#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u39 s PRO 80 N 0.00 4.45 0.14 0.52 0.04 -1.26 -4.94 135.00 133.95 1u39 s PRO 80 Ca 0.00 1.69 -0.19 0.00 0.04 0.00 0.00 61.00 62.54 1u39 s PRO 80 Cb 0.00 -3.39 -0.07 0.00 0.04 0.00 0.00 34.50 31.08 1u39 s PRO 80 CO 0.00 -0.23 0.63 0.08 0.04 0.00 0.00 177.00 177.52 1u39 s VAL 81 N 1.15 4.68 0.02 -0.36 1.01 -1.26 -4.56 120.40 121.08 1u39 s VAL 81 Ca 0.57 1.20 0.09 0.00 0.00 0.00 0.00 61.98 63.84 1u39 s VAL 81 Cb -0.27 -3.88 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1u39 s VAL 81 CO 0.28 0.38 -0.26 -0.89 0.00 0.00 0.00 175.10 174.62 1u39 s THR 82 N -1.31 2.06 -0.34 3.92 2.01 -0.98 -4.95 115.64 116.05 1u39 s THR 82 Ca 0.36 -1.28 -0.08 0.00 0.31 0.00 0.00 61.69 60.99 1u39 s THR 82 Cb -0.18 -1.75 0.03 0.00 0.01 0.00 0.00 72.50 70.61 1u39 s THR 82 CO 0.20 0.42 0.14 -0.89 -0.69 0.00 0.00 174.62 173.80 1u39 s THR 83 N -0.74 4.16 -0.54 -0.82 2.01 -1.26 -0.02 115.64 118.44 1u39 s THR 83 Ca 0.11 -0.90 -0.24 0.00 0.31 0.00 0.00 61.69 60.96 1u39 s THR 83 Cb -0.10 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 69.16 1u39 s THR 83 CO 0.01 -0.14 0.94 -0.69 -0.69 0.00 0.00 174.62 174.05 1u39 s VAL 84 N 1.49 4.40 -0.87 3.82 1.01 0.32 -3.64 120.40 126.93 1u39 s VAL 84 Ca 0.01 0.34 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 1u39 s VAL 84 Cb -0.19 -4.52 0.21 0.00 0.00 0.00 0.00 36.38 31.88 1u39 s VAL 84 CO 0.04 -1.08 0.75 -0.22 0.00 0.00 0.00 175.10 174.60 1u39 s LEU 85 N 3.92 5.58 0.08 3.92 0.20 -1.24 -1.26 118.68 129.88 1u39 s LEU 85 Ca 0.31 -3.58 -0.28 0.00 0.69 0.00 0.00 54.13 51.27 1u39 s LEU 85 Cb -0.12 -1.92 -0.05 0.00 -0.43 0.00 0.00 46.19 43.66 1u39 s LEU 85 CO 0.20 -0.22 0.89 -0.63 -0.29 0.00 0.00 176.35 176.30 1u39 s ILE 86 N -1.14 4.62 -0.46 6.68 1.09 -0.61 -2.77 121.20 128.60 1u39 s ILE 86 Ca 0.26 1.90 -0.21 0.00 -1.10 0.00 0.00 60.65 61.50 1u39 s ILE 86 Cb -0.09 -4.24 0.03 0.00 -1.06 0.00 0.00 42.46 37.10 1u39 s ILE 86 CO -0.11 0.32 0.69 -0.13 -0.10 0.00 0.00 174.94 175.61 1u39 s ARG 87 N 0.07 3.27 -0.69 2.79 0.52 -1.26 -0.93 118.95 122.71 1u39 s ARG 87 Ca 0.44 -0.43 -0.01 0.00 -0.52 0.00 0.00 55.73 55.20 1u39 s ARG 87 Cb -0.22 -3.99 0.17 0.00 0.52 0.00 0.00 34.95 31.44 1u39 s ARG 87 CO 0.27 -1.11 0.52 0.50 0.02 0.00 0.00 175.30 175.49 1u39 s ARG 88 N 2.95 2.70 0.00 3.54 6.06 0.17 -4.83 118.95 129.54 1u39 s ARG 88 Ca 0.23 -2.79 0.25 0.00 -2.50 0.00 0.00 55.73 50.91 1u39 s ARG 88 Cb -0.15 -3.73 1.46 0.00 0.06 0.00 0.00 34.95 32.59 1u39 s ARG 88 CO 0.18 -1.20 1.91 -0.35 -2.50 0.00 0.00 175.30 173.34 1u39 n PRO 89 N 3.05 0.95 -0.29 5.12 -0.04 -1.26 0.18 135.00 142.70 1u39 n PRO 89 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1u39 n PRO 89 Cb 0.37 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1u39 n PRO 89 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1u39 n ASP 90 N -0.90 0.00 0.00 3.54 2.03 -1.26 -4.93 116.55 115.02 1u39 n ASP 90 Ca 0.18 -0.23 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1u39 n ASP 90 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 1u39 n ASP 90 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1u39 n LEU 91 N 0.00 1.67 0.21 -2.67 4.77 -1.26 -4.68 117.00 115.04 1u39 n LEU 91 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.16 1u39 n LEU 91 Cb 0.00 0.00 0.79 0.00 -2.33 0.00 0.00 43.42 41.88 1u39 n LEU 91 CO 0.00 0.27 1.16 -0.09 -1.33 0.00 0.00 177.39 177.39 1u39 h ARG 92 N 0.00 0.00 -6.13 3.23 2.43 -1.98 -3.40 114.38 108.53 1u39 h ARG 92 Ca 0.00 0.00 -0.59 0.00 -0.81 0.00 0.00 59.98 58.58 1u39 h ARG 92 Cb 0.59 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.10 1u39 h ARG 92 CO 0.00 0.00 -0.32 0.71 -1.51 0.00 0.00 179.97 178.85 1u39 s TYR 93 N -4.40 3.50 0.58 2.20 2.02 -1.26 -5.11 117.35 114.88 1u39 s TYR 93 Ca -0.04 0.58 0.06 0.00 -0.37 0.00 0.00 57.07 57.29 1u39 s TYR 93 Cb 0.13 -2.02 0.08 0.00 -0.40 0.00 0.00 41.96 39.75 1u39 s TYR 93 CO 0.43 0.46 0.80 1.14 -1.57 0.00 0.00 175.55 176.81 1u39 s GLN 94 N -2.48 2.27 -0.05 -0.62 0.00 -1.26 -4.97 119.66 112.54 1u39 s GLN 94 Ca 0.39 -1.32 -0.25 0.00 -0.00 0.00 0.00 55.36 54.18 1u39 s GLN 94 Cb -0.12 -2.57 -0.20 0.00 0.00 0.00 0.00 33.01 30.12 1u39 s GLN 94 CO 0.23 -0.88 1.04 -0.07 0.00 0.00 0.00 175.29 175.61 1u39 h LEU 95 N 0.07 -0.07 0.00 2.60 -0.00 -1.97 -3.43 115.31 112.50 1u39 h LEU 95 Ca -0.35 -0.52 0.00 0.00 -0.00 0.00 0.00 57.88 57.01 1u39 h LEU 95 Cb 1.28 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.96 1u39 h LEU 95 CO 0.43 0.52 0.00 0.61 -0.00 0.00 0.00 178.44 180.00 1u39 n GLY 96 N 0.58 1.67 3.63 0.83 0.00 -1.26 -2.55 105.19 108.08 1u39 n GLY 96 Ca -0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 1u39 n GLY 96 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1u39 s PHE 97 N -1.83 -0.16 0.18 1.61 -0.71 -1.26 -1.46 117.98 114.35 1u39 s PHE 97 Ca 0.00 0.34 -0.10 0.00 -1.04 0.00 0.00 56.93 56.13 1u39 s PHE 97 Cb 0.00 0.46 -0.07 0.00 -1.21 0.00 0.00 43.02 42.21 1u39 s PHE 97 CO 0.00 -0.11 0.51 -1.12 -1.34 0.00 0.00 175.22 173.16 1u39 s SER 98 N -0.49 6.65 -0.05 1.98 0.01 -0.97 -4.99 113.70 115.83 1u39 s SER 98 Ca 0.06 0.89 0.06 0.00 1.31 0.00 0.00 55.95 58.27 1u39 s SER 98 Cb -0.03 -2.21 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 1u39 s SER 98 CO -0.09 0.01 -0.23 0.54 0.41 0.00 0.00 173.24 173.88 1u39 s VAL 99 N -1.68 2.25 -0.44 3.43 0.11 -1.26 -1.99 120.40 120.83 1u39 s VAL 99 Ca 0.43 -1.01 0.02 0.00 -2.93 0.00 0.00 61.98 58.49 1u39 s VAL 99 Cb -0.12 -1.82 0.14 0.00 -1.53 0.00 0.00 36.38 33.04 1u39 s VAL 99 CO 0.21 0.57 0.24 -1.10 -3.33 0.00 0.00 175.10 171.69 1u39 s GLN 100 N -0.34 1.27 -1.60 1.54 1.11 0.23 -4.78 119.66 117.09 1u39 s GLN 100 Ca 0.02 -1.99 0.00 0.00 0.01 0.00 0.00 55.36 53.40 1u39 s GLN 100 Cb -0.12 -2.32 0.00 0.00 -1.01 0.00 0.00 33.01 29.56 1u39 s GLN 100 CO 0.02 -1.16 0.00 -1.71 0.01 0.00 0.00 175.29 172.45 1u39 n ASN 101 N 3.55 -5.57 0.00 5.90 5.15 -1.26 -1.74 115.26 121.28 1u39 n ASN 101 Ca 0.09 0.37 0.00 0.00 -0.60 0.00 0.00 54.58 54.44 1u39 n ASN 101 Cb 0.35 -4.40 0.00 0.00 -0.53 0.00 0.00 39.78 35.20 1u39 n ASN 101 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1u39 n GLY 102 N -0.12 3.26 3.72 8.20 0.00 -1.26 -4.63 105.19 114.36 1u39 n GLY 102 Ca -0.15 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1u39 n GLY 102 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u39 s ILE 103 N -0.05 4.53 0.13 -0.61 1.01 -0.71 0.16 121.20 125.65 1u39 s ILE 103 Ca 0.00 1.89 -0.24 0.00 0.00 0.00 0.00 60.65 62.31 1u39 s ILE 103 Cb 0.00 -4.21 -0.07 0.00 0.01 0.00 0.00 42.46 38.18 1u39 s ILE 103 CO 0.00 0.19 0.72 -0.63 0.00 0.00 0.00 174.94 175.22 1u39 s ILE 104 N 0.71 4.51 -0.04 2.92 1.09 -1.18 0.78 121.20 129.99 1u39 s ILE 104 Ca 0.52 1.57 -0.04 0.00 -1.10 0.00 0.00 60.65 61.60 1u39 s ILE 104 Cb -0.24 -4.07 -0.01 0.00 -1.06 0.00 0.00 42.46 37.07 1u39 s ILE 104 CO 0.29 0.51 -0.07 0.00 -0.10 0.00 0.00 174.94 175.58 1u39 s SER 106 N -4.30 4.39 -0.30 0.00 0.01 -1.26 -4.85 113.70 107.40 1u39 s SER 106 Ca -0.06 -0.30 -0.01 0.00 1.31 0.00 0.00 55.95 56.89 1u39 s SER 106 Cb 0.01 -0.90 0.10 0.00 0.21 0.00 0.00 66.02 65.44 1u39 s SER 106 CO 0.09 0.23 0.10 -0.22 0.41 0.00 0.00 173.24 173.84 1u39 s LEU 107 N -1.78 1.92 0.42 2.44 0.20 -1.26 -2.30 118.68 118.32 1u39 s LEU 107 Ca 0.19 -1.52 -0.27 0.00 0.69 0.00 0.00 54.13 53.22 1u39 s LEU 107 Cb -0.11 -0.77 -0.10 0.00 -0.43 0.00 0.00 46.19 44.78 1u39 s LEU 107 CO 0.10 -0.41 1.47 -0.32 -0.29 0.00 0.00 176.35 176.90 1u39 s MET 108 N 1.70 3.88 -0.50 1.98 1.75 -0.54 -4.89 119.30 122.69 1u39 s MET 108 Ca 0.09 2.53 -0.02 0.00 -1.25 0.00 0.00 55.69 57.03 1u39 s MET 108 Cb -0.17 -2.81 0.24 0.00 2.84 0.00 0.00 34.83 34.93 1u39 s MET 108 CO -0.25 -0.70 2.25 -2.13 -0.65 0.00 0.00 175.02 173.53 1u39 n ARG 109 N 0.12 2.29 -0.63 4.11 3.00 -1.26 -3.89 116.66 120.39 1u39 n ARG 109 Ca 0.03 -2.40 -0.02 0.00 -0.00 0.00 0.00 57.85 55.45 1u39 n ARG 109 Cb 0.40 -2.00 -0.02 0.00 0.00 0.00 0.00 32.46 30.84 1u39 n ARG 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1u39 n GLY 110 N 0.12 0.66 3.83 5.14 0.00 -1.26 -5.15 105.19 108.53 1u39 n GLY 110 Ca 0.46 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.21 1u39 n GLY 110 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u39 s GLY 111 N -0.34 2.47 0.34 -0.02 0.00 -1.25 -5.04 107.32 103.48 1u39 s GLY 111 Ca 0.00 -1.38 0.18 0.00 0.00 0.00 0.00 44.72 43.52 1u39 s GLY 111 CO 0.00 -1.97 1.52 -2.22 0.00 0.00 0.00 173.10 170.44 1u39 h ILE 112 N 1.08 0.60 -0.24 0.90 5.03 -1.80 -3.23 117.51 119.85 1u39 h ILE 112 Ca -0.40 -1.79 0.06 0.00 -0.12 0.00 0.00 64.86 62.60 1u39 h ILE 112 Cb 1.29 2.25 -0.01 0.00 -3.03 0.00 0.00 36.82 37.32 1u39 h ILE 112 CO 0.64 0.34 0.17 0.00 -0.68 0.00 0.00 178.15 178.62 1u39 h ALA 113 N 1.66 2.16 -0.49 1.87 0.00 -1.84 -1.39 119.26 121.23 1u39 h ALA 113 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1u39 h ALA 113 Cb 1.23 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1u39 h ALA 113 CO 0.04 -0.23 0.32 1.05 0.00 0.00 0.00 179.25 180.44 1u39 h GLU 114 N 0.05 0.64 -0.26 0.00 4.11 -1.85 -2.84 114.58 114.43 1u39 h GLU 114 Ca 0.11 -0.04 -0.03 0.00 0.07 0.00 0.00 59.36 59.48 1u39 h GLU 114 Cb 0.38 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1u39 h GLU 114 CO -0.01 0.42 0.06 0.00 0.07 0.00 0.00 179.01 179.55 1u39 h ARG 115 N 0.65 0.43 0.00 1.06 3.08 -1.46 -3.33 114.38 114.81 1u39 h ARG 115 Ca 0.18 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1u39 h ARG 115 Cb -0.07 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1u39 h ARG 115 CO -0.04 0.53 0.00 0.41 -1.07 0.00 0.00 179.97 179.80 1u39 n GLY 116 N -0.52 -3.05 0.00 0.04 0.00 -1.03 -4.82 105.19 95.81 1u39 n GLY 116 Ca -0.03 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1u39 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u39 n GLY 117 N -0.89 0.00 2.31 -0.02 0.00 -1.09 -3.59 105.19 101.91 1u39 n GLY 117 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1u39 n GLY 117 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1u39 n VAL 118 N 0.00 0.17 -3.43 1.61 3.14 -1.16 -4.74 118.33 113.91 1u39 n VAL 118 Ca 0.00 -0.35 -0.08 0.00 -2.96 0.00 0.00 64.34 60.94 1u39 n VAL 118 Cb 0.00 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 32.70 1u39 n VAL 118 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 1u39 s ARG 119 N -0.71 0.35 -0.25 1.45 3.52 -1.26 -4.85 118.95 117.21 1u39 s ARG 119 Ca 0.41 0.70 -0.35 0.00 -0.13 0.00 0.00 55.73 56.36 1u39 s ARG 119 Cb -0.39 -0.20 -0.12 0.00 -1.56 0.00 0.00 34.95 32.69 1u39 s ARG 119 CO 0.46 -0.52 2.02 1.55 -0.81 0.00 0.00 175.30 178.00 1u39 n VAL 120 N 5.37 0.35 0.00 7.11 3.14 -1.26 -2.18 118.33 130.86 1u39 n VAL 120 Ca -0.05 -0.19 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 1u39 n VAL 120 Cb 0.50 -1.72 0.00 0.00 -1.06 0.00 0.00 33.84 31.56 1u39 n VAL 120 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1u39 n GLY 121 N 5.41 1.65 3.29 7.55 0.00 -1.23 -5.02 105.19 116.83 1u39 n GLY 121 Ca 0.32 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 1u39 n GLY 121 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u39 s HIS 122 N -2.00 2.23 -0.97 1.61 3.76 -0.93 -3.92 115.29 115.09 1u39 s HIS 122 Ca 0.00 -0.43 -0.22 0.00 -0.15 0.00 0.00 55.06 54.26 1u39 s HIS 122 Cb 0.00 -1.44 0.08 0.00 1.11 0.00 0.00 32.58 32.33 1u39 s HIS 122 CO 0.00 -0.05 1.31 0.50 -0.85 0.00 0.00 174.74 175.66 1u39 s ARG 123 N -0.56 3.56 0.17 1.40 3.52 0.32 -3.09 118.95 124.27 1u39 s ARG 123 Ca 0.09 -1.31 -0.33 0.00 -0.13 0.00 0.00 55.73 54.05 1u39 s ARG 123 Cb -0.10 -5.13 -0.16 0.00 -1.56 0.00 0.00 34.95 28.01 1u39 s ARG 123 CO -0.01 -2.04 1.18 -0.89 -0.81 0.00 0.00 175.30 172.73 1u39 n ILE 124 N 6.34 0.87 0.00 4.11 5.41 0.41 -1.03 119.36 135.47 1u39 n ILE 124 Ca 0.28 -0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.81 1u39 n ILE 124 Cb 0.50 -0.87 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 1u39 n ILE 124 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 1u39 n ILE 125 N 1.55 0.00 -2.59 1.39 -5.35 0.27 -3.87 119.36 110.76 1u39 n ILE 125 Ca 0.15 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.22 1u39 n ILE 125 Cb 0.25 -0.16 -0.03 0.00 -1.74 0.00 0.00 39.64 37.96 1u39 n ILE 125 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1u39 s GLU 126 N 0.00 3.50 -0.74 6.28 2.02 -1.19 0.14 118.70 128.71 1u39 s GLU 126 Ca 0.00 -0.99 -0.18 0.00 0.02 0.00 0.00 54.97 53.82 1u39 s GLU 126 Cb 0.00 -5.07 0.14 0.00 0.10 0.00 0.00 34.13 29.29 1u39 s GLU 126 CO 0.00 -2.16 0.84 0.42 0.02 0.00 0.00 175.26 174.39 1u39 s ILE 127 N 4.94 4.97 -1.73 -1.63 1.01 0.88 0.78 121.20 130.41 1u39 s ILE 127 Ca 0.42 -1.49 0.00 0.00 0.00 0.00 0.00 60.65 59.58 1u39 s ILE 127 Cb -0.02 -4.57 0.00 0.00 0.01 0.00 0.00 42.46 37.87 1u39 s ILE 127 CO -0.05 -1.22 0.00 0.59 0.00 0.00 0.00 174.94 174.26 1u39 n ASN 128 N 5.87 -5.33 0.00 3.58 3.02 0.50 -1.74 115.26 121.16 1u39 n ASN 128 Ca 0.05 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 1u39 n ASN 128 Cb 0.45 -4.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.20 1u39 n ASN 128 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u39 n GLY 129 N -0.90 2.79 3.53 7.41 0.00 -1.26 -5.06 105.19 111.70 1u39 n GLY 129 Ca -0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 1u39 n GLY 129 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1u39 s GLN 130 N -0.55 3.35 -0.88 1.61 0.74 -0.71 -4.99 119.66 118.22 1u39 s GLN 130 Ca 0.00 -0.26 -0.25 0.00 0.05 0.00 0.00 55.36 54.90 1u39 s GLN 130 Cb 0.00 -3.94 0.01 0.00 1.10 0.00 0.00 33.01 30.19 1u39 s GLN 130 CO 0.00 -1.02 1.59 -1.12 -0.55 0.00 0.00 175.29 174.19 1u39 s SER 131 N 2.02 5.94 0.00 6.67 0.01 -1.24 -0.09 113.70 127.01 1u39 s SER 131 Ca 0.25 -0.83 0.21 0.00 1.31 0.00 0.00 55.95 56.88 1u39 s SER 131 Cb -0.14 -2.56 1.05 0.00 0.21 0.00 0.00 66.02 64.59 1u39 s SER 131 CO 0.20 -1.99 1.65 1.33 0.41 0.00 0.00 173.24 174.83 1u39 n VAL 132 N 7.07 0.34 -0.35 3.43 0.24 0.37 -3.67 118.33 125.76 1u39 n VAL 132 Ca 0.27 0.08 0.26 0.00 -2.04 0.00 0.00 64.34 62.91 1u39 n VAL 132 Cb 0.50 -0.75 0.53 0.00 -1.47 0.00 0.00 33.84 32.65 1u39 n VAL 132 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1u39 h VAL 133 N 0.00 0.43 -0.13 3.34 3.04 -1.68 0.31 116.25 121.56 1u39 h VAL 133 Ca 0.00 -0.11 -0.06 0.00 -1.01 0.00 0.00 66.70 65.52 1u39 h VAL 133 Cb 0.17 0.07 -0.04 0.00 -2.01 0.00 0.00 31.29 29.48 1u39 h VAL 133 CO 0.00 0.06 -0.30 0.00 -1.01 0.00 0.00 177.57 176.32 1u39 n ALA 134 N -2.47 3.74 -2.42 3.17 0.00 -1.24 -4.96 120.51 116.34 1u39 n ALA 134 Ca 0.28 -3.16 -0.32 0.00 0.00 0.00 0.00 53.44 50.25 1u39 n ALA 134 Cb 1.00 -0.50 -0.14 0.00 0.00 0.00 0.00 19.45 19.81 1u39 n ALA 134 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1u39 s THR 135 N -3.20 2.69 1.03 0.00 2.01 0.11 -5.12 115.64 113.16 1u39 s THR 135 Ca 0.40 -0.92 -0.16 0.00 0.31 0.00 0.00 61.69 61.32 1u39 s THR 135 Cb 0.37 -2.03 0.04 0.00 0.01 0.00 0.00 72.50 70.90 1u39 s THR 135 CO -0.03 0.55 0.08 -0.81 -0.69 0.00 0.00 174.62 173.72 1u39 n PRO 136 N 2.23 -0.80 -0.02 4.92 -0.04 -1.26 -4.57 135.00 135.46 1u39 n PRO 136 Ca -0.17 -0.21 -0.13 0.00 -0.04 0.00 0.00 63.50 62.96 1u39 n PRO 136 Cb 0.52 -1.70 -0.10 0.00 -0.04 0.00 0.00 33.50 32.17 1u39 n PRO 136 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1u39 h HIS 137 N -1.71 -0.01 -0.76 0.54 2.07 -1.91 -3.19 115.15 110.18 1u39 h HIS 137 Ca -0.48 -0.00 0.16 0.00 -2.85 0.00 0.00 60.37 57.21 1u39 h HIS 137 Cb 1.32 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 31.25 1u39 h HIS 137 CO 0.27 0.54 0.51 0.93 -3.07 0.00 0.00 177.93 177.10 1u39 h GLU 138 N -0.55 0.35 -0.15 5.12 5.08 -1.92 -1.53 114.58 120.98 1u39 h GLU 138 Ca -0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1u39 h GLU 138 Cb 0.54 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1u39 h GLU 138 CO 0.00 0.23 0.05 -0.22 -1.00 0.00 0.00 179.01 178.07 1u39 h LYS 139 N 0.36 0.23 -0.44 2.33 1.63 -1.92 -1.67 116.57 117.09 1u39 h LYS 139 Ca 0.38 -0.05 0.03 0.00 -0.85 0.00 0.00 60.65 60.15 1u39 h LYS 139 Cb 0.94 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.50 1u39 h LYS 139 CO -0.11 0.36 0.24 0.82 -3.45 0.00 0.00 179.45 177.31 1u39 h ILE 140 N 0.06 1.01 -0.28 2.00 2.04 -1.29 -0.97 117.51 120.08 1u39 h ILE 140 Ca 0.05 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1u39 h ILE 140 Cb 0.22 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1u39 h ILE 140 CO -0.00 0.09 0.19 0.58 0.00 0.00 0.00 178.15 179.00 1u39 h VAL 141 N 0.49 1.07 0.36 1.67 2.07 -1.34 -2.61 116.25 117.96 1u39 h VAL 141 Ca 0.18 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 1u39 h VAL 141 Cb 0.05 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1u39 h VAL 141 CO -0.10 0.07 -0.18 -0.74 0.02 0.00 0.00 177.57 176.64 1u39 h HIS 142 N 0.39 -0.45 0.12 1.57 6.17 -0.21 0.79 115.15 123.53 1u39 h HIS 142 Ca 0.10 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.19 1u39 h HIS 142 Cb -0.04 0.15 -0.04 0.00 2.52 0.00 0.00 27.41 30.00 1u39 h HIS 142 CO 0.00 -0.20 -0.40 0.82 0.71 0.00 0.00 177.93 178.86 1u39 h ILE 143 N -0.63 0.18 -0.00 6.26 5.03 -1.15 0.17 117.51 127.37 1u39 h ILE 143 Ca -0.05 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.66 1u39 h ILE 143 Cb 0.46 0.18 -0.00 0.00 -3.03 0.00 0.00 36.82 34.42 1u39 h ILE 143 CO 0.08 0.00 -0.12 -0.07 -0.68 0.00 0.00 178.15 177.36 1u39 h LEU 144 N -0.64 0.00 -1.57 1.44 3.38 -1.48 1.17 115.31 117.62 1u39 h LEU 144 Ca 0.02 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1u39 h LEU 144 Cb 0.67 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1u39 h LEU 144 CO -0.23 0.12 -0.22 0.28 0.09 0.00 0.00 178.44 178.48 1u39 h SER 145 N 0.00 0.00 -0.32 -0.43 0.02 0.24 -3.15 113.55 109.92 1u39 h SER 145 Ca -0.00 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.70 1u39 h SER 145 Cb 0.21 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 62.41 1u39 h SER 145 CO 0.02 0.22 -0.94 0.59 -1.14 0.00 0.00 176.83 175.57 1u39 n ASN 146 N -3.78 2.14 -2.65 3.07 3.02 0.41 -4.88 115.26 112.59 1u39 n ASN 146 Ca -0.02 -2.66 -0.28 0.00 -0.03 0.00 0.00 54.58 51.60 1u39 n ASN 146 Cb 0.32 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 39.07 1u39 n ASN 146 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u39 n ALA 147 N -0.41 5.11 -0.48 5.41 0.00 0.38 -4.94 120.51 125.58 1u39 n ALA 147 Ca 0.16 -4.41 -0.10 0.00 0.00 0.00 0.00 53.44 49.09 1u39 n ALA 147 Cb 0.91 -0.73 0.17 0.00 0.00 0.00 0.00 19.45 19.80 1u39 n ALA 147 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1u39 n VAL 148 N -0.42 0.00 0.00 0.00 0.24 -1.26 -4.31 118.33 112.57 1u39 n VAL 148 Ca 0.38 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.68 1u39 n VAL 148 Cb 0.56 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.35 1u39 n VAL 148 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u39 n GLY 149 N -2.55 1.58 2.59 7.63 0.00 0.48 -4.57 105.19 110.35 1u39 n GLY 149 Ca 0.08 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1u39 n GLY 149 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u39 s GLU 150 N 0.00 0.29 -0.39 1.61 2.02 -1.26 0.45 118.70 121.43 1u39 s GLU 150 Ca 0.00 -0.57 -0.29 0.00 0.02 0.00 0.00 54.97 54.13 1u39 s GLU 150 Cb 0.00 -1.43 0.01 0.00 0.10 0.00 0.00 34.13 32.81 1u39 s GLU 150 CO 0.00 -0.96 1.33 0.42 0.02 0.00 0.00 175.26 176.07 1u39 s ILE 151 N 2.00 4.04 -0.24 -1.63 1.01 -0.11 -4.89 121.20 121.37 1u39 s ILE 151 Ca 0.08 1.10 -0.11 0.00 0.00 0.00 0.00 60.65 61.72 1u39 s ILE 151 Cb -0.16 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.00 1u39 s ILE 151 CO -0.30 -0.71 0.18 -1.00 0.00 0.00 0.00 174.94 173.11 1u39 s HIS 152 N 4.92 3.30 0.05 3.97 3.76 -1.26 -1.57 115.29 128.46 1u39 s HIS 152 Ca 0.57 0.23 -0.15 0.00 -0.15 0.00 0.00 55.06 55.56 1u39 s HIS 152 Cb -0.13 -2.30 0.02 0.00 1.11 0.00 0.00 32.58 31.28 1u39 s HIS 152 CO 0.29 0.03 0.33 1.41 -0.85 0.00 0.00 174.74 175.95 1u39 s MET 153 N 1.18 0.84 0.08 1.40 0.00 -0.39 0.19 119.30 122.61 1u39 s MET 153 Ca 0.08 -0.49 0.07 0.00 0.00 0.00 0.00 55.69 55.35 1u39 s MET 153 Cb -0.14 0.37 -0.04 0.00 0.00 0.00 0.00 34.83 35.02 1u39 s MET 153 CO 0.06 -0.28 -0.12 0.15 0.00 0.00 0.00 175.02 174.83 1u39 s LYS 154 N -2.59 2.16 -0.00 4.11 1.02 0.23 0.12 119.74 124.78 1u39 s LYS 154 Ca -0.05 -0.98 0.04 0.00 0.02 0.00 0.00 55.97 55.00 1u39 s LYS 154 Cb -0.01 -2.30 -0.01 0.00 -0.52 0.00 0.00 37.83 34.99 1u39 s LYS 154 CO -0.04 0.53 -0.12 0.95 -0.92 0.00 0.00 175.35 175.75 1u39 s THR 155 N -1.12 0.97 -0.16 2.17 -4.23 0.97 -0.56 115.64 113.67 1u39 s THR 155 Ca 0.19 -0.60 0.01 0.00 -1.18 0.00 0.00 61.69 60.11 1u39 s THR 155 Cb -0.11 -0.82 0.02 0.00 1.34 0.00 0.00 72.50 72.93 1u39 s THR 155 CO 0.11 0.22 -0.15 -0.32 -0.54 0.00 0.00 174.62 173.94 1u39 s MET 156 N -0.43 2.45 -0.47 3.99 1.75 -0.20 -2.33 119.30 124.06 1u39 s MET 156 Ca 0.04 -0.66 -0.42 0.00 -1.25 0.00 0.00 55.69 53.40 1u39 s MET 156 Cb -0.05 -2.26 -0.18 0.00 2.84 0.00 0.00 34.83 35.18 1u39 s MET 156 CO -0.00 -0.25 2.12 -2.30 -0.65 0.00 0.00 175.02 173.94 1u39 n PRO 157 N 4.72 0.23 0.00 4.11 -0.02 -1.26 0.12 135.00 142.89 1u39 n PRO 157 Ca -0.18 0.06 0.08 0.00 -2.02 0.00 0.00 63.50 61.45 1u39 n PRO 157 Cb 0.50 -1.69 0.47 0.00 -0.02 0.00 0.00 33.50 32.75 1u39 n PRO 157 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48