#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h43 n GLU 76 N 0.00 -0.23 0.09 1.97 4.07 -1.26 0.25 120.64 125.53 3h43 n GLU 76 Ca 0.00 0.83 0.02 0.00 -0.06 0.00 0.00 57.16 57.95 3h43 n GLU 76 Cb 0.00 -1.23 0.37 0.00 -0.06 0.00 0.00 31.44 30.52 3h43 n GLU 76 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 3h43 h ASN 77 N 0.00 0.29 -0.13 4.31 2.35 -2.05 -1.79 115.58 118.56 3h43 h ASN 77 Ca 0.10 -0.06 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 3h43 h ASN 77 Cb 0.24 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3h43 h ASN 77 CO -0.52 0.42 -0.24 -0.08 -1.65 0.00 0.00 177.43 175.35 3h43 h GLU 78 N 0.29 0.57 -0.20 0.81 4.57 -0.63 0.99 114.58 120.98 3h43 h GLU 78 Ca 0.06 -0.22 -0.19 0.00 -1.18 0.00 0.00 59.36 57.83 3h43 h GLU 78 Cb 0.35 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 3h43 h GLU 78 CO 0.02 0.77 -0.64 0.82 -1.18 0.00 0.00 179.01 178.80 3h43 h ILE 79 N 0.50 1.30 -0.39 2.32 2.04 -0.79 -2.03 117.51 120.47 3h43 h ILE 79 Ca 0.07 -1.86 -0.06 0.00 1.00 0.00 0.00 64.86 64.01 3h43 h ILE 79 Cb 0.69 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 3h43 h ILE 79 CO 0.05 0.59 -0.01 -0.07 0.00 0.00 0.00 178.15 178.72 3h43 h LEU 80 N 0.53 0.68 -0.32 1.44 3.38 -1.01 -2.76 115.31 117.25 3h43 h LEU 80 Ca -0.01 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3h43 h LEU 80 Cb 1.23 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 3h43 h LEU 80 CO 0.13 0.83 0.20 -0.09 0.09 0.00 0.00 178.44 179.60 3h43 h ARG 81 N 0.52 0.42 -0.65 1.13 2.43 -0.75 -0.38 114.38 117.10 3h43 h ARG 81 Ca 0.11 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3h43 h ARG 81 Cb 0.48 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 3h43 h ARG 81 CO 0.02 0.30 0.34 0.00 -1.51 0.00 0.00 179.97 179.12 3h43 h ARG 82 N 0.42 0.91 -0.56 0.20 3.08 -1.34 0.10 114.38 117.18 3h43 h ARG 82 Ca 0.12 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 3h43 h ARG 82 Cb -0.02 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 3h43 h ARG 82 CO -0.02 0.68 -0.02 1.49 -1.07 0.00 0.00 179.97 181.03 3h43 h GLU 83 N 0.91 1.01 -0.59 0.04 4.57 -1.15 -1.97 114.58 117.41 3h43 h GLU 83 Ca 0.23 -0.33 -0.09 0.00 -1.18 0.00 0.00 59.36 57.99 3h43 h GLU 83 Cb 0.05 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 3h43 h GLU 83 CO -0.03 1.01 0.01 1.25 -1.18 0.00 0.00 179.01 180.07 3h43 h LEU 84 N 0.89 0.98 -0.94 1.64 5.85 -0.21 -2.80 115.31 120.72 3h43 h LEU 84 Ca 0.16 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 3h43 h LEU 84 Cb 0.57 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3h43 h LEU 84 CO 0.03 1.03 0.58 0.44 -0.34 0.00 0.00 178.44 180.18 3h43 h ASP 85 N 0.93 1.12 0.00 1.25 3.32 -0.52 -1.46 116.42 121.07 3h43 h ASP 85 Ca 0.17 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3h43 h ASP 85 Cb 0.52 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.79 3h43 h ASP 85 CO 0.03 0.85 0.00 0.54 -1.72 0.00 0.00 179.24 178.94 3h43 n ARG 86 N -4.37 0.41 0.00 3.56 1.74 -0.77 -3.07 116.66 114.16 3h43 n ARG 86 Ca 0.11 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.19 3h43 n ARG 86 Cb 0.05 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 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 0.65 0.00 -1.80 5.56 1.74 -0.55 -4.93 116.66 117.32 3h43 n ARG 88 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 3h43 n ARG 88 Cb 0.18 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.59 3h43 n ARG 88 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h43 s VAL 89 N 0.00 2.22 0.37 1.55 1.01 -1.18 -4.93 120.40 119.45 3h43 s VAL 89 Ca 0.00 0.16 -0.27 0.00 0.00 0.00 0.00 61.98 61.87 3h43 s VAL 89 Cb 0.00 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.18 3h43 s VAL 89 CO 0.00 0.01 1.33 -2.16 0.00 0.00 0.00 175.10 174.28 3h43 s PRO 90 N 0.87 4.13 0.71 2.72 0.04 -1.26 -4.99 135.00 137.21 3h43 s PRO 90 Ca 0.71 2.23 -0.11 0.00 0.04 0.00 0.00 61.00 63.87 3h43 s PRO 90 Cb -0.48 -2.90 0.02 0.00 0.04 0.00 0.00 34.50 31.18 3h43 s PRO 90 CO 0.34 -0.38 1.09 -1.25 0.04 0.00 0.00 177.00 176.84 3h43 s PRO 91 N -2.05 2.85 0.11 0.56 0.04 -1.26 -5.07 135.00 130.17 3h43 s PRO 91 Ca 0.53 0.53 0.02 0.00 0.04 0.00 0.00 61.00 62.12 3h43 s PRO 91 Cb -0.40 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3h43 s PRO 91 CO 0.52 -1.06 0.21 -0.51 0.04 0.00 0.00 177.00 176.20 3h43 s LEU 92 N -5.40 4.19 0.19 -3.56 1.43 -1.26 -4.55 118.68 109.72 3h43 s LEU 92 Ca 0.58 0.14 -0.14 0.00 -1.03 0.00 0.00 54.13 53.67 3h43 s LEU 92 Cb -0.11 -2.79 -0.07 0.00 0.03 0.00 0.00 46.19 43.24 3h43 s LEU 92 CO 0.52 0.11 0.59 -0.63 0.23 0.00 0.00 176.35 177.18 3h43 s ILE 93 N -1.61 4.81 -0.15 -0.59 1.01 -0.19 -4.84 121.20 119.63 3h43 s ILE 93 Ca 0.33 0.84 -0.01 0.00 0.00 0.00 0.00 60.65 61.82 3h43 s ILE 93 Cb -0.12 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 3h43 s ILE 93 CO 0.27 0.14 -0.12 -0.69 0.00 0.00 0.00 174.94 174.53 3h43 s VAL 94 N -1.59 3.00 0.27 2.92 1.01 -1.26 0.24 120.40 125.00 3h43 s VAL 94 Ca 0.42 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.78 3h43 s VAL 94 Cb -0.14 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 3h43 s VAL 94 CO 0.20 0.51 0.16 0.61 0.00 0.00 0.00 175.10 176.57 3h43 n GLY 95 N 3.85 3.33 3.19 4.51 0.00 -0.57 -4.41 105.19 115.09 3h43 n GLY 95 Ca -0.18 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.60 3h43 n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h43 s THR 96 N -2.85 1.76 -0.03 2.61 2.01 0.88 -1.01 115.64 119.02 3h43 s THR 96 Ca 0.23 -0.88 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 3h43 s THR 96 Cb 0.01 -1.51 -0.06 0.00 0.01 0.00 0.00 72.50 70.95 3h43 s THR 96 CO 0.16 0.50 1.62 -0.69 -0.69 0.00 0.00 174.62 175.52 3h43 s VAL 97 N 0.09 3.51 -0.17 3.82 1.01 0.67 -1.05 120.40 128.26 3h43 s VAL 97 Ca -0.08 0.71 -0.05 0.00 0.00 0.00 0.00 61.98 62.56 3h43 s VAL 97 Cb -0.14 -3.46 -0.23 0.00 0.00 0.00 0.00 36.38 32.55 3h43 s VAL 97 CO 0.04 -0.05 0.15 0.52 0.00 0.00 0.00 175.10 175.77 3h43 n VAL 98 N 5.26 1.67 -3.61 2.92 0.31 0.80 0.32 118.33 126.00 3h43 n VAL 98 Ca 0.17 -0.59 -0.11 0.00 -0.01 0.00 0.00 64.34 63.79 3h43 n VAL 98 Cb 0.42 -1.66 -0.07 0.00 -0.91 0.00 0.00 33.84 31.63 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 -6.89 -0.51 -0.29 4.52 2.15 -1.10 -4.73 116.67 109.83 3h43 s ASP 99 Ca -0.27 0.87 -0.10 0.00 0.43 0.00 0.00 52.55 53.48 3h43 s ASP 99 Cb 0.08 0.84 -0.03 0.00 -0.30 0.00 0.00 42.92 43.50 3h43 s ASP 99 CO 0.70 -0.26 0.16 -0.75 -0.17 0.00 0.00 175.17 174.86 3h43 s LYS 100 N -0.16 3.71 0.00 4.34 2.20 -1.26 -0.40 119.74 128.17 3h43 s LYS 100 Ca 0.00 -0.47 0.08 0.00 -0.36 0.00 0.00 55.97 55.22 3h43 s LYS 100 Cb -0.04 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 3h43 s LYS 100 CO -0.02 -0.26 0.48 1.33 -0.36 0.00 0.00 175.35 176.53 3h43 n VAL 101 N 5.02 0.00 -3.98 4.02 0.24 -0.94 -5.01 118.33 117.69 3h43 n VAL 101 Ca -0.14 -0.38 -0.11 0.00 -2.04 0.00 0.00 64.34 61.67 3h43 n VAL 101 Cb 0.51 1.06 -0.03 0.00 -1.47 0.00 0.00 33.84 33.91 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 -1.36 0.75 0.47 7.63 0.00 -1.11 -4.97 107.32 108.74 3h43 s GLY 102 Ca 0.05 -1.01 0.20 0.00 0.00 0.00 0.00 44.72 43.97 3h43 s GLY 102 CO 0.24 -0.64 2.00 0.83 0.00 0.00 0.00 173.10 175.53 3h43 h GLU 103 N 2.14 0.00 -0.36 2.90 5.08 -2.00 -3.26 114.58 119.09 3h43 h GLU 103 Ca -0.27 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.85 3h43 h GLU 103 Cb 1.25 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.10 3h43 h GLU 103 CO 0.37 0.18 -1.09 0.54 -1.00 0.00 0.00 179.01 178.01 3h43 n ARG 104 N -3.95 1.47 -3.92 2.33 1.74 -1.26 -4.70 116.66 108.37 3h43 n ARG 104 Ca -0.02 -3.24 -0.16 0.00 -0.77 0.00 0.00 57.85 53.65 3h43 n ARG 104 Cb 0.27 -1.33 -0.16 0.00 -1.02 0.00 0.00 32.46 30.22 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 -3.06 0.25 0.03 5.56 -0.14 -1.23 -2.38 119.74 118.77 3h43 s LYS 105 Ca 0.29 0.07 -0.04 0.00 -1.36 0.00 0.00 55.97 54.93 3h43 s LYS 105 Cb 0.34 -0.42 -0.01 0.00 -1.68 0.00 0.00 37.83 36.05 3h43 s LYS 105 CO -0.06 -0.12 0.07 0.14 -0.76 0.00 0.00 175.35 174.62 3h43 s VAL 106 N 0.91 0.12 -0.21 3.17 -7.23 -0.72 -2.21 120.40 114.24 3h43 s VAL 106 Ca -0.09 -1.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.95 3h43 s VAL 106 Cb -0.12 -0.70 -0.05 0.00 0.56 0.00 0.00 36.38 36.07 3h43 s VAL 106 CO -0.02 -0.56 0.20 -0.69 -0.31 0.00 0.00 175.10 173.73 3h43 s VAL 107 N -2.18 5.35 0.08 1.32 1.01 0.46 -0.25 120.40 126.19 3h43 s VAL 107 Ca -0.09 0.32 0.06 0.00 0.00 0.00 0.00 61.98 62.27 3h43 s VAL 107 Cb -0.04 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 3h43 s VAL 107 CO -0.03 0.37 -0.16 0.68 0.00 0.00 0.00 175.10 175.97 3h43 s VAL 108 N 0.73 1.28 0.00 2.92 -7.23 0.18 -0.14 120.40 118.15 3h43 s VAL 108 Ca 0.11 -1.40 0.06 0.00 -1.81 0.00 0.00 61.98 58.93 3h43 s VAL 108 Cb -0.13 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.56 3h43 s VAL 108 CO 0.03 -0.20 -0.18 -0.75 -0.31 0.00 0.00 175.10 173.68 3h43 s LYS 109 N -1.86 1.39 0.52 4.82 2.20 -0.22 -0.59 119.74 126.00 3h43 s LYS 109 Ca 0.01 -0.72 0.02 0.00 -0.36 0.00 0.00 55.97 54.92 3h43 s LYS 109 Cb -0.10 -1.38 0.03 0.00 -1.51 0.00 0.00 37.83 34.87 3h43 s LYS 109 CO 0.03 0.37 0.74 -1.54 -0.36 0.00 0.00 175.35 174.59 3h43 s SER 110 N -0.67 5.38 0.46 1.43 1.04 -1.25 -0.08 113.70 120.01 3h43 s SER 110 Ca 0.07 -0.03 0.20 0.00 0.48 0.00 0.00 55.95 56.66 3h43 s SER 110 Cb -0.07 -0.92 1.17 0.00 0.10 0.00 0.00 66.02 66.30 3h43 s SER 110 CO 0.00 -1.05 1.91 -1.28 0.98 0.00 0.00 173.24 173.80 3h43 h SER 111 N 0.17 0.28 0.78 7.02 0.87 -1.95 -2.61 113.55 118.11 3h43 h SER 111 Ca -0.42 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.14 3h43 h SER 111 Cb 1.29 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 63.21 3h43 h SER 111 CO 0.52 0.13 -0.10 0.71 -0.53 0.00 0.00 176.83 177.57 3h43 h THR 112 N 0.29 0.29 0.00 2.23 1.35 -1.96 -3.48 112.91 111.63 3h43 h THR 112 Ca 0.38 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 3h43 h THR 112 Cb 1.06 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 3h43 h THR 112 CO -0.10 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 3h43 n GLY 113 N -0.15 3.22 3.71 5.82 0.00 -0.99 -5.10 105.19 111.70 3h43 n GLY 113 Ca -0.00 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 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 4.29 0.26 1.61 0.04 -1.26 -4.73 135.00 135.20 3h43 s PRO 114 Ca 0.00 2.11 -0.06 0.00 0.04 0.00 0.00 61.00 63.09 3h43 s PRO 114 Cb 0.00 -3.33 -0.06 0.00 0.04 0.00 0.00 34.50 31.15 3h43 s PRO 114 CO 0.00 -0.51 0.53 -1.12 0.04 0.00 0.00 177.00 175.94 3h43 s SER 115 N 1.39 6.50 0.02 6.66 0.01 -1.26 -3.86 113.70 123.16 3h43 s SER 115 Ca 0.66 0.76 0.01 0.00 1.31 0.00 0.00 55.95 58.68 3h43 s SER 115 Cb -0.37 -2.16 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 3h43 s SER 115 CO 0.30 -0.13 -0.04 -0.36 0.41 0.00 0.00 173.24 173.41 3h43 s PHE 116 N -1.96 0.37 -0.26 2.43 0.40 0.24 -4.96 117.98 114.24 3h43 s PHE 116 Ca 0.45 -0.37 -0.15 0.00 -0.60 0.00 0.00 56.93 56.26 3h43 s PHE 116 Cb -0.11 -0.24 -0.04 0.00 0.51 0.00 0.00 43.02 43.15 3h43 s PHE 116 CO 0.27 -0.10 0.38 -1.17 0.70 0.00 0.00 175.22 175.30 3h43 s LEU 117 N -1.06 4.06 0.21 -0.37 2.96 -1.26 -0.65 118.68 122.57 3h43 s LEU 117 Ca -0.09 0.33 0.05 0.00 -0.22 0.00 0.00 54.13 54.20 3h43 s LEU 117 Cb -0.07 -2.44 -0.05 0.00 0.50 0.00 0.00 46.19 44.13 3h43 s LEU 117 CO -0.00 -0.17 -0.06 0.68 -1.32 0.00 0.00 176.35 175.48 3h43 s VAL 118 N 1.93 1.27 0.59 1.68 -7.23 0.65 -4.96 120.40 114.33 3h43 s VAL 118 Ca 0.16 -2.08 -0.09 0.00 -1.81 0.00 0.00 61.98 58.15 3h43 s VAL 118 Cb -0.16 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 3h43 s VAL 118 CO 0.09 -0.49 0.97 0.20 -0.31 0.00 0.00 175.10 175.56 3h43 s ASN 119 N -3.28 6.20 -0.10 4.85 0.01 -1.26 -1.75 114.94 119.60 3h43 s ASN 119 Ca 0.24 1.27 0.04 0.00 -0.71 0.00 0.00 52.86 53.69 3h43 s ASN 119 Cb 0.03 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.32 3h43 s ASN 119 CO 0.06 -0.81 -0.23 -0.69 -1.51 0.00 0.00 177.10 173.92 3h43 s VAL 120 N -3.07 1.99 0.85 1.60 1.01 -1.00 -0.85 120.40 120.92 3h43 s VAL 120 Ca 0.53 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 3h43 s VAL 120 Cb -0.11 -1.72 0.10 0.00 0.00 0.00 0.00 36.38 34.65 3h43 s VAL 120 CO 0.51 0.54 1.13 -0.94 0.00 0.00 0.00 175.10 176.35 3h43 s SER 121 N 0.38 3.61 0.35 3.32 1.04 -0.45 -4.91 113.70 117.03 3h43 s SER 121 Ca -0.18 2.07 0.06 0.00 0.48 0.00 0.00 55.95 58.37 3h43 s SER 121 Cb -0.18 -2.55 0.65 0.00 0.10 0.00 0.00 66.02 64.04 3h43 s SER 121 CO 0.08 -2.64 1.88 0.45 0.98 0.00 0.00 173.24 173.99 3h43 h HIS 122 N -1.47 0.45 0.00 5.02 3.86 -2.00 -2.41 115.15 118.60 3h43 h HIS 122 Ca -0.44 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 3h43 h HIS 122 Cb 1.26 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.60 3h43 h HIS 122 CO 0.53 0.49 0.00 1.97 0.86 0.00 0.00 177.93 181.78 3h43 n PHE 123 N -4.27 0.00 -4.24 2.45 1.16 -1.26 -4.69 117.46 106.60 3h43 n PHE 123 Ca 0.01 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.24 3h43 n PHE 123 Cb 0.26 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.02 3h43 n PHE 123 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3h43 s VAL 124 N -2.00 4.32 -0.41 1.97 1.01 -0.91 -5.05 120.40 119.33 3h43 s VAL 124 Ca 0.05 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 3h43 s VAL 124 Cb 0.02 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.52 3h43 s VAL 124 CO 0.04 0.50 1.18 0.21 0.00 0.00 0.00 175.10 177.04 3h43 s ASN 125 N 0.10 6.66 0.65 3.32 3.84 -1.26 -4.88 114.94 123.38 3h43 s ASN 125 Ca 0.02 0.73 0.36 0.00 0.21 0.00 0.00 52.86 54.18 3h43 s ASN 125 Cb -0.13 -2.55 1.96 0.00 -0.55 0.00 0.00 41.25 39.98 3h43 s ASN 125 CO 0.02 -1.18 2.14 1.55 -2.79 0.00 0.00 177.10 176.84 3h43 h PRO 126 N 9.18 0.00 0.00 0.43 0.13 -1.93 0.82 132.00 140.64 3h43 h PRO 126 Ca -0.23 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.85 3h43 h PRO 126 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3h43 h PRO 126 CO 1.09 0.00 -0.20 -0.44 -0.23 0.00 0.00 178.00 178.22 3h43 h ASP 127 N 0.00 0.00 0.79 1.44 3.32 -1.92 -1.94 116.42 118.11 3h43 h ASP 127 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3h43 h ASP 127 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3h43 h ASP 127 CO -0.00 0.20 0.00 0.47 -1.72 0.00 0.00 179.24 178.19 3h43 n ASP 128 N -3.96 0.21 -4.78 6.45 8.00 0.28 -4.73 116.55 118.02 3h43 n ASP 128 Ca -0.02 0.54 -0.38 0.00 0.71 0.00 0.00 54.79 55.64 3h43 n ASP 128 Cb 0.28 -0.59 -0.06 0.00 -0.02 0.00 0.00 41.12 40.73 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 -3.44 4.39 -0.05 0.64 1.43 -0.73 -5.00 118.68 115.92 3h43 s LEU 129 Ca 0.09 0.91 -0.30 0.00 -1.03 0.00 0.00 54.13 53.79 3h43 s LEU 129 Cb 0.12 -2.65 0.08 0.00 0.03 0.00 0.00 46.19 43.77 3h43 s LEU 129 CO 0.40 0.18 0.72 0.00 0.23 0.00 0.00 176.35 177.87 3h43 s ALA 130 N -0.30 -1.78 0.30 4.21 0.00 -1.26 -5.03 121.76 117.90 3h43 s ALA 130 Ca 0.25 1.28 -0.29 0.00 0.00 0.00 0.00 51.96 53.20 3h43 s ALA 130 Cb -0.16 -0.01 -0.12 0.00 0.00 0.00 0.00 23.12 22.82 3h43 s ALA 130 CO 0.12 -0.40 1.40 -0.35 0.00 0.00 0.00 175.76 176.54 3h43 n PRO 131 N 0.77 2.24 0.00 0.00 -0.04 -1.26 -1.91 135.00 134.80 3h43 n PRO 131 Ca -0.18 0.79 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 3h43 n PRO 131 Cb 0.58 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.59 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 1.49 2.68 3.81 0.55 0.00 0.15 -4.98 105.19 108.89 3h43 n GLY 132 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3h43 n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h43 s LYS 133 N -0.91 3.76 -0.03 1.61 1.02 -0.80 -4.69 119.74 119.69 3h43 s LYS 133 Ca 0.00 1.25 -0.17 0.00 0.02 0.00 0.00 55.97 57.08 3h43 s LYS 133 Cb 0.00 -2.09 -0.05 0.00 -0.52 0.00 0.00 37.83 35.16 3h43 s LYS 133 CO 0.00 -0.45 0.46 1.03 -0.92 0.00 0.00 175.35 175.47 3h43 s ARG 134 N -3.51 4.14 0.11 1.68 0.52 -1.26 -0.24 118.95 120.40 3h43 s ARG 134 Ca 0.65 0.49 0.06 0.00 -0.52 0.00 0.00 55.73 56.41 3h43 s ARG 134 Cb -0.15 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 31.98 3h43 s ARG 134 CO 0.24 0.47 -0.16 0.14 0.02 0.00 0.00 175.30 176.02 3h43 s VAL 135 N -0.41 1.39 -0.22 3.52 -7.23 -0.18 -1.05 120.40 116.22 3h43 s VAL 135 Ca 0.25 -1.63 -0.09 0.00 -1.81 0.00 0.00 61.98 58.70 3h43 s VAL 135 Cb -0.17 -1.48 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 3h43 s VAL 135 CO 0.13 -0.32 0.12 0.00 -0.31 0.00 0.00 175.10 174.73 3h43 s LEU 137 N 0.80 2.47 0.36 0.00 1.43 0.14 -0.84 118.68 123.04 3h43 s LEU 137 Ca 0.06 -0.33 -0.28 0.00 -1.03 0.00 0.00 54.13 52.55 3h43 s LEU 137 Cb -0.13 -1.48 -0.11 0.00 0.03 0.00 0.00 46.19 44.50 3h43 s LEU 137 CO 0.02 0.30 1.42 0.21 0.23 0.00 0.00 176.35 178.53 3h43 s ASN 138 N -0.44 6.47 0.50 2.29 3.84 -0.55 -1.03 114.94 126.02 3h43 s ASN 138 Ca 0.05 2.92 0.15 0.00 0.21 0.00 0.00 52.86 56.19 3h43 s ASN 138 Cb -0.12 -2.66 1.20 0.00 -0.55 0.00 0.00 41.25 39.12 3h43 s ASN 138 CO 0.02 -0.77 2.11 1.56 -2.79 0.00 0.00 177.10 177.23 3h43 h GLN 139 N 3.10 0.12 0.06 0.43 4.20 -1.93 0.95 115.11 122.03 3h43 h GLN 139 Ca -0.50 -0.01 -0.34 0.00 0.06 0.00 0.00 58.65 57.86 3h43 h GLN 139 Cb 1.24 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.95 3h43 h GLN 139 CO 0.64 0.08 -1.89 1.04 -0.67 0.00 0.00 178.83 178.03 3h43 n GLN 140 N -4.51 0.67 0.02 1.46 1.13 -1.26 -4.55 117.38 110.34 3h43 n GLN 140 Ca 0.00 0.35 0.11 0.00 -1.94 0.00 0.00 57.00 55.52 3h43 n GLN 140 Cb 0.16 -1.67 -0.09 0.00 0.11 0.00 0.00 30.24 28.74 3h43 n GLN 140 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3h43 n THR 141 N -3.83 0.17 -1.20 5.09 -2.24 -1.25 -4.95 114.28 106.07 3h43 n THR 141 Ca -0.36 -0.43 -0.07 0.00 -2.27 0.00 0.00 64.05 60.92 3h43 n THR 141 Cb 0.91 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.15 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 -2.24 -0.25 -4.73 3.22 4.77 0.33 -4.78 117.00 113.31 3h43 n LEU 142 Ca -0.01 0.17 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 3h43 n LEU 142 Cb 0.52 -1.81 -0.03 0.00 -2.33 0.00 0.00 43.42 39.78 3h43 n LEU 142 CO 0.43 -0.62 1.12 -0.89 -1.33 0.00 0.00 177.39 176.10 3h43 s THR 143 N -2.00 2.80 -0.13 -5.08 2.01 -1.26 -4.53 115.64 107.46 3h43 s THR 143 Ca 0.00 0.63 -0.29 0.00 0.31 0.00 0.00 61.69 62.34 3h43 s THR 143 Cb 0.00 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 3h43 s THR 143 CO 0.00 0.08 1.67 -0.69 -0.69 0.00 0.00 174.62 174.99 3h43 s VAL 144 N 0.48 3.60 -0.50 3.82 1.01 -0.03 -1.49 120.40 127.28 3h43 s VAL 144 Ca 0.63 0.70 0.07 0.00 0.00 0.00 0.00 61.98 63.38 3h43 s VAL 144 Cb -0.41 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 3h43 s VAL 144 CO 0.38 -0.15 0.42 1.33 0.00 0.00 0.00 175.10 177.07 3h43 n VAL 145 N 5.98 0.00 -3.52 2.92 0.24 -0.02 -1.34 118.33 122.59 3h43 n VAL 145 Ca 0.19 -0.38 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 3h43 n VAL 145 Cb 0.44 1.04 -0.04 0.00 -1.47 0.00 0.00 33.84 33.81 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 -1.38 -0.51 -0.17 -1.34 -1.08 -1.22 -4.84 116.67 106.13 3h43 s ASP 146 Ca 0.04 0.40 0.00 0.00 -0.52 0.00 0.00 52.55 52.48 3h43 s ASP 146 Cb 0.06 0.45 0.01 0.00 -1.46 0.00 0.00 42.92 41.97 3h43 s ASP 146 CO 0.23 -0.58 -0.17 -0.69 0.52 0.00 0.00 175.17 174.48 3h43 s VAL 147 N -1.86 2.41 0.44 1.11 1.01 -1.26 -0.86 120.40 121.40 3h43 s VAL 147 Ca -0.04 -0.84 -0.21 0.00 0.00 0.00 0.00 61.98 60.89 3h43 s VAL 147 Cb -0.00 -2.02 -0.10 0.00 0.00 0.00 0.00 36.38 34.26 3h43 s VAL 147 CO 0.01 0.52 1.00 -0.76 0.00 0.00 0.00 175.10 175.87 3h43 s LEU 148 N 1.07 3.96 0.34 3.92 1.43 -0.22 -5.00 118.68 124.18 3h43 s LEU 148 Ca -0.01 1.86 -0.28 0.00 -1.03 0.00 0.00 54.13 54.67 3h43 s LEU 148 Cb -0.14 -4.46 -0.10 0.00 0.03 0.00 0.00 46.19 41.52 3h43 s LEU 148 CO -0.05 -0.54 1.26 -2.16 0.23 0.00 0.00 176.35 175.08 3h43 s PRO 149 N -3.02 4.31 0.53 1.29 0.04 -1.26 -4.50 135.00 132.39 3h43 s PRO 149 Ca 0.63 2.10 -0.21 0.00 0.04 0.00 0.00 61.00 63.56 3h43 s PRO 149 Cb -0.15 -3.00 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 3h43 s PRO 149 CO 0.19 -0.18 1.26 -1.21 0.04 0.00 0.00 177.00 177.10 3h43 s GLU 150 N -1.86 3.27 0.00 4.56 2.02 -1.26 -4.97 118.70 120.47 3h43 s GLU 150 Ca 0.50 2.00 0.27 0.00 0.02 0.00 0.00 54.97 57.76 3h43 s GLU 150 Cb -0.37 -2.22 0.74 0.00 0.10 0.00 0.00 34.13 32.38 3h43 s GLU 150 CO 0.49 -1.01 1.57 1.28 0.02 0.00 0.00 175.26 177.61