#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 4.30 0.18 0.54 0.04 -1.26 -5.01 135.00 133.79 1u39 s PRO 80 Ca 0.00 2.00 -0.25 0.00 0.04 0.00 0.00 61.00 62.79 1u39 s PRO 80 Cb 0.00 -3.48 -0.08 0.00 0.04 0.00 0.00 34.50 30.98 1u39 s PRO 80 CO 0.00 -0.53 0.79 0.54 0.04 0.00 0.00 177.00 177.83 1u39 s VAL 81 N 2.01 4.36 0.31 -0.36 0.11 -1.26 -4.98 120.40 120.59 1u39 s VAL 81 Ca 0.64 1.70 -0.22 0.00 -2.93 0.00 0.00 61.98 61.17 1u39 s VAL 81 Cb -0.33 -4.12 -0.10 0.00 -1.53 0.00 0.00 36.38 30.30 1u39 s VAL 81 CO 0.28 0.49 0.86 -0.89 -3.33 0.00 0.00 175.10 172.51 1u39 s THR 82 N -1.19 4.39 -0.34 5.04 2.01 -0.82 -4.88 115.64 119.86 1u39 s THR 82 Ca 0.37 1.52 -0.07 0.00 0.31 0.00 0.00 61.69 63.82 1u39 s THR 82 Cb -0.23 -3.85 0.03 0.00 0.01 0.00 0.00 72.50 68.46 1u39 s THR 82 CO 0.26 0.04 0.12 -0.89 -0.69 0.00 0.00 174.62 173.46 1u39 s THR 83 N -1.73 3.98 -0.52 -0.82 2.01 -1.26 -1.61 115.64 115.69 1u39 s THR 83 Ca 0.51 -0.98 -0.22 0.00 0.31 0.00 0.00 61.69 61.31 1u39 s THR 83 Cb -0.15 -3.20 0.05 0.00 0.01 0.00 0.00 72.50 69.20 1u39 s THR 83 CO 0.20 -0.13 0.77 -0.69 -0.69 0.00 0.00 174.62 174.09 1u39 s VAL 84 N 1.45 4.65 -0.94 3.82 1.01 0.22 -3.62 120.40 126.99 1u39 s VAL 84 Ca -0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 1u39 s VAL 84 Cb -0.19 -4.40 0.23 0.00 0.00 0.00 0.00 36.38 32.02 1u39 s VAL 84 CO 0.03 -0.92 0.85 -0.22 0.00 0.00 0.00 175.10 174.84 1u39 s LEU 85 N 3.26 5.83 0.38 3.92 0.20 -1.23 -0.58 118.68 130.46 1u39 s LEU 85 Ca 0.23 -3.57 -0.20 0.00 0.69 0.00 0.00 54.13 51.28 1u39 s LEU 85 Cb -0.16 -2.01 -0.10 0.00 -0.43 0.00 0.00 46.19 43.49 1u39 s LEU 85 CO 0.16 -0.25 0.89 -0.63 -0.29 0.00 0.00 176.35 176.23 1u39 s ILE 86 N -1.16 4.44 -0.35 6.68 1.09 -0.59 -2.72 121.20 128.60 1u39 s ILE 86 Ca 0.27 1.39 -0.07 0.00 -1.10 0.00 0.00 60.65 61.15 1u39 s ILE 86 Cb -0.09 -3.66 0.05 0.00 -1.06 0.00 0.00 42.46 37.70 1u39 s ILE 86 CO -0.10 -0.21 0.13 -0.13 -0.10 0.00 0.00 174.94 174.52 1u39 s ARG 87 N -2.95 2.58 -0.45 2.79 1.81 -1.26 -0.69 118.95 120.78 1u39 s ARG 87 Ca 0.58 -1.25 -0.13 0.00 -1.72 0.00 0.00 55.73 53.21 1u39 s ARG 87 Cb -0.11 -3.50 0.08 0.00 -0.45 0.00 0.00 34.95 30.97 1u39 s ARG 87 CO 0.16 -0.72 0.34 0.50 -0.68 0.00 0.00 175.30 174.90 1u39 s ARG 88 N 1.39 2.82 0.03 3.54 3.52 0.19 -4.83 118.95 125.61 1u39 s ARG 88 Ca -0.01 -1.42 -0.24 0.00 -0.13 0.00 0.00 55.73 53.94 1u39 s ARG 88 Cb -0.20 -3.99 -0.17 0.00 -1.56 0.00 0.00 34.95 29.03 1u39 s ARG 88 CO 0.02 -1.01 1.44 -1.00 -0.81 0.00 0.00 175.30 173.94 1u39 h PRO 89 N 8.61 0.09 -4.95 5.12 0.13 -1.88 -0.26 132.00 138.86 1u39 h PRO 89 Ca -0.26 -0.03 -0.51 0.00 -0.87 0.00 0.00 66.00 64.34 1u39 h PRO 89 Cb 1.10 -0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.09 1u39 h PRO 89 CO 0.84 0.38 -0.50 0.34 -0.23 0.00 0.00 178.00 178.83 1u39 s ASP 90 N -5.61 2.11 0.46 1.44 2.15 -1.26 -4.70 116.67 111.26 1u39 s ASP 90 Ca -0.15 -1.73 0.26 0.00 0.43 0.00 0.00 52.55 51.36 1u39 s ASP 90 Cb 0.04 0.56 0.60 0.00 -0.30 0.00 0.00 42.92 43.81 1u39 s ASP 90 CO 0.68 -1.02 1.70 -0.07 -0.17 0.00 0.00 175.17 176.30 1u39 h LEU 91 N 2.00 0.00 -3.34 -1.34 3.38 -1.92 -3.12 115.31 110.97 1u39 h LEU 91 Ca -0.29 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.54 1u39 h LEU 91 Cb 1.25 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.91 1u39 h LEU 91 CO 0.44 0.00 0.18 -2.11 0.09 0.00 0.00 178.44 177.04 1u39 n ARG 92 N -3.08 3.59 -3.96 1.13 1.85 -1.26 -4.74 116.66 110.18 1u39 n ARG 92 Ca 0.03 -2.63 -0.30 0.00 -1.00 0.00 0.00 57.85 53.95 1u39 n ARG 92 Cb 0.47 -2.10 -0.14 0.00 -1.05 0.00 0.00 32.46 29.64 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 -2.59 3.30 1.09 2.89 1.51 -1.18 -5.11 117.35 117.26 1u39 s TYR 93 Ca 0.47 -3.13 -0.12 0.00 -1.01 0.00 0.00 57.07 53.28 1u39 s TYR 93 Cb 0.37 -2.83 0.23 0.00 -0.11 0.00 0.00 41.96 39.62 1u39 s TYR 93 CO 0.12 -0.79 1.01 0.00 -1.11 0.00 0.00 175.55 174.78 1u39 n GLN 94 N 3.37 -1.76 0.09 -0.62 0.00 -1.26 -4.83 117.38 112.37 1u39 n GLN 94 Ca 0.05 -0.47 -0.20 0.00 0.00 0.00 0.00 57.00 56.38 1u39 n GLN 94 Cb 0.34 -2.21 -0.15 0.00 0.00 0.00 0.00 30.24 28.22 1u39 n GLN 94 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1u39 h LEU 95 N -2.40 0.56 -0.41 2.61 4.07 -1.97 -3.45 115.31 114.32 1u39 h LEU 95 Ca -0.55 -0.69 0.00 0.00 0.08 0.00 0.00 57.88 56.72 1u39 h LEU 95 Cb 1.31 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.87 1u39 h LEU 95 CO 0.46 1.56 0.00 0.61 -1.08 0.00 0.00 178.44 179.99 1u39 n GLY 96 N 1.69 0.52 1.11 0.83 0.00 -1.26 -3.22 105.19 104.87 1u39 n GLY 96 Ca -0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 1u39 n GLY 96 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1u39 n PHE 97 N -0.20 -1.37 -4.04 1.61 -1.74 -1.26 -2.05 117.46 108.42 1u39 n PHE 97 Ca 0.00 -0.54 -0.19 0.00 -0.56 0.00 0.00 57.45 56.16 1u39 n PHE 97 Cb 0.10 0.27 -0.16 0.00 1.52 0.00 0.00 39.48 41.20 1u39 n PHE 97 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 1u39 s SER 98 N -1.62 0.83 -0.14 5.98 0.15 -0.51 -4.95 113.70 113.45 1u39 s SER 98 Ca 0.05 -0.09 -0.03 0.00 0.70 0.00 0.00 55.95 56.59 1u39 s SER 98 Cb -0.01 -0.37 -0.03 0.00 -1.71 0.00 0.00 66.02 63.90 1u39 s SER 98 CO 0.03 -0.09 -0.05 0.54 1.20 0.00 0.00 173.24 174.88 1u39 s VAL 99 N 1.06 3.78 -0.52 4.45 0.11 -1.26 -2.01 120.40 126.01 1u39 s VAL 99 Ca -0.09 -0.41 0.04 0.00 -2.93 0.00 0.00 61.98 58.59 1u39 s VAL 99 Cb -0.14 -2.63 0.14 0.00 -1.53 0.00 0.00 36.38 32.22 1u39 s VAL 99 CO -0.01 0.51 0.29 -1.10 -3.33 0.00 0.00 175.10 171.46 1u39 s GLN 100 N 0.16 1.82 -1.66 1.54 -0.21 0.17 -4.76 119.66 116.73 1u39 s GLN 100 Ca -0.02 -2.54 0.00 0.00 0.02 0.00 0.00 55.36 52.82 1u39 s GLN 100 Cb -0.14 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 30.87 1u39 s GLN 100 CO 0.03 -1.16 0.00 0.09 -2.12 0.00 0.00 175.29 172.13 1u39 n ASN 101 N 3.06 -4.63 0.00 5.90 4.13 -1.26 -1.70 115.26 120.76 1u39 n ASN 101 Ca 0.09 0.39 0.00 0.00 1.68 0.00 0.00 54.58 56.73 1u39 n ASN 101 Cb 0.34 -4.01 0.00 0.00 -1.54 0.00 0.00 39.78 34.56 1u39 n ASN 101 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1u39 n GLY 102 N -0.20 3.79 3.73 7.41 0.00 -1.26 -3.82 105.19 114.84 1u39 n GLY 102 Ca -0.16 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 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 4.26 -0.03 -0.61 1.01 -0.69 0.16 121.20 125.30 1u39 s ILE 103 Ca 0.00 1.80 -0.15 0.00 0.00 0.00 0.00 60.65 62.30 1u39 s ILE 103 Cb 0.00 -4.15 -0.05 0.00 0.01 0.00 0.00 42.46 38.26 1u39 s ILE 103 CO 0.00 0.24 0.42 -0.63 0.00 0.00 0.00 174.94 174.97 1u39 s ILE 104 N 0.29 5.07 0.00 2.92 1.09 -1.11 0.46 121.20 129.91 1u39 s ILE 104 Ca 0.51 0.85 0.00 0.00 -1.10 0.00 0.00 60.65 60.91 1u39 s ILE 104 Cb -0.26 -3.73 0.00 0.00 -1.06 0.00 0.00 42.46 37.41 1u39 s ILE 104 CO 0.31 0.52 0.00 0.00 -0.10 0.00 0.00 174.94 175.67 1u39 s SER 106 N -2.11 6.63 -0.21 0.00 0.01 -1.26 -4.82 113.70 111.94 1u39 s SER 106 Ca 0.00 0.75 -0.01 0.00 1.31 0.00 0.00 55.95 58.00 1u39 s SER 106 Cb 0.00 -2.32 0.06 0.00 0.21 0.00 0.00 66.02 63.97 1u39 s SER 106 CO 0.00 -0.21 -0.00 -0.22 0.41 0.00 0.00 173.24 173.22 1u39 s LEU 107 N 1.68 1.75 0.60 2.44 0.20 -1.26 -1.42 118.68 122.67 1u39 s LEU 107 Ca 0.26 -0.96 -0.19 0.00 0.69 0.00 0.00 54.13 53.93 1u39 s LEU 107 Cb -0.16 -0.84 -0.03 0.00 -0.43 0.00 0.00 46.19 44.74 1u39 s LEU 107 CO 0.10 -0.28 1.22 -0.04 -0.29 0.00 0.00 176.35 177.06 1u39 s MET 108 N 1.67 2.91 -0.46 1.98 -1.94 -0.87 -4.91 119.30 117.68 1u39 s MET 108 Ca -0.03 1.85 -0.03 0.00 -1.71 0.00 0.00 55.69 55.78 1u39 s MET 108 Cb -0.18 -1.92 0.18 0.00 2.01 0.00 0.00 34.83 34.92 1u39 s MET 108 CO -0.07 -1.26 2.38 -2.13 -0.01 0.00 0.00 175.02 173.93 1u39 n ARG 109 N -1.65 2.25 0.00 2.03 3.00 -1.26 -3.91 116.66 117.12 1u39 n ARG 109 Ca 0.14 -2.27 0.00 0.00 -0.00 0.00 0.00 57.85 55.72 1u39 n ARG 109 Cb 0.49 -1.99 0.00 0.00 0.00 0.00 0.00 32.46 30.97 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 0.40 0.08 3.25 5.14 0.00 -1.26 -5.13 105.19 107.67 1u39 n GLY 110 Ca 0.44 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.28 -2.63 0.21 -0.02 0.00 -1.25 -4.88 105.19 96.33 1u39 n GLY 111 Ca 0.00 -0.68 0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.70 0.00 -0.22 -0.61 5.03 -1.85 -3.22 117.51 114.94 1u39 h ILE 112 Ca -0.48 -0.89 0.05 0.00 -0.12 0.00 0.00 64.86 63.42 1u39 h ILE 112 Cb 1.34 1.89 -0.01 0.00 -3.03 0.00 0.00 36.82 37.01 1u39 h ILE 112 CO 0.34 0.00 0.16 0.00 -0.68 0.00 0.00 178.15 177.96 1u39 h ALA 113 N 2.05 2.15 -0.52 1.87 0.00 -1.90 -1.38 119.26 121.53 1u39 h ALA 113 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1u39 h ALA 113 Cb 0.92 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1u39 h ALA 113 CO 0.00 -0.20 0.33 1.05 0.00 0.00 0.00 179.25 180.43 1u39 h GLU 114 N 0.05 0.65 -0.18 0.00 4.11 -1.88 -2.83 114.58 114.49 1u39 h GLU 114 Ca 0.10 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.48 1u39 h GLU 114 Cb 0.35 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1u39 h GLU 114 CO -0.01 0.43 0.04 0.00 0.07 0.00 0.00 179.01 179.55 1u39 h ARG 115 N 0.67 0.29 0.00 1.06 3.08 -1.47 -3.33 114.38 114.67 1u39 h ARG 115 Ca 0.20 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1u39 h ARG 115 Cb -0.03 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1u39 h ARG 115 CO -0.07 0.42 0.00 0.41 -1.07 0.00 0.00 179.97 179.67 1u39 n GLY 116 N -0.53 -3.07 0.00 0.04 0.00 -1.05 -4.82 105.19 95.76 1u39 n GLY 116 Ca -0.04 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.90 0.00 2.46 -0.02 0.00 -1.10 -3.58 105.19 102.05 1u39 n GLY 117 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 -3.88 1.61 3.14 -1.16 -4.74 118.33 113.30 1u39 n VAL 118 Ca 0.00 -0.39 -0.13 0.00 -2.96 0.00 0.00 64.34 60.87 1u39 n VAL 118 Cb 0.00 0.00 -0.14 0.00 -1.06 0.00 0.00 33.84 32.64 1u39 n VAL 118 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1u39 s ARG 119 N -1.02 0.02 -1.16 1.45 1.81 -1.26 -4.85 118.95 113.94 1u39 s ARG 119 Ca 0.40 0.01 -0.22 0.00 -1.72 0.00 0.00 55.73 54.20 1u39 s ARG 119 Cb -0.31 -0.06 -0.06 0.00 -0.45 0.00 0.00 34.95 34.07 1u39 s ARG 119 CO 0.55 -0.01 1.90 0.08 -0.68 0.00 0.00 175.30 177.14 1u39 s VAL 120 N 0.12 3.61 0.00 3.52 1.01 -1.26 -3.03 120.40 124.37 1u39 s VAL 120 Ca -0.01 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1u39 s VAL 120 Cb -0.02 -4.60 0.00 0.00 0.00 0.00 0.00 36.38 31.77 1u39 s VAL 120 CO -0.00 -1.13 0.00 0.61 0.00 0.00 0.00 175.10 174.58 1u39 n GLY 121 N 5.90 0.39 2.98 4.51 0.00 -1.20 -5.01 105.19 112.76 1u39 n GLY 121 Ca 0.45 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.71 1.07 -0.94 1.61 3.76 -1.17 -3.69 115.29 115.22 1u39 s HIS 122 Ca 0.00 -0.33 -0.23 0.00 -0.15 0.00 0.00 55.06 54.35 1u39 s HIS 122 Cb 0.00 -0.81 0.06 0.00 1.11 0.00 0.00 32.58 32.94 1u39 s HIS 122 CO 0.00 -0.19 1.36 0.50 -0.85 0.00 0.00 174.74 175.57 1u39 s ARG 123 N 0.57 3.49 0.83 1.40 3.52 0.44 -2.74 118.95 126.47 1u39 s ARG 123 Ca -0.10 -1.00 -0.16 0.00 -0.13 0.00 0.00 55.73 54.34 1u39 s ARG 123 Cb -0.13 -5.03 -0.07 0.00 -1.56 0.00 0.00 34.95 28.15 1u39 s ARG 123 CO 0.02 -2.14 -0.03 -0.89 -0.81 0.00 0.00 175.30 171.44 1u39 n ILE 124 N 6.61 0.51 0.00 4.11 5.41 0.41 -1.92 119.36 134.48 1u39 n ILE 124 Ca 0.25 -0.40 0.00 0.00 1.00 0.00 0.00 62.75 63.60 1u39 n ILE 124 Cb 0.50 -0.36 0.00 0.00 -0.71 0.00 0.00 39.64 39.07 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 -2.58 0.00 -2.41 1.39 -5.35 0.92 -4.33 119.36 107.00 1u39 n ILE 125 Ca 0.05 0.00 -0.38 0.00 -0.27 0.00 0.00 62.75 62.15 1u39 n ILE 125 Cb 0.52 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.39 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 3.22 -0.66 6.28 2.02 -1.22 0.12 118.70 128.45 1u39 s GLU 126 Ca 0.00 -0.64 -0.20 0.00 0.02 0.00 0.00 54.97 54.14 1u39 s GLU 126 Cb 0.00 -5.00 0.09 0.00 0.10 0.00 0.00 34.13 29.32 1u39 s GLU 126 CO 0.00 -2.49 0.86 0.42 0.02 0.00 0.00 175.26 174.07 1u39 s ILE 127 N 6.54 4.62 -0.80 -1.63 1.01 0.10 -1.01 121.20 130.03 1u39 s ILE 127 Ca 0.51 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.34 1u39 s ILE 127 Cb -0.04 -4.60 0.00 0.00 0.01 0.00 0.00 42.46 37.83 1u39 s ILE 127 CO -0.01 -1.31 0.00 -0.46 0.00 0.00 0.00 174.94 173.16 1u39 n ASN 128 N 6.88 -2.76 0.00 3.58 0.23 0.43 -0.99 115.26 122.64 1u39 n ASN 128 Ca -0.03 0.26 0.00 0.00 -0.53 0.00 0.00 54.58 54.28 1u39 n ASN 128 Cb 0.44 -2.51 0.00 0.00 -2.08 0.00 0.00 39.78 35.64 1u39 n ASN 128 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1u39 n GLY 129 N -0.52 1.15 3.51 4.83 0.00 -1.26 -5.05 105.19 107.85 1u39 n GLY 129 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 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 3.36 -0.67 1.61 -2.07 -0.16 -5.03 119.66 116.71 1u39 s GLN 130 Ca 0.00 -0.74 -0.27 0.00 -1.82 0.00 0.00 55.36 52.53 1u39 s GLN 130 Cb 0.00 -3.85 0.02 0.00 -1.09 0.00 0.00 33.01 28.09 1u39 s GLN 130 CO 0.00 -0.52 1.35 0.45 -1.32 0.00 0.00 175.29 175.25 1u39 s SER 131 N 1.71 6.12 0.00 12.60 0.15 -1.25 0.01 113.70 133.04 1u39 s SER 131 Ca 0.06 -0.14 0.12 0.00 0.70 0.00 0.00 55.95 56.68 1u39 s SER 131 Cb -0.18 -2.55 0.57 0.00 -1.71 0.00 0.00 66.02 62.15 1u39 s SER 131 CO 0.10 -1.81 1.39 1.33 1.20 0.00 0.00 173.24 175.46 1u39 n VAL 132 N 6.60 0.11 -1.69 4.45 0.24 0.32 -4.87 118.33 123.48 1u39 n VAL 132 Ca 0.07 -0.13 -0.52 0.00 -2.04 0.00 0.00 64.34 61.72 1u39 n VAL 132 Cb 0.49 -0.01 -0.06 0.00 -1.47 0.00 0.00 33.84 32.80 1u39 n VAL 132 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1u39 n VAL 133 N -0.31 0.46 -1.60 3.34 3.14 -1.26 0.10 118.33 122.20 1u39 n VAL 133 Ca 0.10 -0.09 -0.12 0.00 -2.96 0.00 0.00 64.34 61.27 1u39 n VAL 133 Cb 0.12 -1.59 -0.04 0.00 -1.06 0.00 0.00 33.84 31.27 1u39 n VAL 133 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1u39 n ALA 134 N 6.24 -0.23 -2.86 1.55 0.00 -1.25 -5.00 120.51 118.95 1u39 n ALA 134 Ca 0.25 0.17 -0.36 0.00 0.00 0.00 0.00 53.44 53.50 1u39 n ALA 134 Cb 0.22 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.19 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 -2.49 5.45 0.32 0.00 2.01 0.28 -5.06 115.64 116.15 1u39 s THR 135 Ca 0.00 0.14 -0.25 0.00 0.31 0.00 0.00 61.69 61.88 1u39 s THR 135 Cb 0.00 -3.47 -0.14 0.00 0.01 0.00 0.00 72.50 68.90 1u39 s THR 135 CO 0.00 0.52 0.62 -2.65 -0.69 0.00 0.00 174.62 172.42 1u39 n PRO 136 N 1.62 0.57 -0.04 4.92 -0.02 -1.26 -4.17 135.00 136.61 1u39 n PRO 136 Ca -0.16 0.20 -0.11 0.00 -2.02 0.00 0.00 63.50 61.41 1u39 n PRO 136 Cb 0.54 -1.41 -0.05 0.00 -0.02 0.00 0.00 33.50 32.56 1u39 n PRO 136 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 1u39 h HIS 137 N 1.13 0.24 -0.66 6.00 2.07 -1.91 -2.67 115.15 119.34 1u39 h HIS 137 Ca -0.36 -0.02 0.13 0.00 -2.85 0.00 0.00 60.37 57.27 1u39 h HIS 137 Cb 1.40 -0.07 -0.04 0.00 2.57 0.00 0.00 27.41 31.27 1u39 h HIS 137 CO 0.40 0.29 0.45 1.49 -3.07 0.00 0.00 177.93 177.49 1u39 h GLU 138 N 0.12 0.35 -0.03 5.12 4.81 -1.90 -1.59 114.58 121.45 1u39 h GLU 138 Ca 0.05 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1u39 h GLU 138 Cb 0.15 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 1u39 h GLU 138 CO -0.01 0.23 0.00 -0.22 -0.73 0.00 0.00 179.01 178.29 1u39 h LYS 139 N 0.36 0.06 -0.52 1.92 3.11 -1.84 -1.32 116.57 118.34 1u39 h LYS 139 Ca 0.32 -0.02 0.02 0.00 -2.81 0.00 0.00 60.65 58.16 1u39 h LYS 139 Cb 0.74 -0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 31.93 1u39 h LYS 139 CO -0.09 0.35 0.31 0.82 -2.81 0.00 0.00 179.45 178.04 1u39 h ILE 140 N -0.23 1.06 -0.26 2.00 2.04 -1.14 -0.71 117.51 120.28 1u39 h ILE 140 Ca 0.01 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 1u39 h ILE 140 Cb 0.32 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1u39 h ILE 140 CO 0.00 0.11 0.13 0.58 0.00 0.00 0.00 178.15 178.97 1u39 h VAL 141 N 0.63 1.09 0.26 1.67 2.07 -1.27 -2.51 116.25 118.18 1u39 h VAL 141 Ca 0.21 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 1u39 h VAL 141 Cb 0.01 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1u39 h VAL 141 CO -0.09 0.10 -0.13 -0.74 0.02 0.00 0.00 177.57 176.73 1u39 h HIS 142 N 0.35 -0.33 0.12 1.57 6.17 0.07 1.01 115.15 124.11 1u39 h HIS 142 Ca 0.09 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.18 1u39 h HIS 142 Cb 0.03 0.11 -0.04 0.00 2.52 0.00 0.00 27.41 30.03 1u39 h HIS 142 CO 0.00 -0.20 -0.39 0.82 0.71 0.00 0.00 177.93 178.87 1u39 h ILE 143 N -0.35 0.21 0.00 6.26 5.03 -1.03 0.26 117.51 127.88 1u39 h ILE 143 Ca -0.03 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.69 1u39 h ILE 143 Cb 0.27 0.21 -0.00 0.00 -3.03 0.00 0.00 36.82 34.27 1u39 h ILE 143 CO 0.05 0.00 -0.09 -0.07 -0.68 0.00 0.00 178.15 177.36 1u39 h LEU 144 N -0.62 0.00 -1.30 1.44 3.38 -1.38 1.07 115.31 117.91 1u39 h LEU 144 Ca 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1u39 h LEU 144 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1u39 h LEU 144 CO -0.23 0.09 -0.30 0.28 0.09 0.00 0.00 178.44 178.38 1u39 h SER 145 N 0.00 0.00 -0.13 -0.43 0.02 0.29 -3.12 113.55 110.18 1u39 h SER 145 Ca -0.00 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 1u39 h SER 145 Cb 0.17 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.51 1u39 h SER 145 CO 0.01 0.30 -0.75 0.59 -1.14 0.00 0.00 176.83 175.84 1u39 n ASN 146 N -3.71 1.91 -3.00 3.07 3.02 0.73 -4.86 115.26 112.42 1u39 n ASN 146 Ca -0.01 -3.18 -0.29 0.00 -0.03 0.00 0.00 54.58 51.07 1u39 n ASN 146 Cb 0.40 -0.43 -0.03 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 -0.55 4.87 -0.46 5.41 0.00 0.35 -4.95 120.51 125.18 1u39 n ALA 147 Ca 0.18 -4.68 -0.26 0.00 0.00 0.00 0.00 53.44 48.67 1u39 n ALA 147 Cb 0.87 -0.89 0.21 0.00 0.00 0.00 0.00 19.45 19.64 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 -0.24 0.00 0.00 0.00 0.24 -1.26 -4.48 118.33 112.59 1u39 n VAL 148 Ca 0.33 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.47 1u39 n VAL 148 Cb 0.39 -0.74 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 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 1.99 2.22 3.02 7.63 0.00 -0.11 -4.65 105.19 115.29 1u39 n GLY 149 Ca 0.06 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 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 2.24 -0.41 1.61 2.02 -1.26 0.54 118.70 123.44 1u39 s GLU 150 Ca 0.00 -0.75 -0.22 0.00 0.02 0.00 0.00 54.97 54.02 1u39 s GLU 150 Cb 0.00 -2.32 0.02 0.00 0.10 0.00 0.00 34.13 31.92 1u39 s GLU 150 CO 0.00 -0.33 0.73 0.42 0.02 0.00 0.00 175.26 176.09 1u39 s ILE 151 N 1.41 4.75 -0.27 -1.63 1.01 0.13 -4.94 121.20 121.67 1u39 s ILE 151 Ca 0.02 0.50 -0.16 0.00 0.00 0.00 0.00 60.65 61.01 1u39 s ILE 151 Cb -0.15 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.06 1u39 s ILE 151 CO -0.10 -0.56 0.41 -1.00 0.00 0.00 0.00 174.94 173.70 1u39 s HIS 152 N 3.05 3.25 0.10 3.97 3.76 -1.26 -1.54 115.29 126.62 1u39 s HIS 152 Ca 0.28 0.47 -0.01 0.00 -0.15 0.00 0.00 55.06 55.65 1u39 s HIS 152 Cb -0.13 -2.61 -0.04 0.00 1.11 0.00 0.00 32.58 30.91 1u39 s HIS 152 CO 0.19 -0.24 0.02 1.41 -0.85 0.00 0.00 174.74 175.27 1u39 s MET 153 N 2.13 0.79 0.00 1.40 0.00 0.26 0.16 119.30 124.04 1u39 s MET 153 Ca 0.17 -1.34 0.04 0.00 0.00 0.00 0.00 55.69 54.55 1u39 s MET 153 Cb -0.16 0.21 -0.01 0.00 0.00 0.00 0.00 34.83 34.87 1u39 s MET 153 CO 0.10 -0.19 -0.13 0.15 0.00 0.00 0.00 175.02 174.94 1u39 s LYS 154 N -3.99 1.03 0.02 4.11 1.02 -0.18 0.71 119.74 122.47 1u39 s LYS 154 Ca 0.16 -0.53 0.00 0.00 0.02 0.00 0.00 55.97 55.62 1u39 s LYS 154 Cb 0.08 -1.01 -0.02 0.00 -0.52 0.00 0.00 37.83 36.36 1u39 s LYS 154 CO -0.03 0.27 -0.03 0.95 -0.92 0.00 0.00 175.35 175.59 1u39 s THR 155 N -0.43 0.12 0.54 2.17 -4.23 -0.63 -0.06 115.64 113.13 1u39 s THR 155 Ca 0.04 -0.69 0.03 0.00 -1.18 0.00 0.00 61.69 59.89 1u39 s THR 155 Cb -0.06 -0.23 0.03 0.00 1.34 0.00 0.00 72.50 73.58 1u39 s THR 155 CO -0.00 -0.36 0.25 0.23 -0.54 0.00 0.00 174.62 174.20 1u39 n MET 156 N 1.97 0.70 -2.84 3.99 0.00 -0.81 -1.94 117.12 118.20 1u39 n MET 156 Ca -0.21 -3.58 -0.43 0.00 0.00 0.00 0.00 57.70 53.48 1u39 n MET 156 Cb 0.56 0.62 -0.04 0.00 0.00 0.00 0.00 33.22 34.36 1u39 n MET 156 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1u39 s PRO 157 N -4.12 3.67 0.00 0.03 0.04 -1.26 0.17 135.00 133.53 1u39 s PRO 157 Ca 0.19 0.32 0.26 0.00 0.04 0.00 0.00 61.00 61.81 1u39 s PRO 157 Cb -0.02 -3.87 0.68 0.00 0.04 0.00 0.00 34.50 31.33 1u39 s PRO 157 CO 0.12 -1.08 1.53 0.00 0.04 0.00 0.00 177.00 177.62