#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h43 h GLU 76 N 0.00 0.10 -0.62 1.64 4.81 -2.06 0.53 114.58 118.98 3h43 h GLU 76 Ca 0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 3h43 h GLU 76 Cb 0.00 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 3h43 h GLU 76 CO 0.00 0.07 0.14 -0.97 -0.73 0.00 0.00 179.01 177.52 3h43 h ASN 77 N 0.10 0.94 0.66 1.04 -0.73 -2.05 -1.63 115.58 113.90 3h43 h ASN 77 Ca 0.40 -0.24 -0.11 0.00 1.87 0.00 0.00 56.30 58.22 3h43 h ASN 77 Cb 1.41 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 39.74 3h43 h ASN 77 CO -0.05 0.94 -0.52 -0.08 -0.37 0.00 0.00 177.43 177.34 3h43 h GLU 78 N 0.91 0.00 -0.40 6.67 4.81 -0.44 -2.09 114.58 124.04 3h43 h GLU 78 Ca 0.19 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.31 3h43 h GLU 78 Cb 0.37 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3h43 h GLU 78 CO 0.00 0.52 -0.17 0.82 -0.73 0.00 0.00 179.01 179.46 3h43 h ILE 79 N 0.00 1.28 -0.62 2.32 2.04 -0.78 -0.46 117.51 121.29 3h43 h ILE 79 Ca -0.01 -1.30 -0.09 0.00 1.00 0.00 0.00 64.86 64.46 3h43 h ILE 79 Cb 0.99 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 3h43 h ILE 79 CO 0.07 0.44 0.02 -0.07 0.00 0.00 0.00 178.15 178.60 3h43 h LEU 80 N 0.64 1.06 -1.18 1.44 3.38 -1.13 -0.70 115.31 118.81 3h43 h LEU 80 Ca 0.09 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3h43 h LEU 80 Cb 0.72 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 3h43 h LEU 80 CO 0.05 1.09 0.34 0.03 0.09 0.00 0.00 178.44 180.05 3h43 h ARG 81 N 0.99 0.91 -0.26 1.13 3.08 -1.20 0.17 114.38 119.19 3h43 h ARG 81 Ca 0.18 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3h43 h ARG 81 Cb 0.54 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3h43 h ARG 81 CO 0.03 0.68 -0.05 -0.09 -1.07 0.00 0.00 179.97 179.47 3h43 h ARG 82 N 0.91 0.49 -0.91 0.04 2.43 -0.54 -1.75 114.38 115.04 3h43 h ARG 82 Ca 0.23 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3h43 h ARG 82 Cb 0.05 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.52 3h43 h ARG 82 CO -0.03 0.70 0.60 0.93 -1.51 0.00 0.00 179.97 180.65 3h43 h GLU 83 N 0.24 1.16 0.08 0.20 4.39 -0.43 -0.67 114.58 119.54 3h43 h GLU 83 Ca 0.07 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 3h43 h GLU 83 Cb 0.51 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3h43 h GLU 83 CO 0.02 0.76 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.53 3h43 h LEU 84 N 1.19 -0.09 -1.44 1.33 3.38 -0.80 -3.07 115.31 115.81 3h43 h LEU 84 Ca 0.35 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.15 3h43 h LEU 84 Cb -0.07 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 3h43 h LEU 84 CO -0.09 0.15 0.41 0.44 0.09 0.00 0.00 178.44 179.44 3h43 h ASP 85 N -0.33 0.62 0.00 -0.43 3.32 -1.13 -3.23 116.42 115.24 3h43 h ASP 85 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3h43 h ASP 85 Cb 0.28 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3h43 h ASP 85 CO 0.02 0.42 0.00 -1.14 -1.72 0.00 0.00 179.24 176.82 3h43 n ARG 86 N -4.47 0.00 0.00 3.56 0.63 -0.28 -2.28 116.66 113.83 3h43 n ARG 86 Ca 0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.01 3h43 n ARG 86 Cb 0.15 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 31.59 3h43 n ARG 86 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 3h43 n ARG 88 N 1.62 0.00 -2.89 -0.14 1.85 -1.22 -4.94 116.66 110.94 3h43 n ARG 88 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.50 3h43 n ARG 88 Cb 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.35 3h43 n ARG 88 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 3h43 s VAL 89 N 0.00 4.37 0.87 8.89 -7.23 -0.96 -4.99 120.40 121.35 3h43 s VAL 89 Ca 0.00 1.56 -0.13 0.00 -1.81 0.00 0.00 61.98 61.60 3h43 s VAL 89 Cb 0.00 -3.85 0.08 0.00 0.56 0.00 0.00 36.38 33.16 3h43 s VAL 89 CO 0.00 0.02 0.90 -2.65 -0.31 0.00 0.00 175.10 173.07 3h43 n PRO 90 N 0.25 -0.12 -2.89 4.82 -0.02 -1.26 -4.50 135.00 131.27 3h43 n PRO 90 Ca 0.02 0.03 -0.38 0.00 -2.02 0.00 0.00 63.50 61.15 3h43 n PRO 90 Cb 0.51 -2.20 -0.06 0.00 -0.02 0.00 0.00 33.50 31.73 3h43 n PRO 90 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3h43 s PRO 91 N -3.99 4.58 0.04 0.52 0.04 -1.26 -5.15 135.00 129.79 3h43 s PRO 91 Ca 0.66 1.23 0.09 0.00 0.04 0.00 0.00 61.00 63.02 3h43 s PRO 91 Cb -0.26 -3.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 3h43 s PRO 91 CO 0.58 0.44 -0.26 -0.51 0.04 0.00 0.00 177.00 177.29 3h43 s LEU 92 N -1.57 2.16 0.01 -3.56 1.43 -1.26 -4.28 118.68 111.62 3h43 s LEU 92 Ca 0.42 -0.58 -0.20 0.00 -1.03 0.00 0.00 54.13 52.74 3h43 s LEU 92 Cb -0.21 -1.28 -0.06 0.00 0.03 0.00 0.00 46.19 44.67 3h43 s LEU 92 CO 0.26 0.26 0.57 -0.63 0.23 0.00 0.00 176.35 177.04 3h43 s ILE 93 N -0.80 4.89 -0.02 -0.59 1.01 -0.49 -4.81 121.20 120.40 3h43 s ILE 93 Ca 0.12 1.20 -0.19 0.00 0.00 0.00 0.00 60.65 61.78 3h43 s ILE 93 Cb -0.10 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 3h43 s ILE 93 CO 0.02 0.45 0.54 -0.69 0.00 0.00 0.00 174.94 175.26 3h43 s VAL 94 N -0.42 4.97 0.31 2.92 1.01 -1.26 0.12 120.40 128.05 3h43 s VAL 94 Ca 0.30 1.12 0.05 0.00 0.00 0.00 0.00 61.98 63.46 3h43 s VAL 94 Cb -0.18 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 3h43 s VAL 94 CO 0.17 0.43 0.26 -0.83 0.00 0.00 0.00 175.10 175.13 3h43 s GLY 95 N -0.22 2.14 -0.05 4.51 0.00 -0.35 -1.18 107.32 112.17 3h43 s GLY 95 Ca 0.29 -1.99 0.05 0.00 0.00 0.00 0.00 44.72 43.07 3h43 s GLY 95 CO 0.15 -1.44 -0.20 -1.59 0.00 0.00 0.00 173.10 170.02 3h43 s THR 96 N -3.56 1.68 0.04 0.90 2.01 0.19 -0.67 115.64 116.23 3h43 s THR 96 Ca 0.40 -0.85 -0.31 0.00 0.31 0.00 0.00 61.69 61.24 3h43 s THR 96 Cb 0.03 -1.44 -0.06 0.00 0.01 0.00 0.00 72.50 71.04 3h43 s THR 96 CO 0.25 0.48 1.38 -0.69 -0.69 0.00 0.00 174.62 175.34 3h43 s VAL 97 N 0.01 3.61 -0.21 3.82 1.01 0.12 -0.27 120.40 128.48 3h43 s VAL 97 Ca -0.05 1.07 -0.17 0.00 0.00 0.00 0.00 61.98 62.83 3h43 s VAL 97 Cb -0.13 -3.69 -0.13 0.00 0.00 0.00 0.00 36.38 32.43 3h43 s VAL 97 CO 0.03 0.03 -0.04 0.52 0.00 0.00 0.00 175.10 175.65 3h43 n VAL 98 N 4.35 1.51 -3.59 2.92 0.31 0.26 -0.28 118.33 123.81 3h43 n VAL 98 Ca 0.12 -0.06 -0.08 0.00 -0.01 0.00 0.00 64.34 64.32 3h43 n VAL 98 Cb 0.43 -2.09 -0.04 0.00 -0.91 0.00 0.00 33.84 31.23 3h43 n VAL 98 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 3h43 s ASP 99 N -6.74 -0.27 0.40 4.52 -4.77 -1.12 -4.38 116.67 104.31 3h43 s ASP 99 Ca -0.29 0.25 -0.23 0.00 -3.30 0.00 0.00 52.55 48.98 3h43 s ASP 99 Cb 0.07 0.23 -0.10 0.00 -1.09 0.00 0.00 42.92 42.03 3h43 s ASP 99 CO 0.49 -0.27 1.00 -0.54 0.70 0.00 0.00 175.17 176.54 3h43 s LYS 100 N -1.33 4.24 0.00 2.11 1.02 -1.26 -0.32 119.74 124.20 3h43 s LYS 100 Ca 0.02 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.38 3h43 s LYS 100 Cb -0.01 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.82 3h43 s LYS 100 CO -0.02 -0.05 0.00 0.28 -0.92 0.00 0.00 175.35 174.64 3h43 n VAL 101 N -0.13 0.00 -2.40 3.17 0.31 -0.53 -4.87 118.33 113.88 3h43 n VAL 101 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 3h43 n VAL 101 Cb 0.51 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 3h43 n VAL 101 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h43 n GLY 102 N 1.77 5.99 0.06 2.92 0.00 -1.17 -4.96 105.19 109.80 3h43 n GLY 102 Ca 0.00 -1.76 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 3h43 n GLY 102 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h43 h GLU 103 N 0.00 0.06 -1.04 1.61 4.81 -2.02 -3.36 114.58 114.64 3h43 h GLU 103 Ca 0.00 -0.02 -0.36 0.00 -0.13 0.00 0.00 59.36 58.85 3h43 h GLU 103 Cb 0.00 -0.01 -0.38 0.00 0.63 0.00 0.00 28.75 29.00 3h43 h GLU 103 CO 0.00 0.32 -1.12 0.54 -0.73 0.00 0.00 179.01 178.02 3h43 n ARG 104 N -4.92 1.12 -4.17 1.92 1.74 -1.26 -5.09 116.66 106.01 3h43 n ARG 104 Ca -0.07 -3.14 -0.17 0.00 -0.77 0.00 0.00 57.85 53.70 3h43 n ARG 104 Cb 0.16 -1.20 -0.12 0.00 -1.02 0.00 0.00 32.46 30.28 3h43 n ARG 104 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3h43 s LYS 105 N -2.72 0.75 0.01 5.56 1.02 -1.26 -1.03 119.74 122.07 3h43 s LYS 105 Ca 0.28 -0.86 -0.05 0.00 0.02 0.00 0.00 55.97 55.36 3h43 s LYS 105 Cb 0.44 -0.70 -0.01 0.00 -0.52 0.00 0.00 37.83 37.05 3h43 s LYS 105 CO 0.01 0.15 0.08 0.14 -0.92 0.00 0.00 175.35 174.81 3h43 s VAL 106 N -1.22 0.09 -0.18 3.17 -7.23 -0.60 -1.46 120.40 112.97 3h43 s VAL 106 Ca -0.04 -0.75 -0.15 0.00 -1.81 0.00 0.00 61.98 59.23 3h43 s VAL 106 Cb -0.10 -0.37 -0.04 0.00 0.56 0.00 0.00 36.38 36.44 3h43 s VAL 106 CO 0.02 -0.41 0.37 -0.69 -0.31 0.00 0.00 175.10 174.07 3h43 s VAL 107 N -1.38 5.23 0.00 1.32 1.01 0.56 -0.76 120.40 126.38 3h43 s VAL 107 Ca -0.15 0.66 0.05 0.00 0.00 0.00 0.00 61.98 62.54 3h43 s VAL 107 Cb -0.08 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 3h43 s VAL 107 CO 0.01 0.30 -0.16 0.68 0.00 0.00 0.00 175.10 175.92 3h43 s VAL 108 N 1.01 1.30 -0.33 2.92 -7.23 0.24 -0.57 120.40 117.74 3h43 s VAL 108 Ca 0.18 -0.79 -0.19 0.00 -1.81 0.00 0.00 61.98 59.37 3h43 s VAL 108 Cb -0.14 -1.10 -0.01 0.00 0.56 0.00 0.00 36.38 35.69 3h43 s VAL 108 CO 0.07 0.30 0.58 -0.75 -0.31 0.00 0.00 175.10 174.98 3h43 s LYS 109 N -0.57 3.76 0.28 4.82 2.20 0.63 -1.19 119.74 129.67 3h43 s LYS 109 Ca 0.06 0.07 -0.28 0.00 -0.36 0.00 0.00 55.97 55.45 3h43 s LYS 109 Cb -0.07 -3.77 -0.09 0.00 -1.51 0.00 0.00 37.83 32.39 3h43 s LYS 109 CO -0.00 -0.62 0.99 0.45 -0.36 0.00 0.00 175.35 175.81 3h43 s SER 110 N 1.72 7.41 0.00 1.43 0.15 -0.67 -0.64 113.70 123.09 3h43 s SER 110 Ca 0.22 2.00 0.07 0.00 0.70 0.00 0.00 55.95 58.94 3h43 s SER 110 Cb -0.15 -2.60 0.30 0.00 -1.71 0.00 0.00 66.02 61.86 3h43 s SER 110 CO 0.13 -0.02 1.18 -1.54 1.20 0.00 0.00 173.24 174.19 3h43 n SER 111 N 1.05 0.00 0.00 5.45 3.41 -0.32 -0.57 113.62 122.65 3h43 n SER 111 Ca -0.00 0.43 0.14 0.00 -0.26 0.00 0.00 58.87 59.17 3h43 n SER 111 Cb 0.47 -0.45 0.66 0.00 -0.26 0.00 0.00 64.21 64.64 3h43 n SER 111 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3h43 n THR 112 N -1.45 0.10 0.00 6.66 -2.24 -1.26 -4.97 114.28 111.11 3h43 n THR 112 Ca 0.02 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 3h43 n THR 112 Cb 0.07 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 3h43 n THR 112 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h43 n GLY 113 N 1.18 2.20 3.75 3.38 0.00 0.27 -5.11 105.19 110.86 3h43 n GLY 113 Ca 0.11 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 3h43 n GLY 113 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h43 s PRO 114 N 0.00 0.91 0.04 1.61 0.04 -1.26 -4.60 135.00 131.75 3h43 s PRO 114 Ca 0.00 0.38 0.02 0.00 0.04 0.00 0.00 61.00 61.44 3h43 s PRO 114 Cb 0.00 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 3h43 s PRO 114 CO 0.00 -2.37 0.04 -1.12 0.04 0.00 0.00 177.00 173.59 3h43 s SER 115 N -3.82 5.35 0.09 6.66 0.01 -1.26 -1.67 113.70 119.05 3h43 s SER 115 Ca 0.64 -0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.91 3h43 s SER 115 Cb -0.16 -1.42 -0.04 0.00 0.21 0.00 0.00 66.02 64.61 3h43 s SER 115 CO 0.55 0.22 -0.06 -0.36 0.41 0.00 0.00 173.24 174.00 3h43 s PHE 116 N -1.25 0.83 -0.37 2.43 0.40 -0.33 -4.97 117.98 114.72 3h43 s PHE 116 Ca 0.25 -0.91 -0.12 0.00 -0.60 0.00 0.00 56.93 55.55 3h43 s PHE 116 Cb -0.12 -0.49 0.02 0.00 0.51 0.00 0.00 43.02 42.94 3h43 s PHE 116 CO 0.16 -0.17 0.23 -1.17 0.70 0.00 0.00 175.22 174.97 3h43 s LEU 117 N -2.93 4.72 0.28 -0.37 2.96 -1.26 -0.59 118.68 121.49 3h43 s LEU 117 Ca 0.10 -0.86 0.09 0.00 -0.22 0.00 0.00 54.13 53.24 3h43 s LEU 117 Cb 0.05 -2.07 -0.06 0.00 0.50 0.00 0.00 46.19 44.62 3h43 s LEU 117 CO -0.05 -0.36 -0.12 0.68 -1.32 0.00 0.00 176.35 175.17 3h43 s VAL 118 N 1.61 2.05 0.34 1.68 -7.23 0.06 -4.95 120.40 113.96 3h43 s VAL 118 Ca 0.03 -2.24 -0.25 0.00 -1.81 0.00 0.00 61.98 57.71 3h43 s VAL 118 Cb -0.19 -2.39 -0.10 0.00 0.56 0.00 0.00 36.38 34.26 3h43 s VAL 118 CO 0.08 -0.35 0.96 0.21 -0.31 0.00 0.00 175.10 175.68 3h43 s ASN 119 N -3.48 7.24 -0.35 4.85 2.47 -1.26 -1.56 114.94 122.84 3h43 s ASN 119 Ca 0.29 1.84 -0.13 0.00 0.42 0.00 0.00 52.86 55.29 3h43 s ASN 119 Cb 0.00 -2.58 -0.00 0.00 -1.45 0.00 0.00 41.25 37.22 3h43 s ASN 119 CO 0.13 -0.14 0.24 -0.69 -3.72 0.00 0.00 177.10 172.92 3h43 s VAL 120 N -1.68 5.11 0.84 -5.21 1.01 -0.19 -0.75 120.40 119.53 3h43 s VAL 120 Ca 0.52 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 3h43 s VAL 120 Cb -0.18 -3.69 0.09 0.00 0.00 0.00 0.00 36.38 32.60 3h43 s VAL 120 CO 0.23 -0.08 1.09 -0.94 0.00 0.00 0.00 175.10 175.40 3h43 s SER 121 N 1.68 4.00 0.00 3.32 1.04 -0.42 -4.91 113.70 118.41 3h43 s SER 121 Ca 0.05 1.54 0.01 0.00 0.48 0.00 0.00 55.95 58.04 3h43 s SER 121 Cb -0.18 -2.25 0.09 0.00 0.10 0.00 0.00 66.02 63.78 3h43 s SER 121 CO 0.09 -2.31 1.01 1.41 0.98 0.00 0.00 173.24 174.42 3h43 n HIS 122 N -3.68 0.00 0.69 5.02 8.25 -1.26 -2.26 115.22 121.99 3h43 n HIS 122 Ca 0.08 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.66 3h43 n HIS 122 Cb 0.55 0.00 0.34 0.00 1.12 0.00 0.00 29.99 32.00 3h43 n HIS 122 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3h43 n PHE 123 N -0.52 0.60 -4.67 4.41 0.99 -1.26 -4.84 117.46 112.16 3h43 n PHE 123 Ca 0.01 0.17 -0.33 0.00 -0.00 0.00 0.00 57.45 57.30 3h43 n PHE 123 Cb 0.00 -0.72 -0.12 0.00 -1.00 0.00 0.00 39.48 37.64 3h43 n PHE 123 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 3h43 s VAL 124 N -3.10 3.45 -0.47 -4.37 1.01 -0.96 -4.83 120.40 111.13 3h43 s VAL 124 Ca 0.10 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 3h43 s VAL 124 Cb 0.14 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 34.14 3h43 s VAL 124 CO 0.64 0.54 0.69 0.21 0.00 0.00 0.00 175.10 177.18 3h43 s ASN 125 N -0.95 6.31 0.55 3.32 3.84 -1.26 -4.90 114.94 121.85 3h43 s ASN 125 Ca 0.13 -0.46 0.22 0.00 0.21 0.00 0.00 52.86 52.96 3h43 s ASN 125 Cb -0.11 -2.33 1.20 0.00 -0.55 0.00 0.00 41.25 39.45 3h43 s ASN 125 CO 0.03 -0.88 1.64 1.55 -2.79 0.00 0.00 177.10 176.64 3h43 h PRO 126 N 8.98 0.00 -0.15 0.43 0.13 -1.95 0.63 132.00 140.06 3h43 h PRO 126 Ca -0.26 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.73 3h43 h PRO 126 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3h43 h PRO 126 CO 0.94 0.00 -0.52 0.22 -0.23 0.00 0.00 178.00 178.41 3h43 h ASP 127 N 0.00 0.47 0.11 1.44 1.82 -2.04 -2.67 116.42 115.55 3h43 h ASP 127 Ca 0.00 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.40 3h43 h ASP 127 Cb 0.76 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 40.64 3h43 h ASP 127 CO 0.00 0.91 0.00 0.47 -1.61 0.00 0.00 179.24 179.01 3h43 n ASP 128 N -3.95 0.00 -4.70 2.28 8.00 0.21 -4.68 116.55 113.71 3h43 n ASP 128 Ca -0.02 -0.54 -0.36 0.00 0.71 0.00 0.00 54.79 54.57 3h43 n ASP 128 Cb 0.58 -0.08 -0.08 0.00 -0.02 0.00 0.00 41.12 41.52 3h43 n ASP 128 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3h43 s LEU 129 N -2.16 4.19 -0.06 0.64 1.43 -1.01 -4.96 118.68 116.76 3h43 s LEU 129 Ca 0.31 0.38 -0.29 0.00 -1.03 0.00 0.00 54.13 53.50 3h43 s LEU 129 Cb 0.16 -2.30 0.06 0.00 0.03 0.00 0.00 46.19 44.14 3h43 s LEU 129 CO 0.29 0.07 0.64 0.00 0.23 0.00 0.00 176.35 177.58 3h43 s ALA 130 N 0.74 -1.66 0.23 4.21 0.00 -1.26 -5.02 121.76 119.00 3h43 s ALA 130 Ca 0.14 1.27 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 3h43 s ALA 130 Cb -0.13 -0.08 -0.15 0.00 0.00 0.00 0.00 23.12 22.75 3h43 s ALA 130 CO 0.04 -0.35 0.94 -0.35 0.00 0.00 0.00 175.76 176.03 3h43 n PRO 131 N 1.09 0.95 0.00 0.00 -0.04 -1.26 -0.90 135.00 134.84 3h43 n PRO 131 Ca -0.19 0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 3h43 n PRO 131 Cb 0.57 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 3h43 n PRO 131 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3h43 n GLY 132 N 1.61 3.27 3.72 0.55 0.00 0.61 -4.97 105.19 109.99 3h43 n GLY 132 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3h43 n GLY 132 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h43 s LYS 133 N -0.58 4.26 0.03 1.61 2.47 -0.07 -4.69 119.74 122.77 3h43 s LYS 133 Ca 0.00 2.23 -0.24 0.00 -1.56 0.00 0.00 55.97 56.40 3h43 s LYS 133 Cb 0.00 -3.19 -0.05 0.00 -1.46 0.00 0.00 37.83 33.13 3h43 s LYS 133 CO 0.00 -0.52 0.75 1.03 0.16 0.00 0.00 175.35 176.76 3h43 s ARG 134 N 1.06 4.47 0.25 4.03 0.52 -1.26 -0.70 118.95 127.31 3h43 s ARG 134 Ca 0.67 1.02 0.04 0.00 -0.52 0.00 0.00 55.73 56.94 3h43 s ARG 134 Cb -0.41 -3.37 -0.05 0.00 0.52 0.00 0.00 34.95 31.64 3h43 s ARG 134 CO 0.31 0.26 -0.01 0.14 0.02 0.00 0.00 175.30 176.02 3h43 s VAL 135 N 0.06 1.16 -0.20 3.52 -7.23 0.15 -1.39 120.40 116.48 3h43 s VAL 135 Ca 0.38 -2.05 -0.06 0.00 -1.81 0.00 0.00 61.98 58.44 3h43 s VAL 135 Cb -0.20 -2.39 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 3h43 s VAL 135 CO 0.22 -0.30 0.02 0.00 -0.31 0.00 0.00 175.10 174.73 3h43 s LEU 137 N 0.82 3.07 0.25 0.00 1.43 0.12 -1.47 118.68 122.89 3h43 s LEU 137 Ca 0.01 -0.10 -0.31 0.00 -1.03 0.00 0.00 54.13 52.70 3h43 s LEU 137 Cb -0.14 -1.68 -0.12 0.00 0.03 0.00 0.00 46.19 44.28 3h43 s LEU 137 CO 0.02 0.30 1.65 -3.20 0.23 0.00 0.00 176.35 175.35 3h43 n ASN 138 N 2.63 3.89 0.25 2.29 2.85 -0.35 -1.39 115.26 125.43 3h43 n ASN 138 Ca -0.18 1.11 0.16 0.00 -0.11 0.00 0.00 54.58 55.56 3h43 n ASN 138 Cb 0.53 -1.58 0.86 0.00 1.24 0.00 0.00 39.78 40.83 3h43 n ASN 138 CO 0.00 0.00 0.00 0.06 -2.11 0.00 0.00 177.26 175.21 3h43 h GLN 139 N 5.68 0.00 0.07 1.20 3.07 -1.92 0.36 115.11 123.56 3h43 h GLN 139 Ca -0.45 0.00 -0.36 0.00 0.09 0.00 0.00 58.65 57.92 3h43 h GLN 139 Cb 1.22 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.74 3h43 h GLN 139 CO 0.87 0.00 -2.13 1.04 0.09 0.00 0.00 178.83 178.70 3h43 n GLN 140 N -3.87 0.71 0.00 0.06 6.02 -1.26 -4.63 117.38 114.41 3h43 n GLN 140 Ca -0.01 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 3h43 n GLN 140 Cb 0.19 -1.65 -0.00 0.00 1.02 0.00 0.00 30.24 29.80 3h43 n GLN 140 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3h43 n THR 141 N -3.31 0.00 -1.28 5.09 -2.24 -1.21 -4.99 114.28 106.33 3h43 n THR 141 Ca -0.34 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 60.85 3h43 n THR 141 Cb 1.04 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 70.24 3h43 n THR 141 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3h43 n LEU 142 N -0.51 -0.39 -4.77 3.22 4.77 0.13 -4.81 117.00 114.65 3h43 n LEU 142 Ca 0.00 0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.83 3h43 n LEU 142 Cb 0.02 -2.25 0.01 0.00 -2.33 0.00 0.00 43.42 38.87 3h43 n LEU 142 CO 0.01 -0.84 1.05 0.28 -1.33 0.00 0.00 177.39 176.56 3h43 s THR 143 N -2.04 2.17 -0.35 -5.08 -1.32 -1.26 -4.38 115.64 103.38 3h43 s THR 143 Ca 0.00 0.15 -0.29 0.00 -1.21 0.00 0.00 61.69 60.34 3h43 s THR 143 Cb 0.00 -3.09 0.01 0.00 -1.51 0.00 0.00 72.50 67.91 3h43 s THR 143 CO 0.00 0.02 1.30 -0.69 -2.21 0.00 0.00 174.62 173.04 3h43 s VAL 144 N -1.22 4.11 -0.96 5.08 1.01 0.07 -1.21 120.40 127.28 3h43 s VAL 144 Ca 0.60 1.21 0.11 0.00 0.00 0.00 0.00 61.98 63.90 3h43 s VAL 144 Cb -0.43 -4.24 -0.00 0.00 0.00 0.00 0.00 36.38 31.71 3h43 s VAL 144 CO 0.55 -0.62 0.65 1.33 0.00 0.00 0.00 175.10 177.01 3h43 n VAL 145 N 6.50 0.00 -3.57 2.92 0.24 -0.54 -1.31 118.33 122.58 3h43 n VAL 145 Ca 0.15 -0.39 -0.06 0.00 -2.04 0.00 0.00 64.34 62.00 3h43 n VAL 145 Cb 0.47 1.12 -0.02 0.00 -1.47 0.00 0.00 33.84 33.95 3h43 n VAL 145 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3h43 s ASP 146 N -1.41 -0.27 -0.02 -1.34 2.15 -1.21 -4.52 116.67 110.04 3h43 s ASP 146 Ca 0.09 -0.07 0.06 0.00 0.43 0.00 0.00 52.55 53.05 3h43 s ASP 146 Cb 0.08 0.34 -0.01 0.00 -0.30 0.00 0.00 42.92 43.03 3h43 s ASP 146 CO 0.27 -0.57 -0.19 -0.69 -0.17 0.00 0.00 175.17 173.82 3h43 s VAL 147 N -2.96 1.53 0.27 1.11 1.01 -1.26 -0.35 120.40 119.74 3h43 s VAL 147 Ca 0.07 -0.81 -0.23 0.00 0.00 0.00 0.00 61.98 61.02 3h43 s VAL 147 Cb -0.01 -1.28 -0.09 0.00 0.00 0.00 0.00 36.38 35.00 3h43 s VAL 147 CO -0.06 0.43 0.83 -0.76 0.00 0.00 0.00 175.10 175.54 3h43 s LEU 148 N -0.31 4.35 0.81 3.92 1.43 -0.49 -4.92 118.68 123.47 3h43 s LEU 148 Ca 0.04 1.62 -0.13 0.00 -1.03 0.00 0.00 54.13 54.62 3h43 s LEU 148 Cb -0.09 -3.78 0.08 0.00 0.03 0.00 0.00 46.19 42.44 3h43 s LEU 148 CO 0.00 -0.01 1.20 -2.16 0.23 0.00 0.00 176.35 175.61 3h43 s PRO 149 N -1.99 1.65 0.57 1.29 0.04 -1.26 -4.70 135.00 130.60 3h43 s PRO 149 Ca 0.46 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 63.22 3h43 s PRO 149 Cb -0.18 -1.78 0.03 0.00 0.04 0.00 0.00 34.50 32.61 3h43 s PRO 149 CO 0.22 -2.20 0.82 -1.21 0.04 0.00 0.00 177.00 174.68 3h43 s GLU 150 N -4.16 2.59 0.90 4.56 2.02 -1.26 -4.99 118.70 118.36 3h43 s GLU 150 Ca 0.73 -0.54 -0.11 0.00 0.02 0.00 0.00 54.97 55.07 3h43 s GLU 150 Cb -0.28 -2.41 0.13 0.00 0.10 0.00 0.00 34.13 31.67 3h43 s GLU 150 CO 0.51 -0.75 1.09 -0.51 0.02 0.00 0.00 175.26 175.62 3h43 s LEU 151 N -4.86 2.40 0.00 1.80 1.43 -1.26 -5.25 118.68 112.94 3h43 s LEU 151 Ca 0.56 1.68 0.02 0.00 -1.03 0.00 0.00 54.13 55.37 3h43 s LEU 151 Cb -0.10 -4.11 0.14 0.00 0.03 0.00 0.00 46.19 42.14 3h43 s LEU 151 CO 0.40 -2.72 0.63 -1.84 0.23 0.00 0.00 176.35 173.05