#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dge s THR 72 N 0.00 3.98 0.19 5.09 -4.23 -1.26 -4.96 115.64 114.45 2dge s THR 72 Ca 0.00 0.20 -0.12 0.00 -1.18 0.00 0.00 61.69 60.60 2dge s THR 72 Cb 0.00 -3.58 0.12 0.00 1.34 0.00 0.00 72.50 70.38 2dge s THR 72 CO 0.00 -0.63 1.85 -0.07 -0.54 0.00 0.00 174.62 175.22 2dge h LEU 73 N -0.19 0.79 -1.10 4.79 3.38 -2.05 -2.45 115.31 118.48 2dge h LEU 73 Ca -0.45 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 57.52 2dge h LEU 73 Cb 1.24 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 2dge h LEU 73 CO 0.61 0.60 0.61 0.44 0.09 0.00 0.00 178.44 180.79 2dge h ASP 74 N 0.91 0.99 0.10 -0.43 3.45 -1.99 0.58 116.42 120.03 2dge h ASP 74 Ca 0.24 -0.01 -0.15 0.00 0.43 0.00 0.00 57.03 57.55 2dge h ASP 74 Cb -0.06 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 38.48 2dge h ASP 74 CO -0.05 0.67 -0.53 0.40 -1.57 0.00 0.00 179.24 178.16 2dge h ILE 75 N 1.15 1.33 -0.70 0.35 1.08 -1.87 -1.10 117.51 117.74 2dge h ILE 75 Ca 0.38 -1.78 -0.03 0.00 -0.39 0.00 0.00 64.86 63.04 2dge h ILE 75 Cb 0.06 1.78 -0.03 0.00 -3.07 0.00 0.00 36.82 35.56 2dge h ILE 75 CO -0.12 0.55 0.32 1.56 -0.69 0.00 0.00 178.15 179.76 2dge h GLN 76 N 0.36 1.02 -0.53 2.37 4.20 -0.89 -0.93 115.11 120.71 2dge h GLN 76 Ca 0.01 -0.16 -0.11 0.00 0.06 0.00 0.00 58.65 58.45 2dge h GLN 76 Cb 1.04 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 2dge h GLN 76 CO 0.09 0.82 -0.11 0.00 -0.67 0.00 0.00 178.83 178.96 2dge h ARG 77 N 0.98 1.01 -0.57 1.46 3.08 -0.75 -2.43 114.38 117.16 2dge h ARG 77 Ca 0.24 -0.38 -0.11 0.00 0.07 0.00 0.00 59.98 59.80 2dge h ARG 77 Cb 0.15 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2dge h ARG 77 CO -0.03 1.06 -0.06 0.78 -1.07 0.00 0.00 179.97 180.65 2dge h GLY 78 N 0.88 1.13 1.01 0.04 0.00 -1.05 -2.72 103.07 102.37 2dge h GLY 78 Ca 0.14 -0.88 -0.02 0.00 0.00 0.00 0.00 47.33 46.57 2dge h GLY 78 CO 0.05 0.80 0.40 0.00 0.00 0.00 0.00 176.54 177.79 2dge h ALA 79 N 0.97 0.96 -0.59 3.60 0.00 -0.97 0.53 119.26 123.75 2dge h ALA 79 Ca 0.15 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2dge h ALA 79 Cb 0.63 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2dge h ALA 79 CO 0.04 0.48 0.34 1.15 0.00 0.00 0.00 179.25 181.26 2dge h THR 80 N 1.03 1.02 -0.38 0.00 2.02 -1.28 -0.48 112.91 114.85 2dge h THR 80 Ca 0.26 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 67.10 2dge h THR 80 Cb 0.05 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2dge h THR 80 CO -0.04 0.12 -0.20 -0.07 0.37 0.00 0.00 175.52 175.70 2dge h LEU 81 N 0.67 0.84 -0.56 2.58 3.38 -1.17 -3.00 115.31 118.05 2dge h LEU 81 Ca 0.25 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2dge h LEU 81 Cb 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2dge h LEU 81 CO -0.13 1.07 0.19 0.15 0.09 0.00 0.00 178.44 179.81 2dge h PHE 82 N 0.61 0.89 0.00 1.13 3.57 -0.49 -0.22 116.94 122.43 2dge h PHE 82 Ca 0.08 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2dge h PHE 82 Cb 0.76 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 2dge h PHE 82 CO 0.06 0.74 -0.08 -0.91 -2.23 0.00 0.00 178.31 175.89 2dge h ASN 83 N 0.78 0.00 0.01 0.41 -0.26 -1.12 -0.33 115.58 115.07 2dge h ASN 83 Ca 0.18 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.80 2dge h ASN 83 Cb 0.26 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 2dge h ASN 83 CO -0.01 0.08 -0.68 0.03 -1.06 0.00 0.00 177.43 175.79 2dge h ARG 84 N 0.00 0.02 0.00 0.81 3.08 -1.27 -3.42 114.38 113.60 2dge h ARG 84 Ca -0.00 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 2dge h ARG 84 Cb 0.34 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2dge h ARG 84 CO 0.01 1.01 -2.04 0.00 -1.07 0.00 0.00 179.97 177.88 2dge n ALA 85 N -3.01 2.62 -0.01 0.04 0.00 -0.15 -4.62 120.51 115.37 2dge n ALA 85 Ca -0.21 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.60 2dge n ALA 85 Cb 0.60 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2dge n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dge h ILE 87 N 0.01 0.00 -0.50 0.00 6.09 -1.76 -0.97 117.51 120.38 2dge h ILE 87 Ca 0.00 -0.31 0.00 0.00 -1.37 0.00 0.00 64.86 63.18 2dge h ILE 87 Cb 0.01 1.13 -0.02 0.00 0.47 0.00 0.00 36.82 38.41 2dge h ILE 87 CO 0.00 0.00 0.33 1.23 -3.07 0.00 0.00 178.15 176.64 2dge h GLY 88 N 2.07 0.70 0.00 8.18 0.00 -1.90 -3.29 103.07 108.84 2dge h GLY 88 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2dge h GLY 88 CO 0.00 0.26 -0.73 0.00 0.00 0.00 0.00 176.54 176.07 2dge n HIS 90 N -1.25 0.00 -1.65 0.00 8.25 -0.39 -1.63 115.22 118.55 2dge n HIS 90 Ca 0.00 -1.31 -0.46 0.00 -0.26 0.00 0.00 57.72 55.69 2dge n HIS 90 Cb 0.11 -0.21 -0.03 0.00 1.12 0.00 0.00 29.99 30.98 2dge n HIS 90 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2dge n ASP 91 N -1.24 2.53 -1.88 0.41 2.03 -1.24 -1.16 116.55 116.00 2dge n ASP 91 Ca 0.18 1.13 -0.21 0.00 0.52 0.00 0.00 54.79 56.42 2dge n ASP 91 Cb 0.67 -1.39 -0.06 0.00 -0.72 0.00 0.00 41.12 39.63 2dge n ASP 91 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2dge n THR 92 N 2.05 -0.35 -0.84 5.18 5.66 -1.26 -2.20 114.28 122.53 2dge n THR 92 Ca 0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.13 2dge n THR 92 Cb 0.30 -2.31 0.00 0.00 -1.55 0.00 0.00 70.33 66.76 2dge n THR 92 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2dge n GLY 93 N -0.61 0.71 0.00 1.09 0.00 -0.31 -4.98 105.19 101.10 2dge n GLY 93 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2dge n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dge n GLY 94 N -2.51 -0.02 3.01 -0.02 0.00 -0.94 -0.34 105.19 104.39 2dge n GLY 94 Ca 0.00 -1.75 -0.03 0.00 0.00 0.00 0.00 46.02 44.24 2dge n GLY 94 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dge s ASN 95 N -1.00 -0.46 0.30 1.61 3.84 -1.24 -4.10 114.94 113.90 2dge s ASN 95 Ca 0.00 0.26 0.26 0.00 0.21 0.00 0.00 52.86 53.59 2dge s ASN 95 Cb 0.00 1.55 0.77 0.00 -0.55 0.00 0.00 41.25 43.01 2dge s ASN 95 CO 0.00 -0.30 1.74 0.16 -2.79 0.00 0.00 177.10 175.91 2dge h ILE 96 N 6.10 0.00 0.04 -5.21 3.07 -1.65 -3.35 117.51 116.51 2dge h ILE 96 Ca -0.15 -0.57 -0.10 0.00 1.55 0.00 0.00 64.86 65.58 2dge h ILE 96 Cb 1.15 1.53 0.01 0.00 -0.27 0.00 0.00 36.82 39.24 2dge h ILE 96 CO 0.25 0.00 -0.43 0.40 -1.05 0.00 0.00 178.15 177.32 2dge h ILE 97 N 0.00 1.57 -3.10 0.16 1.08 -1.95 -3.47 117.51 111.79 2dge h ILE 97 Ca 0.00 -2.22 -0.09 0.00 -0.39 0.00 0.00 64.86 62.16 2dge h ILE 97 Cb 0.73 2.99 -0.18 0.00 -3.07 0.00 0.00 36.82 37.29 2dge h ILE 97 CO 0.00 0.61 -0.20 0.00 -0.69 0.00 0.00 178.15 177.88 2dge s GLN 98 N -2.76 0.81 0.55 2.37 -2.07 -1.26 -5.17 119.66 112.14 2dge s GLN 98 Ca -0.15 -0.35 -0.16 0.00 -1.82 0.00 0.00 55.36 52.88 2dge s GLN 98 Cb 0.01 0.36 -0.06 0.00 -1.09 0.00 0.00 33.01 32.22 2dge s GLN 98 CO 0.77 -0.26 1.01 -1.25 -1.32 0.00 0.00 175.29 174.25 2dge s PRO 99 N -2.13 3.70 -0.16 9.60 0.04 -1.26 -4.16 135.00 140.63 2dge s PRO 99 Ca -0.08 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.00 2dge s PRO 99 Cb -0.02 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2dge s PRO 99 CO -0.00 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 176.96 2dge n GLY 100 N -1.42 0.52 2.74 0.56 0.00 -1.26 -4.92 105.19 101.41 2dge n GLY 100 Ca 0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 2dge n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dge n ALA 101 N 1.03 2.99 -1.68 4.61 0.00 -1.26 -4.84 120.51 121.36 2dge n ALA 101 Ca -0.02 -2.94 -0.30 0.00 0.00 0.00 0.00 53.44 50.19 2dge n ALA 101 Cb 0.08 -0.85 0.21 0.00 0.00 0.00 0.00 19.45 18.89 2dge n ALA 101 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2dge s THR 102 N -3.76 1.87 -1.26 0.00 -4.23 -1.26 -4.69 115.64 102.31 2dge s THR 102 Ca 0.29 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.94 2dge s THR 102 Cb 0.36 -2.85 0.56 0.00 1.34 0.00 0.00 72.50 71.92 2dge s THR 102 CO -0.02 0.00 1.44 0.18 -0.54 0.00 0.00 174.62 175.68 2dge n LEU 103 N -4.09 3.80 -4.82 4.79 4.77 0.54 -4.15 117.00 117.83 2dge n LEU 103 Ca 0.15 -1.92 -0.33 0.00 -0.03 0.00 0.00 56.01 53.89 2dge n LEU 103 Cb 0.59 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 2dge n LEU 103 CO 0.45 0.66 0.65 -0.36 -1.33 0.00 0.00 177.39 177.45 2dge s PHE 104 N -1.76 3.31 0.25 -1.77 0.08 -1.25 -4.42 117.98 112.42 2dge s PHE 104 Ca 0.40 1.60 -0.06 0.00 0.12 0.00 0.00 56.93 58.99 2dge s PHE 104 Cb 0.26 -2.84 0.46 0.00 -0.57 0.00 0.00 43.02 40.32 2dge s PHE 104 CO 0.20 -0.11 1.66 1.15 -0.10 0.00 0.00 175.22 178.01 2dge h THR 105 N 1.88 0.41 -0.90 0.64 2.02 -1.91 -0.97 112.91 114.08 2dge h THR 105 Ca -0.49 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 66.70 2dge h THR 105 Cb 1.18 0.23 -0.07 0.00 -1.74 0.00 0.00 68.15 67.75 2dge h THR 105 CO 0.61 0.03 0.56 0.11 0.37 0.00 0.00 175.52 177.21 2dge h LYS 106 N 0.17 0.98 0.15 6.66 1.57 -1.95 0.48 116.57 124.63 2dge h LYS 106 Ca 0.42 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.83 2dge h LYS 106 Cb 0.74 -0.22 0.03 0.00 0.08 0.00 0.00 32.23 32.86 2dge h LYS 106 CO -0.60 0.65 -1.30 -0.44 -0.57 0.00 0.00 179.45 177.19 2dge h ASP 107 N 1.01 0.81 -0.94 0.86 3.45 -1.50 -0.34 116.42 119.77 2dge h ASP 107 Ca 0.40 -0.79 0.06 0.00 0.43 0.00 0.00 57.03 57.13 2dge h ASP 107 Cb 0.21 -0.26 -0.06 0.00 -0.56 0.00 0.00 39.33 38.66 2dge h ASP 107 CO -0.19 1.60 0.60 -0.07 -1.57 0.00 0.00 179.24 179.61 2dge h LEU 108 N 0.22 0.97 -0.08 1.55 3.38 -0.97 -0.77 115.31 119.60 2dge h LEU 108 Ca -0.20 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 2dge h LEU 108 Cb 1.98 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 42.53 2dge h LEU 108 CO 0.24 0.63 -0.11 -0.33 0.09 0.00 0.00 178.44 178.96 2dge h GLU 109 N 1.11 0.23 -0.83 1.13 5.08 -0.85 0.14 114.58 120.59 2dge h GLU 109 Ca 0.40 -0.13 0.16 0.00 -1.00 0.00 0.00 59.36 58.79 2dge h GLU 109 Cb 0.13 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 2dge h GLU 109 CO -0.16 0.69 0.38 -0.09 -1.00 0.00 0.00 179.01 178.83 2dge h ARG 110 N -0.22 0.50 -0.01 2.33 2.43 -0.84 -2.30 114.38 116.28 2dge h ARG 110 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2dge h ARG 110 Cb 0.66 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2dge h ARG 110 CO 0.03 0.33 -0.28 0.09 -1.51 0.00 0.00 179.97 178.63 2dge n ASN 111 N -4.95 1.11 -0.70 -3.80 4.13 -0.32 -4.94 115.26 105.79 2dge n ASN 111 Ca 0.17 -0.94 -0.07 0.00 1.68 0.00 0.00 54.58 55.42 2dge n ASN 111 Cb 0.47 0.17 -0.02 0.00 -1.54 0.00 0.00 39.78 38.87 2dge n ASN 111 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dge n GLY 112 N 1.35 0.46 2.66 7.41 0.00 -0.61 -4.95 105.19 111.51 2dge n GLY 112 Ca 0.12 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 2dge n GLY 112 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2dge n VAL 113 N -3.46 3.00 0.44 1.61 0.31 0.38 -4.77 118.33 115.84 2dge n VAL 113 Ca -0.08 -4.98 0.07 0.00 -0.01 0.00 0.00 64.34 59.34 2dge n VAL 113 Cb 0.42 -1.30 0.08 0.00 -0.91 0.00 0.00 33.84 32.12 2dge n VAL 113 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2dge n ASP 114 N -0.43 2.26 -4.67 4.52 5.75 -1.21 -4.62 116.55 118.15 2dge n ASP 114 Ca 0.41 -1.62 -0.30 0.00 -0.01 0.00 0.00 54.79 53.27 2dge n ASP 114 Cb 0.50 -0.04 -0.08 0.00 -1.03 0.00 0.00 41.12 40.46 2dge n ASP 114 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2dge s THR 115 N -1.09 3.96 0.34 2.12 -4.23 -1.26 -5.01 115.64 110.46 2dge s THR 115 Ca 0.17 -0.97 0.05 0.00 -1.18 0.00 0.00 61.69 59.76 2dge s THR 115 Cb 0.12 -2.87 0.30 0.00 1.34 0.00 0.00 72.50 71.39 2dge s THR 115 CO 0.17 0.15 1.92 -0.33 -0.54 0.00 0.00 174.62 175.99 2dge h GLU 116 N 3.57 0.79 -0.39 3.99 5.08 -1.92 0.46 114.58 126.16 2dge h GLU 116 Ca -0.48 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 57.87 2dge h GLU 116 Cb 1.17 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.20 2dge h GLU 116 CO 0.59 0.52 0.18 0.93 -1.00 0.00 0.00 179.01 180.23 2dge h GLU 117 N 0.81 0.36 -0.20 2.33 3.07 -1.96 0.15 114.58 119.15 2dge h GLU 117 Ca 0.37 -0.02 -0.20 0.00 -0.50 0.00 0.00 59.36 59.01 2dge h GLU 117 Cb 0.38 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 2dge h GLU 117 CO -0.15 0.24 -0.66 1.49 -1.40 0.00 0.00 179.01 178.53 2dge h GLU 118 N 0.37 0.75 -0.60 2.33 4.57 -1.77 -1.43 114.58 118.81 2dge h GLU 118 Ca 0.17 -0.55 0.01 0.00 -1.18 0.00 0.00 59.36 57.81 2dge h GLU 118 Cb 0.09 0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2dge h GLU 118 CO -0.13 1.17 0.40 0.82 -1.18 0.00 0.00 179.01 180.09 2dge h ILE 119 N 0.55 1.16 -0.33 2.32 2.04 -0.75 0.06 117.51 122.55 2dge h ILE 119 Ca -0.02 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.59 2dge h ILE 119 Cb 1.27 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2dge h ILE 119 CO 0.14 0.15 0.11 0.22 0.00 0.00 0.00 178.15 178.77 2dge h TYR 120 N 0.82 0.20 -0.26 1.37 3.20 -0.58 -1.37 116.97 120.35 2dge h TYR 120 Ca 0.22 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 2dge h TYR 120 Cb -0.09 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 2dge h TYR 120 CO -0.03 0.09 0.16 -0.09 -1.64 0.00 0.00 178.16 176.64 2dge h ARG 121 N 0.26 0.36 -0.50 1.82 2.43 -0.67 0.12 114.38 118.18 2dge h ARG 121 Ca 0.15 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2dge h ARG 121 Cb 0.12 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 2dge h ARG 121 CO -0.16 0.29 0.30 0.28 -1.51 0.00 0.00 179.97 179.17 2dge h VAL 122 N 0.33 1.15 -0.55 0.20 2.07 -0.91 -0.56 116.25 117.98 2dge h VAL 122 Ca 0.09 -0.35 -0.08 0.00 0.82 0.00 0.00 66.70 67.18 2dge h VAL 122 Cb 0.02 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2dge h VAL 122 CO -0.02 0.16 0.01 0.74 0.02 0.00 0.00 177.57 178.48 2dge h THR 123 N 0.67 1.26 0.16 2.57 2.02 -0.97 0.45 112.91 119.06 2dge h THR 123 Ca 0.18 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 2dge h THR 123 Cb -0.01 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 2dge h THR 123 CO -0.03 0.39 -0.08 0.22 0.37 0.00 0.00 175.52 176.39 2dge h TYR 124 N 0.87 -0.20 0.00 3.16 3.20 -0.54 0.06 116.97 123.51 2dge h TYR 124 Ca 0.16 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2dge h TYR 124 Cb 0.50 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.83 2dge h TYR 124 CO 0.03 0.23 -1.16 1.19 -1.64 0.00 0.00 178.16 176.82 2dge n PHE 125 N -4.95 0.07 0.00 -3.82 3.01 -0.24 -0.14 117.46 111.38 2dge n PHE 125 Ca -0.08 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.40 2dge n PHE 125 Cb 0.26 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.51 2dge n PHE 125 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dge n GLY 126 N 1.42 -1.42 3.32 1.37 0.00 0.15 -4.14 105.19 105.89 2dge n GLY 126 Ca 0.02 -1.57 0.03 0.00 0.00 0.00 0.00 46.02 44.50 2dge n GLY 126 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dge s LYS 127 N -1.59 0.41 6.14 1.61 2.20 -0.43 -4.72 119.74 123.37 2dge s LYS 127 Ca 0.00 0.88 0.00 0.00 -0.36 0.00 0.00 55.97 56.49 2dge s LYS 127 Cb 0.00 0.51 0.00 0.00 -1.51 0.00 0.00 37.83 36.83 2dge s LYS 127 CO 0.00 -0.30 0.00 0.41 -0.36 0.00 0.00 175.35 175.10 2dge n GLY 128 N 5.32 3.79 0.00 5.54 0.00 -1.26 -0.94 105.19 117.64 2dge n GLY 128 Ca -0.07 0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.24 2dge n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dge n ARG 129 N 14.00 0.63 -3.32 1.61 1.74 -1.26 -4.68 116.66 125.38 2dge n ARG 129 Ca 0.00 0.01 -0.39 0.00 -0.77 0.00 0.00 57.85 56.71 2dge n ARG 129 Cb 0.00 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.87 2dge n ARG 129 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 2dge s MET 130 N -2.30 4.15 0.49 5.56 1.75 -0.12 -5.07 119.30 123.76 2dge s MET 130 Ca 0.34 0.27 -0.21 0.00 -1.25 0.00 0.00 55.69 54.84 2dge s MET 130 Cb 0.19 -3.57 -0.07 0.00 2.84 0.00 0.00 34.83 34.22 2dge s MET 130 CO 0.38 -0.14 1.10 -1.25 -0.65 0.00 0.00 175.02 174.46 2dge s PRO 131 N 1.62 3.66 0.40 4.11 0.04 -1.26 -1.31 135.00 142.26 2dge s PRO 131 Ca 0.20 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.68 2dge s PRO 131 Cb -0.15 -2.16 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 2dge s PRO 131 CO 0.09 -0.58 0.78 0.20 0.04 0.00 0.00 177.00 177.52 2dge s GLY 132 N -1.75 1.99 0.00 0.56 0.00 -0.14 -4.39 107.32 103.59 2dge s GLY 132 Ca 0.68 -0.16 0.03 0.00 0.00 0.00 0.00 44.72 45.27 2dge s GLY 132 CO 0.26 0.04 0.43 0.69 0.00 0.00 0.00 173.10 174.52 2dge n PHE 133 N -1.22 0.00 -1.90 1.90 3.01 0.01 -0.46 117.46 118.80 2dge n PHE 133 Ca 0.03 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.16 2dge n PHE 133 Cb 0.54 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.04 2dge n PHE 133 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2dge s GLY 134 N -0.55 2.20 0.19 1.37 0.00 0.80 -0.97 107.32 110.35 2dge s GLY 134 Ca 0.02 0.53 -0.12 0.00 0.00 0.00 0.00 44.72 45.16 2dge s GLY 134 CO 0.06 0.87 1.75 -2.09 0.00 0.00 0.00 173.10 173.69 2dge h GLU 135 N 0.28 0.38 -0.58 2.90 4.81 -1.87 -2.38 114.58 118.12 2dge h GLU 135 Ca -0.47 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.64 2dge h GLU 135 Cb 1.24 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 30.48 2dge h GLU 135 CO 0.55 0.25 0.10 1.17 -0.73 0.00 0.00 179.01 180.36 2dge n LYS 136 N -4.98 3.98 -1.68 1.92 3.00 -1.26 -4.94 118.16 114.19 2dge n LYS 136 Ca 0.06 -3.09 -0.45 0.00 -0.00 0.00 0.00 58.31 54.84 2dge n LYS 136 Cb 0.21 -2.16 -0.04 0.00 0.00 0.00 0.00 35.03 33.05 2dge n LYS 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dge s THR 138 N 0.81 0.05 0.88 0.00 -1.32 -1.26 -4.68 115.64 110.12 2dge s THR 138 Ca 0.76 -0.43 -0.12 0.00 -1.21 0.00 0.00 61.69 60.68 2dge s THR 138 Cb -0.63 -0.89 0.12 0.00 -1.51 0.00 0.00 72.50 69.60 2dge s THR 138 CO 0.38 -0.24 1.14 -2.16 -2.21 0.00 0.00 174.62 171.53 2dge s PRO 139 N -2.14 1.36 0.35 7.08 0.04 -1.26 -4.87 135.00 135.56 2dge s PRO 139 Ca -0.07 0.31 0.13 0.00 0.04 0.00 0.00 61.00 61.41 2dge s PRO 139 Cb -0.02 -1.86 0.98 0.00 0.04 0.00 0.00 34.50 33.64 2dge s PRO 139 CO -0.00 -2.05 1.75 0.00 0.04 0.00 0.00 177.00 176.74 2dge h ARG 140 N -1.39 0.49 0.00 4.56 3.08 -1.94 -0.37 114.38 118.81 2dge h ARG 140 Ca -0.50 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.52 2dge h ARG 140 Cb 1.32 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 2dge h ARG 140 CO 0.62 0.33 -0.02 0.78 -1.07 0.00 0.00 179.97 180.60 2dge h GLY 141 N 0.51 0.00 -1.41 0.04 0.00 -1.97 -1.82 103.07 98.41 2dge h GLY 141 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.95 2dge h GLY 141 CO -0.39 0.00 0.00 -0.18 0.00 0.00 0.00 176.54 175.97 2dge n GLN 142 N -3.18 2.09 -4.37 4.80 -0.06 -0.15 -4.97 117.38 111.54 2dge n GLN 142 Ca -0.01 -1.59 -0.21 0.00 -2.00 0.00 0.00 57.00 53.18 2dge n GLN 142 Cb 0.21 -1.47 -0.10 0.00 -4.06 0.00 0.00 30.24 24.82 2dge n GLN 142 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2dge n THR 144 N -0.21 2.35 1.19 0.00 5.66 0.39 -4.76 114.28 118.90 2dge n THR 144 Ca -0.09 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.53 2dge n THR 144 Cb 0.59 -1.77 0.27 0.00 -1.55 0.00 0.00 70.33 67.87 2dge n THR 144 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2dge n PHE 145 N 0.08 0.00 -1.58 1.09 3.01 -1.26 -4.87 117.46 113.93 2dge n PHE 145 Ca 0.04 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.36 2dge n PHE 145 Cb 0.39 -0.06 0.10 0.00 -0.01 0.00 0.00 39.48 39.90 2dge n PHE 145 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dge n GLY 146 N 1.34 -1.09 3.73 1.37 0.00 -1.26 -5.00 105.19 104.28 2dge n GLY 146 Ca 0.12 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2dge n GLY 146 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dge n PRO 147 N -2.38 2.66 -2.33 1.61 -0.04 -1.26 -4.98 135.00 128.27 2dge n PRO 147 Ca 0.08 0.95 -0.36 0.00 -0.04 0.00 0.00 63.50 64.13 2dge n PRO 147 Cb 0.30 -2.75 -0.01 0.00 -0.04 0.00 0.00 33.50 31.00 2dge n PRO 147 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dge s ARG 148 N 0.12 3.76 0.32 0.54 1.81 -1.26 -5.04 118.95 119.19 2dge s ARG 148 Ca 0.69 1.66 -0.12 0.00 -1.72 0.00 0.00 55.73 56.24 2dge s ARG 148 Cb -0.52 -2.33 -0.08 0.00 -0.45 0.00 0.00 34.95 31.58 2dge s ARG 148 CO 0.43 -0.52 0.69 -0.51 -0.68 0.00 0.00 175.30 174.71 2dge s LEU 149 N -3.14 4.03 0.65 2.53 1.43 -0.14 -4.96 118.68 119.07 2dge s LEU 149 Ca 0.65 1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 54.74 2dge s LEU 149 Cb -0.25 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.01 2dge s LEU 149 CO 0.31 -0.22 1.06 -1.10 0.23 0.00 0.00 176.35 176.62 2dge s GLN 150 N -3.19 3.09 0.22 1.70 -1.52 -1.26 -4.04 119.66 114.66 2dge s GLN 150 Ca 0.51 1.12 -0.08 0.00 -1.95 0.00 0.00 55.36 54.96 2dge s GLN 150 Cb -0.10 -2.01 0.35 0.00 -0.22 0.00 0.00 33.01 31.03 2dge s GLN 150 CO 0.22 -0.99 1.72 -0.44 -0.25 0.00 0.00 175.29 175.55 2dge h ASP 151 N -0.11 0.12 0.08 5.90 3.45 -1.98 -1.30 116.42 122.58 2dge h ASP 151 Ca -0.45 0.11 -0.05 0.00 0.43 0.00 0.00 57.03 57.06 2dge h ASP 151 Cb 1.22 0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 40.10 2dge h ASP 151 CO 0.57 0.05 -0.17 -0.08 -1.57 0.00 0.00 179.24 178.04 2dge h GLU 152 N 0.34 0.20 -0.35 3.56 4.22 -1.99 -0.27 114.58 120.28 2dge h GLU 152 Ca 0.35 -0.05 -0.10 0.00 0.08 0.00 0.00 59.36 59.64 2dge h GLU 152 Cb 0.52 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2dge h GLU 152 CO -0.40 0.37 -0.18 0.93 -2.18 0.00 0.00 179.01 177.56 2dge h GLU 153 N 0.18 0.75 -0.27 1.92 5.08 -1.64 -1.35 114.58 119.25 2dge h GLU 153 Ca 0.04 -0.33 -0.14 0.00 -1.00 0.00 0.00 59.36 57.93 2dge h GLU 153 Cb 0.42 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2dge h GLU 153 CO 0.03 0.94 -0.39 0.82 -1.00 0.00 0.00 179.01 179.41 2dge h ILE 154 N 0.53 1.29 -0.39 3.13 2.04 -0.95 -0.96 117.51 122.20 2dge h ILE 154 Ca 0.08 -1.56 0.05 0.00 1.00 0.00 0.00 64.86 64.43 2dge h ILE 154 Cb 0.73 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 2dge h ILE 154 CO 0.05 0.50 0.13 0.50 0.00 0.00 0.00 178.15 179.33 2dge h LYS 155 N 0.53 0.27 -0.87 2.37 3.64 -0.97 0.46 116.57 122.00 2dge h LYS 155 Ca 0.05 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2dge h LYS 155 Cb 0.91 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.63 2dge h LYS 155 CO 0.08 0.18 0.44 -0.07 -2.27 0.00 0.00 179.45 177.81 2dge h LEU 156 N 0.28 1.13 -0.59 5.20 4.07 -1.00 -2.05 115.31 122.34 2dge h LEU 156 Ca 0.18 -0.13 -0.09 0.00 0.08 0.00 0.00 57.88 57.92 2dge h LEU 156 Cb 0.17 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.60 2dge h LEU 156 CO -0.19 0.93 0.00 -0.07 -1.08 0.00 0.00 178.44 178.03 2dge h LEU 157 N 1.24 1.02 -0.65 1.67 3.38 -0.73 -0.12 115.31 121.12 2dge h LEU 157 Ca 0.30 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2dge h LEU 157 Cb 0.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2dge h LEU 157 CO -0.04 1.08 0.30 0.00 0.09 0.00 0.00 178.44 179.87 2dge h ALA 158 N 0.98 0.84 -0.55 1.53 0.00 -0.77 -0.32 119.26 120.98 2dge h ALA 158 Ca 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2dge h ALA 158 Cb 0.55 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2dge h ALA 158 CO 0.03 0.42 0.32 1.49 0.00 0.00 0.00 179.25 181.51 2dge h GLU 159 N 0.91 0.76 0.16 0.00 4.81 -1.18 -1.33 114.58 118.71 2dge h GLU 159 Ca 0.22 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 2dge h GLU 159 Cb 0.14 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2dge h GLU 159 CO -0.03 0.56 -0.08 0.35 -0.73 0.00 0.00 179.01 179.09 2dge h PHE 160 N 0.74 -0.20 -0.35 0.92 3.57 -0.65 -0.75 116.94 120.22 2dge h PHE 160 Ca 0.20 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 2dge h PHE 160 Cb 0.01 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2dge h PHE 160 CO -0.02 -0.11 0.19 0.28 -2.23 0.00 0.00 178.31 176.42 2dge h VAL 161 N -0.24 1.14 -0.36 1.41 2.07 -0.97 0.88 116.25 120.18 2dge h VAL 161 Ca -0.02 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.15 2dge h VAL 161 Cb 0.18 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 2dge h VAL 161 CO 0.04 0.14 0.19 0.50 0.02 0.00 0.00 177.57 178.46 2dge h LYS 162 N 0.44 0.38 -0.15 1.57 1.63 -1.16 0.53 116.57 119.82 2dge h LYS 162 Ca 0.12 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.86 2dge h LYS 162 Cb 0.06 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.60 2dge h LYS 162 CO -0.02 0.25 -0.08 0.35 -3.45 0.00 0.00 179.45 176.50 2dge h PHE 163 N 0.39 0.36 -0.95 1.91 3.57 -0.91 -1.44 116.94 119.88 2dge h PHE 163 Ca 0.15 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.56 2dge h PHE 163 Cb 0.05 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 2dge h PHE 163 CO -0.09 0.65 0.63 1.96 -2.23 0.00 0.00 178.31 179.23 2dge h GLN 164 N -0.03 1.25 -0.43 1.11 1.08 -0.72 -0.78 115.11 116.59 2dge h GLN 164 Ca 0.03 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 2dge h GLN 164 Cb 0.56 -0.28 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 2dge h GLN 164 CO 0.02 0.83 0.22 0.00 -0.95 0.00 0.00 178.83 178.95 2dge h ALA 165 N 1.41 0.55 -0.67 3.87 0.00 -0.75 0.19 119.26 123.86 2dge h ALA 165 Ca 0.35 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.22 2dge h ALA 165 Cb -0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 2dge h ALA 165 CO -0.07 0.09 0.44 -0.44 0.00 0.00 0.00 179.25 179.27 2dge h ASP 166 N 0.56 0.62 0.06 0.00 3.45 -0.54 -2.48 116.42 118.07 2dge h ASP 166 Ca 0.15 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.61 2dge h ASP 166 Cb 0.08 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.71 2dge h ASP 166 CO -0.02 0.41 -0.14 0.00 -1.57 0.00 0.00 179.24 177.92 2dge n GLN 167 N -4.47 1.47 -1.95 3.56 1.13 -0.37 -4.95 117.38 111.79 2dge n GLN 167 Ca 0.09 -0.99 -0.05 0.00 -1.94 0.00 0.00 57.00 54.11 2dge n GLN 167 Cb 0.21 -1.48 -0.01 0.00 0.11 0.00 0.00 30.24 29.07 2dge n GLN 167 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2dge n GLY 168 N 1.28 0.25 3.35 1.08 0.00 -0.23 -4.28 105.19 106.65 2dge n GLY 168 Ca 0.15 -0.68 -0.17 0.00 0.00 0.00 0.00 46.02 45.31 2dge n GLY 168 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2dge n TRP 169 N -3.82 -2.33 -2.12 1.61 7.02 0.50 -5.02 117.44 113.29 2dge n TRP 169 Ca -0.06 0.83 -0.32 0.00 -1.02 0.00 0.00 57.50 56.93 2dge n TRP 169 Cb 0.49 -4.27 -0.00 0.00 -2.42 0.00 0.00 31.31 25.11 2dge n TRP 169 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2dge s PRO 170 N -4.84 3.50 0.38 -0.99 0.04 -1.26 -4.99 135.00 126.84 2dge s PRO 170 Ca 0.34 1.09 -0.28 0.00 0.04 0.00 0.00 61.00 62.19 2dge s PRO 170 Cb -0.06 -2.06 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 2dge s PRO 170 CO 0.75 -0.65 1.50 0.95 0.04 0.00 0.00 177.00 179.59 2dge s THR 171 N -2.57 2.01 -0.98 1.26 -4.23 -1.26 -5.09 115.64 104.78 2dge s THR 171 Ca 0.61 0.01 0.08 0.00 -1.18 0.00 0.00 61.69 61.21 2dge s THR 171 Cb -0.14 -3.01 0.06 0.00 1.34 0.00 0.00 72.50 70.76 2dge s THR 171 CO 0.37 0.00 0.75 0.52 -0.54 0.00 0.00 174.62 175.72