#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h2v n MET 58 N 0.00 0.83 -0.03 -0.41 0.00 -1.26 -4.83 117.12 111.43 3h2v n MET 58 Ca 0.00 -2.57 0.02 0.00 0.00 0.00 0.00 57.70 55.15 3h2v n MET 58 Cb 0.00 0.17 0.03 0.00 0.00 0.00 0.00 33.22 33.42 3h2v n MET 58 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 3h2v n ARG 59 N -1.60 2.76 -3.89 2.12 1.85 -1.26 -4.19 116.66 112.45 3h2v n ARG 59 Ca 0.02 -1.69 -0.36 0.00 -1.00 0.00 0.00 57.85 54.81 3h2v n ARG 59 Cb 0.47 -1.09 -0.07 0.00 -1.05 0.00 0.00 32.46 30.72 3h2v n ARG 59 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3h2v s LYS 60 N -1.27 3.55 0.12 2.89 1.02 -1.26 0.32 119.74 125.11 3h2v s LYS 60 Ca 0.06 -0.17 0.05 0.00 0.02 0.00 0.00 55.97 55.93 3h2v s LYS 60 Cb 0.05 -3.20 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 3h2v s LYS 60 CO 0.02 0.68 -0.11 0.96 -0.92 0.00 0.00 175.35 175.97 3h2v s ILE 61 N -0.73 1.12 -0.08 2.17 -4.36 -0.76 -2.25 121.20 116.30 3h2v s ILE 61 Ca 0.13 -1.75 0.03 0.00 -0.26 0.00 0.00 60.65 58.80 3h2v s ILE 61 Cb -0.12 -1.51 0.01 0.00 1.25 0.00 0.00 42.46 42.09 3h2v s ILE 61 CO 0.03 -0.55 -0.16 -0.22 0.24 0.00 0.00 174.94 174.28 3h2v s LEU 62 N -2.59 1.78 -0.16 0.37 2.96 0.10 -2.15 118.68 118.99 3h2v s LEU 62 Ca 0.09 -0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 53.50 3h2v s LEU 62 Cb -0.02 -1.03 -0.05 0.00 0.50 0.00 0.00 46.19 45.59 3h2v s LEU 62 CO 0.01 0.06 0.19 -0.63 -1.32 0.00 0.00 176.35 174.66 3h2v s ILE 63 N 0.63 5.39 0.09 6.68 1.01 -0.27 -2.51 121.20 132.21 3h2v s ILE 63 Ca -0.14 0.32 0.08 0.00 0.00 0.00 0.00 60.65 60.91 3h2v s ILE 63 Cb -0.16 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 3h2v s ILE 63 CO 0.04 0.48 -0.22 -0.13 0.00 0.00 0.00 174.94 175.12 3h2v s ARG 64 N -0.06 1.26 0.00 2.79 0.52 -0.36 -1.46 118.95 121.64 3h2v s ARG 64 Ca 0.13 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.22 3h2v s ARG 64 Cb -0.12 -1.50 0.00 0.00 0.52 0.00 0.00 34.95 33.85 3h2v s ARG 64 CO 0.02 0.36 0.00 0.41 0.02 0.00 0.00 175.30 176.11 3h2v n GLY 65 N 1.31 0.82 3.74 -3.53 0.00 -1.01 -1.25 105.19 105.28 3h2v n GLY 65 Ca -0.19 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 3h2v n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h2v s LEU 66 N 0.00 3.40 0.80 0.99 1.43 -0.50 -4.61 118.68 120.19 3h2v s LEU 66 Ca 0.00 2.24 -0.14 0.00 -1.03 0.00 0.00 54.13 55.20 3h2v s LEU 66 Cb 0.00 -4.58 0.04 0.00 0.03 0.00 0.00 46.19 41.68 3h2v s LEU 66 CO 0.00 -1.94 0.86 -2.65 0.23 0.00 0.00 176.35 172.85 3h2v n PRO 67 N -2.42 0.16 -0.17 1.29 -0.02 -1.26 -4.60 135.00 127.97 3h2v n PRO 67 Ca 0.12 0.11 -0.10 0.00 -2.02 0.00 0.00 63.50 61.62 3h2v n PRO 67 Cb 0.51 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3h2v n PRO 67 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3h2v h GLY 68 N -0.82 0.94 -3.10 -1.23 0.00 -1.94 -2.90 103.07 94.02 3h2v h GLY 68 Ca -0.46 -0.68 -0.28 0.00 0.00 0.00 0.00 47.33 45.91 3h2v h GLY 68 CO 0.43 0.63 0.35 2.09 0.00 0.00 0.00 176.54 180.04 3h2v n ASP 69 N -4.34 3.45 -4.77 0.19 5.75 -1.26 -4.88 116.55 110.69 3h2v n ASP 69 Ca 0.01 -2.89 -0.38 0.00 -0.01 0.00 0.00 54.79 51.51 3h2v n ASP 69 Cb 0.31 -0.69 -0.01 0.00 -1.03 0.00 0.00 41.12 39.70 3h2v n ASP 69 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h2v s VAL 70 N -1.89 2.97 0.31 2.12 0.11 -1.10 -5.06 120.40 117.87 3h2v s VAL 70 Ca 0.32 0.79 0.09 0.00 -2.93 0.00 0.00 61.98 60.26 3h2v s VAL 70 Cb 0.27 -3.43 -0.05 0.00 -1.53 0.00 0.00 36.38 31.64 3h2v s VAL 70 CO 0.06 0.05 0.03 0.42 -3.33 0.00 0.00 175.10 172.33 3h2v s THR 71 N -1.42 2.96 0.17 5.04 -4.23 -1.26 -4.95 115.64 111.95 3h2v s THR 71 Ca 0.60 -1.91 -0.14 0.00 -1.18 0.00 0.00 61.69 59.06 3h2v s THR 71 Cb -0.32 -2.82 0.06 0.00 1.34 0.00 0.00 72.50 70.75 3h2v s THR 71 CO 0.40 -0.26 1.79 0.78 -0.54 0.00 0.00 174.62 176.79 3h2v h ASN 72 N 1.80 0.64 -0.59 3.99 2.35 -1.97 -2.33 115.58 119.46 3h2v h ASN 72 Ca -0.43 -0.07 0.11 0.00 -0.55 0.00 0.00 56.30 55.35 3h2v h ASN 72 Cb 1.25 -0.16 -0.11 0.00 0.05 0.00 0.00 38.32 39.34 3h2v h ASN 72 CO 0.64 0.52 -0.32 -0.61 -1.65 0.00 0.00 177.43 176.01 3h2v h GLN 73 N 0.70 -0.14 -0.40 0.81 5.75 -1.98 0.49 115.11 120.34 3h2v h GLN 73 Ca 0.19 0.01 0.11 0.00 -0.15 0.00 0.00 58.65 58.81 3h2v h GLN 73 Cb 0.01 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 3h2v h GLN 73 CO -0.03 -0.10 0.36 0.93 -2.65 0.00 0.00 178.83 177.34 3h2v h GLU 74 N -0.15 0.00 0.17 1.69 5.08 -1.83 0.14 114.58 119.68 3h2v h GLU 74 Ca 0.24 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.30 3h2v h GLU 74 Cb 0.55 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.83 3h2v h GLU 74 CO -0.68 0.00 -1.26 0.28 -1.00 0.00 0.00 179.01 176.35 3h2v h VAL 75 N 0.00 1.31 -0.21 3.13 2.07 0.07 -2.06 116.25 120.57 3h2v h VAL 75 Ca 0.19 -2.54 -0.06 0.00 0.82 0.00 0.00 66.70 65.11 3h2v h VAL 75 Cb 0.90 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 33.53 3h2v h VAL 75 CO -0.00 0.76 -0.15 0.45 0.02 0.00 0.00 177.57 178.65 3h2v h HIS 76 N 0.14 0.37 0.00 1.57 3.86 -0.20 -1.70 115.15 119.19 3h2v h HIS 76 Ca -0.21 -0.05 -0.22 0.00 -1.16 0.00 0.00 60.37 58.74 3h2v h HIS 76 Cb 1.96 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 30.33 3h2v h HIS 76 CO 0.13 0.49 -0.93 -0.44 0.86 0.00 0.00 177.93 178.04 3h2v h ASP 77 N 0.32 0.44 0.90 2.45 3.32 -0.84 -2.29 116.42 120.73 3h2v h ASP 77 Ca 0.06 -0.36 -0.04 0.00 0.02 0.00 0.00 57.03 56.71 3h2v h ASP 77 Cb 0.46 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 39.88 3h2v h ASP 77 CO 0.03 1.16 -0.45 0.25 -1.72 0.00 0.00 179.24 178.50 3h2v h LEU 78 N 0.19 -1.09 -4.58 1.55 5.85 -1.08 -3.07 115.31 113.08 3h2v h LEU 78 Ca -0.07 0.04 -0.61 0.00 0.84 0.00 0.00 57.88 58.09 3h2v h LEU 78 Cb 1.56 0.29 -0.22 0.00 0.37 0.00 0.00 40.66 42.66 3h2v h LEU 78 CO 0.15 -0.76 0.70 0.18 -0.34 0.00 0.00 178.44 178.38 3h2v n LEU 79 N -5.63 7.00 0.06 2.25 4.77 -0.66 -4.58 117.00 120.21 3h2v n LEU 79 Ca -0.16 -4.32 0.10 0.00 -0.03 0.00 0.00 56.01 51.59 3h2v n LEU 79 Cb 0.50 -1.13 0.40 0.00 -2.33 0.00 0.00 43.42 40.86 3h2v n LEU 79 CO 0.39 1.68 0.80 -1.54 -1.33 0.00 0.00 177.39 177.39 3h2v n SER 80 N 0.12 0.33 -0.72 -1.43 3.41 -0.86 -2.41 113.62 112.05 3h2v n SER 80 Ca 0.51 0.58 0.10 0.00 -0.26 0.00 0.00 58.87 59.80 3h2v n SER 80 Cb 0.44 -0.65 0.31 0.00 -0.26 0.00 0.00 64.21 64.05 3h2v n SER 80 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3h2v n ASP 81 N -1.86 2.14 -4.28 4.04 10.43 -1.26 -4.93 116.55 120.83 3h2v n ASP 81 Ca 0.03 -1.82 -0.15 0.00 2.57 0.00 0.00 54.79 55.42 3h2v n ASP 81 Cb 0.21 -0.16 -0.10 0.00 1.84 0.00 0.00 41.12 42.90 3h2v n ASP 81 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 3h2v s TYR 82 N -1.67 1.36 -0.44 1.24 2.02 -1.01 -5.11 117.35 113.73 3h2v s TYR 82 Ca 0.33 -1.05 -0.16 0.00 -0.37 0.00 0.00 57.07 55.82 3h2v s TYR 82 Cb 0.18 -0.78 0.04 0.00 -0.40 0.00 0.00 41.96 41.00 3h2v s TYR 82 CO 0.26 -0.23 0.38 -2.00 -1.57 0.00 0.00 175.55 172.39 3h2v s GLU 83 N -3.94 3.00 -0.22 -0.62 2.12 -1.26 -5.02 118.70 112.76 3h2v s GLU 83 Ca 0.29 -1.10 -0.27 0.00 0.36 0.00 0.00 54.97 54.25 3h2v s GLU 83 Cb 0.07 -4.04 -0.00 0.00 0.26 0.00 0.00 34.13 30.41 3h2v s GLU 83 CO 0.08 -0.90 0.91 -0.51 -0.54 0.00 0.00 175.26 174.30 3h2v s LEU 84 N 1.79 4.11 0.09 2.70 1.43 -1.26 -2.86 118.68 124.69 3h2v s LEU 84 Ca 0.06 1.21 0.21 0.00 -1.03 0.00 0.00 54.13 54.58 3h2v s LEU 84 Cb -0.21 -3.34 -0.12 0.00 0.03 0.00 0.00 46.19 42.55 3h2v s LEU 84 CO 0.09 -0.54 0.81 0.29 0.23 0.00 0.00 176.35 177.23 3h2v n LYS 85 N 5.91 0.63 -3.72 1.70 4.76 1.00 -4.92 118.16 123.52 3h2v n LYS 85 Ca 0.08 0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.46 3h2v n LYS 85 Cb 0.47 -1.74 -0.10 0.00 -1.84 0.00 0.00 35.03 31.83 3h2v n LYS 85 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3h2v s TYR 86 N -3.24 -0.48 -0.20 2.13 5.04 -0.99 -4.92 117.35 114.70 3h2v s TYR 86 Ca -0.03 1.16 -0.04 0.00 -2.44 0.00 0.00 57.07 55.71 3h2v s TYR 86 Cb 0.10 0.17 0.10 0.00 0.35 0.00 0.00 41.96 42.68 3h2v s TYR 86 CO 0.82 -0.24 0.33 0.00 -1.34 0.00 0.00 175.55 175.12 3h2v s PHE 88 N 2.49 1.68 -0.20 0.00 2.19 -0.32 -4.97 117.98 118.85 3h2v s PHE 88 Ca 0.07 -1.08 -0.09 0.00 0.33 0.00 0.00 56.93 56.16 3h2v s PHE 88 Cb -0.14 -1.30 -0.05 0.00 -1.31 0.00 0.00 43.02 40.22 3h2v s PHE 88 CO -0.13 -0.62 0.10 0.08 1.83 0.00 0.00 175.22 176.48 3h2v s VAL 89 N 1.64 5.08 -0.52 3.12 1.01 -1.26 0.09 120.40 129.56 3h2v s VAL 89 Ca 0.00 0.07 -0.15 0.00 0.00 0.00 0.00 61.98 61.91 3h2v s VAL 89 Cb -0.15 -3.31 0.12 0.00 0.00 0.00 0.00 36.38 33.03 3h2v s VAL 89 CO -0.08 0.44 0.46 -0.62 0.00 0.00 0.00 175.10 175.30 3h2v s ASP 90 N 0.48 6.11 0.38 3.32 3.68 0.80 -4.92 116.67 126.52 3h2v s ASP 90 Ca 0.06 -1.73 0.13 0.00 2.13 0.00 0.00 52.55 53.13 3h2v s ASP 90 Cb -0.12 -2.18 0.76 0.00 -1.45 0.00 0.00 42.92 39.93 3h2v s ASP 90 CO -0.00 -0.80 1.85 0.11 0.13 0.00 0.00 175.17 176.45 3h2v h LYS 91 N 8.80 0.00 0.00 4.34 1.57 -1.91 0.19 116.57 129.57 3h2v h LYS 91 Ca -0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.48 3h2v h LYS 91 Cb 1.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.40 3h2v h LYS 91 CO 0.99 0.35 -0.09 -0.92 -0.57 0.00 0.00 179.45 179.21 3h2v h TYR 92 N 0.00 0.00 -0.00 -1.35 3.20 -1.91 -3.27 116.97 113.63 3h2v h TYR 92 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3h2v h TYR 92 Cb 0.62 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.89 3h2v h TYR 92 CO 0.00 0.09 -0.07 1.63 -1.64 0.00 0.00 178.16 178.17 3h2v n LYS 93 N -3.19 1.63 -3.23 1.82 4.76 -1.00 -5.01 118.16 113.95 3h2v n LYS 93 Ca 0.01 -0.55 -0.23 0.00 -2.87 0.00 0.00 58.31 54.67 3h2v n LYS 93 Cb 0.40 -0.98 0.04 0.00 -1.84 0.00 0.00 35.03 32.66 3h2v n LYS 93 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h2v n GLY 94 N 0.57 -0.52 3.11 0.72 0.00 0.65 -4.73 105.19 104.99 3h2v n GLY 94 Ca 0.02 0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 3h2v n GLY 94 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h2v s THR 95 N -3.18 1.31 0.16 2.61 -4.23 -1.15 -1.42 115.64 109.74 3h2v s THR 95 Ca 0.39 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 60.33 3h2v s THR 95 Cb -0.18 -1.13 -0.04 0.00 1.34 0.00 0.00 72.50 72.49 3h2v s THR 95 CO 0.49 0.38 -0.07 0.00 -0.54 0.00 0.00 174.62 174.87 3h2v s ALA 96 N 0.03 3.01 -0.31 3.99 0.00 -0.53 -0.14 121.76 127.80 3h2v s ALA 96 Ca -0.03 -1.39 0.02 0.00 0.00 0.00 0.00 51.96 50.56 3h2v s ALA 96 Cb -0.11 -0.84 0.09 0.00 0.00 0.00 0.00 23.12 22.27 3h2v s ALA 96 CO 0.02 0.52 0.05 -0.06 0.00 0.00 0.00 175.76 176.28 3h2v s PHE 97 N -1.58 2.79 0.15 0.00 0.40 0.11 -1.12 117.98 118.74 3h2v s PHE 97 Ca 0.24 -2.34 0.05 0.00 -0.60 0.00 0.00 56.93 54.28 3h2v s PHE 97 Cb -0.09 -2.26 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 3h2v s PHE 97 CO 0.16 -0.90 0.14 0.08 0.70 0.00 0.00 175.22 175.40 3h2v s VAL 98 N 1.24 4.56 -0.12 -0.44 1.01 -0.91 -1.18 120.40 124.56 3h2v s VAL 98 Ca 0.08 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.05 3h2v s VAL 98 Cb -0.18 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.91 3h2v s VAL 98 CO -0.14 -0.07 -0.09 -0.89 0.00 0.00 0.00 175.10 173.91 3h2v s THR 99 N -1.70 1.14 0.45 3.92 2.01 0.35 -1.84 115.64 119.97 3h2v s THR 99 Ca 0.31 -0.38 0.08 0.00 0.31 0.00 0.00 61.69 62.01 3h2v s THR 99 Cb -0.10 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 71.28 3h2v s THR 99 CO 0.24 0.37 0.61 -0.76 -0.69 0.00 0.00 174.62 174.40 3h2v s LEU 100 N 1.66 3.56 0.23 4.42 1.43 0.15 -0.00 118.68 130.13 3h2v s LEU 100 Ca 0.05 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 52.64 3h2v s LEU 100 Cb -0.13 -2.53 0.39 0.00 0.03 0.00 0.00 46.19 43.95 3h2v s LEU 100 CO -0.09 -0.87 1.75 0.25 0.23 0.00 0.00 176.35 177.63 3h2v h LEU 101 N 0.54 0.35 0.00 1.79 5.85 -1.81 -3.44 115.31 118.59 3h2v h LEU 101 Ca -0.39 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.45 3h2v h LEU 101 Cb 1.28 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.35 3h2v h LEU 101 CO 0.45 0.17 0.25 -0.46 -0.34 0.00 0.00 178.44 178.51 3h2v n ASN 102 N -4.94 -1.25 -0.38 1.25 0.23 -1.26 -5.03 115.26 103.88 3h2v n ASN 102 Ca 0.12 -1.79 -0.02 0.00 -0.53 0.00 0.00 54.58 52.36 3h2v n ASN 102 Cb 0.34 2.07 0.11 0.00 -2.08 0.00 0.00 39.78 40.22 3h2v n ASN 102 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3h2v h GLY 103 N 1.20 1.41 0.81 4.83 0.00 -1.88 -2.05 103.07 107.39 3h2v h GLY 103 Ca -0.19 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 3h2v h GLY 103 CO 0.24 0.51 0.02 -2.09 0.00 0.00 0.00 176.54 175.23 3h2v h GLU 104 N 1.35 0.20 -0.41 4.80 4.57 -1.97 -1.99 114.58 121.14 3h2v h GLU 104 Ca 0.37 -0.05 0.07 0.00 -1.18 0.00 0.00 59.36 58.57 3h2v h GLU 104 Cb -0.15 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.36 3h2v h GLU 104 CO -0.08 0.39 0.04 1.96 -1.18 0.00 0.00 179.01 180.13 3h2v h GLN 105 N -0.02 0.14 0.00 1.92 4.20 -1.91 -0.34 115.11 119.11 3h2v h GLN 105 Ca 0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 3h2v h GLN 105 Cb 0.28 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 3h2v h GLN 105 CO 0.00 0.10 -0.06 0.00 -0.67 0.00 0.00 178.83 178.20 3h2v h ALA 106 N 1.34 1.63 0.09 3.87 0.00 -1.29 -1.09 119.26 123.80 3h2v h ALA 106 Ca 0.20 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h2v h ALA 106 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3h2v h ALA 106 CO -0.30 0.08 -0.04 1.49 0.00 0.00 0.00 179.25 180.47 3h2v h GLU 107 N 0.00 -0.11 -0.98 0.00 4.57 -0.32 -2.24 114.58 115.50 3h2v h GLU 107 Ca -0.00 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.20 3h2v h GLU 107 Cb 0.13 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.70 3h2v h GLU 107 CO 0.01 0.43 0.65 0.00 -1.18 0.00 0.00 179.01 178.91 3h2v h ALA 108 N -0.11 1.24 -0.54 2.92 0.00 -1.10 0.13 119.26 121.80 3h2v h ALA 108 Ca -0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3h2v h ALA 108 Cb 0.59 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3h2v h ALA 108 CO 0.02 0.63 0.26 0.00 0.00 0.00 0.00 179.25 180.15 3h2v h ALA 109 N 1.36 0.70 -0.39 0.00 0.00 -1.29 0.25 119.26 119.89 3h2v h ALA 109 Ca 0.36 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 3h2v h ALA 109 Cb -0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3h2v h ALA 109 CO -0.08 0.27 0.05 0.82 0.00 0.00 0.00 179.25 180.31 3h2v h ILE 110 N 0.73 1.25 -0.19 0.00 2.04 -0.67 -0.98 117.51 119.69 3h2v h ILE 110 Ca 0.19 -0.90 -0.12 0.00 1.00 0.00 0.00 64.86 65.02 3h2v h ILE 110 Cb 0.13 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3h2v h ILE 110 CO -0.02 0.31 -0.41 0.78 0.00 0.00 0.00 178.15 178.80 3h2v h ASN 111 N 0.50 0.46 0.28 1.72 2.35 -0.49 0.08 115.58 120.48 3h2v h ASN 111 Ca 0.12 -0.20 -0.19 0.00 -0.55 0.00 0.00 56.30 55.48 3h2v h ASN 111 Cb 0.40 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.64 3h2v h ASN 111 CO 0.01 0.82 -0.76 0.00 -1.65 0.00 0.00 177.43 175.85 3h2v h ALA 112 N 1.20 0.57 -0.00 -0.83 0.00 -0.42 -3.38 119.26 116.40 3h2v h ALA 112 Ca 0.03 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.32 3h2v h ALA 112 Cb 0.88 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3h2v h ALA 112 CO 0.07 0.77 -0.04 1.19 0.00 0.00 0.00 179.25 181.24 3h2v n PHE 113 N -3.82 0.00 -2.57 0.00 3.72 -0.38 -4.79 117.46 109.61 3h2v n PHE 113 Ca -0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.93 3h2v n PHE 113 Cb 0.72 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.24 3h2v n PHE 113 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3h2v s HIS 114 N -0.60 2.98 0.00 1.38 2.46 0.01 -3.65 115.29 117.87 3h2v s HIS 114 Ca 0.04 1.05 0.00 0.00 0.47 0.00 0.00 55.06 56.62 3h2v s HIS 114 Cb 0.03 -3.84 0.00 0.00 -0.13 0.00 0.00 32.58 28.64 3h2v s HIS 114 CO 0.08 -1.09 0.00 1.04 -2.47 0.00 0.00 174.74 172.29 3h2v n GLN 115 N 7.11 0.00 -2.16 2.88 6.02 0.47 -4.89 117.38 126.81 3h2v n GLN 115 Ca 0.13 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.85 3h2v n GLN 115 Cb 0.47 -1.59 0.10 0.00 1.02 0.00 0.00 30.24 30.23 3h2v n GLN 115 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3h2v s SER 116 N -2.11 4.41 -0.13 1.08 1.04 -1.24 -4.58 113.70 112.17 3h2v s SER 116 Ca 0.00 0.36 -0.02 0.00 0.48 0.00 0.00 55.95 56.77 3h2v s SER 116 Cb 0.00 -0.85 -0.03 0.00 0.10 0.00 0.00 66.02 65.24 3h2v s SER 116 CO 0.00 -1.87 -0.05 -0.13 0.98 0.00 0.00 173.24 172.16 3h2v s ARG 117 N -5.39 3.39 -0.21 4.02 1.81 -1.26 0.72 118.95 122.03 3h2v s ARG 117 Ca 0.64 -0.54 0.01 0.00 -1.72 0.00 0.00 55.73 54.11 3h2v s ARG 117 Cb -0.09 -2.80 0.03 0.00 -0.45 0.00 0.00 34.95 31.64 3h2v s ARG 117 CO 0.47 0.36 -0.15 -1.17 -0.68 0.00 0.00 175.30 174.13 3h2v s LEU 118 N 0.02 2.60 -1.54 2.53 2.96 0.76 -4.69 118.68 121.32 3h2v s LEU 118 Ca -0.00 -0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 53.07 3h2v s LEU 118 Cb -0.13 -1.54 0.02 0.00 0.50 0.00 0.00 46.19 45.04 3h2v s LEU 118 CO 0.03 -0.06 0.18 0.54 -1.32 0.00 0.00 176.35 175.72 3h2v n ARG 119 N 4.60 -1.62 -0.81 1.98 1.74 -1.26 -0.56 116.66 120.72 3h2v n ARG 119 Ca -0.19 0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3h2v n ARG 119 Cb 0.48 -3.97 0.00 0.00 -1.02 0.00 0.00 32.46 27.95 3h2v n ARG 119 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3h2v n GLU 120 N -4.49 0.00 -5.08 5.56 -0.58 -1.26 -5.03 120.64 109.75 3h2v n GLU 120 Ca -0.28 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.14 3h2v n GLU 120 Cb 0.67 -2.35 -0.16 0.00 -0.57 0.00 0.00 31.44 29.03 3h2v n GLU 120 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3h2v s ARG 121 N -0.19 3.01 -0.06 3.49 1.81 0.27 -5.06 118.95 122.23 3h2v s ARG 121 Ca 0.00 -0.82 -0.30 0.00 -1.72 0.00 0.00 55.73 52.90 3h2v s ARG 121 Cb 0.00 -2.37 -0.02 0.00 -0.45 0.00 0.00 34.95 32.10 3h2v s ARG 121 CO 0.00 0.26 1.03 -2.00 -0.68 0.00 0.00 175.30 173.91 3h2v s GLU 122 N 0.17 4.46 0.05 3.54 2.12 -1.26 -0.17 118.70 127.61 3h2v s GLU 122 Ca -0.11 1.46 -0.02 0.00 0.36 0.00 0.00 54.97 56.66 3h2v s GLU 122 Cb -0.16 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 3h2v s GLU 122 CO 0.06 -0.24 0.23 -0.51 -0.54 0.00 0.00 175.26 174.26 3h2v s LEU 123 N 1.65 4.35 -0.34 2.70 1.43 0.22 -4.65 118.68 124.05 3h2v s LEU 123 Ca 0.51 0.34 0.04 0.00 -1.03 0.00 0.00 54.13 53.99 3h2v s LEU 123 Cb -0.21 -2.91 0.10 0.00 0.03 0.00 0.00 46.19 43.20 3h2v s LEU 123 CO 0.22 0.18 0.06 -0.94 0.23 0.00 0.00 176.35 176.10 3h2v s SER 124 N -2.33 4.72 -0.18 2.29 1.04 -0.38 0.18 113.70 119.04 3h2v s SER 124 Ca 0.34 -2.16 -0.11 0.00 0.48 0.00 0.00 55.95 54.49 3h2v s SER 124 Cb -0.13 -1.60 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 3h2v s SER 124 CO 0.25 -0.38 0.19 -0.69 0.98 0.00 0.00 173.24 173.59 3h2v s VAL 125 N 0.89 5.38 0.22 5.02 1.01 -1.26 -1.22 120.40 130.44 3h2v s VAL 125 Ca 0.11 0.31 -0.20 0.00 0.00 0.00 0.00 61.98 62.20 3h2v s VAL 125 Cb -0.19 -3.52 0.04 0.00 0.00 0.00 0.00 36.38 32.70 3h2v s VAL 125 CO -0.08 0.43 0.61 0.00 0.00 0.00 0.00 175.10 176.06 3h2v s GLN 126 N 0.34 1.50 0.11 2.72 -2.07 -1.04 -4.56 119.66 116.66 3h2v s GLN 126 Ca 0.11 -0.81 -0.31 0.00 -1.82 0.00 0.00 55.36 52.53 3h2v s GLN 126 Cb -0.12 0.57 -0.09 0.00 -1.09 0.00 0.00 33.01 32.29 3h2v s GLN 126 CO 0.00 -0.66 1.59 -0.51 -1.32 0.00 0.00 175.29 174.39 3h2v s LEU 127 N -2.86 4.37 -0.38 2.60 1.43 -1.26 0.01 118.68 122.59 3h2v s LEU 127 Ca 0.08 2.52 -0.41 0.00 -1.03 0.00 0.00 54.13 55.29 3h2v s LEU 127 Cb -0.03 -3.58 -0.16 0.00 0.03 0.00 0.00 46.19 42.46 3h2v s LEU 127 CO -0.02 -0.84 1.95 1.67 0.23 0.00 0.00 176.35 179.34 3h2v n GLN 128 N 4.79 0.72 -1.34 1.70 7.27 -0.96 -4.64 117.38 124.92 3h2v n GLN 128 Ca 0.15 0.23 -0.58 0.00 0.07 0.00 0.00 57.00 56.87 3h2v n GLN 128 Cb 0.40 -1.99 -0.11 0.00 2.41 0.00 0.00 30.24 30.95 3h2v n GLN 128 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 3h2v n PRO 129 N 6.53 0.30 0.00 3.69 -0.04 -1.26 -4.96 135.00 139.26 3h2v n PRO 129 Ca 0.38 0.09 0.06 0.00 -0.04 0.00 0.00 63.50 63.99 3h2v n PRO 129 Cb 0.09 -1.76 0.05 0.00 -0.04 0.00 0.00 33.50 31.85 3h2v n PRO 129 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87