR 172 Ca 0.12 -0.85 0.06 0.00 0.31 0.00 0.00 61.69 61.33 2hxc s THR 172 Cb -0.04 -2.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 2hxc s THR 172 CO 0.05 0.57 0.37 0.42 -0.69 0.00 0.00 174.62 175.34 2hxc s THR 173 N -0.23 4.44 -0.47 -0.82 -4.23 0.12 -1.58 115.64 112.88 2hxc s THR 173 Ca -0.00 -1.10 0.03 0.00 -1.18 0.00 0.00 61.69 59.43 2hxc s THR 173 Cb -0.13 -3.53 0.14 0.00 1.34 0.00 0.00 72.50 70.32 2hxc s THR 173 CO 0.03 -0.24 0.27 -0.44 -0.54 0.00 0.00 174.62 173.70 2hxc s SER 174 N -4.04 3.64 -0.22 3.99 0.01 -0.60 -3.35 113.70 113.13 2hxc s SER 174 Ca 0.39 -2.81 -0.15 0.00 1.31 0.00 0.00 55.95 54.69 2hxc s SER 174 Cb -0.09 -1.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.01 2hxc s SER 174 CO 0.29 -0.24 0.38 -0.69 0.41 0.00 0.00 173.24 173.39 2hxc s VAL 175 N 0.10 5.20 -0.19 3.43 1.01 -0.22 -4.71 120.40 125.02 2hxc s VAL 175 Ca 0.19 0.65 -0.29 0.00 0.00 0.00 0.00 61.98 62.53 2hxc s VAL 175 Cb -0.20 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 2hxc s VAL 175 CO -0.03 0.22 1.23 -0.22 0.00 0.00 0.00 175.10 176.30 2hxc s LEU 176 N 1.54 4.14 -0.18 3.92 2.96 -1.26 -0.11 118.68 129.68 2hxc s LEU 176 Ca 0.17 1.60 -0.19 0.00 -0.22 0.00 0.00 54.13 55.49 2hxc s LEU 176 Cb -0.15 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.84 2hxc s LEU 176 CO 0.08 -0.78 0.19 0.58 -1.32 0.00 0.00 176.35 175.11 2hxc h VAL 177 N 5.53 0.80 0.00 1.68 2.07 -1.46 -3.48 116.25 121.39 2hxc h VAL 177 Ca -0.25 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.35 2hxc h VAL 177 Cb 1.10 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 2hxc h VAL 177 CO 0.98 0.27 0.00 0.61 0.02 0.00 0.00 177.57 179.45 2hxc n GLY 178 N 1.50 -1.56 3.77 2.17 0.00 -1.19 -5.01 105.19 104.87 2hxc n GLY 178 Ca -0.24 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.23 2hxc n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hxc s LEU 179 N 0.00 4.33 0.00 0.99 1.43 -1.26 -0.62 118.68 123.55 2hxc s LEU 179 Ca 0.00 2.87 0.25 0.00 -1.03 0.00 0.00 54.13 56.22 2hxc s LEU 179 Cb 0.00 -3.70 1.50 0.00 0.03 0.00 0.00 46.19 44.02 2hxc s LEU 179 CO 0.00 -0.77 1.86 0.00 0.23 0.00 0.00 176.35 177.67