#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 1.29 -0.03 1.97 4.81 -2.05 -0.92 114.58 119.65 3h43 h GLU 76 Ca 0.00 -0.08 -0.11 0.00 -0.13 0.00 0.00 59.36 59.04 3h43 h GLU 76 Cb 0.00 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 29.07 3h43 h GLU 76 CO 0.00 0.85 -0.50 -0.91 -0.73 0.00 0.00 179.01 177.73 3h43 h ASN 77 N 1.33 0.08 -0.42 1.04 2.35 -2.05 -0.96 115.58 116.95 3h43 h ASN 77 Ca 0.38 -0.04 -0.12 0.00 -0.55 0.00 0.00 56.30 55.97 3h43 h ASN 77 Cb -0.09 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 3h43 h ASN 77 CO -0.10 0.56 -0.22 -0.33 -1.65 0.00 0.00 177.43 175.70 3h43 h GLU 78 N 0.06 0.88 -0.31 0.81 5.08 -1.81 -0.70 114.58 118.59 3h43 h GLU 78 Ca -0.00 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3h43 h GLU 78 Cb 0.90 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 3h43 h GLU 78 CO 0.07 1.04 0.18 0.82 -1.00 0.00 0.00 179.01 180.11 3h43 h ILE 79 N 0.70 1.12 -0.88 3.13 2.04 -0.90 -0.77 117.51 121.96 3h43 h ILE 79 Ca 0.09 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3h43 h ILE 79 Cb 0.78 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 3h43 h ILE 79 CO 0.06 0.12 0.51 -0.07 0.00 0.00 0.00 178.15 178.78 3h43 h LEU 80 N 0.38 1.07 -0.62 1.44 3.38 -1.03 0.47 115.31 120.40 3h43 h LEU 80 Ca 0.11 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 3h43 h LEU 80 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3h43 h LEU 80 CO -0.02 0.83 -0.60 0.03 0.09 0.00 0.00 178.44 178.77 3h43 h ARG 81 N 1.22 0.30 -0.16 1.13 3.08 -0.87 -0.85 114.38 118.23 3h43 h ARG 81 Ca 0.31 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 3h43 h ARG 81 Cb -0.03 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3h43 h ARG 81 CO -0.06 0.81 0.02 -0.09 -1.07 0.00 0.00 179.97 179.58 3h43 h ARG 82 N 0.22 0.27 -0.49 0.04 9.65 -0.69 -1.15 114.38 122.23 3h43 h ARG 82 Ca -0.01 -0.08 -0.00 0.00 -1.10 0.00 0.00 59.98 58.80 3h43 h ARG 82 Cb 1.11 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.64 3h43 h ARG 82 CO 0.10 0.46 0.30 1.49 2.80 0.00 0.00 179.97 185.11 3h43 h GLU 83 N 0.04 0.67 -0.52 0.20 4.57 -0.80 0.14 114.58 118.87 3h43 h GLU 83 Ca 0.05 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 3h43 h GLU 83 Cb 0.33 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 3h43 h GLU 83 CO 0.00 0.48 0.28 1.25 -1.18 0.00 0.00 179.01 179.85 3h43 h LEU 84 N 0.66 0.65 -0.12 1.64 5.85 -1.07 -2.79 115.31 120.14 3h43 h LEU 84 Ca 0.18 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 3h43 h LEU 84 Cb -0.01 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3h43 h LEU 84 CO -0.03 0.56 0.07 -0.78 -0.34 0.00 0.00 178.44 177.91 3h43 h ASP 85 N 0.69 0.15 0.00 1.25 3.58 -0.80 -1.10 116.42 120.19 3h43 h ASP 85 Ca 0.18 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.57 3h43 h ASP 85 Cb 0.05 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.06 3h43 h ASP 85 CO -0.03 0.17 0.00 0.54 -2.88 0.00 0.00 179.24 177.04 3h43 n ARG 86 N -4.97 0.22 0.00 0.28 1.74 0.44 -1.95 116.66 112.42 3h43 n ARG 86 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 3h43 n ARG 86 Cb 0.06 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 3h43 n ARG 86 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3h43 n ARG 88 N 1.02 0.00 -2.16 5.56 1.74 -0.42 -5.00 116.66 117.40 3h43 n ARG 88 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 3h43 n ARG 88 Cb 0.11 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.54 3h43 n ARG 88 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3h43 s VAL 89 N 0.00 2.86 0.50 1.55 -7.23 -0.82 -4.97 120.40 112.28 3h43 s VAL 89 Ca 0.00 0.76 -0.22 0.00 -1.81 0.00 0.00 61.98 60.72 3h43 s VAL 89 Cb 0.00 -3.45 -0.06 0.00 0.56 0.00 0.00 36.38 33.43 3h43 s VAL 89 CO 0.00 0.11 1.22 -2.16 -0.31 0.00 0.00 175.10 173.96 3h43 s PRO 90 N -2.17 3.47 0.81 4.82 0.04 -1.26 -5.01 135.00 135.70 3h43 s PRO 90 Ca 0.55 1.89 -0.11 0.00 0.04 0.00 0.00 61.00 63.37 3h43 s PRO 90 Cb -0.35 -2.28 0.08 0.00 0.04 0.00 0.00 34.50 31.98 3h43 s PRO 90 CO 0.45 -0.82 1.10 -1.25 0.04 0.00 0.00 177.00 176.52 3h43 s PRO 91 N -2.87 2.00 -0.10 0.56 0.04 -1.26 -4.99 135.00 128.38 3h43 s PRO 91 Ca 0.68 0.67 -0.03 0.00 0.04 0.00 0.00 61.00 62.36 3h43 s PRO 91 Cb -0.32 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 3h43 s PRO 91 CO 0.37 -1.69 0.02 -0.51 0.04 0.00 0.00 177.00 175.24 3h43 s LEU 92 N -5.83 3.66 0.06 -3.56 1.43 -1.26 -4.35 118.68 108.83 3h43 s LEU 92 Ca 0.61 0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 53.56 3h43 s LEU 92 Cb -0.15 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3h43 s LEU 92 CO 0.55 0.35 0.97 -0.63 0.23 0.00 0.00 176.35 177.81 3h43 s ILE 93 N -0.68 4.68 -0.07 -0.59 1.01 -0.39 -4.78 121.20 120.38 3h43 s ILE 93 Ca 0.11 2.06 -0.19 0.00 0.00 0.00 0.00 60.65 62.64 3h43 s ILE 93 Cb -0.12 -4.32 -0.05 0.00 0.01 0.00 0.00 42.46 37.99 3h43 s ILE 93 CO 0.02 0.24 0.52 -0.69 0.00 0.00 0.00 174.94 175.04 3h43 s VAL 94 N 0.51 5.09 0.33 2.92 1.01 -1.26 -0.43 120.40 128.56 3h43 s VAL 94 Ca 0.49 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.60 3h43 s VAL 94 Cb -0.22 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 3h43 s VAL 94 CO 0.29 0.36 0.22 -0.83 0.00 0.00 0.00 175.10 175.14 3h43 s GLY 95 N 0.29 2.25 -0.08 4.51 0.00 -0.35 -1.54 107.32 112.40 3h43 s GLY 95 Ca 0.28 -1.84 0.03 0.00 0.00 0.00 0.00 44.72 43.19 3h43 s GLY 95 CO 0.13 -1.55 -0.16 -1.59 0.00 0.00 0.00 173.10 169.93 3h43 s THR 96 N -3.51 1.48 0.13 0.90 2.01 0.25 -0.89 115.64 116.01 3h43 s THR 96 Ca 0.37 -0.67 -0.31 0.00 0.31 0.00 0.00 61.69 61.38 3h43 s THR 96 Cb 0.03 -1.32 -0.10 0.00 0.01 0.00 0.00 72.50 71.12 3h43 s THR 96 CO 0.22 0.43 1.65 -0.69 -0.69 0.00 0.00 174.62 175.54 3h43 s VAL 97 N 0.60 2.66 -0.22 3.82 1.01 -0.49 0.01 120.40 127.80 3h43 s VAL 97 Ca -0.15 0.35 -0.20 0.00 0.00 0.00 0.00 61.98 61.98 3h43 s VAL 97 Cb -0.16 -3.22 -0.18 0.00 0.00 0.00 0.00 36.38 32.82 3h43 s VAL 97 CO 0.05 0.01 0.13 0.52 0.00 0.00 0.00 175.10 175.81 3h43 n VAL 98 N 4.31 1.53 -3.61 2.92 0.31 0.12 -0.95 118.33 122.96 3h43 n VAL 98 Ca 0.15 -0.06 -0.06 0.00 -0.01 0.00 0.00 64.34 64.36 3h43 n VAL 98 Cb 0.39 -2.03 -0.05 0.00 -0.91 0.00 0.00 33.84 31.23 3h43 n VAL 98 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3h43 s ASP 99 N -6.90 -0.21 0.17 4.52 2.15 -1.10 -4.43 116.67 110.87 3h43 s ASP 99 Ca -0.30 0.23 -0.30 0.00 0.43 0.00 0.00 52.55 52.62 3h43 s ASP 99 Cb 0.07 0.18 -0.07 0.00 -0.30 0.00 0.00 42.92 42.79 3h43 s ASP 99 CO 0.57 -0.19 0.93 -0.54 -0.17 0.00 0.00 175.17 175.77 3h43 s LYS 100 N -1.04 4.76 0.00 4.34 1.02 -1.26 -0.10 119.74 127.46 3h43 s LYS 100 Ca 0.03 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.46 3h43 s LYS 100 Cb -0.01 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 3h43 s LYS 100 CO -0.03 0.37 0.38 1.33 -0.92 0.00 0.00 175.35 176.48 3h43 n VAL 101 N 2.14 0.00 -3.78 3.17 0.24 0.36 -4.91 118.33 115.55 3h43 n VAL 101 Ca -0.00 -0.44 -0.03 0.00 -2.04 0.00 0.00 64.34 61.83 3h43 n VAL 101 Cb 0.48 1.09 -0.00 0.00 -1.47 0.00 0.00 33.84 33.94 3h43 n VAL 101 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3h43 s GLY 102 N -0.13 -0.15 0.08 7.63 0.00 -1.02 -4.98 107.32 108.75 3h43 s GLY 102 Ca 0.00 0.05 -0.16 0.00 0.00 0.00 0.00 44.72 44.61 3h43 s GLY 102 CO 0.00 0.75 1.04 -2.21 0.00 0.00 0.00 173.10 172.68 3h43 n GLU 103 N -0.54 -0.22 -2.41 2.90 2.13 -1.26 -2.18 120.64 119.05 3h43 n GLU 103 Ca -0.05 1.02 -0.18 0.00 0.66 0.00 0.00 57.16 58.60 3h43 n GLU 103 Cb 0.61 -1.51 0.02 0.00 0.27 0.00 0.00 31.44 30.83 3h43 n GLU 103 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3h43 n ARG 104 N -4.23 2.83 -4.18 5.31 1.74 -1.26 -4.97 116.66 111.90 3h43 n ARG 104 Ca 0.01 -4.02 -0.20 0.00 -0.77 0.00 0.00 57.85 52.87 3h43 n ARG 104 Cb 0.13 -1.99 -0.16 0.00 -1.02 0.00 0.00 32.46 29.42 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 -3.54 0.86 0.03 5.56 1.02 -0.93 -0.88 119.74 121.87 3h43 s LYS 105 Ca 0.42 -0.12 0.01 0.00 0.02 0.00 0.00 55.97 56.31 3h43 s LYS 105 Cb 0.40 -0.85 -0.02 0.00 -0.52 0.00 0.00 37.83 36.84 3h43 s LYS 105 CO -0.05 -0.07 -0.06 0.14 -0.92 0.00 0.00 175.35 174.39 3h43 s VAL 106 N 0.89 0.38 -0.16 3.17 -7.23 -0.57 -0.49 120.40 116.39 3h43 s VAL 106 Ca -0.11 -0.92 -0.15 0.00 -1.81 0.00 0.00 61.98 58.98 3h43 s VAL 106 Cb -0.14 -0.46 -0.04 0.00 0.56 0.00 0.00 36.38 36.30 3h43 s VAL 106 CO 0.00 -0.36 0.37 -0.69 -0.31 0.00 0.00 175.10 174.11 3h43 s VAL 107 N -1.25 5.24 -0.04 1.32 1.01 0.85 -0.32 120.40 127.22 3h43 s VAL 107 Ca -0.10 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.62 3h43 s VAL 107 Cb -0.09 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3h43 s VAL 107 CO -0.00 0.33 -0.20 -0.69 0.00 0.00 0.00 175.10 174.53 3h43 s VAL 108 N 0.78 1.67 -0.41 2.92 1.01 0.32 0.11 120.40 126.80 3h43 s VAL 108 Ca 0.20 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 61.14 3h43 s VAL 108 Cb -0.14 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.84 3h43 s VAL 108 CO 0.07 0.47 0.42 -0.75 0.00 0.00 0.00 175.10 175.31 3h43 s LYS 109 N -0.17 3.12 0.30 2.72 2.20 0.10 -1.29 119.74 126.71 3h43 s LYS 109 Ca -0.00 -0.75 -0.29 0.00 -0.36 0.00 0.00 55.97 54.57 3h43 s LYS 109 Cb -0.11 -3.95 -0.09 0.00 -1.51 0.00 0.00 37.83 32.16 3h43 s LYS 109 CO 0.02 -0.82 1.10 0.45 -0.36 0.00 0.00 175.35 175.74 3h43 s SER 110 N 1.79 7.18 0.13 1.43 0.15 -0.54 -0.59 113.70 123.26 3h43 s SER 110 Ca 0.11 2.25 0.15 0.00 0.70 0.00 0.00 55.95 59.16 3h43 s SER 110 Cb -0.17 -2.62 0.68 0.00 -1.71 0.00 0.00 66.02 62.20 3h43 s SER 110 CO 0.13 -0.20 1.46 -1.54 1.20 0.00 0.00 173.24 174.29 3h43 n SER 111 N 1.01 0.29 0.00 5.45 3.41 -0.59 -1.00 113.62 122.19 3h43 n SER 111 Ca -0.00 0.60 0.14 0.00 -0.26 0.00 0.00 58.87 59.34 3h43 n SER 111 Cb 0.45 -0.65 0.71 0.00 -0.26 0.00 0.00 64.21 64.46 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 -1.85 0.06 0.00 6.66 -2.24 -1.26 -4.97 114.28 110.68 3h43 n THR 112 Ca 0.01 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 3h43 n THR 112 Cb 0.12 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 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 2.39 3.78 3.38 0.00 -0.17 -5.11 105.19 110.63 3h43 n GLY 113 Ca 0.13 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 1.37 0.00 1.61 0.04 -1.26 -4.64 135.00 132.12 3h43 s PRO 114 Ca 0.00 0.43 0.05 0.00 0.04 0.00 0.00 61.00 61.51 3h43 s PRO 114 Cb 0.00 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.65 3h43 s PRO 114 CO 0.00 -2.07 -0.12 -1.12 0.04 0.00 0.00 177.00 173.73 3h43 s SER 115 N -3.93 4.21 0.12 6.66 0.01 -1.26 -1.47 113.70 118.04 3h43 s SER 115 Ca 0.63 -0.25 0.03 0.00 1.31 0.00 0.00 55.95 57.67 3h43 s SER 115 Cb -0.15 -0.86 -0.04 0.00 0.21 0.00 0.00 66.02 65.17 3h43 s SER 115 CO 0.54 0.29 -0.08 -0.36 0.41 0.00 0.00 173.24 174.03 3h43 s PHE 116 N -0.91 1.08 -0.31 2.43 0.40 -0.41 -4.97 117.98 115.28 3h43 s PHE 116 Ca 0.15 -0.84 -0.08 0.00 -0.60 0.00 0.00 56.93 55.56 3h43 s PHE 116 Cb -0.11 -0.58 0.01 0.00 0.51 0.00 0.00 43.02 42.85 3h43 s PHE 116 CO 0.05 -0.03 0.11 -1.17 0.70 0.00 0.00 175.22 174.88 3h43 s LEU 117 N -3.11 4.03 0.29 -0.37 2.96 -1.26 -0.52 118.68 120.70 3h43 s LEU 117 Ca 0.14 -0.71 0.06 0.00 -0.22 0.00 0.00 54.13 53.41 3h43 s LEU 117 Cb 0.04 -1.93 -0.06 0.00 0.50 0.00 0.00 46.19 44.74 3h43 s LEU 117 CO -0.02 -0.22 -0.03 0.68 -1.32 0.00 0.00 176.35 175.44 3h43 s VAL 118 N 1.53 1.55 0.60 1.68 -7.23 0.57 -4.94 120.40 114.15 3h43 s VAL 118 Ca 0.03 -2.09 -0.12 0.00 -1.81 0.00 0.00 61.98 57.98 3h43 s VAL 118 Cb -0.17 -2.52 -0.05 0.00 0.56 0.00 0.00 36.38 34.20 3h43 s VAL 118 CO 0.04 -0.24 1.02 0.20 -0.31 0.00 0.00 175.10 175.81 3h43 s ASN 119 N -3.45 6.24 -0.18 4.85 0.01 -1.26 -1.51 114.94 119.64 3h43 s ASN 119 Ca 0.31 1.48 -0.03 0.00 -0.71 0.00 0.00 52.86 53.91 3h43 s ASN 119 Cb 0.05 -2.48 -0.01 0.00 0.41 0.00 0.00 41.25 39.21 3h43 s ASN 119 CO 0.13 -0.86 -0.06 -0.69 -1.51 0.00 0.00 177.10 174.10 3h43 s VAL 120 N -3.02 3.41 0.40 1.60 1.01 -0.05 -1.53 120.40 122.22 3h43 s VAL 120 Ca 0.56 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.79 3h43 s VAL 120 Cb -0.11 -2.51 -0.11 0.00 0.00 0.00 0.00 36.38 33.65 3h43 s VAL 120 CO 0.48 0.46 1.11 -0.24 0.00 0.00 0.00 175.10 176.91 3h43 n SER 121 N 4.20 1.75 0.24 3.32 2.88 -0.14 -4.83 113.62 121.03 3h43 n SER 121 Ca -0.18 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.60 3h43 n SER 121 Cb 0.52 -1.40 0.84 0.00 -0.75 0.00 0.00 64.21 63.42 3h43 n SER 121 CO 0.00 0.00 0.00 0.45 -1.23 0.00 0.00 175.04 174.26 3h43 h HIS 122 N 1.83 0.00 -0.00 0.66 3.86 -1.98 -0.71 115.15 118.81 3h43 h HIS 122 Ca -0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 3h43 h HIS 122 Cb 1.32 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.79 3h43 h HIS 122 CO 0.46 0.00 -0.01 1.19 0.86 0.00 0.00 177.93 180.43 3h43 n PHE 123 N -3.92 0.00 -4.04 2.45 3.01 -1.26 -4.77 117.46 108.93 3h43 n PHE 123 Ca -0.00 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.11 3h43 n PHE 123 Cb 0.21 -0.06 -0.07 0.00 -0.01 0.00 0.00 39.48 39.56 3h43 n PHE 123 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3h43 s VAL 124 N -2.13 5.05 -0.55 -4.37 1.01 -0.27 -5.04 120.40 114.10 3h43 s VAL 124 Ca 0.42 -0.12 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 3h43 s VAL 124 Cb 0.21 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 33.38 3h43 s VAL 124 CO 0.39 0.48 1.02 0.21 0.00 0.00 0.00 175.10 177.20 3h43 s ASN 125 N -1.38 6.39 0.54 3.32 2.47 -1.26 -4.85 114.94 120.17 3h43 s ASN 125 Ca 0.19 -0.16 0.42 0.00 0.42 0.00 0.00 52.86 53.73 3h43 s ASN 125 Cb -0.12 -2.47 1.62 0.00 -1.45 0.00 0.00 41.25 38.82 3h43 s ASN 125 CO 0.09 -1.29 1.70 -0.65 -3.72 0.00 0.00 177.10 173.23 3h43 h PRO 126 N 9.36 0.01 0.00 0.43 0.11 -1.93 0.48 132.00 140.46 3h43 h PRO 126 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3h43 h PRO 126 Cb 1.07 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3h43 h PRO 126 CO 1.11 0.01 0.00 -0.44 -0.21 0.00 0.00 178.00 178.47 3h43 h ASP 127 N 0.01 0.00 -0.29 -2.05 3.32 -1.97 -2.64 116.42 112.80 3h43 h ASP 127 Ca 0.73 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.78 3h43 h ASP 127 Cb 2.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 42.45 3h43 h ASP 127 CO -0.03 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.96 3h43 n ASP 128 N -2.36 1.78 -4.54 6.45 8.00 0.17 -4.77 116.55 121.27 3h43 n ASP 128 Ca 0.03 -1.90 -0.34 0.00 0.71 0.00 0.00 54.79 53.29 3h43 n ASP 128 Cb 0.29 -0.19 -0.11 0.00 -0.02 0.00 0.00 41.12 41.08 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 -1.19 3.32 0.17 0.64 1.43 -1.00 -4.96 118.68 117.09 3h43 s LEU 129 Ca 0.26 -0.06 -0.22 0.00 -1.03 0.00 0.00 54.13 53.08 3h43 s LEU 129 Cb 0.14 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.63 3h43 s LEU 129 CO 0.19 0.22 0.59 0.00 0.23 0.00 0.00 176.35 177.59 3h43 s ALA 130 N 0.04 -1.46 0.14 4.21 0.00 -1.26 -4.97 121.76 118.46 3h43 s ALA 130 Ca 0.01 0.30 -0.35 0.00 0.00 0.00 0.00 51.96 51.92 3h43 s ALA 130 Cb -0.13 0.87 -0.15 0.00 0.00 0.00 0.00 23.12 23.71 3h43 s ALA 130 CO 0.03 -0.79 1.51 -2.30 0.00 0.00 0.00 175.76 174.20 3h43 n PRO 131 N -0.37 1.84 0.00 0.00 -0.02 -1.26 -1.89 135.00 133.30 3h43 n PRO 131 Ca -0.15 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3h43 n PRO 131 Cb 0.64 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3h43 n PRO 131 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h43 n GLY 132 N 3.15 1.08 3.73 -1.23 0.00 -0.13 -4.98 105.19 106.81 3h43 n GLY 132 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.79 4.36 -0.07 1.61 2.47 -0.79 -4.71 119.74 121.83 3h43 s LYS 133 Ca 0.00 2.07 -0.25 0.00 -1.56 0.00 0.00 55.97 56.23 3h43 s LYS 133 Cb 0.00 -3.20 -0.03 0.00 -1.46 0.00 0.00 37.83 33.13 3h43 s LYS 133 CO 0.00 -0.32 0.79 1.03 0.16 0.00 0.00 175.35 177.02 3h43 s ARG 134 N 0.22 4.45 0.26 4.03 0.52 -1.26 -1.39 118.95 125.78 3h43 s ARG 134 Ca 0.59 1.04 0.07 0.00 -0.52 0.00 0.00 55.73 56.90 3h43 s ARG 134 Cb -0.37 -3.47 -0.06 0.00 0.52 0.00 0.00 34.95 31.58 3h43 s ARG 134 CO 0.36 -0.03 -0.07 0.14 0.02 0.00 0.00 175.30 175.72 3h43 s VAL 135 N 1.07 1.64 -0.14 3.52 -7.23 -0.07 -1.27 120.40 117.92 3h43 s VAL 135 Ca 0.41 -2.14 -0.03 0.00 -1.81 0.00 0.00 61.98 58.42 3h43 s VAL 135 Cb -0.18 -2.37 -0.03 0.00 0.56 0.00 0.00 36.38 34.36 3h43 s VAL 135 CO 0.20 -0.36 -0.04 0.00 -0.31 0.00 0.00 175.10 174.59 3h43 s LEU 137 N 0.10 2.92 0.34 0.00 1.43 0.43 -1.04 118.68 122.87 3h43 s LEU 137 Ca -0.01 -0.17 -0.28 0.00 -1.03 0.00 0.00 54.13 52.64 3h43 s LEU 137 Cb -0.14 -1.64 -0.10 0.00 0.03 0.00 0.00 46.19 44.35 3h43 s LEU 137 CO 0.03 0.28 1.27 0.21 0.23 0.00 0.00 176.35 178.37 3h43 s ASN 138 N -0.34 6.74 0.15 2.29 3.84 -0.20 -1.26 114.94 126.16 3h43 s ASN 138 Ca 0.04 2.61 -0.13 0.00 0.21 0.00 0.00 52.86 55.58 3h43 s ASN 138 Cb -0.13 -2.64 0.03 0.00 -0.55 0.00 0.00 41.25 37.97 3h43 s ASN 138 CO 0.02 -0.55 1.67 1.56 -2.79 0.00 0.00 177.10 177.01 3h43 h GLN 139 N 3.25 0.81 -0.18 0.43 4.20 -1.92 0.25 115.11 121.96 3h43 h GLN 139 Ca -0.49 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 57.84 3h43 h GLN 139 Cb 1.23 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.90 3h43 h GLN 139 CO 0.65 0.77 -0.65 1.96 -0.67 0.00 0.00 178.83 180.89 3h43 h GLN 140 N 0.71 0.75 -0.00 1.46 4.20 -1.95 -3.37 115.11 116.91 3h43 h GLN 140 Ca 0.16 -0.57 0.00 0.00 0.06 0.00 0.00 58.65 58.30 3h43 h GLN 140 Cb 0.31 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.20 3h43 h GLN 140 CO -0.00 1.19 -0.44 0.25 -0.67 0.00 0.00 178.83 179.16 3h43 n THR 141 N -4.03 0.00 -0.90 -0.54 -2.24 -1.24 -4.98 114.28 100.35 3h43 n THR 141 Ca -0.07 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 3h43 n THR 141 Cb 0.68 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.94 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 -1.02 0.68 -4.74 3.22 4.77 0.87 -4.88 117.00 115.89 3h43 n LEU 142 Ca 0.03 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.60 3h43 n LEU 142 Cb 0.18 -1.62 0.01 0.00 -2.33 0.00 0.00 43.42 39.66 3h43 n LEU 142 CO 0.20 -0.58 1.01 0.41 -1.33 0.00 0.00 177.39 177.09 3h43 n THR 143 N -2.23 2.47 -2.47 -5.08 -1.04 -1.26 -4.45 114.28 100.23 3h43 n THR 143 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.08 3h43 n THR 143 Cb 0.24 -1.76 -0.02 0.00 -1.82 0.00 0.00 70.33 66.97 3h43 n THR 143 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3h43 s VAL 144 N -1.17 4.16 -1.02 12.58 1.01 -0.58 -1.04 120.40 134.34 3h43 s VAL 144 Ca 0.59 1.26 0.08 0.00 0.00 0.00 0.00 61.98 63.92 3h43 s VAL 144 Cb -0.48 -4.29 0.09 0.00 0.00 0.00 0.00 36.38 31.70 3h43 s VAL 144 CO 0.59 -0.64 0.82 1.33 0.00 0.00 0.00 175.10 177.21 3h43 n VAL 145 N 6.46 0.12 -3.55 2.92 0.24 -0.21 -0.97 118.33 123.35 3h43 n VAL 145 Ca 0.14 -0.56 -0.07 0.00 -2.04 0.00 0.00 64.34 61.81 3h43 n VAL 145 Cb 0.47 1.09 -0.03 0.00 -1.47 0.00 0.00 33.84 33.91 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 -0.75 -0.27 -0.04 -1.34 2.15 -1.21 -4.84 116.67 110.38 3h43 s ASP 146 Ca 0.11 0.07 0.07 0.00 0.43 0.00 0.00 52.55 53.22 3h43 s ASP 146 Cb 0.07 0.27 -0.01 0.00 -0.30 0.00 0.00 42.92 42.95 3h43 s ASP 146 CO 0.11 -0.41 -0.25 -0.69 -0.17 0.00 0.00 175.17 173.76 3h43 s VAL 147 N -2.47 1.97 0.24 1.11 1.01 -1.26 -0.10 120.40 120.91 3h43 s VAL 147 Ca 0.06 -1.05 -0.21 0.00 0.00 0.00 0.00 61.98 60.78 3h43 s VAL 147 Cb -0.01 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.63 3h43 s VAL 147 CO -0.06 0.55 0.77 -0.76 0.00 0.00 0.00 175.10 175.60 3h43 s LEU 148 N -0.37 4.34 0.89 3.92 1.43 -0.40 -4.95 118.68 123.53 3h43 s LEU 148 Ca 0.03 1.50 -0.10 0.00 -1.03 0.00 0.00 54.13 54.53 3h43 s LEU 148 Cb -0.11 -3.67 0.13 0.00 0.03 0.00 0.00 46.19 42.57 3h43 s LEU 148 CO 0.01 0.01 1.12 -2.16 0.23 0.00 0.00 176.35 175.57 3h43 s PRO 149 N -1.99 1.25 0.49 1.29 0.04 -1.26 -4.72 135.00 130.09 3h43 s PRO 149 Ca 0.44 1.39 0.03 0.00 0.04 0.00 0.00 61.00 62.90 3h43 s PRO 149 Cb -0.17 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 3h43 s PRO 149 CO 0.21 -2.42 0.04 -1.21 0.04 0.00 0.00 177.00 173.66 3h43 s GLU 150 N -4.72 2.16 0.42 4.56 2.02 -1.26 -4.99 118.70 116.88 3h43 s GLU 150 Ca 0.65 -2.30 -0.26 0.00 0.02 0.00 0.00 54.97 53.08 3h43 s GLU 150 Cb -0.21 -1.61 -0.09 0.00 0.10 0.00 0.00 34.13 32.32 3h43 s GLU 150 CO 0.58 -0.31 1.32 -0.51 0.02 0.00 0.00 175.26 176.35 3h43 s LEU 151 N -3.88 4.19 0.00 1.80 1.43 -1.26 -5.27 118.68 115.69 3h43 s LEU 151 Ca 0.14 2.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.93 3h43 s LEU 151 Cb 0.03 -3.92 0.00 0.00 0.03 0.00 0.00 46.19 42.33 3h43 s LEU 151 CO 0.08 -0.91 0.00 -0.62 0.23 0.00 0.00 176.35 175.12