#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 2.70 -0.00 0.54 0.04 -1.26 -4.97 135.00 132.05 1u39 s PRO 80 Ca 0.00 0.45 -0.29 0.00 0.04 0.00 0.00 61.00 61.20 1u39 s PRO 80 Cb 0.00 -4.40 -0.03 0.00 0.04 0.00 0.00 34.50 30.11 1u39 s PRO 80 CO 0.00 -2.68 0.94 0.54 0.04 0.00 0.00 177.00 175.84 1u39 s VAL 81 N 8.66 4.87 0.02 -0.36 0.11 -1.26 -4.65 120.40 127.79 1u39 s VAL 81 Ca 0.63 1.98 0.08 0.00 -2.93 0.00 0.00 61.98 61.75 1u39 s VAL 81 Cb -0.12 -4.29 -0.02 0.00 -1.53 0.00 0.00 36.38 30.42 1u39 s VAL 81 CO 0.19 0.18 -0.25 -0.89 -3.33 0.00 0.00 175.10 171.01 1u39 s THR 82 N 0.91 1.97 -0.39 5.04 2.01 -0.95 -4.94 115.64 119.29 1u39 s THR 82 Ca 0.50 -1.23 -0.13 0.00 0.31 0.00 0.00 61.69 61.13 1u39 s THR 82 Cb -0.21 -1.67 0.01 0.00 0.01 0.00 0.00 72.50 70.64 1u39 s THR 82 CO 0.27 0.40 0.26 -0.89 -0.69 0.00 0.00 174.62 173.97 1u39 s THR 83 N -0.72 5.05 -0.57 -0.82 2.01 -1.26 -0.51 115.64 118.82 1u39 s THR 83 Ca 0.10 -0.63 -0.26 0.00 0.31 0.00 0.00 61.69 61.21 1u39 s THR 83 Cb -0.10 -3.77 0.03 0.00 0.01 0.00 0.00 72.50 68.68 1u39 s THR 83 CO 0.01 -0.23 1.08 -0.69 -0.69 0.00 0.00 174.62 174.10 1u39 s VAL 84 N 1.65 4.18 -1.12 3.82 1.01 0.28 -4.25 120.40 125.97 1u39 s VAL 84 Ca 0.04 0.62 -0.09 0.00 0.00 0.00 0.00 61.98 62.56 1u39 s VAL 84 Cb -0.19 -4.64 0.28 0.00 0.00 0.00 0.00 36.38 31.83 1u39 s VAL 84 CO 0.09 -1.24 1.13 -0.11 0.00 0.00 0.00 175.10 174.97 1u39 n LEU 85 N 8.01 5.55 -4.55 3.92 0.00 -1.12 -1.90 117.00 126.90 1u39 n LEU 85 Ca 0.05 -5.04 -0.42 0.00 0.00 0.00 0.00 56.01 50.60 1u39 n LEU 85 Cb 0.48 -1.48 -0.03 0.00 0.00 0.00 0.00 43.42 42.39 1u39 n LEU 85 CO 0.68 1.35 0.96 -0.63 0.00 0.00 0.00 177.39 179.75 1u39 s ILE 86 N -1.32 4.13 -0.46 1.96 1.01 0.13 -3.03 121.20 123.63 1u39 s ILE 86 Ca 0.31 0.56 -0.28 0.00 0.00 0.00 0.00 60.65 61.24 1u39 s ILE 86 Cb -0.10 -4.68 0.01 0.00 0.01 0.00 0.00 42.46 37.70 1u39 s ILE 86 CO -0.08 -1.33 1.44 0.00 0.00 0.00 0.00 174.94 174.98 1u39 s ARG 87 N 4.65 3.45 -0.41 2.79 1.70 -1.26 0.53 118.95 130.40 1u39 s ARG 87 Ca 0.36 0.81 -0.20 0.00 -0.47 0.00 0.00 55.73 56.23 1u39 s ARG 87 Cb -0.10 -4.07 0.02 0.00 -0.57 0.00 0.00 34.95 30.23 1u39 s ARG 87 CO 0.21 -1.72 0.61 1.03 -1.08 0.00 0.00 175.30 174.34 1u39 s ARG 88 N 5.20 3.38 0.03 3.89 0.52 0.30 -4.88 118.95 127.38 1u39 s ARG 88 Ca 0.60 -0.31 -0.21 0.00 -0.52 0.00 0.00 55.73 55.29 1u39 s ARG 88 Cb -0.13 -3.91 -0.11 0.00 0.52 0.00 0.00 34.95 31.32 1u39 s ARG 88 CO 0.30 -0.90 1.20 -1.35 0.02 0.00 0.00 175.30 174.57 1u39 h PRO 89 N 8.74 -0.71 0.00 3.54 0.11 -1.94 -1.94 132.00 139.80 1u39 h PRO 89 Ca -0.26 0.05 -0.23 0.00 0.11 0.00 0.00 66.00 65.67 1u39 h PRO 89 Cb 1.10 0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.33 1u39 h PRO 89 CO 0.86 -0.48 -0.17 -3.47 -0.21 0.00 0.00 178.00 174.54 1u39 n ASP 90 N -4.18 2.30 0.04 -2.05 -0.08 -1.26 -4.74 116.55 106.57 1u39 n ASP 90 Ca -0.09 -1.78 0.09 0.00 -1.51 0.00 0.00 54.79 51.50 1u39 n ASP 90 Cb 0.29 0.16 -0.09 0.00 2.34 0.00 0.00 41.12 43.82 1u39 n ASP 90 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1u39 n LEU 91 N 0.00 0.45 -1.79 -2.67 4.77 -1.26 -4.10 117.00 112.39 1u39 n LEU 91 Ca -0.07 0.18 -0.03 0.00 -0.03 0.00 0.00 56.01 56.06 1u39 n LEU 91 Cb 0.22 0.01 0.28 0.00 -2.33 0.00 0.00 43.42 41.61 1u39 n LEU 91 CO 0.12 -0.03 0.90 -2.11 -1.33 0.00 0.00 177.39 174.94 1u39 n ARG 92 N -2.53 3.56 -3.23 3.23 1.85 -1.26 -4.94 116.66 113.35 1u39 n ARG 92 Ca -0.05 -2.61 -0.21 0.00 -1.00 0.00 0.00 57.85 53.98 1u39 n ARG 92 Cb 0.62 -2.10 0.05 0.00 -1.05 0.00 0.00 32.46 29.98 1u39 n ARG 92 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1u39 s TYR 93 N -2.57 1.48 0.01 2.89 2.02 -1.26 -5.14 117.35 114.78 1u39 s TYR 93 Ca 0.46 -0.75 0.02 0.00 -0.37 0.00 0.00 57.07 56.44 1u39 s TYR 93 Cb 0.37 -2.14 -0.01 0.00 -0.40 0.00 0.00 41.96 39.77 1u39 s TYR 93 CO 0.12 -0.99 -0.06 -0.65 -1.57 0.00 0.00 175.55 172.39 1u39 s GLN 94 N -4.57 0.49 0.25 -0.62 1.11 -1.26 -5.04 119.66 110.02 1u39 s GLN 94 Ca 0.55 -0.40 0.08 0.00 0.01 0.00 0.00 55.36 55.60 1u39 s GLN 94 Cb -0.05 -0.40 0.29 0.00 -1.01 0.00 0.00 33.01 31.85 1u39 s GLN 94 CO 0.35 0.10 1.58 -0.07 0.01 0.00 0.00 175.29 177.25 1u39 h LEU 95 N 5.46 0.10 -2.14 2.90 4.07 -1.99 -3.42 115.31 120.29 1u39 h LEU 95 Ca -0.31 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.59 1u39 h LEU 95 Cb 1.19 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.90 1u39 h LEU 95 CO 0.47 0.71 0.00 0.61 -1.08 0.00 0.00 178.44 179.15 1u39 n GLY 96 N 0.31 0.69 3.58 0.83 0.00 -1.26 -2.65 105.19 106.69 1u39 n GLY 96 Ca -0.02 -0.38 -0.06 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.78 -0.20 0.18 1.61 -0.71 -1.26 -2.06 117.98 112.76 1u39 s PHE 97 Ca 0.00 0.20 0.02 0.00 -1.04 0.00 0.00 56.93 56.11 1u39 s PHE 97 Cb 0.00 0.50 -0.04 0.00 -1.21 0.00 0.00 43.02 42.28 1u39 s PHE 97 CO 0.00 -0.26 0.32 -1.12 -1.34 0.00 0.00 175.22 172.82 1u39 s SER 98 N -1.88 6.34 -0.04 1.98 0.01 -1.22 -4.97 113.70 113.93 1u39 s SER 98 Ca 0.07 0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.54 1u39 s SER 98 Cb -0.01 -1.92 0.01 0.00 0.21 0.00 0.00 66.02 64.31 1u39 s SER 98 CO -0.05 0.00 -0.07 0.54 0.41 0.00 0.00 173.24 174.08 1u39 s VAL 99 N -1.82 0.69 -0.45 3.43 0.11 -1.26 -2.00 120.40 119.10 1u39 s VAL 99 Ca 0.35 -0.25 0.02 0.00 -2.93 0.00 0.00 61.98 59.17 1u39 s VAL 99 Cb -0.11 -0.66 0.14 0.00 -1.53 0.00 0.00 36.38 34.22 1u39 s VAL 99 CO 0.29 0.24 0.25 -1.58 -3.33 0.00 0.00 175.10 170.97 1u39 s GLN 100 N 0.60 1.37 -1.48 1.54 0.74 0.19 -4.77 119.66 117.85 1u39 s GLN 100 Ca -0.09 -2.10 0.00 0.00 0.05 0.00 0.00 55.36 53.22 1u39 s GLN 100 Cb -0.12 -2.42 0.00 0.00 1.10 0.00 0.00 33.01 31.57 1u39 s GLN 100 CO 0.01 -1.17 0.00 0.09 -0.55 0.00 0.00 175.29 173.67 1u39 n ASN 101 N 3.44 -5.16 0.00 6.67 3.02 -1.26 -1.80 115.26 120.17 1u39 n ASN 101 Ca 0.09 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.99 1u39 n ASN 101 Cb 0.35 -4.15 0.00 0.00 -0.61 0.00 0.00 39.78 35.37 1u39 n ASN 101 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u39 n GLY 102 N -0.01 3.91 3.71 7.41 0.00 -1.26 -4.31 105.19 114.64 1u39 n GLY 102 Ca -0.14 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 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 0.00 4.46 0.16 -0.61 1.01 -0.74 0.16 121.20 125.64 1u39 s ILE 103 Ca 0.00 1.78 -0.25 0.00 0.00 0.00 0.00 60.65 62.17 1u39 s ILE 103 Cb 0.00 -4.14 -0.08 0.00 0.01 0.00 0.00 42.46 38.25 1u39 s ILE 103 CO 0.00 0.14 0.78 -0.63 0.00 0.00 0.00 174.94 175.24 1u39 s ILE 104 N 0.99 4.38 0.00 2.92 1.09 -1.08 0.54 121.20 130.04 1u39 s ILE 104 Ca 0.55 1.72 0.00 0.00 -1.10 0.00 0.00 60.65 61.82 1u39 s ILE 104 Cb -0.25 -4.15 0.00 0.00 -1.06 0.00 0.00 42.46 37.00 1u39 s ILE 104 CO 0.29 0.51 0.00 0.00 -0.10 0.00 0.00 174.94 175.64 1u39 s SER 106 N -1.98 1.78 -0.30 0.00 0.15 -1.26 -4.76 113.70 107.33 1u39 s SER 106 Ca 0.00 -0.20 -0.09 0.00 0.70 0.00 0.00 55.95 56.37 1u39 s SER 106 Cb 0.00 -0.64 -0.01 0.00 -1.71 0.00 0.00 66.02 63.66 1u39 s SER 106 CO 0.00 -0.13 0.12 -0.22 1.20 0.00 0.00 173.24 174.21 1u39 s LEU 107 N 1.65 3.93 0.17 3.45 2.96 -1.26 -3.37 118.68 126.22 1u39 s LEU 107 Ca 0.02 -0.51 -0.30 0.00 -0.22 0.00 0.00 54.13 53.11 1u39 s LEU 107 Cb -0.13 -1.96 -0.08 0.00 0.50 0.00 0.00 46.19 44.52 1u39 s LEU 107 CO -0.05 -0.17 1.34 -0.04 -1.32 0.00 0.00 176.35 176.11 1u39 s MET 108 N 1.59 4.36 -0.92 1.98 -1.94 -0.87 -4.88 119.30 118.62 1u39 s MET 108 Ca 0.04 2.07 -0.24 0.00 -1.71 0.00 0.00 55.69 55.85 1u39 s MET 108 Cb -0.17 -3.21 -0.17 0.00 2.01 0.00 0.00 34.83 33.30 1u39 s MET 108 CO 0.05 -0.32 1.92 0.54 -0.01 0.00 0.00 175.02 177.20 1u39 n ARG 109 N 3.06 1.14 0.00 2.03 1.74 -1.26 -2.36 116.66 121.01 1u39 n ARG 109 Ca 0.08 -2.00 0.00 0.00 -0.77 0.00 0.00 57.85 55.16 1u39 n ARG 109 Cb 0.43 -3.40 0.00 0.00 -1.02 0.00 0.00 32.46 28.46 1u39 n ARG 109 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1u39 n GLY 110 N 5.41 0.31 3.23 -0.13 0.00 -1.26 -5.16 105.19 107.60 1u39 n GLY 110 Ca 0.46 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 46.19 1u39 n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u39 n GLY 111 N 0.00 -3.05 0.20 -0.02 0.00 -0.99 -4.91 105.19 96.42 1u39 n GLY 111 Ca 0.00 -1.28 0.09 0.00 0.00 0.00 0.00 46.02 44.83 1u39 n GLY 111 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1u39 h ILE 112 N -3.06 0.34 -0.24 -0.61 2.04 -1.75 -3.22 117.51 111.01 1u39 h ILE 112 Ca -0.43 -1.39 0.06 0.00 1.00 0.00 0.00 64.86 64.10 1u39 h ILE 112 Cb 1.20 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1u39 h ILE 112 CO 0.29 0.19 0.17 0.00 0.00 0.00 0.00 178.15 178.80 1u39 h ALA 113 N 1.81 2.18 -0.27 1.87 0.00 -1.91 -1.82 119.26 121.12 1u39 h ALA 113 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1u39 h ALA 113 Cb 1.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1u39 h ALA 113 CO 0.02 -0.25 0.17 1.05 0.00 0.00 0.00 179.25 180.25 1u39 h GLU 114 N 0.04 0.37 -0.51 0.00 4.11 -1.87 -2.52 114.58 114.19 1u39 h GLU 114 Ca 0.11 -0.03 -0.09 0.00 0.07 0.00 0.00 59.36 59.42 1u39 h GLU 114 Cb 0.41 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1u39 h GLU 114 CO -0.01 0.27 -0.04 0.00 0.07 0.00 0.00 179.01 179.31 1u39 h ARG 115 N 0.35 0.93 0.00 1.06 3.08 -1.55 -3.33 114.38 114.92 1u39 h ARG 115 Ca 0.10 -0.31 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1u39 h ARG 115 Cb -0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1u39 h ARG 115 CO -0.02 0.97 0.00 0.41 -1.07 0.00 0.00 179.97 180.26 1u39 n GLY 116 N -0.34 -2.71 0.00 0.04 0.00 -0.97 -4.67 105.19 96.54 1u39 n GLY 116 Ca 0.01 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 -0.02 0.00 -0.96 -2.80 105.19 100.51 1u39 n GLY 117 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1u39 n GLY 117 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1u39 n VAL 118 N 0.00 0.00 -1.43 1.61 0.31 -1.16 -4.81 118.33 112.85 1u39 n VAL 118 Ca 0.00 0.70 0.00 0.00 -0.01 0.00 0.00 64.34 65.03 1u39 n VAL 118 Cb 0.00 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 1u39 n VAL 118 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1u39 n ARG 119 N -2.23 -4.07 -2.13 5.55 0.63 -1.26 -4.53 116.66 108.62 1u39 n ARG 119 Ca 0.00 3.00 -0.43 0.00 -0.92 0.00 0.00 57.85 59.50 1u39 n ARG 119 Cb 0.00 -3.35 -0.03 0.00 0.45 0.00 0.00 32.46 29.54 1u39 n ARG 119 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1u39 s VAL 120 N -2.68 3.75 0.00 5.15 1.01 -1.26 -3.53 120.40 122.83 1u39 s VAL 120 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.85 1u39 s VAL 120 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1u39 s VAL 120 CO 0.00 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.50 1u39 n GLY 121 N 4.37 1.67 2.90 4.51 0.00 -1.26 -5.09 105.19 112.30 1u39 n GLY 121 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 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 0.55 -0.79 1.61 4.02 -1.23 -3.61 115.29 113.84 1u39 s HIS 122 Ca 0.00 -0.11 -0.21 0.00 1.02 0.00 0.00 55.06 55.76 1u39 s HIS 122 Cb 0.00 -0.49 0.10 0.00 -1.02 0.00 0.00 32.58 31.17 1u39 s HIS 122 CO 0.00 -0.12 1.04 0.50 1.02 0.00 0.00 174.74 177.18 1u39 s ARG 123 N 0.61 3.34 0.48 1.40 3.52 0.34 -2.63 118.95 126.00 1u39 s ARG 123 Ca -0.07 -1.27 -0.21 0.00 -0.13 0.00 0.00 55.73 54.04 1u39 s ARG 123 Cb -0.11 -4.57 -0.10 0.00 -1.56 0.00 0.00 34.95 28.61 1u39 s ARG 123 CO -0.00 -1.80 0.71 -0.89 -0.81 0.00 0.00 175.30 172.51 1u39 n ILE 124 N 5.75 2.28 0.00 4.11 5.41 0.41 -0.91 119.36 136.41 1u39 n ILE 124 Ca 0.09 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.34 1u39 n ILE 124 Cb 0.47 -0.81 0.00 0.00 -0.71 0.00 0.00 39.64 38.59 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 -1.06 0.00 -2.59 1.39 -5.35 0.80 -3.93 119.36 108.62 1u39 n ILE 125 Ca 0.11 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.18 1u39 n ILE 125 Cb 0.42 -0.04 -0.03 0.00 -1.74 0.00 0.00 39.64 38.25 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 3.56 -0.60 6.28 2.02 -1.25 0.12 118.70 128.83 1u39 s GLU 126 Ca 0.00 -1.10 -0.20 0.00 0.02 0.00 0.00 54.97 53.69 1u39 s GLU 126 Cb 0.00 -5.22 0.09 0.00 0.10 0.00 0.00 34.13 29.09 1u39 s GLU 126 CO 0.00 -2.17 0.79 0.42 0.02 0.00 0.00 175.26 174.32 1u39 s ILE 127 N 4.86 4.64 -1.56 -1.63 1.01 0.12 -0.80 121.20 127.83 1u39 s ILE 127 Ca 0.44 -0.69 0.00 0.00 0.00 0.00 0.00 60.65 60.40 1u39 s ILE 127 Cb -0.01 -4.54 0.00 0.00 0.01 0.00 0.00 42.46 37.92 1u39 s ILE 127 CO -0.08 -1.21 0.00 0.59 0.00 0.00 0.00 174.94 174.25 1u39 n ASN 128 N 6.82 -5.02 0.00 3.58 3.02 0.39 -1.51 115.26 122.54 1u39 n ASN 128 Ca -0.07 0.36 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 1u39 n ASN 128 Cb 0.44 -4.14 0.00 0.00 -0.61 0.00 0.00 39.78 35.47 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 -0.08 2.01 3.61 7.41 0.00 -1.26 -5.09 105.19 111.78 1u39 n GLY 129 Ca -0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 1u39 n GLY 129 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1u39 s GLN 130 N 0.00 4.00 -0.88 1.61 0.00 -0.57 -5.00 119.66 118.82 1u39 s GLN 130 Ca 0.00 -0.16 -0.25 0.00 -0.00 0.00 0.00 55.36 54.95 1u39 s GLN 130 Cb 0.00 -3.64 0.04 0.00 0.00 0.00 0.00 33.01 29.41 1u39 s GLN 130 CO 0.00 -0.17 1.41 -1.54 0.00 0.00 0.00 175.29 174.99 1u39 s SER 131 N 1.59 6.26 0.00 12.60 1.04 -1.24 0.11 113.70 134.05 1u39 s SER 131 Ca 0.10 -0.93 0.22 0.00 0.48 0.00 0.00 55.95 55.83 1u39 s SER 131 Cb -0.16 -2.56 1.16 0.00 0.10 0.00 0.00 66.02 64.56 1u39 s SER 131 CO 0.10 -1.73 1.72 1.33 0.98 0.00 0.00 173.24 175.64 1u39 n VAL 132 N 6.72 0.26 -0.35 5.02 0.24 0.33 -3.74 118.33 126.80 1u39 n VAL 132 Ca 0.20 0.07 0.25 0.00 -2.04 0.00 0.00 64.34 62.82 1u39 n VAL 132 Cb 0.50 -0.70 0.51 0.00 -1.47 0.00 0.00 33.84 32.68 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 0.39 -0.15 3.34 3.04 -1.68 0.31 116.25 121.50 1u39 h VAL 133 Ca 0.00 -0.12 -0.08 0.00 -1.01 0.00 0.00 66.70 65.50 1u39 h VAL 133 Cb 0.18 0.02 -0.05 0.00 -2.01 0.00 0.00 31.29 29.43 1u39 h VAL 133 CO 0.00 0.06 -0.31 0.00 -1.01 0.00 0.00 177.57 176.31 1u39 n ALA 134 N -2.42 3.91 -2.40 3.17 0.00 -1.25 -4.87 120.51 116.66 1u39 n ALA 134 Ca 0.30 -3.22 -0.31 0.00 0.00 0.00 0.00 53.44 50.20 1u39 n ALA 134 Cb 1.00 -0.51 -0.14 0.00 0.00 0.00 0.00 19.45 19.79 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 -3.24 2.56 1.02 0.00 2.01 0.11 -5.12 115.64 112.98 1u39 s THR 135 Ca 0.41 -1.05 -0.17 0.00 0.31 0.00 0.00 61.69 61.19 1u39 s THR 135 Cb 0.38 -1.99 0.02 0.00 0.01 0.00 0.00 72.50 70.92 1u39 s THR 135 CO -0.04 0.49 -0.05 -0.81 -0.69 0.00 0.00 174.62 173.52 1u39 n PRO 136 N 2.08 -0.67 -0.03 4.92 -0.04 -1.26 -4.32 135.00 135.67 1u39 n PRO 136 Ca -0.16 -0.17 -0.15 0.00 -0.04 0.00 0.00 63.50 62.98 1u39 n PRO 136 Cb 0.52 -1.62 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.61 0.44 -0.89 0.54 2.07 -1.92 -3.22 115.15 110.56 1u39 h HIS 137 Ca -0.47 -0.19 0.15 0.00 -2.85 0.00 0.00 60.37 57.01 1u39 h HIS 137 Cb 1.32 -0.07 -0.07 0.00 2.57 0.00 0.00 27.41 31.16 1u39 h HIS 137 CO 0.26 0.93 0.57 0.93 -3.07 0.00 0.00 177.93 177.55 1u39 h GLU 138 N -0.17 0.64 -0.21 5.12 5.08 -1.92 -1.46 114.58 121.65 1u39 h GLU 138 Ca -0.02 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1u39 h GLU 138 Cb 0.97 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1u39 h GLU 138 CO 0.07 0.42 0.08 -0.22 -1.00 0.00 0.00 179.01 178.36 1u39 h LYS 139 N 0.65 0.32 -0.84 2.33 3.64 -1.92 -1.61 116.57 119.14 1u39 h LYS 139 Ca 0.45 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.80 1u39 h LYS 139 Cb 0.77 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.49 1u39 h LYS 139 CO -0.21 0.38 0.54 0.82 -2.27 0.00 0.00 179.45 178.71 1u39 h ILE 140 N 0.19 1.14 -0.21 2.00 2.04 -1.30 -0.72 117.51 120.64 1u39 h ILE 140 Ca 0.07 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1u39 h ILE 140 Cb 0.18 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.24 1u39 h ILE 140 CO -0.01 0.19 -0.05 0.58 0.00 0.00 0.00 178.15 178.87 1u39 h VAL 141 N 1.05 1.16 0.41 1.67 2.07 -1.17 -2.56 116.25 118.90 1u39 h VAL 141 Ca 0.33 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1u39 h VAL 141 Cb 0.00 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1u39 h VAL 141 CO -0.11 0.22 -0.20 -0.74 0.02 0.00 0.00 177.57 176.76 1u39 h HIS 142 N 0.31 -0.51 0.12 1.57 6.17 -0.14 0.85 115.15 123.52 1u39 h HIS 142 Ca 0.07 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.16 1u39 h HIS 142 Cb 0.29 0.17 -0.04 0.00 2.52 0.00 0.00 27.41 30.35 1u39 h HIS 142 CO 0.01 -0.26 -0.38 0.82 0.71 0.00 0.00 177.93 178.83 1u39 h ILE 143 N -0.67 0.21 -0.03 6.26 5.03 -1.29 0.17 117.51 127.19 1u39 h ILE 143 Ca -0.06 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.68 1u39 h ILE 143 Cb 0.49 0.21 -0.00 0.00 -3.03 0.00 0.00 36.82 34.48 1u39 h ILE 143 CO 0.09 0.00 -0.01 -0.07 -0.68 0.00 0.00 178.15 177.48 1u39 h LEU 144 N -0.62 0.03 -1.41 1.44 3.38 -1.44 1.24 115.31 117.93 1u39 h LEU 144 Ca 0.03 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1u39 h LEU 144 Cb 0.65 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1u39 h LEU 144 CO -0.22 0.06 -0.27 0.28 0.09 0.00 0.00 178.44 178.37 1u39 h SER 145 N 0.04 0.00 -0.28 -0.43 0.02 0.27 -3.13 113.55 110.04 1u39 h SER 145 Ca 0.01 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.73 1u39 h SER 145 Cb 0.05 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.29 1u39 h SER 145 CO 0.00 0.27 -0.87 0.59 -1.14 0.00 0.00 176.83 175.68 1u39 n ASN 146 N -3.79 2.22 -2.76 3.07 3.02 0.41 -4.87 115.26 112.56 1u39 n ASN 146 Ca -0.01 -2.90 -0.28 0.00 -0.03 0.00 0.00 54.58 51.36 1u39 n ASN 146 Cb 0.37 -0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 39.11 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 -0.46 4.97 -0.45 5.41 0.00 0.40 -4.94 120.51 125.43 1u39 n ALA 147 Ca 0.18 -4.52 -0.27 0.00 0.00 0.00 0.00 53.44 48.83 1u39 n ALA 147 Cb 0.91 -0.74 0.23 0.00 0.00 0.00 0.00 19.45 19.85 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 -0.35 0.00 0.00 0.00 0.24 -1.26 -4.20 118.33 112.75 1u39 n VAL 148 Ca 0.36 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.46 1u39 n VAL 148 Cb 0.50 -0.79 0.00 0.00 -1.47 0.00 0.00 33.84 32.08 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 1.85 1.55 2.80 7.63 0.00 -0.73 -4.59 105.19 113.71 1u39 n GLY 149 Ca 0.06 -0.42 -0.15 0.00 0.00 0.00 0.00 46.02 45.51 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 0.53 -0.19 1.61 2.02 -1.26 0.11 118.70 121.52 1u39 s GLU 150 Ca 0.00 -0.49 -0.28 0.00 0.02 0.00 0.00 54.97 54.22 1u39 s GLU 150 Cb 0.00 -0.61 -0.05 0.00 0.10 0.00 0.00 34.13 33.57 1u39 s GLU 150 CO 0.00 -1.13 2.08 0.42 0.02 0.00 0.00 175.26 176.66 1u39 s ILE 151 N 1.87 3.11 -0.32 -1.63 1.01 0.19 -4.73 121.20 120.70 1u39 s ILE 151 Ca 0.14 0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1u39 s ILE 151 Cb -0.14 -3.14 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 1u39 s ILE 151 CO -0.16 -0.07 0.19 -2.28 0.00 0.00 0.00 174.94 172.61 1u39 s HIS 152 N 7.24 3.20 0.18 3.97 2.46 -1.25 -0.69 115.29 130.39 1u39 s HIS 152 Ca 0.94 -0.43 -0.09 0.00 0.47 0.00 0.00 55.06 55.95 1u39 s HIS 152 Cb -0.33 -2.40 -0.01 0.00 -0.13 0.00 0.00 32.58 29.71 1u39 s HIS 152 CO 0.36 -0.42 0.31 0.00 -2.47 0.00 0.00 174.74 172.51 1u39 s MET 153 N 1.65 1.24 0.20 2.88 0.23 -0.80 0.15 119.30 124.85 1u39 s MET 153 Ca 0.05 -1.24 0.08 0.00 -1.03 0.00 0.00 55.69 53.56 1u39 s MET 153 Cb -0.17 0.38 -0.04 0.00 -1.53 0.00 0.00 34.83 33.47 1u39 s MET 153 CO 0.08 -0.46 -0.03 0.15 -2.03 0.00 0.00 175.02 172.72 1u39 s LYS 154 N -4.00 2.26 -0.00 3.16 1.02 0.02 0.10 119.74 122.30 1u39 s LYS 154 Ca 0.21 -1.24 -0.02 0.00 0.02 0.00 0.00 55.97 54.94 1u39 s LYS 154 Cb 0.03 -2.24 -0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1u39 s LYS 154 CO 0.03 0.42 0.03 0.95 -0.92 0.00 0.00 175.35 175.87 1u39 s THR 155 N -1.88 0.04 0.56 2.17 -4.23 0.33 -0.14 115.64 112.50 1u39 s THR 155 Ca 0.28 -0.35 0.05 0.00 -1.18 0.00 0.00 61.69 60.48 1u39 s THR 155 Cb -0.08 -0.17 0.05 0.00 1.34 0.00 0.00 72.50 73.64 1u39 s THR 155 CO 0.18 -0.19 0.38 -0.04 -0.54 0.00 0.00 174.62 174.40 1u39 s MET 156 N -0.58 2.23 -0.49 3.99 -1.94 -0.09 -2.25 119.30 120.17 1u39 s MET 156 Ca -0.06 -2.11 -0.20 0.00 -1.71 0.00 0.00 55.69 51.60 1u39 s MET 156 Cb -0.04 -2.02 0.04 0.00 2.01 0.00 0.00 34.83 34.82 1u39 s MET 156 CO -0.00 -0.66 0.66 -1.25 -0.01 0.00 0.00 175.02 173.76 1u39 s PRO 157 N -4.28 3.19 0.00 2.03 0.04 -1.26 0.13 135.00 134.85 1u39 s PRO 157 Ca 0.29 -0.66 0.25 0.00 0.04 0.00 0.00 61.00 60.91 1u39 s PRO 157 Cb -0.02 -4.05 0.30 0.00 0.04 0.00 0.00 34.50 30.77 1u39 s PRO 157 CO 0.18 -1.18 1.32 0.00 0.04 0.00 0.00 177.00 177.37