#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iuq h VAL 72 N 0.00 0.00 -0.06 3.84 -1.51 -2.02 -2.48 116.25 114.02 2iuq h VAL 72 Ca 0.00 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 2iuq h VAL 72 Cb 0.00 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.44 2iuq h VAL 72 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.93 2iuq n ASN 73 N -2.74 1.09 -4.85 4.19 3.02 -1.26 -4.87 115.26 109.85 2iuq n ASN 73 Ca 0.01 -1.47 -0.37 0.00 -0.03 0.00 0.00 54.58 52.72 2iuq n ASN 73 Cb 0.27 -0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 2iuq n ASN 73 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2iuq s SER 74 N -1.80 6.70 0.57 6.41 0.15 -0.93 -4.95 113.70 119.85 2iuq s SER 74 Ca 0.36 0.83 0.29 0.00 0.70 0.00 0.00 55.95 58.14 2iuq s SER 74 Cb 0.19 -2.20 1.72 0.00 -1.71 0.00 0.00 66.02 64.02 2iuq s SER 74 CO 0.30 0.31 2.21 0.00 1.20 0.00 0.00 173.24 177.26 2iuq n ASP 76 N -3.79 0.91 -4.75 0.00 8.00 -1.26 -4.76 116.55 110.90 2iuq n ASP 76 Ca -0.03 -1.34 -0.41 0.00 0.71 0.00 0.00 54.79 53.72 2iuq n ASP 76 Cb 0.12 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.20 2iuq n ASP 76 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2iuq s TYR 77 N -1.98 2.79 0.49 1.24 6.04 -0.86 -4.85 117.35 120.21 2iuq s TYR 77 Ca 0.41 0.83 0.16 0.00 0.04 0.00 0.00 57.07 58.51 2iuq s TYR 77 Cb 0.21 -4.03 1.19 0.00 -1.04 0.00 0.00 41.96 38.28 2iuq s TYR 77 CO 0.34 -3.44 2.06 0.11 -1.54 0.00 0.00 175.55 173.08 2iuq h TRP 78 N 4.83 0.17 0.00 4.97 5.08 -1.89 -0.65 115.95 128.46 2iuq h TRP 78 Ca -0.47 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.51 2iuq h TRP 78 Cb 1.22 -0.06 0.00 0.00 -3.00 0.00 0.00 29.16 27.32 2iuq h TRP 78 CO 0.59 0.09 0.00 0.54 -1.28 0.00 0.00 178.44 178.38 2iuq n ARG 79 N -4.48 0.14 -0.78 0.12 1.74 -1.26 -3.28 116.66 108.87 2iuq n ARG 79 Ca 0.04 0.24 -0.04 0.00 -0.77 0.00 0.00 57.85 57.32 2iuq n ARG 79 Cb 0.27 -1.70 0.24 0.00 -1.02 0.00 0.00 32.46 30.25 2iuq n ARG 79 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2iuq n HIS 80 N -1.95 1.87 0.38 -1.55 8.25 -0.25 -4.68 115.22 117.29 2iuq n HIS 80 Ca 0.04 -0.93 0.12 0.00 -0.26 0.00 0.00 57.72 56.69 2iuq n HIS 80 Cb 0.30 -0.56 0.49 0.00 1.12 0.00 0.00 29.99 31.34 2iuq n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2iuq n ALA 82 N -1.76 3.01 -2.55 0.00 0.00 -1.26 -1.30 120.51 116.65 2iuq n ALA 82 Ca 0.02 -2.82 -0.42 0.00 0.00 0.00 0.00 53.44 50.22 2iuq n ALA 82 Cb 0.21 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 2iuq n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2iuq s VAL 83 N -1.80 4.47 -0.37 0.00 1.01 -0.93 -4.84 120.40 117.93 2iuq s VAL 83 Ca 0.36 1.77 0.03 0.00 0.00 0.00 0.00 61.98 64.14 2iuq s VAL 83 Cb 0.38 -4.14 0.11 0.00 0.00 0.00 0.00 36.38 32.72 2iuq s VAL 83 CO -0.11 -0.03 0.10 -0.62 0.00 0.00 0.00 175.10 174.44 2iuq s ASP 84 N 1.37 4.54 0.00 3.32 2.15 -1.26 -0.98 116.67 125.82 2iuq s ASP 84 Ca 0.52 -2.26 0.00 0.00 0.43 0.00 0.00 52.55 51.24 2iuq s ASP 84 Cb -0.21 -1.50 0.00 0.00 -0.30 0.00 0.00 42.92 40.90 2iuq s ASP 84 CO 0.18 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.44 2iuq n GLY 85 N 4.10 -0.81 3.78 2.66 0.00 -0.55 -5.00 105.19 109.37 2iuq n GLY 85 Ca 0.04 -1.36 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 2iuq n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2iuq s PHE 86 N -2.81 3.55 -0.07 1.61 0.40 -1.26 -0.30 117.98 119.10 2iuq s PHE 86 Ca 0.00 0.66 -0.30 0.00 -0.60 0.00 0.00 56.93 56.70 2iuq s PHE 86 Cb 0.00 -2.24 -0.05 0.00 0.51 0.00 0.00 43.02 41.24 2iuq s PHE 86 CO 0.00 0.43 1.49 -0.51 0.70 0.00 0.00 175.22 177.33 2iuq s LEU 87 N -0.18 4.28 0.57 -0.37 1.43 -0.49 -0.16 118.68 123.76 2iuq s LEU 87 Ca 0.18 2.07 0.27 0.00 -1.03 0.00 0.00 54.13 55.61 2iuq s LEU 87 Cb -0.14 -3.54 1.68 0.00 0.03 0.00 0.00 46.19 44.23 2iuq s LEU 87 CO 0.06 -0.83 2.22 0.00 0.23 0.00 0.00 176.35 178.03 2iuq h SER 89 N 0.00 0.00 -0.03 0.00 4.64 -1.74 -0.48 113.55 115.94 2iuq h SER 89 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2iuq h SER 89 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2iuq h SER 89 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2iuq n GLY 92 N -1.12 0.74 0.00 0.00 0.00 -1.22 -4.71 105.19 98.89 2iuq n GLY 92 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2iuq n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iuq n GLY 93 N -2.18 4.71 2.69 -0.02 0.00 -0.66 -4.44 105.19 105.29 2iuq n GLY 93 Ca 0.00 -1.97 -0.19 0.00 0.00 0.00 0.00 46.02 43.86 2iuq n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2iuq n THR 94 N 0.00 0.00 0.21 2.61 -2.24 -0.78 -4.24 114.28 109.84 2iuq n THR 94 Ca 0.00 -1.93 0.16 0.00 -2.27 0.00 0.00 64.05 60.00 2iuq n THR 94 Cb 0.00 0.75 0.80 0.00 -2.10 0.00 0.00 70.33 69.79 2iuq n THR 94 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2iuq h THR 95 N 1.61 0.58 0.00 4.28 2.02 -1.92 -2.87 112.91 116.61 2iuq h THR 95 Ca -0.24 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2iuq h THR 95 Cb 0.98 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 2iuq h THR 95 CO 0.38 0.00 -0.04 0.35 0.37 0.00 0.00 175.52 176.57 2iuq n THR 96 N -3.97 0.85 -3.99 3.16 -2.24 -1.26 -0.81 114.28 106.02 2iuq n THR 96 Ca 0.01 -0.92 -0.11 0.00 -2.27 0.00 0.00 64.05 60.75 2iuq n THR 96 Cb 0.28 0.47 -0.12 0.00 -2.10 0.00 0.00 70.33 68.86 2iuq n THR 96 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2iuq s THR 97 N -1.04 0.20 0.35 4.28 -4.23 -1.08 -5.04 115.64 109.08 2iuq s THR 97 Ca 0.06 -0.63 -0.25 0.00 -1.18 0.00 0.00 61.69 59.69 2iuq s THR 97 Cb 0.05 -0.28 -0.10 0.00 1.34 0.00 0.00 72.50 73.52 2iuq s THR 97 CO 0.01 -0.27 0.95 0.00 -0.54 0.00 0.00 174.62 174.76 2iuq n PRO 99 N 0.32 0.42 -1.61 0.00 -0.02 -1.26 -4.72 135.00 128.14 2iuq n PRO 99 Ca 0.03 0.21 -0.50 0.00 -2.02 0.00 0.00 63.50 61.22 2iuq n PRO 99 Cb 0.51 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 2iuq n PRO 99 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2iuq n PRO 100 N -2.33 1.44 -0.93 0.52 -0.02 -1.26 -2.07 135.00 130.35 2iuq n PRO 100 Ca 0.13 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2iuq n PRO 100 Cb 0.50 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 2iuq n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2iuq n GLY 101 N 2.70 0.61 3.50 -1.23 0.00 -1.26 -5.03 105.19 104.48 2iuq n GLY 101 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2iuq n GLY 101 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2iuq s SER 102 N -2.18 3.99 -0.12 1.61 1.04 -0.88 -4.71 113.70 112.44 2iuq s SER 102 Ca 0.00 -0.43 -0.01 0.00 0.48 0.00 0.00 55.95 55.98 2iuq s SER 102 Cb 0.00 -0.67 -0.02 0.00 0.10 0.00 0.00 66.02 65.43 2iuq s SER 102 CO 0.00 0.22 -0.07 -0.89 0.98 0.00 0.00 173.24 173.48 2iuq s THR 103 N -1.04 3.58 0.43 2.02 2.01 -0.35 -4.71 115.64 117.58 2iuq s THR 103 Ca 0.17 -0.48 -0.26 0.00 0.31 0.00 0.00 61.69 61.43 2iuq s THR 103 Cb -0.11 -2.52 -0.09 0.00 0.01 0.00 0.00 72.50 69.79 2iuq s THR 103 CO 0.08 0.53 1.40 -2.84 -0.69 0.00 0.00 174.62 173.10 2iuq s PRO 104 N 0.06 3.80 0.20 4.92 0.02 -1.26 -0.20 135.00 142.54 2iuq s PRO 104 Ca -0.02 2.35 -0.30 0.00 0.02 0.00 0.00 61.00 63.06 2iuq s PRO 104 Cb -0.14 -2.71 -0.08 0.00 0.02 0.00 0.00 34.50 31.59 2iuq s PRO 104 CO 0.03 -0.70 1.05 -1.54 -0.33 0.00 0.00 177.00 175.51 2iuq s SER 105 N -0.55 7.38 0.40 2.53 1.04 0.29 -4.87 113.70 119.92 2iuq s SER 105 Ca 0.59 2.05 0.20 0.00 0.48 0.00 0.00 55.95 59.27 2iuq s SER 105 Cb -0.42 -2.61 0.77 0.00 0.10 0.00 0.00 66.02 63.86 2iuq s SER 105 CO 0.55 -0.11 1.78 1.55 0.98 0.00 0.00 173.24 177.98 2iuq h PRO 106 N 4.74 0.00 -6.14 4.02 0.13 -1.91 -3.44 132.00 129.40 2iuq h PRO 106 Ca -0.45 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.17 2iuq h PRO 106 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2iuq h PRO 106 CO 0.70 0.33 -0.46 0.96 -0.23 0.00 0.00 178.00 179.30 2iuq s ILE 107 N -3.69 3.10 0.00 -3.56 -4.36 -1.26 -5.12 121.20 106.31 2iuq s ILE 107 Ca -0.00 -1.49 0.00 0.00 -0.26 0.00 0.00 60.65 58.90 2iuq s ILE 107 Cb 0.11 -3.07 0.00 0.00 1.25 0.00 0.00 42.46 40.75 2iuq s ILE 107 CO 0.67 -0.13 0.00 -1.54 0.24 0.00 0.00 174.94 174.19 2iuq n SER 108 N -1.33 2.14 -3.64 4.36 3.41 -1.26 -4.59 113.62 112.70 2iuq n SER 108 Ca -0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.49 2iuq n SER 108 Cb 0.61 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.49 2iuq n SER 108 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2iuq s ILE 110 N 0.69 -0.00 0.16 -1.33 -1.09 -0.35 -4.87 121.20 114.41 2iuq s ILE 110 Ca 0.00 0.00 0.08 0.00 -2.23 0.00 0.00 60.65 58.50 2iuq s ILE 110 Cb 0.00 -0.98 -0.04 0.00 -1.58 0.00 0.00 42.46 39.86 2iuq s ILE 110 CO 0.00 0.00 -0.08 -0.83 -1.23 0.00 0.00 174.94 172.80 2iuq s GLY 111 N 0.98 1.74 -0.33 6.18 0.00 0.21 -4.62 107.32 111.49 2iuq s GLY 111 Ca -0.05 -1.40 -0.05 0.00 0.00 0.00 0.00 44.72 43.22 2iuq s GLY 111 CO -0.09 -1.41 0.08 -1.59 0.00 0.00 0.00 173.10 170.09 2iuq s THR 112 N -1.59 3.62 0.02 0.90 2.01 -1.26 -0.32 115.64 119.02 2iuq s THR 112 Ca 0.24 -1.15 0.06 0.00 0.31 0.00 0.00 61.69 61.15 2iuq s THR 112 Cb -0.09 -3.04 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 2iuq s THR 112 CO 0.15 -0.14 -0.17 0.00 -0.69 0.00 0.00 174.62 173.77 2iuq s HIS 114 N -0.86 3.32 -0.29 0.00 2.46 -1.26 -0.49 115.29 118.16 2iuq s HIS 114 Ca 0.14 0.99 -0.29 0.00 0.47 0.00 0.00 55.06 56.37 2iuq s HIS 114 Cb -0.11 -2.92 0.01 0.00 -0.13 0.00 0.00 32.58 29.44 2iuq s HIS 114 CO 0.04 -0.31 1.05 1.21 -2.47 0.00 0.00 174.74 174.26 2iuq s ASN 115 N 1.34 6.96 0.00 9.88 3.84 0.48 -4.88 114.94 132.56 2iuq s ASN 115 Ca 0.31 1.11 0.27 0.00 0.21 0.00 0.00 52.86 54.76 2iuq s ASN 115 Cb -0.16 -2.53 1.38 0.00 -0.55 0.00 0.00 41.25 39.39 2iuq s ASN 115 CO 0.09 -0.80 1.93 -0.81 -2.79 0.00 0.00 177.10 174.71 2iuq n PRO 116 N 6.67 0.41 -0.11 0.43 -0.04 -1.26 -1.07 135.00 140.04 2iuq n PRO 116 Ca 0.11 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.39 2iuq n PRO 116 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 2iuq n PRO 116 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2iuq n HIS 117 N -1.27 0.83 0.79 0.54 8.25 -1.26 -4.59 115.22 118.50 2iuq n HIS 117 Ca 0.13 0.36 0.09 0.00 -0.26 0.00 0.00 57.72 58.04 2iuq n HIS 117 Cb 0.21 -1.04 0.03 0.00 1.12 0.00 0.00 29.99 30.30 2iuq n HIS 117 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2iuq n ASP 118 N -4.42 2.07 0.00 0.41 5.68 -1.24 -4.99 116.55 114.07 2iuq n ASP 118 Ca -0.33 -1.54 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 2iuq n ASP 118 Cb 0.68 0.29 0.00 0.00 -1.14 0.00 0.00 41.12 40.94 2iuq n ASP 118 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2iuq n GLY 119 N 1.17 0.40 3.93 6.12 0.00 -0.23 -5.01 105.19 111.56 2iuq n GLY 119 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 2iuq n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iuq s LYS 120 N -0.51 3.37 -0.04 1.61 1.02 -1.24 -4.83 119.74 119.12 2iuq s LYS 120 Ca 0.00 -0.68 -0.12 0.00 0.02 0.00 0.00 55.97 55.18 2iuq s LYS 120 Cb 0.00 -2.90 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 2iuq s LYS 120 CO 0.00 0.49 0.32 -0.51 -0.92 0.00 0.00 175.35 174.73 2iuq s ASP 121 N -3.45 6.68 0.04 2.83 1.01 -1.26 -0.39 116.67 122.13 2iuq s ASP 121 Ca 0.34 0.81 0.06 0.00 0.71 0.00 0.00 52.55 54.47 2iuq s ASP 121 Cb -0.10 -2.19 -0.02 0.00 1.01 0.00 0.00 42.92 41.61 2iuq s ASP 121 CO 0.28 0.35 -0.18 -0.31 0.21 0.00 0.00 175.17 175.52 2iuq s TYR 122 N -1.06 1.59 -0.13 4.23 1.51 0.35 -4.62 117.35 119.22 2iuq s TYR 122 Ca 0.21 -0.36 -0.29 0.00 -1.01 0.00 0.00 57.07 55.61 2iuq s TYR 122 Cb -0.15 -0.95 -0.01 0.00 -0.11 0.00 0.00 41.96 40.74 2iuq s TYR 122 CO 0.10 0.07 1.00 -0.51 -1.11 0.00 0.00 175.55 175.11 2iuq s LEU 123 N -1.14 4.22 -0.12 -1.29 1.43 0.59 -0.72 118.68 121.66 2iuq s LEU 123 Ca 0.05 1.49 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 2iuq s LEU 123 Cb -0.08 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.58 2iuq s LEU 123 CO 0.02 -0.48 -0.14 -0.63 0.23 0.00 0.00 176.35 175.35 2iuq s ILE 124 N 2.20 3.00 -0.27 -0.59 -1.09 0.57 -1.17 121.20 123.85 2iuq s ILE 124 Ca 0.47 -0.68 -0.11 0.00 -2.23 0.00 0.00 60.65 58.10 2iuq s ILE 124 Cb -0.18 -2.25 -0.05 0.00 -1.58 0.00 0.00 42.46 38.41 2iuq s ILE 124 CO 0.16 0.53 0.20 -0.55 -1.23 0.00 0.00 174.94 174.04 2iuq s SER 125 N 0.29 6.07 -0.79 3.58 0.15 0.47 -0.62 113.70 122.84 2iuq s SER 125 Ca -0.10 0.05 -0.15 0.00 0.70 0.00 0.00 55.95 56.45 2iuq s SER 125 Cb -0.16 -2.12 0.20 0.00 -1.71 0.00 0.00 66.02 62.23 2iuq s SER 125 CO 0.06 -0.02 0.76 -0.31 1.20 0.00 0.00 173.24 174.92 2iuq s TYR 126 N 1.57 3.65 -0.04 3.44 1.51 -1.26 -1.09 117.35 125.12 2iuq s TYR 126 Ca 0.08 -1.85 -0.21 0.00 -1.01 0.00 0.00 57.07 54.08 2iuq s TYR 126 Cb -0.15 -3.85 -0.05 0.00 -0.11 0.00 0.00 41.96 37.80 2iuq s TYR 126 CO 0.09 -1.03 0.61 -1.01 -1.11 0.00 0.00 175.55 173.10 2iuq s HIS 127 N 0.54 3.62 0.53 2.71 3.76 -1.22 -4.58 115.29 120.65 2iuq s HIS 127 Ca 0.17 1.16 -0.13 0.00 -0.15 0.00 0.00 55.06 56.11 2iuq s HIS 127 Cb -0.13 -2.67 -0.06 0.00 1.11 0.00 0.00 32.58 30.83 2iuq s HIS 127 CO -0.07 0.23 0.96 -0.51 -0.85 0.00 0.00 174.74 174.49 2iuq s ASP 128 N 0.29 6.47 -0.15 1.40 1.01 -1.26 -0.75 116.67 123.68 2iuq s ASP 128 Ca 0.32 1.42 -0.04 0.00 0.71 0.00 0.00 52.55 54.97 2iuq s ASP 128 Cb -0.18 -2.45 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 2iuq s ASP 128 CO 0.16 -0.64 -0.02 0.00 0.21 0.00 0.00 175.17 174.87 2iuq n GLY 131 N -0.45 0.68 3.07 0.00 0.00 0.00 -1.21 105.19 107.28 2iuq n GLY 131 Ca -0.07 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 2iuq n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2iuq s LYS 132 N -0.72 0.51 0.88 1.61 1.02 -1.25 -4.91 119.74 116.87 2iuq s LYS 132 Ca 0.00 -0.82 -0.12 0.00 0.02 0.00 0.00 55.97 55.05 2iuq s LYS 132 Cb 0.00 0.19 0.12 0.00 -0.52 0.00 0.00 37.83 37.62 2iuq s LYS 132 CO 0.00 -0.11 1.12 0.95 -0.92 0.00 0.00 175.35 176.39 2iuq s THR 133 N -2.58 2.41 0.13 2.17 -4.23 -1.26 -3.18 115.64 109.09 2iuq s THR 133 Ca -0.05 0.13 -0.35 0.00 -1.18 0.00 0.00 61.69 60.24 2iuq s THR 133 Cb -0.02 -2.83 -0.15 0.00 1.34 0.00 0.00 72.50 70.84 2iuq s THR 133 CO -0.05 -0.17 1.47 0.00 -0.54 0.00 0.00 174.62 175.33 2iuq n ALA 134 N -3.71 0.35 -0.18 3.99 0.00 -1.24 -4.52 120.51 115.20 2iuq n ALA 134 Ca 0.07 0.48 -0.09 0.00 0.00 0.00 0.00 53.44 53.89 2iuq n ALA 134 Cb 0.58 -2.23 0.01 0.00 0.00 0.00 0.00 19.45 17.81 2iuq n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2iuq n GLY 136 N -0.63 0.86 3.46 0.00 0.00 -1.26 -5.02 105.19 102.60 2iuq n GLY 136 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2iuq n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2iuq s ARG 137 N -0.28 2.24 -1.20 1.61 0.52 -1.26 -4.75 118.95 115.83 2iuq s ARG 137 Ca 0.00 -0.87 -0.06 0.00 -0.52 0.00 0.00 55.73 54.28 2iuq s ARG 137 Cb 0.00 -2.26 -0.02 0.00 0.52 0.00 0.00 34.95 33.19 2iuq s ARG 137 CO 0.00 0.57 0.79 0.00 0.02 0.00 0.00 175.30 176.69 2iuq s GLN 139 N -5.58 4.34 0.14 0.00 0.74 -1.26 -1.40 119.66 116.64 2iuq s GLN 139 Ca 0.21 1.98 0.08 0.00 0.05 0.00 0.00 55.36 57.68 2iuq s GLN 139 Cb -0.05 -3.36 -0.04 0.00 1.10 0.00 0.00 33.01 30.66 2iuq s GLN 139 CO 0.80 -0.43 -0.20 0.00 -0.55 0.00 0.00 175.29 174.91 2iuq n ASN 141 N 0.63 -1.17 -4.57 0.00 5.15 -1.19 -1.48 115.26 112.62 2iuq n ASN 141 Ca -0.16 -2.68 -0.31 0.00 -0.60 0.00 0.00 54.58 50.84 2iuq n ASN 141 Cb 0.55 0.15 -0.10 0.00 -0.53 0.00 0.00 39.78 39.85 2iuq n ASN 141 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2iuq s THR 142 N -0.05 3.44 -0.04 -0.44 2.01 -0.15 -4.99 115.64 115.42 2iuq s THR 142 Ca 0.33 -1.01 0.15 0.00 0.31 0.00 0.00 61.69 61.47 2iuq s THR 142 Cb 0.09 -2.54 0.28 0.00 0.01 0.00 0.00 72.50 70.34 2iuq s THR 142 CO -0.15 0.28 1.12 0.00 -0.69 0.00 0.00 174.62 175.18 2iuq n GLN 143 N 1.22 0.34 -1.74 4.92 1.13 -1.12 -3.65 117.38 118.48 2iuq n GLN 143 Ca -0.15 -1.91 -0.42 0.00 -1.94 0.00 0.00 57.00 52.58 2iuq n GLN 143 Cb 0.52 -0.52 -0.03 0.00 0.11 0.00 0.00 30.24 30.32 2iuq n GLN 143 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2iuq s THR 144 N -0.71 3.16 -0.88 5.09 2.01 -0.42 -2.02 115.64 121.87 2iuq s THR 144 Ca 0.23 0.18 0.00 0.00 0.31 0.00 0.00 61.69 62.42 2iuq s THR 144 Cb 0.25 -3.15 0.00 0.00 0.01 0.00 0.00 72.50 69.61 2iuq s THR 144 CO -0.08 -0.06 0.00 0.54 -0.69 0.00 0.00 174.62 174.33 2iuq n ARG 145 N 7.95 -1.07 -2.61 4.92 1.74 -1.26 -4.59 116.66 121.74 2iuq n ARG 145 Ca 0.23 0.72 -0.39 0.00 -0.77 0.00 0.00 57.85 57.64 2iuq n ARG 145 Cb 0.43 -4.75 -0.05 0.00 -1.02 0.00 0.00 32.46 27.07 2iuq n ARG 145 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2iuq s GLU 146 N -2.43 4.65 0.17 5.56 -6.30 -0.85 -4.91 118.70 114.58 2iuq s GLU 146 Ca 0.00 1.61 0.03 0.00 -2.50 0.00 0.00 54.97 54.12 2iuq s GLU 146 Cb 0.00 -3.10 -0.05 0.00 0.00 0.00 0.00 34.13 30.99 2iuq s GLU 146 CO 0.00 0.28 -0.05 1.03 0.02 0.00 0.00 175.26 176.54 2iuq s ARG 147 N -1.56 1.13 1.27 4.30 1.81 -0.85 -5.03 118.95 120.03 2iuq s ARG 147 Ca 0.46 -1.52 -0.21 0.00 -1.72 0.00 0.00 55.73 52.73 2iuq s ARG 147 Cb -0.27 -0.51 0.31 0.00 -0.45 0.00 0.00 34.95 34.03 2iuq s ARG 147 CO 0.35 -0.03 1.10 -2.14 -0.68 0.00 0.00 175.30 173.90 2iuq s PRO 148 N -3.82 -1.73 0.17 3.54 0.02 -1.26 -3.64 135.00 128.27 2iuq s PRO 148 Ca 0.21 -0.18 0.21 0.00 0.02 0.00 0.00 61.00 61.26 2iuq s PRO 148 Cb 0.04 -1.55 0.86 0.00 0.02 0.00 0.00 34.50 33.88 2iuq s PRO 148 CO 0.03 -4.03 1.63 0.41 -0.33 0.00 0.00 177.00 174.72 2iuq n GLY 149 N -0.72 -1.20 0.00 0.52 0.00 -1.26 -0.84 105.19 101.69 2iuq n GLY 149 Ca 0.15 0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.32 2iuq n GLY 149 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2iuq n TYR 150 N -2.00 0.00 -3.61 1.61 0.18 -1.26 -3.12 117.16 108.96 2iuq n TYR 150 Ca 0.03 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.53 2iuq n TYR 150 Cb 0.21 -0.36 -0.09 0.00 -0.38 0.00 0.00 39.34 38.72 2iuq n TYR 150 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2iuq n GLU 151 N -1.36 2.29 -0.26 -3.48 1.02 -0.02 -5.02 120.64 113.80 2iuq n GLU 151 Ca 0.09 -4.60 -0.05 0.00 -0.02 0.00 0.00 57.16 52.58 2iuq n GLU 151 Cb 0.21 -2.28 0.10 0.00 -0.02 0.00 0.00 31.44 29.45 2iuq n GLU 151 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2iuq h PHE 152 N 4.70 1.14 -0.13 -0.32 3.57 -1.71 -1.01 116.94 123.19 2iuq h PHE 152 Ca 0.18 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.60 2iuq h PHE 152 Cb 0.70 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.09 2iuq h PHE 152 CO 0.71 0.86 0.00 1.19 -2.23 0.00 0.00 178.31 178.84 2iuq n PHE 153 N -4.29 0.17 -0.18 0.41 3.01 -1.26 -2.09 117.46 113.23 2iuq n PHE 153 Ca 0.07 -0.08 0.08 0.00 1.01 0.00 0.00 57.45 58.52 2iuq n PHE 153 Cb 0.18 0.00 0.20 0.00 -0.01 0.00 0.00 39.48 39.85 2iuq n PHE 153 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2iuq n LEU 154 N -0.12 3.20 -4.49 4.37 4.77 -0.39 -1.21 117.00 123.14 2iuq n LEU 154 Ca 0.10 -1.93 -0.34 0.00 -0.03 0.00 0.00 56.01 53.81 2iuq n LEU 154 Cb 0.17 -0.29 -0.12 0.00 -2.33 0.00 0.00 43.42 40.84 2iuq n LEU 154 CO 0.08 0.79 -0.35 -2.28 -1.33 0.00 0.00 177.39 174.30 2iuq s HIS 155 N -1.02 3.03 -0.47 -1.77 2.46 -0.89 -2.00 115.29 114.64 2iuq s HIS 155 Ca 0.31 -0.33 0.07 0.00 0.47 0.00 0.00 55.06 55.58 2iuq s HIS 155 Cb 0.16 -1.98 0.19 0.00 -0.13 0.00 0.00 32.58 30.81 2iuq s HIS 155 CO 0.21 -0.07 1.15 0.27 -2.47 0.00 0.00 174.74 173.83 2iuq n ASN 156 N 3.66 2.55 -0.77 9.88 0.23 -1.26 -4.52 115.26 125.04 2iuq n ASN 156 Ca -0.17 -2.09 0.05 0.00 -0.53 0.00 0.00 54.58 51.84 2iuq n ASN 156 Cb 0.52 -0.16 0.17 0.00 -2.08 0.00 0.00 39.78 38.24 2iuq n ASN 156 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2iuq n ASP 157 N -0.04 2.21 -4.58 0.53 8.00 -1.26 -4.71 116.55 116.70 2iuq n ASP 157 Ca 0.07 -2.08 -0.25 0.00 0.71 0.00 0.00 54.79 53.24 2iuq n ASP 157 Cb 0.38 -0.31 -0.10 0.00 -0.02 0.00 0.00 41.12 41.08 2iuq n ASP 157 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2iuq s VAL 158 N -1.57 2.38 -0.49 2.53 -7.23 -1.26 -5.10 120.40 109.65 2iuq s VAL 158 Ca 0.25 -2.12 -0.24 0.00 -1.81 0.00 0.00 61.98 58.06 2iuq s VAL 158 Cb 0.14 -2.70 0.03 0.00 0.56 0.00 0.00 36.38 34.41 2iuq s VAL 158 CO 0.15 -0.20 0.89 0.21 -0.31 0.00 0.00 175.10 175.84 2iuq s ASN 159 N -3.65 6.42 0.00 4.85 2.47 -1.26 -4.92 114.94 118.86 2iuq s ASN 159 Ca 0.33 -0.10 0.24 0.00 0.42 0.00 0.00 52.86 53.75 2iuq s ASN 159 Cb 0.02 -2.43 1.43 0.00 -1.45 0.00 0.00 41.25 38.82 2iuq s ASN 159 CO 0.18 -1.06 1.80 0.79 -3.72 0.00 0.00 177.10 175.08 2iuq n TRP 160 N 7.11 0.00 1.67 0.43 7.02 -1.26 -1.46 117.44 130.96 2iuq n TRP 160 Ca 0.04 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.63 2iuq n TRP 160 Cb 0.48 0.00 0.54 0.00 -2.42 0.00 0.00 31.31 29.91 2iuq n TRP 160 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2iuq h MET 162 N 1.04 0.00 -0.20 0.00 -0.00 -1.52 -1.02 114.93 113.22 2iuq h MET 162 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2iuq h MET 162 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.83 2iuq h MET 162 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.91 2iuq n ALA 163 N -2.23 2.33 -1.58 -3.00 0.00 -1.26 -4.92 120.51 109.85 2iuq n ALA 163 Ca 0.03 -0.89 -0.31 0.00 0.00 0.00 0.00 53.44 52.27 2iuq n ALA 163 Cb 0.43 -0.44 0.05 0.00 0.00 0.00 0.00 19.45 19.48 2iuq n ALA 163 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2iuq s ASN 164 N -1.00 5.38 0.29 0.00 0.01 -0.39 -4.94 114.94 114.28 2iuq s ASN 164 Ca 0.20 1.60 0.03 0.00 -0.71 0.00 0.00 52.86 53.98 2iuq s ASN 164 Cb 0.12 -2.48 0.64 0.00 0.41 0.00 0.00 41.25 39.94 2iuq s ASN 164 CO 0.16 -1.45 1.78 -0.08 -1.51 0.00 0.00 177.10 176.01 2iuq h GLU 165 N -0.72 0.73 -4.92 -0.60 4.81 -1.95 -3.35 114.58 108.58 2iuq h GLU 165 Ca -0.44 -0.04 -0.61 0.00 -0.13 0.00 0.00 59.36 58.13 2iuq h GLU 165 Cb 1.21 -0.16 -0.34 0.00 0.63 0.00 0.00 28.75 30.09 2iuq h GLU 165 CO 0.57 0.48 -0.85 1.21 -0.73 0.00 0.00 179.01 179.69 2iuq s ASN 166 N -5.46 2.63 0.00 1.04 3.84 -1.26 -5.04 114.94 110.69 2iuq s ASN 166 Ca -0.12 -0.48 0.27 0.00 0.21 0.00 0.00 52.86 52.75 2iuq s ASN 166 Cb 0.24 -1.20 1.08 0.00 -0.55 0.00 0.00 41.25 40.82 2iuq s ASN 166 CO 0.80 0.06 1.76 -1.54 -2.79 0.00 0.00 177.10 175.38 2iuq n SER 167 N 4.02 1.35 -4.69 -4.21 3.41 -1.26 -3.63 113.62 108.61 2iuq n SER 167 Ca -0.20 -1.49 -0.42 0.00 -0.26 0.00 0.00 58.87 56.51 2iuq n SER 167 Cb 0.52 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2iuq n SER 167 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2iuq s THR 168 N -1.96 2.98 -0.08 6.66 2.01 -1.26 -4.67 115.64 119.31 2iuq s THR 168 Ca 0.38 0.45 -0.05 0.00 0.31 0.00 0.00 61.69 62.77 2iuq s THR 168 Cb 0.20 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 2iuq s THR 168 CO 0.32 -0.00 0.13 0.72 -0.69 0.00 0.00 174.62 175.10 2iuq s PHE 169 N 2.60 3.52 -0.19 4.92 -0.12 -1.26 -0.82 117.98 126.63 2iuq s PHE 169 Ca 0.74 0.43 -0.11 0.00 -0.05 0.00 0.00 56.93 57.94 2iuq s PHE 169 Cb -0.40 -1.88 -0.08 0.00 -0.63 0.00 0.00 43.02 40.02 2iuq s PHE 169 CO 0.33 0.68 -0.27 1.58 -0.05 0.00 0.00 175.22 177.48 2iuq n HIS 170 N 1.70 0.00 -3.81 3.49 -0.00 0.04 -3.65 115.22 112.99 2iuq n HIS 170 Ca -0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 57.72 57.50 2iuq n HIS 170 Cb 0.54 -0.67 -0.00 0.00 -0.00 0.00 0.00 29.99 29.85 2iuq n HIS 170 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2iuq s THR 172 N -3.06 2.02 0.28 0.00 2.01 0.77 -0.20 115.64 117.47 2iuq s THR 172 Ca 0.14 -1.05 0.05 0.00 0.31 0.00 0.00 61.69 61.13 2iuq s THR 172 Cb -0.03 -1.71 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2iuq s THR 172 CO 0.05 0.56 0.42 0.42 -0.69 0.00 0.00 174.62 175.38 2iuq s THR 173 N -0.19 4.95 -0.46 -0.82 -4.23 0.07 -1.74 115.64 113.21 2iuq s THR 173 Ca -0.02 -0.91 0.03 0.00 -1.18 0.00 0.00 61.69 59.60 2iuq s THR 173 Cb -0.13 -3.75 0.13 0.00 1.34 0.00 0.00 72.50 70.09 2iuq s THR 173 CO 0.03 -0.32 0.24 -0.44 -0.54 0.00 0.00 174.62 173.59 2iuq s SER 174 N -4.04 3.91 -0.36 3.99 0.01 0.01 -3.38 113.70 113.85 2iuq s SER 174 Ca 0.37 -2.74 -0.15 0.00 1.31 0.00 0.00 55.95 54.74 2iuq s SER 174 Cb -0.09 -1.26 -0.00 0.00 0.21 0.00 0.00 66.02 64.87 2iuq s SER 174 CO 0.31 -0.26 0.35 -0.69 0.41 0.00 0.00 173.24 173.36 2iuq s VAL 175 N 0.15 5.18 -0.01 3.43 1.01 -0.25 -4.64 120.40 125.28 2iuq s VAL 175 Ca 0.17 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 2iuq s VAL 175 Cb -0.25 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 2iuq s VAL 175 CO -0.00 -0.15 1.67 -0.22 0.00 0.00 0.00 175.10 176.40 2iuq s LEU 176 N 1.96 4.35 -0.21 3.92 1.98 -1.26 -0.40 118.68 129.01 2iuq s LEU 176 Ca 0.10 2.34 -0.19 0.00 -2.89 0.00 0.00 54.13 53.50 2iuq s LEU 176 Cb -0.17 -3.54 -0.16 0.00 0.66 0.00 0.00 46.19 42.98 2iuq s LEU 176 CO 0.12 -0.92 0.07 0.52 -1.89 0.00 0.00 176.35 174.25 2iuq n VAL 177 N 5.23 1.52 -3.76 1.68 0.31 -0.32 -4.93 118.33 118.07 2iuq n VAL 177 Ca 0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2iuq n VAL 177 Cb 0.42 -2.06 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 2iuq n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2iuq n GLY 178 N 1.42 -1.46 0.00 2.92 0.00 -1.21 -5.01 105.19 101.84 2iuq n GLY 178 Ca -0.33 -1.22 0.04 0.00 0.00 0.00 0.00 46.02 44.51 2iuq n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36