#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 2.53 -0.25 0.54 0.02 -1.26 -4.93 135.00 131.65 1u39 s PRO 80 Ca 0.00 -0.67 -0.09 0.00 0.02 0.00 0.00 61.00 60.26 1u39 s PRO 80 Cb 0.00 -5.14 -0.04 0.00 0.02 0.00 0.00 34.50 29.34 1u39 s PRO 80 CO 0.00 -3.64 0.13 0.08 -0.33 0.00 0.00 177.00 173.24 1u39 s VAL 81 N 10.50 5.00 -0.08 3.83 1.01 -1.26 -4.21 120.40 135.19 1u39 s VAL 81 Ca 0.69 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.74 1u39 s VAL 81 Cb -0.04 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 1u39 s VAL 81 CO 0.05 0.33 -0.08 -0.89 0.00 0.00 0.00 175.10 174.51 1u39 s THR 82 N 1.33 3.58 -0.40 3.92 2.01 -0.91 -4.92 115.64 120.25 1u39 s THR 82 Ca 0.06 -0.52 -0.16 0.00 0.31 0.00 0.00 61.69 61.39 1u39 s THR 82 Cb -0.15 -2.47 0.01 0.00 0.01 0.00 0.00 72.50 69.91 1u39 s THR 82 CO 0.06 0.58 0.35 -0.89 -0.69 0.00 0.00 174.62 174.03 1u39 s THR 83 N -0.61 5.20 -0.55 -0.82 2.01 -1.26 -1.05 115.64 118.56 1u39 s THR 83 Ca 0.09 -0.44 -0.25 0.00 0.31 0.00 0.00 61.69 61.40 1u39 s THR 83 Cb -0.12 -3.93 0.04 0.00 0.01 0.00 0.00 72.50 68.50 1u39 s THR 83 CO 0.02 -0.29 0.99 -0.69 -0.69 0.00 0.00 174.62 173.95 1u39 s VAL 84 N 1.87 4.32 -0.93 3.82 1.01 0.14 -4.17 120.40 126.46 1u39 s VAL 84 Ca 0.08 0.44 -0.08 0.00 0.00 0.00 0.00 61.98 62.43 1u39 s VAL 84 Cb -0.18 -4.57 0.23 0.00 0.00 0.00 0.00 36.38 31.87 1u39 s VAL 84 CO 0.11 -1.14 0.86 -0.22 0.00 0.00 0.00 175.10 174.72 1u39 s LEU 85 N 4.14 6.10 0.00 3.92 0.20 -1.11 -1.95 118.68 129.98 1u39 s LEU 85 Ca 0.33 -3.33 -0.28 0.00 0.69 0.00 0.00 54.13 51.54 1u39 s LEU 85 Cb -0.11 -2.09 -0.04 0.00 -0.43 0.00 0.00 46.19 43.52 1u39 s LEU 85 CO 0.21 -0.33 0.90 -0.63 -0.29 0.00 0.00 176.35 176.20 1u39 s ILE 86 N -0.81 4.86 -0.20 6.68 1.01 0.03 -3.06 121.20 129.70 1u39 s ILE 86 Ca 0.25 1.89 -0.18 0.00 0.00 0.00 0.00 60.65 62.61 1u39 s ILE 86 Cb -0.11 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 1u39 s ILE 86 CO -0.09 0.21 0.50 -0.13 0.00 0.00 0.00 174.94 175.43 1u39 s ARG 87 N 0.76 4.19 -0.13 2.79 0.52 -1.26 -0.44 118.95 125.37 1u39 s ARG 87 Ca 0.47 0.37 0.00 0.00 -0.52 0.00 0.00 55.73 56.06 1u39 s ARG 87 Cb -0.20 -3.56 0.02 0.00 0.52 0.00 0.00 34.95 31.73 1u39 s ARG 87 CO 0.26 -0.13 -0.12 0.50 0.02 0.00 0.00 175.30 175.83 1u39 s ARG 88 N 1.57 2.00 0.29 3.54 3.52 0.17 -4.80 118.95 125.24 1u39 s ARG 88 Ca 0.23 -0.44 0.13 0.00 -0.13 0.00 0.00 55.73 55.52 1u39 s ARG 88 Cb -0.15 -1.90 0.38 0.00 -1.56 0.00 0.00 34.95 31.72 1u39 s ARG 88 CO 0.09 -0.24 1.61 -1.00 -0.81 0.00 0.00 175.30 174.95 1u39 h PRO 89 N 8.07 0.00 0.00 5.12 0.13 -1.88 -3.09 132.00 140.35 1u39 h PRO 89 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1u39 h PRO 89 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1u39 h PRO 89 CO 0.48 0.58 0.00 -3.47 -0.23 0.00 0.00 178.00 175.36 1u39 n ASP 90 N -3.65 0.00 -0.01 1.44 -0.08 -1.26 -4.89 116.55 108.10 1u39 n ASP 90 Ca -0.01 -0.94 0.15 0.00 -1.51 0.00 0.00 54.79 52.48 1u39 n ASP 90 Cb 0.62 0.00 0.75 0.00 2.34 0.00 0.00 41.12 44.83 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 0.03 -1.91 -2.67 4.32 -1.26 -3.35 117.00 112.17 1u39 n LEU 91 Ca 0.00 0.26 -0.12 0.00 -0.02 0.00 0.00 56.01 56.13 1u39 n LEU 91 Cb 0.00 -0.27 0.24 0.00 -1.62 0.00 0.00 43.42 41.76 1u39 n LEU 91 CO 0.00 0.01 1.07 -2.11 -1.22 0.00 0.00 177.39 175.14 1u39 n ARG 92 N -1.26 2.78 -3.44 3.23 1.85 -1.26 -4.70 116.66 113.86 1u39 n ARG 92 Ca 0.14 -3.06 -0.27 0.00 -1.00 0.00 0.00 57.85 53.66 1u39 n ARG 92 Cb 0.24 -2.12 -0.10 0.00 -1.05 0.00 0.00 32.46 29.43 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 -3.16 1.23 0.96 2.89 1.51 -1.21 -5.11 117.35 114.46 1u39 s TYR 93 Ca 0.54 -2.31 -0.11 0.00 -1.01 0.00 0.00 57.07 54.18 1u39 s TYR 93 Cb 0.45 -1.06 0.17 0.00 -0.11 0.00 0.00 41.96 41.41 1u39 s TYR 93 CO 0.10 -0.81 1.12 -0.65 -1.11 0.00 0.00 175.55 174.20 1u39 s GLN 94 N 0.09 0.68 -0.05 -0.62 1.11 -1.26 -4.83 119.66 114.78 1u39 s GLN 94 Ca 0.30 1.39 -0.00 0.00 0.01 0.00 0.00 55.36 57.07 1u39 s GLN 94 Cb -0.01 -1.70 -0.00 0.00 -1.01 0.00 0.00 33.01 30.29 1u39 s GLN 94 CO -0.17 -2.81 0.00 -0.07 0.01 0.00 0.00 175.29 172.25 1u39 h LEU 95 N -2.00 -0.00 0.00 2.90 4.07 -1.97 -3.45 115.31 114.87 1u39 h LEU 95 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1u39 h LEU 95 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1u39 h LEU 95 CO 0.44 0.23 0.00 0.61 -1.08 0.00 0.00 178.44 178.64 1u39 n GLY 96 N 1.90 0.57 3.62 0.83 0.00 -1.26 -4.14 105.19 106.71 1u39 n GLY 96 Ca -0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.52 -0.82 0.39 1.61 -0.71 -1.25 -1.65 117.98 115.03 1u39 s PHE 97 Ca 0.00 1.59 -0.25 0.00 -1.04 0.00 0.00 56.93 57.23 1u39 s PHE 97 Cb 0.00 0.49 -0.09 0.00 -1.21 0.00 0.00 43.02 42.21 1u39 s PHE 97 CO 0.00 -0.40 1.13 0.45 -1.34 0.00 0.00 175.22 175.06 1u39 s SER 98 N 1.65 6.65 -0.09 1.98 0.15 -1.20 -4.90 113.70 117.95 1u39 s SER 98 Ca -0.09 2.27 0.01 0.00 0.70 0.00 0.00 55.95 58.84 1u39 s SER 98 Cb -0.05 -2.61 -0.03 0.00 -1.71 0.00 0.00 66.02 61.63 1u39 s SER 98 CO -0.17 -0.58 -0.10 -0.69 1.20 0.00 0.00 173.24 172.90 1u39 s VAL 99 N -1.44 3.44 -0.40 4.45 1.01 -1.26 -1.88 120.40 124.31 1u39 s VAL 99 Ca 0.56 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1u39 s VAL 99 Cb -0.29 -2.41 0.14 0.00 0.00 0.00 0.00 36.38 33.82 1u39 s VAL 99 CO 0.36 0.57 0.25 -1.10 0.00 0.00 0.00 175.10 175.18 1u39 s GLN 100 N -0.43 0.92 -1.46 2.72 -1.52 0.64 -4.74 119.66 115.78 1u39 s GLN 100 Ca 0.06 -1.75 0.00 0.00 -1.95 0.00 0.00 55.36 51.72 1u39 s GLN 100 Cb -0.12 -1.75 0.00 0.00 -0.22 0.00 0.00 33.01 30.92 1u39 s GLN 100 CO 0.02 -1.22 0.00 0.09 -0.25 0.00 0.00 175.29 173.93 1u39 n ASN 101 N 3.61 -3.85 0.00 5.90 3.02 -1.26 -0.64 115.26 122.04 1u39 n ASN 101 Ca 0.14 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 1u39 n ASN 101 Cb 0.38 -3.51 0.00 0.00 -0.61 0.00 0.00 39.78 36.04 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 -0.36 1.28 3.70 7.41 0.00 -1.26 -4.50 105.19 111.46 1u39 n GLY 102 Ca -0.15 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.65 4.50 0.25 -0.61 1.01 0.18 0.15 121.20 126.04 1u39 s ILE 103 Ca 0.00 1.80 -0.21 0.00 0.00 0.00 0.00 60.65 62.24 1u39 s ILE 103 Cb 0.00 -4.15 -0.09 0.00 0.01 0.00 0.00 42.46 38.23 1u39 s ILE 103 CO 0.00 0.10 0.77 -0.63 0.00 0.00 0.00 174.94 175.18 1u39 s ILE 104 N 1.35 4.50 0.00 2.92 1.09 -1.08 -0.26 121.20 129.71 1u39 s ILE 104 Ca 0.54 1.39 0.00 0.00 -1.10 0.00 0.00 60.65 61.48 1u39 s ILE 104 Cb -0.24 -3.88 0.00 0.00 -1.06 0.00 0.00 42.46 37.29 1u39 s ILE 104 CO 0.26 0.17 0.00 0.00 -0.10 0.00 0.00 174.94 175.27 1u39 n SER 106 N -0.94 5.54 -4.45 0.00 7.64 -1.26 -4.81 113.62 115.34 1u39 n SER 106 Ca 0.00 -2.72 -0.43 0.00 1.01 0.00 0.00 58.87 56.73 1u39 n SER 106 Cb 0.00 -1.58 -0.04 0.00 -1.01 0.00 0.00 64.21 61.58 1u39 n SER 106 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1u39 s LEU 107 N 1.37 4.53 0.23 -3.43 2.96 -1.26 -3.21 118.68 119.86 1u39 s LEU 107 Ca 0.55 -1.01 -0.28 0.00 -0.22 0.00 0.00 54.13 53.17 1u39 s LEU 107 Cb 0.15 -2.43 -0.09 0.00 0.50 0.00 0.00 46.19 44.32 1u39 s LEU 107 CO -0.07 -1.36 0.89 0.00 -1.32 0.00 0.00 176.35 174.49 1u39 s MET 108 N 3.81 4.74 1.01 1.98 0.23 -0.66 -4.98 119.30 125.43 1u39 s MET 108 Ca 0.21 1.36 -0.12 0.00 -1.03 0.00 0.00 55.69 56.11 1u39 s MET 108 Cb -0.18 -3.22 0.20 0.00 -1.53 0.00 0.00 34.83 30.10 1u39 s MET 108 CO 0.10 0.51 1.08 0.50 -2.03 0.00 0.00 175.02 175.18 1u39 s ARG 109 N -1.27 0.28 0.00 3.16 3.00 -1.26 -3.69 118.95 119.17 1u39 s ARG 109 Ca 0.40 0.86 0.00 0.00 -1.00 0.00 0.00 55.73 56.00 1u39 s ARG 109 Cb -0.24 -1.69 0.00 0.00 0.00 0.00 0.00 34.95 33.02 1u39 s ARG 109 CO 0.29 -2.92 0.00 0.41 0.00 0.00 0.00 175.30 173.08 1u39 n GLY 110 N -0.27 2.36 3.43 8.12 0.00 -1.26 -5.02 105.19 112.57 1u39 n GLY 110 Ca 0.06 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.08 0.14 -0.02 0.00 -1.24 -4.90 105.19 97.09 1u39 n GLY 111 Ca 0.00 -1.08 0.13 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.54 0.00 -0.27 -0.61 5.03 -1.87 -3.23 117.51 114.02 1u39 h ILE 112 Ca -0.59 -0.57 0.07 0.00 -0.12 0.00 0.00 64.86 63.65 1u39 h ILE 112 Cb 1.34 1.54 -0.01 0.00 -3.03 0.00 0.00 36.82 36.65 1u39 h ILE 112 CO 0.46 0.00 0.19 0.00 -0.68 0.00 0.00 178.15 178.13 1u39 h ALA 113 N 2.35 2.21 -0.33 1.87 0.00 -1.91 -1.54 119.26 121.90 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 0.74 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1u39 h ALA 113 CO 0.00 -0.28 0.22 1.05 0.00 0.00 0.00 179.25 180.24 1u39 h GLU 114 N 0.04 0.44 -0.26 0.00 4.11 -1.84 -2.77 114.58 114.30 1u39 h GLU 114 Ca 0.13 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.50 1u39 h GLU 114 Cb 0.46 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1u39 h GLU 114 CO -0.01 0.30 0.06 0.00 0.07 0.00 0.00 179.01 179.43 1u39 h ARG 115 N 0.44 0.42 0.00 1.06 3.08 -1.52 -3.33 114.38 114.54 1u39 h ARG 115 Ca 0.12 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1u39 h ARG 115 Cb -0.04 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.95 1u39 h ARG 115 CO -0.03 0.52 0.00 0.41 -1.07 0.00 0.00 179.97 179.80 1u39 n GLY 116 N -0.53 -2.95 0.00 0.04 0.00 -1.00 -4.72 105.19 96.03 1u39 n GLY 116 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.91 0.03 3.09 -0.02 0.00 -1.06 -2.76 105.19 103.55 1u39 n GLY 117 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 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 1.06 -4.03 1.61 0.31 -1.16 -4.83 118.33 111.28 1u39 n VAL 118 Ca 0.00 -0.26 -0.17 0.00 -0.01 0.00 0.00 64.34 63.89 1u39 n VAL 118 Cb 0.00 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 32.77 1u39 n VAL 118 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1u39 s ARG 119 N -0.53 0.45 -0.83 5.55 0.52 -1.26 -4.72 118.95 118.13 1u39 s ARG 119 Ca 0.67 -0.03 -0.24 0.00 -0.52 0.00 0.00 55.73 55.62 1u39 s ARG 119 Cb -0.96 -0.54 -0.17 0.00 0.52 0.00 0.00 34.95 33.80 1u39 s ARG 119 CO 0.51 -0.07 2.36 0.28 0.02 0.00 0.00 175.30 178.40 1u39 n VAL 120 N 3.84 0.00 0.00 3.52 0.31 -1.26 -0.26 118.33 124.47 1u39 n VAL 120 Ca -0.23 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.62 1u39 n VAL 120 Cb 0.52 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 1u39 n VAL 120 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u39 n GLY 121 N 6.59 0.17 3.70 2.92 0.00 -0.81 -4.97 105.19 112.79 1u39 n GLY 121 Ca 0.49 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.80 3.47 -0.93 1.61 4.02 0.64 -2.46 115.29 120.83 1u39 s HIS 122 Ca 0.00 0.95 -0.23 0.00 1.02 0.00 0.00 55.06 56.80 1u39 s HIS 122 Cb 0.00 -2.68 0.07 0.00 -1.02 0.00 0.00 32.58 28.95 1u39 s HIS 122 CO 0.00 0.03 1.32 0.50 1.02 0.00 0.00 174.74 177.61 1u39 s ARG 123 N 1.13 3.49 0.87 1.40 3.52 0.29 -2.64 118.95 127.01 1u39 s ARG 123 Ca 0.29 -1.09 -0.14 0.00 -0.13 0.00 0.00 55.73 54.65 1u39 s ARG 123 Cb -0.16 -4.99 -0.01 0.00 -1.56 0.00 0.00 34.95 28.22 1u39 s ARG 123 CO 0.12 -2.08 0.31 -0.89 -0.81 0.00 0.00 175.30 171.95 1u39 n ILE 124 N 6.44 0.63 0.00 4.11 5.41 0.39 -0.92 119.36 135.43 1u39 n ILE 124 Ca 0.24 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.68 1u39 n ILE 124 Cb 0.50 -0.58 0.00 0.00 -0.71 0.00 0.00 39.64 38.85 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 -3.00 0.00 -2.33 1.39 -5.35 0.10 -4.07 119.36 106.09 1u39 n ILE 125 Ca 0.07 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.20 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 3.21 -0.57 6.28 2.02 -1.24 0.12 118.70 128.51 1u39 s GLU 126 Ca 0.00 -1.17 -0.20 0.00 0.02 0.00 0.00 54.97 53.62 1u39 s GLU 126 Cb 0.00 -5.31 0.08 0.00 0.10 0.00 0.00 34.13 28.99 1u39 s GLU 126 CO 0.00 -2.90 0.74 0.42 0.02 0.00 0.00 175.26 173.54 1u39 s ILE 127 N 7.35 4.71 -1.12 -1.63 1.01 0.14 -1.37 121.20 130.29 1u39 s ILE 127 Ca 0.59 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.66 1u39 s ILE 127 Cb -0.01 -4.46 0.00 0.00 0.01 0.00 0.00 42.46 38.01 1u39 s ILE 127 CO 0.02 -1.06 0.00 0.59 0.00 0.00 0.00 174.94 174.49 1u39 n ASN 128 N 6.62 -5.49 0.00 3.58 4.13 0.31 -1.84 115.26 122.56 1u39 n ASN 128 Ca -0.06 0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.46 1u39 n ASN 128 Cb 0.44 -3.92 0.00 0.00 -1.54 0.00 0.00 39.78 34.77 1u39 n ASN 128 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1u39 n GLY 129 N -0.06 2.00 3.59 7.41 0.00 -1.26 -5.08 105.19 111.78 1u39 n GLY 129 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.01 3.93 -0.69 1.61 -2.07 -0.77 -5.00 119.66 116.67 1u39 s GLN 130 Ca 0.00 -0.34 -0.27 0.00 -1.82 0.00 0.00 55.36 52.93 1u39 s GLN 130 Cb 0.00 -3.48 0.03 0.00 -1.09 0.00 0.00 33.01 28.47 1u39 s GLN 130 CO 0.00 -0.04 1.21 0.45 -1.32 0.00 0.00 175.29 175.60 1u39 s SER 131 N 1.30 6.24 0.00 12.60 0.15 -1.24 0.27 113.70 133.01 1u39 s SER 131 Ca 0.06 -0.37 0.23 0.00 0.70 0.00 0.00 55.95 56.58 1u39 s SER 131 Cb -0.14 -2.54 1.30 0.00 -1.71 0.00 0.00 66.02 62.93 1u39 s SER 131 CO 0.06 -1.69 1.85 1.33 1.20 0.00 0.00 173.24 175.99 1u39 n VAL 132 N 6.40 0.02 -0.30 4.45 0.24 0.31 -4.17 118.33 125.28 1u39 n VAL 132 Ca 0.04 -0.05 0.12 0.00 -2.04 0.00 0.00 64.34 62.41 1u39 n VAL 132 Cb 0.49 -0.23 0.28 0.00 -1.47 0.00 0.00 33.84 32.90 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 0.39 0.26 -0.39 3.34 3.04 -1.73 0.21 116.25 121.38 1u39 h VAL 133 Ca 0.00 -0.05 -0.21 0.00 -1.01 0.00 0.00 66.70 65.43 1u39 h VAL 133 Cb 0.08 0.10 -0.12 0.00 -2.01 0.00 0.00 31.29 29.34 1u39 h VAL 133 CO 0.00 0.03 -0.07 0.00 -1.01 0.00 0.00 177.57 176.52 1u39 n ALA 134 N -2.80 4.43 -2.63 3.17 0.00 -1.26 -4.85 120.51 116.57 1u39 n ALA 134 Ca 0.21 -3.17 -0.33 0.00 0.00 0.00 0.00 53.44 50.15 1u39 n ALA 134 Cb 0.68 -0.77 -0.10 0.00 0.00 0.00 0.00 19.45 19.26 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 -3.29 3.91 1.02 0.00 2.01 0.75 -5.11 115.64 114.93 1u39 s THR 135 Ca 0.45 -0.56 -0.16 0.00 0.31 0.00 0.00 61.69 61.74 1u39 s THR 135 Cb 0.41 -2.68 0.04 0.00 0.01 0.00 0.00 72.50 70.28 1u39 s THR 135 CO -0.00 0.48 0.07 -2.65 -0.69 0.00 0.00 174.62 171.83 1u39 n PRO 136 N 1.80 -0.74 -0.00 4.92 -0.02 -1.26 -4.30 135.00 135.40 1u39 n PRO 136 Ca -0.16 -0.19 -0.13 0.00 -2.02 0.00 0.00 63.50 61.00 1u39 n PRO 136 Cb 0.53 -1.69 -0.10 0.00 -0.02 0.00 0.00 33.50 32.22 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 -1.68 -0.06 -0.53 6.00 2.07 -1.92 -3.14 115.15 115.90 1u39 h HIS 137 Ca -0.47 -0.00 0.13 0.00 -2.85 0.00 0.00 60.37 57.18 1u39 h HIS 137 Cb 1.32 0.02 -0.02 0.00 2.57 0.00 0.00 27.41 31.29 1u39 h HIS 137 CO 0.27 0.49 0.37 0.93 -3.07 0.00 0.00 177.93 176.92 1u39 h GLU 138 N -0.67 0.10 -0.10 5.12 5.08 -1.92 -1.51 114.58 120.68 1u39 h GLU 138 Ca -0.01 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1u39 h GLU 138 Cb 0.58 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 1u39 h GLU 138 CO 0.01 0.06 0.02 -0.22 -1.00 0.00 0.00 179.01 177.89 1u39 h LYS 139 N 0.10 0.15 -0.53 2.33 3.11 -1.91 -1.45 116.57 118.37 1u39 h LYS 139 Ca 0.25 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 58.08 1u39 h LYS 139 Cb 0.86 -0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 32.03 1u39 h LYS 139 CO -0.03 0.34 0.32 0.82 -2.81 0.00 0.00 179.45 178.09 1u39 h ILE 140 N -0.05 1.06 -0.23 2.00 2.04 -1.24 -1.04 117.51 120.05 1u39 h ILE 140 Ca 0.03 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1u39 h ILE 140 Cb 0.25 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1u39 h ILE 140 CO 0.00 0.12 0.09 0.58 0.00 0.00 0.00 178.15 178.93 1u39 h VAL 141 N 0.64 1.10 0.28 1.67 2.07 -1.35 -2.54 116.25 118.12 1u39 h VAL 141 Ca 0.21 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1u39 h VAL 141 Cb 0.02 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1u39 h VAL 141 CO -0.09 0.11 -0.13 0.45 0.02 0.00 0.00 177.57 177.93 1u39 h HIS 142 N 0.32 -0.35 0.09 1.57 3.86 -0.08 1.01 115.15 121.56 1u39 h HIS 142 Ca 0.08 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1u39 h HIS 142 Cb 0.08 0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.62 1u39 h HIS 142 CO 0.00 -0.14 -0.36 0.82 0.86 0.00 0.00 177.93 179.11 1u39 h ILE 143 N -0.49 0.25 -0.03 2.45 5.03 -1.15 0.25 117.51 123.83 1u39 h ILE 143 Ca -0.04 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.67 1u39 h ILE 143 Cb 0.36 0.25 -0.01 0.00 -3.03 0.00 0.00 36.82 34.40 1u39 h ILE 143 CO 0.06 0.00 -0.13 -0.07 -0.68 0.00 0.00 178.15 177.33 1u39 h LEU 144 N -0.57 0.04 -1.28 1.44 3.38 -1.42 1.71 115.31 118.61 1u39 h LEU 144 Ca 0.04 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1u39 h LEU 144 Cb 0.62 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1u39 h LEU 144 CO -0.23 0.18 -0.36 0.28 0.09 0.00 0.00 178.44 178.40 1u39 h SER 145 N 0.04 0.00 -0.47 -0.43 0.02 0.28 -3.16 113.55 109.83 1u39 h SER 145 Ca 0.01 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.63 1u39 h SER 145 Cb 0.26 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 62.42 1u39 h SER 145 CO 0.02 0.36 -0.95 0.59 -1.14 0.00 0.00 176.83 175.70 1u39 n ASN 146 N -4.10 2.76 -0.10 3.07 3.02 0.72 -4.84 115.26 115.79 1u39 n ASN 146 Ca -0.02 -2.80 -0.19 0.00 -0.03 0.00 0.00 54.58 51.55 1u39 n ASN 146 Cb 0.40 -0.42 -0.10 0.00 -0.61 0.00 0.00 39.78 39.05 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 -0.57 0.73 -1.34 5.41 0.00 0.57 -4.92 120.51 120.39 1u39 n ALA 147 Ca 0.21 -0.49 0.16 0.00 0.00 0.00 0.00 53.44 53.32 1u39 n ALA 147 Cb 0.89 -0.44 -0.07 0.00 0.00 0.00 0.00 19.45 19.83 1u39 n ALA 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u39 n VAL 148 N -4.46 -0.46 -1.48 0.00 0.31 -1.26 -4.88 118.33 106.09 1u39 n VAL 148 Ca -0.28 0.65 0.00 0.00 -0.01 0.00 0.00 64.34 64.71 1u39 n VAL 148 Cb 0.61 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 1u39 n VAL 148 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1u39 n GLY 149 N -4.12 1.36 3.10 2.92 0.00 -1.17 -4.45 105.19 102.84 1u39 n GLY 149 Ca -0.06 -0.58 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 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 1.92 -0.28 1.61 2.02 -1.26 0.45 118.70 123.17 1u39 s GLU 150 Ca 0.00 -1.85 -0.29 0.00 0.02 0.00 0.00 54.97 52.85 1u39 s GLU 150 Cb 0.00 -3.52 -0.02 0.00 0.10 0.00 0.00 34.13 30.69 1u39 s GLU 150 CO 0.00 -1.05 1.75 0.42 0.02 0.00 0.00 175.26 176.40 1u39 s ILE 151 N 1.06 3.52 -0.28 -1.63 1.01 0.41 -4.81 121.20 120.48 1u39 s ILE 151 Ca 0.09 0.56 -0.07 0.00 0.00 0.00 0.00 60.65 61.23 1u39 s ILE 151 Cb -0.22 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1u39 s ILE 151 CO -0.05 -0.35 0.07 -2.28 0.00 0.00 0.00 174.94 172.33 1u39 s HIS 152 N 6.26 3.13 0.30 3.97 2.46 -1.25 -0.79 115.29 129.37 1u39 s HIS 152 Ca 0.78 -0.91 0.01 0.00 0.47 0.00 0.00 55.06 55.40 1u39 s HIS 152 Cb -0.24 -2.24 -0.02 0.00 -0.13 0.00 0.00 32.58 29.95 1u39 s HIS 152 CO 0.33 -0.55 0.32 0.00 -2.47 0.00 0.00 174.74 172.37 1u39 s MET 153 N 1.51 1.66 0.14 2.88 0.23 -0.82 0.11 119.30 125.01 1u39 s MET 153 Ca 0.03 -1.78 0.10 0.00 -1.03 0.00 0.00 55.69 53.01 1u39 s MET 153 Cb -0.17 0.36 -0.04 0.00 -1.53 0.00 0.00 34.83 33.46 1u39 s MET 153 CO 0.02 -0.64 -0.22 0.15 -2.03 0.00 0.00 175.02 172.30 1u39 s LYS 154 N -3.53 1.31 -0.02 3.16 1.02 -0.47 -0.69 119.74 120.52 1u39 s LYS 154 Ca 0.35 -1.34 -0.02 0.00 0.02 0.00 0.00 55.97 54.99 1u39 s LYS 154 Cb 0.02 -1.60 0.00 0.00 -0.52 0.00 0.00 37.83 35.74 1u39 s LYS 154 CO 0.20 0.36 0.05 0.95 -0.92 0.00 0.00 175.35 175.99 1u39 s THR 155 N -1.43 0.01 -0.05 2.17 -4.23 -0.21 0.03 115.64 111.92 1u39 s THR 155 Ca 0.13 -0.12 0.04 0.00 -1.18 0.00 0.00 61.69 60.56 1u39 s THR 155 Cb -0.09 -0.12 0.00 0.00 1.34 0.00 0.00 72.50 73.63 1u39 s THR 155 CO 0.06 -0.06 -0.17 -0.04 -0.54 0.00 0.00 174.62 173.87 1u39 s MET 156 N -0.17 1.92 -0.37 3.99 1.00 -0.09 -2.14 119.30 123.44 1u39 s MET 156 Ca -0.02 -0.60 -0.43 0.00 0.00 0.00 0.00 55.69 54.64 1u39 s MET 156 Cb -0.02 -1.62 -0.17 0.00 0.00 0.00 0.00 34.83 33.02 1u39 s MET 156 CO 0.00 0.19 1.68 -2.30 0.00 0.00 0.00 175.02 174.59 1u39 n PRO 157 N 3.33 0.68 0.00 2.03 -0.02 -1.26 0.11 135.00 139.86 1u39 n PRO 157 Ca -0.19 0.25 0.15 0.00 -2.02 0.00 0.00 63.50 61.69 1u39 n PRO 157 Cb 0.53 -1.85 0.74 0.00 -0.02 0.00 0.00 33.50 32.89 1u39 n PRO 157 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48