#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dl3 s VAL 2 N 0.00 0.61 0.42 2.03 0.11 -1.26 -4.87 120.40 117.44 1dl3 s VAL 2 Ca 0.00 -0.12 -0.13 0.00 -2.93 0.00 0.00 61.98 58.80 1dl3 s VAL 2 Cb 0.00 -0.66 -0.07 0.00 -1.53 0.00 0.00 36.38 34.12 1dl3 s VAL 2 CO 0.00 0.26 0.82 -0.13 -3.33 0.00 0.00 175.10 172.72 1dl3 s ARG 3 N 1.25 3.88 -0.06 1.54 3.00 -0.84 -4.71 118.95 123.00 1dl3 s ARG 3 Ca -0.06 0.65 0.05 0.00 0.00 0.00 0.00 55.73 56.38 1dl3 s ARG 3 Cb -0.14 -2.33 -0.01 0.00 0.00 0.00 0.00 34.95 32.47 1dl3 s ARG 3 CO -0.02 -0.05 -0.24 0.08 0.00 0.00 0.00 175.30 175.07 1dl3 s VAL 4 N -2.35 2.17 -0.13 3.52 1.01 -1.26 -0.89 120.40 122.47 1dl3 s VAL 4 Ca 0.54 -1.02 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1dl3 s VAL 4 Cb -0.10 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.49 1dl3 s VAL 4 CO 0.28 0.57 -0.22 -0.75 0.00 0.00 0.00 175.10 174.98 1dl3 s LYS 5 N -0.13 3.05 -0.36 2.72 2.20 -0.14 -0.59 119.74 126.49 1dl3 s LYS 5 Ca -0.04 -0.85 -0.10 0.00 -0.36 0.00 0.00 55.97 54.61 1dl3 s LYS 5 Cb -0.14 -2.41 0.02 0.00 -1.51 0.00 0.00 37.83 33.79 1dl3 s LYS 5 CO 0.04 0.05 0.19 0.42 -0.36 0.00 0.00 175.35 175.69 1dl3 s ILE 6 N 0.66 4.56 0.22 5.43 -1.09 -0.32 -2.13 121.20 128.53 1dl3 s ILE 6 Ca -0.11 -0.74 0.05 0.00 -2.23 0.00 0.00 60.65 57.62 1dl3 s ILE 6 Cb -0.16 -3.48 -0.03 0.00 -1.58 0.00 0.00 42.46 37.20 1dl3 s ILE 6 CO 0.02 -0.15 0.35 0.00 -1.23 0.00 0.00 174.94 173.92 1dl3 n GLY 8 N -1.26 0.55 3.73 0.00 0.00 0.21 -4.44 105.19 103.97 1dl3 n GLY 8 Ca -0.09 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 1dl3 n GLY 8 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dl3 s ILE 9 N -2.83 4.67 0.00 -0.61 -1.09 -0.93 -4.70 121.20 115.71 1dl3 s ILE 9 Ca 0.08 1.93 0.00 0.00 -2.23 0.00 0.00 60.65 60.43 1dl3 s ILE 9 Cb -0.04 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.58 1dl3 s ILE 9 CO 0.10 0.29 0.00 0.35 -1.23 0.00 0.00 174.94 174.45 1dl3 n THR 10 N 3.11 0.00 -4.04 2.92 -2.24 -1.26 -4.70 114.28 108.07 1dl3 n THR 10 Ca 0.02 -0.37 -0.08 0.00 -2.27 0.00 0.00 64.05 61.34 1dl3 n THR 10 Cb 0.50 0.90 -0.11 0.00 -2.10 0.00 0.00 70.33 69.53 1dl3 n THR 10 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1dl3 s ASN 11 N -1.07 0.40 0.13 3.42 2.20 -1.26 -5.01 114.94 113.75 1dl3 s ASN 11 Ca 0.00 -0.74 -0.19 0.00 -0.94 0.00 0.00 52.86 51.00 1dl3 s ASN 11 Cb 0.00 0.14 -0.01 0.00 -2.00 0.00 0.00 41.25 39.38 1dl3 s ASN 11 CO 0.00 -0.43 1.75 0.25 -2.94 0.00 0.00 177.10 175.73 1dl3 h LEU 12 N 3.93 0.09 -0.72 3.54 5.85 -1.97 -2.34 115.31 123.69 1dl3 h LEU 12 Ca -0.33 0.03 0.13 0.00 0.84 0.00 0.00 57.88 58.55 1dl3 h LEU 12 Cb 1.18 0.02 -0.13 0.00 0.37 0.00 0.00 40.66 42.09 1dl3 h LEU 12 CO 0.53 0.08 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.12 1dl3 h GLU 13 N 0.20 -0.06 -0.33 1.25 4.39 -1.99 0.20 114.58 118.23 1dl3 h GLU 13 Ca 0.11 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 1dl3 h GLU 13 Cb 0.08 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1dl3 h GLU 13 CO -0.11 -0.04 0.08 -0.44 -1.16 0.00 0.00 179.01 177.34 1dl3 h ASP 14 N -0.06 0.50 0.55 1.42 3.32 -1.89 -2.17 116.42 118.09 1dl3 h ASP 14 Ca 0.31 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1dl3 h ASP 14 Cb 0.56 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1dl3 h ASP 14 CO -0.77 0.60 -0.51 0.00 -1.72 0.00 0.00 179.24 176.85 1dl3 h ALA 15 N 0.92 -1.17 -0.50 3.45 0.00 -0.60 -0.70 119.26 120.67 1dl3 h ALA 15 Ca 0.10 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.89 1dl3 h ALA 15 Cb 0.29 0.72 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1dl3 h ALA 15 CO 0.00 -1.19 0.14 -0.07 0.00 0.00 0.00 179.25 178.13 1dl3 h LEU 16 N -1.04 0.09 -1.25 0.00 3.38 -1.08 -1.20 115.31 114.21 1dl3 h LEU 16 Ca -0.07 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1dl3 h LEU 16 Cb 0.89 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.69 1dl3 h LEU 16 CO -0.04 0.08 0.51 0.15 0.09 0.00 0.00 178.44 179.23 1dl3 h PHE 17 N 0.30 0.96 -0.83 1.13 3.57 -1.21 -0.03 116.94 120.81 1dl3 h PHE 17 Ca 0.25 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 1dl3 h PHE 17 Cb 0.30 -0.32 -0.04 0.00 2.79 0.00 0.00 35.95 38.68 1dl3 h PHE 17 CO -0.19 0.59 0.38 0.77 -2.23 0.00 0.00 178.31 177.63 1dl3 h SER 18 N 1.02 1.11 0.21 0.41 0.02 0.06 0.24 113.55 116.62 1dl3 h SER 18 Ca 0.29 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1dl3 h SER 18 Cb -0.08 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 62.17 1dl3 h SER 18 CO -0.07 0.95 -0.10 0.58 -1.14 0.00 0.00 176.83 177.06 1dl3 h VAL 19 N 1.20 0.85 -0.70 2.27 2.07 -0.49 0.41 116.25 121.85 1dl3 h VAL 19 Ca 0.28 -0.25 0.10 0.00 0.82 0.00 0.00 66.70 67.66 1dl3 h VAL 19 Cb 0.15 1.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 1dl3 h VAL 19 CO -0.03 0.06 0.32 -0.33 0.02 0.00 0.00 177.57 177.61 1dl3 h GLU 20 N -0.40 0.52 0.00 1.57 4.39 -0.73 -0.32 114.58 119.61 1dl3 h GLU 20 Ca -0.03 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1dl3 h GLU 20 Cb 0.31 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1dl3 h GLU 20 CO 0.05 0.35 0.00 0.43 -1.16 0.00 0.00 179.01 178.67 1dl3 n SER 21 N -4.91 0.00 0.00 1.42 7.64 0.04 -4.86 113.62 112.95 1dl3 n SER 21 Ca 0.11 -0.10 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1dl3 n SER 21 Cb 0.30 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 1dl3 n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dl3 n GLY 22 N 0.06 0.96 3.77 0.23 0.00 -0.13 -4.85 105.19 105.23 1dl3 n GLY 22 Ca 0.09 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1dl3 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dl3 s ALA 23 N -2.00 3.15 -0.18 4.61 0.00 0.10 -4.75 121.76 122.70 1dl3 s ALA 23 Ca 0.00 0.88 0.19 0.00 0.00 0.00 0.00 51.96 53.04 1dl3 s ALA 23 Cb 0.00 -3.35 -0.28 0.00 0.00 0.00 0.00 23.12 19.49 1dl3 s ALA 23 CO 0.00 -0.41 0.49 -0.25 0.00 0.00 0.00 175.76 175.59 1dl3 n ASP 24 N 0.12 0.66 -3.83 0.00 8.00 0.24 -4.69 116.55 117.05 1dl3 n ASP 24 Ca 0.04 -0.17 -0.12 0.00 0.71 0.00 0.00 54.79 55.25 1dl3 n ASP 24 Cb 0.47 1.72 -0.12 0.00 -0.02 0.00 0.00 41.12 43.17 1dl3 n ASP 24 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1dl3 s TYR 25 N -3.23 -0.12 -0.09 1.24 2.02 -0.84 -3.40 117.35 112.92 1dl3 s TYR 25 Ca -0.04 0.29 0.03 0.00 -0.37 0.00 0.00 57.07 56.98 1dl3 s TYR 25 Cb 0.13 0.04 0.01 0.00 -0.40 0.00 0.00 41.96 41.73 1dl3 s TYR 25 CO 0.79 -0.09 -0.20 0.14 -1.57 0.00 0.00 175.55 174.63 1dl3 s VAL 26 N -0.08 1.73 -0.11 0.71 -7.23 -0.63 -1.17 120.40 113.62 1dl3 s VAL 26 Ca -0.01 -0.82 -0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1dl3 s VAL 26 Cb -0.02 -1.52 -0.02 0.00 0.56 0.00 0.00 36.38 35.38 1dl3 s VAL 26 CO 0.00 0.49 -0.09 -0.83 -0.31 0.00 0.00 175.10 174.36 1dl3 s GLY 27 N 0.51 1.63 -0.18 2.32 0.00 0.11 -0.57 107.32 111.15 1dl3 s GLY 27 Ca -0.16 -0.88 -0.07 0.00 0.00 0.00 0.00 44.72 43.61 1dl3 s GLY 27 CO 0.06 -0.35 0.06 -1.36 0.00 0.00 0.00 173.10 171.51 1dl3 s PHE 28 N -0.09 3.25 -0.50 1.90 0.08 0.91 -0.62 117.98 122.92 1dl3 s PHE 28 Ca -0.00 0.07 -0.22 0.00 0.12 0.00 0.00 56.93 56.91 1dl3 s PHE 28 Cb -0.13 -2.07 0.04 0.00 -0.57 0.00 0.00 43.02 40.29 1dl3 s PHE 28 CO 0.03 0.17 0.76 0.08 -0.10 0.00 0.00 175.22 176.16 1dl3 s VAL 29 N 0.32 4.66 -0.72 -0.44 1.01 -1.26 0.05 120.40 124.03 1dl3 s VAL 29 Ca 0.03 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.00 1dl3 s VAL 29 Cb -0.12 -4.37 0.33 0.00 0.00 0.00 0.00 36.38 32.22 1dl3 s VAL 29 CO 0.00 -0.87 2.13 0.49 0.00 0.00 0.00 175.10 176.85 1dl3 n PHE 30 N 6.72 2.80 -4.07 5.22 3.72 -0.10 -2.01 117.46 129.74 1dl3 n PHE 30 Ca -0.02 -2.45 -0.32 0.00 -0.05 0.00 0.00 57.45 54.61 1dl3 n PHE 30 Cb 0.47 -1.28 -0.15 0.00 -0.94 0.00 0.00 39.48 37.58 1dl3 n PHE 30 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1dl3 s TYR 31 N -3.59 3.13 0.35 1.38 5.04 -1.26 -4.61 117.35 117.80 1dl3 s TYR 31 Ca 0.55 -2.20 0.12 0.00 -2.44 0.00 0.00 57.07 53.10 1dl3 s TYR 31 Cb 0.44 -1.90 0.91 0.00 0.35 0.00 0.00 41.96 41.76 1dl3 s TYR 31 CO -0.26 -0.86 1.79 -1.35 -1.34 0.00 0.00 175.55 173.53 1dl3 h PRO 32 N 7.81 0.57 -0.01 4.97 0.11 -1.96 -1.68 132.00 141.81 1dl3 h PRO 32 Ca -0.22 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1dl3 h PRO 32 Cb 1.05 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1dl3 h PRO 32 CO 0.48 0.38 0.00 1.63 -0.21 0.00 0.00 178.00 180.28 1dl3 n LYS 33 N -4.68 1.08 -3.19 1.05 5.02 -1.26 -4.81 118.16 111.37 1dl3 n LYS 33 Ca 0.23 -0.11 -0.39 0.00 -2.02 0.00 0.00 58.31 56.02 1dl3 n LYS 33 Cb 0.68 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 34.19 1dl3 n LYS 33 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1dl3 s SER 34 N -1.89 7.00 0.29 4.39 0.15 -0.63 -4.94 113.70 118.07 1dl3 s SER 34 Ca 0.42 1.19 0.22 0.00 0.70 0.00 0.00 55.95 58.47 1dl3 s SER 34 Cb 0.20 -2.37 1.08 0.00 -1.71 0.00 0.00 66.02 63.21 1dl3 s SER 34 CO 0.33 0.10 1.67 0.29 1.20 0.00 0.00 173.24 176.83 1dl3 n LYS 35 N 2.69 0.16 -0.80 5.44 5.02 -1.26 -0.93 118.16 128.47 1dl3 n LYS 35 Ca -0.07 0.56 0.07 0.00 -2.02 0.00 0.00 58.31 56.85 1dl3 n LYS 35 Cb 0.51 -1.92 0.38 0.00 -0.02 0.00 0.00 35.03 33.98 1dl3 n LYS 35 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1dl3 n ARG 36 N -2.24 4.50 -1.83 1.97 1.74 -1.26 -4.55 116.66 114.99 1dl3 n ARG 36 Ca -0.00 -3.10 -0.40 0.00 -0.77 0.00 0.00 57.85 53.58 1dl3 n ARG 36 Cb 0.11 -2.17 0.01 0.00 -1.02 0.00 0.00 32.46 29.38 1dl3 n ARG 36 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1dl3 s TYR 37 N -2.73 2.53 -0.01 -1.55 5.04 -0.10 -4.36 117.35 116.17 1dl3 s TYR 37 Ca 0.52 1.25 -0.00 0.00 -2.44 0.00 0.00 57.07 56.40 1dl3 s TYR 37 Cb 0.40 -3.92 0.01 0.00 0.35 0.00 0.00 41.96 38.80 1dl3 s TYR 37 CO 0.15 -2.86 0.02 -1.50 -1.34 0.00 0.00 175.55 170.02 1dl3 s ILE 38 N -1.19 -0.02 0.69 3.14 2.07 -0.85 -5.01 121.20 120.05 1dl3 s ILE 38 Ca 0.58 0.06 -0.11 0.00 -1.41 0.00 0.00 60.65 59.78 1dl3 s ILE 38 Cb -0.44 -0.04 0.01 0.00 0.13 0.00 0.00 42.46 42.12 1dl3 s ILE 38 CO 0.57 0.02 1.06 -0.94 -1.91 0.00 0.00 174.94 173.75 1dl3 s SER 39 N 0.30 5.41 0.15 4.50 1.04 -1.26 -4.58 113.70 119.27 1dl3 s SER 39 Ca -0.02 1.55 -0.16 0.00 0.48 0.00 0.00 55.95 57.80 1dl3 s SER 39 Cb -0.04 -2.44 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1dl3 s SER 39 CO -0.01 -1.41 1.81 -0.65 0.98 0.00 0.00 173.24 173.96 1dl3 h PRO 40 N -0.70 0.50 -0.18 4.02 0.11 -1.98 -1.04 132.00 132.73 1dl3 h PRO 40 Ca -0.44 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1dl3 h PRO 40 Cb 1.21 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1dl3 h PRO 40 CO 0.58 0.33 0.09 1.49 -0.21 0.00 0.00 178.00 180.28 1dl3 h GLU 41 N 0.52 0.25 -0.85 1.05 4.22 -1.96 0.17 114.58 117.97 1dl3 h GLU 41 Ca 0.15 -0.03 0.04 0.00 0.08 0.00 0.00 59.36 59.60 1dl3 h GLU 41 Cb -0.04 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 1dl3 h GLU 41 CO -0.04 0.26 0.54 -0.44 -2.18 0.00 0.00 179.01 177.15 1dl3 h ASP 42 N 0.18 0.89 0.06 1.04 3.32 -1.91 -2.11 116.42 117.90 1dl3 h ASP 42 Ca 0.06 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1dl3 h ASP 42 Cb 0.08 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1dl3 h ASP 42 CO -0.01 0.60 -0.03 0.00 -1.72 0.00 0.00 179.24 178.08 1dl3 h ALA 43 N 1.36 -0.09 -0.95 3.45 0.00 -0.90 -2.94 119.26 119.20 1dl3 h ALA 43 Ca 0.35 -0.13 0.21 0.00 0.00 0.00 0.00 54.91 55.33 1dl3 h ALA 43 Cb 0.04 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.75 1dl3 h ALA 43 CO -0.13 -0.43 0.52 -0.09 0.00 0.00 0.00 179.25 179.12 1dl3 h ARG 44 N -0.33 0.57 -0.76 0.00 2.43 -0.27 0.53 114.38 116.56 1dl3 h ARG 44 Ca -0.01 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1dl3 h ARG 44 Cb 0.29 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1dl3 h ARG 44 CO 0.01 0.38 0.47 0.00 -1.51 0.00 0.00 179.97 179.32 1dl3 h ARG 45 N 0.59 0.87 0.14 0.20 3.08 -1.22 -2.51 114.38 115.53 1dl3 h ARG 45 Ca 0.57 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.57 1dl3 h ARG 45 Cb 1.00 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1dl3 h ARG 45 CO -0.44 0.57 -0.07 0.82 -1.07 0.00 0.00 179.97 179.78 1dl3 h ILE 46 N 0.89 0.00 -0.80 2.04 2.04 -0.08 -3.36 117.51 118.24 1dl3 h ILE 46 Ca 0.32 -0.32 0.14 0.00 1.00 0.00 0.00 64.86 66.01 1dl3 h ILE 46 Cb 0.09 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.03 1dl3 h ILE 46 CO -0.14 0.00 -0.24 -0.24 0.00 0.00 0.00 178.15 177.53 1dl3 n SER 47 N -3.38 -0.38 0.16 1.72 2.88 0.12 -0.13 113.62 114.62 1dl3 n SER 47 Ca -0.02 1.38 0.17 0.00 -1.33 0.00 0.00 58.87 59.06 1dl3 n SER 47 Cb 0.07 -0.38 0.77 0.00 -0.75 0.00 0.00 64.21 63.93 1dl3 n SER 47 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1dl3 h VAL 48 N 0.00 0.59 -0.00 2.46 2.07 -1.62 -1.20 116.25 118.56 1dl3 h VAL 48 Ca 0.34 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.86 1dl3 h VAL 48 Cb 0.54 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1dl3 h VAL 48 CO -0.81 0.00 -0.16 1.21 0.02 0.00 0.00 177.57 177.83 1dl3 n GLU 49 N -4.02 0.14 -3.46 1.57 4.07 0.82 -4.91 120.64 114.85 1dl3 n GLU 49 Ca 0.03 -0.04 -0.38 0.00 -0.06 0.00 0.00 57.16 56.72 1dl3 n GLU 49 Cb 0.37 -1.50 -0.06 0.00 -0.06 0.00 0.00 31.44 30.19 1dl3 n GLU 49 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1dl3 s LEU 50 N -2.89 4.38 0.00 4.31 1.43 -0.45 -4.99 118.68 120.46 1dl3 s LEU 50 Ca 0.16 0.83 0.21 0.00 -1.03 0.00 0.00 54.13 54.31 1dl3 s LEU 50 Cb 0.19 -2.57 0.57 0.00 0.03 0.00 0.00 46.19 44.41 1dl3 s LEU 50 CO 0.57 0.19 1.48 -0.81 0.23 0.00 0.00 176.35 178.01 1dl3 n PRO 51 N 2.67 2.52 -4.58 1.29 -0.04 -1.26 -4.94 135.00 130.66 1dl3 n PRO 51 Ca -0.12 -2.36 -0.27 0.00 -0.04 0.00 0.00 63.50 60.72 1dl3 n PRO 51 Cb 0.52 -1.52 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 1dl3 n PRO 51 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1dl3 s VAL 54 N -1.17 1.82 0.05 0.52 -7.23 -1.26 -5.09 120.40 108.04 1dl3 s VAL 54 Ca 0.44 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 58.26 1dl3 s VAL 54 Cb 0.23 -2.95 -0.13 0.00 0.56 0.00 0.00 36.38 34.09 1dl3 s VAL 54 CO 0.31 -0.00 1.67 -0.62 -0.31 0.00 0.00 175.10 176.14 1dl3 n GLU 55 N -0.90 2.02 -4.11 4.82 -0.58 -1.22 -4.89 120.64 115.78 1dl3 n GLU 55 Ca -0.04 0.73 -0.35 0.00 -0.42 0.00 0.00 57.16 57.08 1dl3 n GLU 55 Cb 0.67 -2.51 -0.12 0.00 -0.57 0.00 0.00 31.44 28.91 1dl3 n GLU 55 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1dl3 s ARG 56 N 2.08 3.74 -0.11 3.49 0.52 -1.26 -1.60 118.95 125.80 1dl3 s ARG 56 Ca 0.85 -0.47 0.03 0.00 -0.52 0.00 0.00 55.73 55.62 1dl3 s ARG 56 Cb -0.73 -3.10 -0.00 0.00 0.52 0.00 0.00 34.95 31.64 1dl3 s ARG 56 CO 0.45 0.12 -0.22 0.08 0.02 0.00 0.00 175.30 175.75 1dl3 s VAL 57 N 0.73 2.21 -0.18 3.52 1.01 0.27 -1.42 120.40 126.54 1dl3 s VAL 57 Ca 0.01 -0.96 -0.09 0.00 0.00 0.00 0.00 61.98 60.95 1dl3 s VAL 57 Cb -0.14 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1dl3 s VAL 57 CO 0.02 0.55 0.10 -0.83 0.00 0.00 0.00 175.10 174.94 1dl3 s GLY 58 N 0.43 1.99 -0.27 4.51 0.00 -0.99 -0.06 107.32 112.92 1dl3 s GLY 58 Ca -0.16 -0.71 -0.12 0.00 0.00 0.00 0.00 44.72 43.74 1dl3 s GLY 58 CO 0.07 0.05 0.22 0.14 0.00 0.00 0.00 173.10 173.58 1dl3 s VAL 59 N 0.24 5.29 -0.05 1.40 1.01 0.11 -0.89 120.40 127.51 1dl3 s VAL 59 Ca 0.06 0.24 0.06 0.00 0.00 0.00 0.00 61.98 62.35 1dl3 s VAL 59 Cb -0.12 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 1dl3 s VAL 59 CO -0.01 0.25 -0.25 -0.36 0.00 0.00 0.00 175.10 174.73 1dl3 s PHE 60 N 1.73 2.35 -0.29 5.22 0.08 -0.94 -0.92 117.98 125.21 1dl3 s PHE 60 Ca 0.08 -0.63 -0.00 0.00 0.12 0.00 0.00 56.93 56.50 1dl3 s PHE 60 Cb -0.16 -1.53 0.06 0.00 -0.57 0.00 0.00 43.02 40.81 1dl3 s PHE 60 CO 0.10 -0.16 -0.03 0.08 -0.10 0.00 0.00 175.22 175.11 1dl3 s VAL 61 N -0.27 2.71 -1.38 -0.44 1.01 -1.26 -0.21 120.40 120.56 1dl3 s VAL 61 Ca 0.00 -1.51 -0.03 0.00 0.00 0.00 0.00 61.98 60.44 1dl3 s VAL 61 Cb -0.12 -2.59 0.02 0.00 0.00 0.00 0.00 36.38 33.69 1dl3 s VAL 61 CO 0.02 -0.11 0.71 0.59 0.00 0.00 0.00 175.10 176.31 1dl3 n ASN 62 N 4.55 -1.78 -4.83 3.32 5.03 -1.26 -4.93 115.26 115.36 1dl3 n ASN 62 Ca -0.13 -0.85 -0.32 0.00 0.87 0.00 0.00 54.58 54.16 1dl3 n ASN 62 Cb 0.43 -3.83 -0.06 0.00 -1.02 0.00 0.00 39.78 35.30 1dl3 n ASN 62 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1dl3 s GLU 63 N -6.22 3.14 0.27 3.52 2.56 -1.26 -5.08 118.70 115.63 1dl3 s GLU 63 Ca 0.15 -0.52 -0.29 0.00 0.00 0.00 0.00 54.97 54.31 1dl3 s GLU 63 Cb -0.08 -2.89 -0.09 0.00 2.00 0.00 0.00 34.13 33.07 1dl3 s GLU 63 CO 0.83 0.62 1.10 -1.83 -0.56 0.00 0.00 175.26 175.41 1dl3 s GLU 64 N -2.13 4.64 0.33 4.30 -1.05 -1.26 -4.88 118.70 118.65 1dl3 s GLU 64 Ca 0.28 1.79 0.12 0.00 -0.15 0.00 0.00 54.97 57.01 1dl3 s GLU 64 Cb -0.12 -3.20 1.04 0.00 -0.44 0.00 0.00 34.13 31.41 1dl3 s GLU 64 CO 0.20 0.21 1.63 -1.00 0.95 0.00 0.00 175.26 177.25 1dl3 h PRO 65 N 3.95 0.18 -0.60 -4.83 0.13 -1.98 -0.55 132.00 128.31 1dl3 h PRO 65 Ca -0.46 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1dl3 h PRO 65 Cb 1.21 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1dl3 h PRO 65 CO 0.67 0.12 0.38 0.93 -0.23 0.00 0.00 178.00 179.88 1dl3 h GLU 66 N 0.19 0.79 0.22 0.86 4.39 -1.99 -0.02 114.58 119.02 1dl3 h GLU 66 Ca 0.71 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 60.35 1dl3 h GLU 66 Cb 1.66 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 30.13 1dl3 h GLU 66 CO -0.69 0.54 -0.11 -0.22 -1.16 0.00 0.00 179.01 177.37 1dl3 h LYS 67 N 0.82 -0.29 -0.55 2.33 1.63 -1.49 -2.26 116.57 116.76 1dl3 h LYS 67 Ca 0.22 0.02 0.11 0.00 -0.85 0.00 0.00 60.65 60.15 1dl3 h LYS 67 Cb -0.07 0.06 -0.11 0.00 -0.60 0.00 0.00 32.23 31.51 1dl3 h LYS 67 CO -0.05 0.09 -0.18 0.82 -3.45 0.00 0.00 179.45 176.68 1dl3 h ILE 68 N -0.87 0.37 -0.43 2.00 2.04 -1.23 0.90 117.51 120.30 1dl3 h ILE 68 Ca -0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 1dl3 h ILE 68 Cb 0.51 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1dl3 h ILE 68 CO 0.05 0.00 0.26 -0.07 0.00 0.00 0.00 178.15 178.39 1dl3 h LEU 69 N -0.05 0.51 0.15 1.44 3.38 -1.06 0.68 115.31 120.36 1dl3 h LEU 69 Ca 0.26 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1dl3 h LEU 69 Cb 0.45 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1dl3 h LEU 69 CO -0.59 0.42 -0.14 0.44 0.09 0.00 0.00 178.44 178.65 1dl3 h ASP 70 N 0.57 -0.36 0.02 -0.43 5.19 -0.58 -0.43 116.42 120.39 1dl3 h ASP 70 Ca 0.15 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 56.61 1dl3 h ASP 70 Cb -0.00 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.61 1dl3 h ASP 70 CO -0.03 -0.21 -0.09 0.58 -3.12 0.00 0.00 179.24 176.37 1dl3 h VAL 71 N -0.31 0.77 -0.45 -1.35 2.07 -0.73 -1.08 116.25 115.17 1dl3 h VAL 71 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1dl3 h VAL 71 Cb 0.29 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 30.75 1dl3 h VAL 71 CO -0.03 0.00 -0.11 0.00 0.02 0.00 0.00 177.57 177.45 1dl3 h ALA 72 N 0.80 0.30 -0.51 1.67 0.00 -0.63 0.17 119.26 121.07 1dl3 h ALA 72 Ca 0.03 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.14 1dl3 h ALA 72 Cb 0.20 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1dl3 h ALA 72 CO -0.08 -0.44 0.30 1.03 0.00 0.00 0.00 179.25 180.05 1dl3 h SER 73 N 0.00 0.47 -0.28 0.00 0.87 -0.73 0.55 113.55 114.42 1dl3 h SER 73 Ca 0.22 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.65 1dl3 h SER 73 Cb 0.33 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1dl3 h SER 73 CO -0.47 0.33 -0.37 0.22 -0.53 0.00 0.00 176.83 176.01 1dl3 h TYR 74 N 0.59 0.92 -0.00 2.24 3.20 -0.14 -3.11 116.97 120.67 1dl3 h TYR 74 Ca 0.21 -0.30 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1dl3 h TYR 74 Cb 0.04 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.13 1dl3 h TYR 74 CO -0.07 1.08 -0.16 0.28 -1.64 0.00 0.00 178.16 177.65 1dl3 n VAL 75 N -4.18 0.00 -3.32 1.81 0.31 0.50 -4.87 118.33 108.58 1dl3 n VAL 75 Ca -0.04 -0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.13 1dl3 n VAL 75 Cb 0.53 -0.26 0.08 0.00 -0.91 0.00 0.00 33.84 33.27 1dl3 n VAL 75 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1dl3 n GLN 76 N -1.49 -5.20 -1.88 5.55 6.02 0.10 -4.53 117.38 115.96 1dl3 n GLN 76 Ca 0.07 0.82 -0.31 0.00 -0.01 0.00 0.00 57.00 57.57 1dl3 n GLN 76 Cb 0.34 -5.72 0.01 0.00 1.02 0.00 0.00 30.24 25.88 1dl3 n GLN 76 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1dl3 s LEU 77 N -5.94 3.24 -0.12 1.08 1.43 -0.68 -4.87 118.68 112.82 1dl3 s LEU 77 Ca 0.12 1.44 0.06 0.00 -1.03 0.00 0.00 54.13 54.72 1dl3 s LEU 77 Cb -0.02 -4.47 -0.11 0.00 0.03 0.00 0.00 46.19 41.62 1dl3 s LEU 77 CO 0.71 -0.89 -0.03 0.59 0.23 0.00 0.00 176.35 176.95 1dl3 n ASN 78 N -2.72 2.65 -4.26 2.29 3.02 -0.51 -4.91 115.26 110.82 1dl3 n ASN 78 Ca 0.06 -0.03 -0.14 0.00 -0.03 0.00 0.00 54.58 54.44 1dl3 n ASN 78 Cb 0.54 0.34 -0.10 0.00 -0.61 0.00 0.00 39.78 39.94 1dl3 n ASN 78 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dl3 s ALA 79 N -2.26 1.45 -0.05 5.41 0.00 -0.92 -4.08 121.76 121.31 1dl3 s ALA 79 Ca -0.11 -1.69 -0.02 0.00 0.00 0.00 0.00 51.96 50.14 1dl3 s ALA 79 Cb 0.04 0.80 0.04 0.00 0.00 0.00 0.00 23.12 23.99 1dl3 s ALA 79 CO 0.38 -0.39 0.10 0.54 0.00 0.00 0.00 175.76 176.39 1dl3 s VAL 80 N -3.74 -0.08 -0.49 0.00 0.11 -0.51 -2.35 120.40 113.34 1dl3 s VAL 80 Ca 0.30 0.23 -0.09 0.00 -2.93 0.00 0.00 61.98 59.49 1dl3 s VAL 80 Cb 0.07 -0.19 0.12 0.00 -1.53 0.00 0.00 36.38 34.86 1dl3 s VAL 80 CO 0.08 0.10 0.37 -1.58 -3.33 0.00 0.00 175.10 170.73 1dl3 s GLN 81 N 1.34 2.53 -0.34 1.54 0.74 -0.07 -0.41 119.66 124.99 1dl3 s GLN 81 Ca -0.07 -1.81 -0.29 0.00 0.05 0.00 0.00 55.36 53.24 1dl3 s GLN 81 Cb -0.12 -3.95 -0.00 0.00 1.10 0.00 0.00 33.01 30.04 1dl3 s GLN 81 CO -0.05 -1.20 1.49 -0.51 -0.55 0.00 0.00 175.29 174.47 1dl3 s LEU 82 N 1.29 3.68 -0.32 3.68 1.43 -0.02 -2.21 118.68 126.20 1dl3 s LEU 82 Ca 0.06 1.12 0.09 0.00 -1.03 0.00 0.00 54.13 54.37 1dl3 s LEU 82 Cb -0.26 -3.54 0.58 0.00 0.03 0.00 0.00 46.19 43.00 1dl3 s LEU 82 CO -0.01 -1.38 1.61 1.57 0.23 0.00 0.00 176.35 178.37 1dl3 n HIS 83 N 8.79 1.73 -2.38 0.29 -0.00 0.70 -0.79 115.22 123.55 1dl3 n HIS 83 Ca 0.18 -1.55 0.00 0.00 0.46 0.00 0.00 57.72 56.81 1dl3 n HIS 83 Cb 0.47 -0.61 0.00 0.00 -0.12 0.00 0.00 29.99 29.73 1dl3 n HIS 83 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1dl3 n GLY 84 N -0.97 5.78 2.75 1.57 0.00 -1.26 -4.69 105.19 108.38 1dl3 n GLY 84 Ca 0.40 -1.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.41 1dl3 n GLY 84 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dl3 n GLU 85 N 0.00 4.03 -2.60 1.61 4.71 -1.26 -4.91 120.64 122.22 1dl3 n GLU 85 Ca 0.00 -3.97 -0.43 0.00 -0.01 0.00 0.00 57.16 52.75 1dl3 n GLU 85 Cb 0.00 -2.37 -0.02 0.00 -1.01 0.00 0.00 31.44 28.04 1dl3 n GLU 85 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1dl3 s GLU 86 N -3.92 4.32 0.41 3.49 8.01 -1.26 -5.01 118.70 124.73 1dl3 s GLU 86 Ca 0.47 1.47 -0.26 0.00 0.01 0.00 0.00 54.97 56.65 1dl3 s GLU 86 Cb 0.31 -3.62 -0.10 0.00 -4.31 0.00 0.00 34.13 26.41 1dl3 s GLU 86 CO -0.26 -0.52 1.37 -0.35 0.01 0.00 0.00 175.26 175.51 1dl3 n PRO 87 N 5.78 2.24 -0.32 0.39 -0.04 -1.26 -4.78 135.00 137.01 1dl3 n PRO 87 Ca 0.11 0.79 0.18 0.00 -0.04 0.00 0.00 63.50 64.54 1dl3 n PRO 87 Cb 0.47 -2.52 0.37 0.00 -0.04 0.00 0.00 33.50 31.78 1dl3 n PRO 87 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1dl3 h ILE 88 N 2.43 0.23 -0.33 0.52 5.03 -1.95 0.28 117.51 123.73 1dl3 h ILE 88 Ca -0.49 -0.06 -0.06 0.00 -0.12 0.00 0.00 64.86 64.12 1dl3 h ILE 88 Cb 1.27 0.03 -0.02 0.00 -3.03 0.00 0.00 36.82 35.08 1dl3 h ILE 88 CO 0.62 0.03 -0.06 -0.33 -0.68 0.00 0.00 178.15 177.73 1dl3 h GLU 89 N 0.19 0.53 -0.03 2.37 3.07 -2.00 -2.19 114.58 116.51 1dl3 h GLU 89 Ca 0.64 -0.13 -0.00 0.00 -0.50 0.00 0.00 59.36 59.37 1dl3 h GLU 89 Cb 1.40 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1dl3 h GLU 89 CO -0.69 0.59 0.01 1.25 -1.40 0.00 0.00 179.01 178.77 1dl3 h LEU 90 N 0.50 0.05 -1.35 1.33 5.85 -0.80 -2.15 115.31 118.73 1dl3 h LEU 90 Ca 0.10 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1dl3 h LEU 90 Cb 0.41 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1dl3 h LEU 90 CO 0.02 0.18 0.21 0.00 -0.34 0.00 0.00 178.44 178.51 1dl3 h ARG 92 N 0.65 0.21 -0.18 0.00 2.43 -1.17 0.25 114.38 116.58 1dl3 h ARG 92 Ca 0.16 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 1dl3 h ARG 92 Cb 0.10 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1dl3 h ARG 92 CO -0.02 0.71 -0.36 -0.22 -1.51 0.00 0.00 179.97 178.56 1dl3 h LYS 93 N 0.16 0.38 -0.02 0.20 3.64 -0.90 -2.14 116.57 117.90 1dl3 h LYS 93 Ca 0.00 -0.17 -0.18 0.00 -1.27 0.00 0.00 60.65 59.03 1dl3 h LYS 93 Cb 1.02 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1dl3 h LYS 93 CO 0.08 0.70 -0.69 0.82 -2.27 0.00 0.00 179.45 178.09 1dl3 h ILE 94 N 0.33 1.38 -0.03 2.00 1.08 -1.25 -3.17 117.51 117.85 1dl3 h ILE 94 Ca 0.04 -2.07 0.01 0.00 -0.39 0.00 0.00 64.86 62.44 1dl3 h ILE 94 Cb 0.79 2.47 -0.00 0.00 -3.07 0.00 0.00 36.82 37.01 1dl3 h ILE 94 CO 0.06 0.62 0.04 0.00 -0.69 0.00 0.00 178.15 178.18 1dl3 h ALA 95 N 0.37 1.46 0.00 1.87 0.00 -0.73 0.12 119.26 122.34 1dl3 h ALA 95 Ca -0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1dl3 h ALA 95 Cb 1.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1dl3 h ALA 95 CO 0.14 -0.05 0.00 0.93 0.00 0.00 0.00 179.25 180.27 1dl3 h GLU 96 N 0.00 0.00 0.00 0.00 5.08 -1.36 -3.24 114.58 115.06 1dl3 h GLU 96 Ca 0.01 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 1dl3 h GLU 96 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1dl3 h GLU 96 CO -0.00 0.00 -1.35 0.54 -1.00 0.00 0.00 179.01 177.20 1dl3 n ARG 97 N -2.96 2.36 -3.62 2.33 5.12 0.26 -5.08 116.66 115.06 1dl3 n ARG 97 Ca -0.00 -0.02 -0.15 0.00 -1.93 0.00 0.00 57.85 55.75 1dl3 n ARG 97 Cb 0.21 -1.14 -0.07 0.00 -1.16 0.00 0.00 32.46 30.30 1dl3 n ARG 97 CO 0.00 0.00 0.00 -1.50 -1.93 0.00 0.00 177.63 174.20 1dl3 s ILE 98 N -2.20 0.03 0.12 0.55 2.07 -0.33 -5.13 121.20 116.31 1dl3 s ILE 98 Ca -0.03 -0.23 -0.31 0.00 -1.41 0.00 0.00 60.65 58.67 1dl3 s ILE 98 Cb 0.02 -0.87 -0.10 0.00 0.13 0.00 0.00 42.46 41.64 1dl3 s ILE 98 CO 0.23 -0.13 1.80 -0.22 -1.91 0.00 0.00 174.94 174.71 1dl3 s LEU 99 N -1.44 4.39 0.04 8.50 0.20 -1.26 -3.78 118.68 125.33 1dl3 s LEU 99 Ca -0.10 2.73 0.08 0.00 0.69 0.00 0.00 54.13 57.52 1dl3 s LEU 99 Cb -0.02 -3.57 -0.03 0.00 -0.43 0.00 0.00 46.19 42.15 1dl3 s LEU 99 CO 0.05 -0.98 -0.23 0.68 -0.29 0.00 0.00 176.35 175.58 1dl3 s VAL 100 N 2.63 1.83 -0.06 1.68 -7.23 -1.26 -1.42 120.40 116.57 1dl3 s VAL 100 Ca 0.79 -1.24 0.03 0.00 -1.81 0.00 0.00 61.98 59.76 1dl3 s VAL 100 Cb -0.45 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 34.89 1dl3 s VAL 100 CO 0.35 0.29 -0.16 0.26 -0.31 0.00 0.00 175.10 175.54 1dl3 s TRP 101 N -0.77 2.67 -0.16 2.82 0.52 0.46 -3.98 118.94 120.50 1dl3 s TRP 101 Ca 0.09 -0.30 -0.05 0.00 0.02 0.00 0.00 56.10 55.86 1dl3 s TRP 101 Cb -0.09 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.54 1dl3 s TRP 101 CO 0.02 0.07 -0.01 0.21 0.02 0.00 0.00 176.95 177.26 1dl3 s LYS 102 N -0.49 3.73 -0.14 4.98 2.47 -0.13 -0.84 119.74 129.31 1dl3 s LYS 102 Ca 0.06 -0.47 -0.10 0.00 -1.56 0.00 0.00 55.97 53.90 1dl3 s LYS 102 Cb -0.12 -2.99 -0.05 0.00 -1.46 0.00 0.00 37.83 33.22 1dl3 s LYS 102 CO 0.02 0.28 0.21 0.00 0.16 0.00 0.00 175.35 176.01 1dl3 s ALA 103 N 0.30 3.74 -0.05 3.13 0.00 0.03 -0.68 121.76 128.21 1dl3 s ALA 103 Ca -0.01 -0.56 0.03 0.00 0.00 0.00 0.00 51.96 51.42 1dl3 s ALA 103 Cb -0.14 -2.18 0.01 0.00 0.00 0.00 0.00 23.12 20.82 1dl3 s ALA 103 CO 0.02 0.35 -0.12 0.08 0.00 0.00 0.00 175.76 176.09 1dl3 s VAL 104 N -0.31 1.10 0.25 0.00 1.01 -0.77 -4.56 120.40 117.13 1dl3 s VAL 104 Ca 0.15 -0.49 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 1dl3 s VAL 104 Cb -0.13 -0.99 -0.09 0.00 0.00 0.00 0.00 36.38 35.17 1dl3 s VAL 104 CO 0.04 0.34 1.18 -0.83 0.00 0.00 0.00 175.10 175.83 1dl3 s GLY 105 N 0.45 2.88 -0.11 4.51 0.00 -1.26 -1.55 107.32 112.24 1dl3 s GLY 105 Ca -0.10 0.99 0.00 0.00 0.00 0.00 0.00 44.72 45.62 1dl3 s GLY 105 CO 0.03 1.73 -0.09 0.14 0.00 0.00 0.00 173.10 174.91 1dl3 s VAL 106 N -0.69 1.11 0.00 1.40 1.01 -0.94 -4.87 120.40 117.43 1dl3 s VAL 106 Ca 0.49 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1dl3 s VAL 106 Cb -0.34 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 34.94 1dl3 s VAL 106 CO 0.41 0.38 0.00 -1.54 0.00 0.00 0.00 175.10 174.35 1dl3 n SER 107 N 4.72 1.48 -3.04 3.32 3.41 -1.26 -4.47 113.62 117.78 1dl3 n SER 107 Ca -0.15 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.35 1dl3 n SER 107 Cb 0.50 0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 64.60 1dl3 n SER 107 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1dl3 s ASN 108 N -1.62 0.41 0.38 4.04 4.22 -1.26 -5.05 114.94 116.05 1dl3 s ASN 108 Ca 0.00 -1.30 0.11 0.00 -2.14 0.00 0.00 52.86 49.53 1dl3 s ASN 108 Cb 0.00 0.78 0.89 0.00 1.28 0.00 0.00 41.25 44.20 1dl3 s ASN 108 CO 0.00 -1.53 1.88 -0.33 -2.04 0.00 0.00 177.10 175.07 1dl3 h GLU 109 N 2.04 0.59 0.00 3.55 4.39 -2.00 -2.43 114.58 120.71 1dl3 h GLU 109 Ca -0.31 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.33 1dl3 h GLU 109 Cb 1.25 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1dl3 h GLU 109 CO 0.40 0.39 -0.14 0.07 -1.16 0.00 0.00 179.01 178.56 1dl3 h ARG 110 N 0.60 0.00 0.00 2.33 0.11 -2.01 -2.09 114.38 113.32 1dl3 h ARG 110 Ca 0.43 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.46 1dl3 h ARG 110 Cb 0.80 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.87 1dl3 h ARG 110 CO -0.19 0.14 -0.28 -0.44 0.10 0.00 0.00 179.97 179.31 1dl3 h ASP 111 N 0.00 0.00 -0.38 0.08 3.32 -1.77 -1.34 116.42 116.34 1dl3 h ASP 111 Ca -0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1dl3 h ASP 111 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1dl3 h ASP 111 CO 0.02 0.28 -0.26 0.24 -1.72 0.00 0.00 179.24 177.79 1dl3 h MET 112 N 0.00 0.85 -0.44 3.56 2.86 -1.50 -0.47 114.93 119.79 1dl3 h MET 112 Ca -0.00 -0.41 -0.14 0.00 -2.06 0.00 0.00 59.70 57.10 1dl3 h MET 112 Cb 0.50 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1dl3 h MET 112 CO 0.04 1.05 -0.26 0.93 1.06 0.00 0.00 176.91 179.72 1dl3 h GLU 113 N 0.65 0.94 -0.86 1.72 5.08 -1.46 -1.41 114.58 119.24 1dl3 h GLU 113 Ca 0.07 -0.42 0.05 0.00 -1.00 0.00 0.00 59.36 58.07 1dl3 h GLU 113 Cb 0.84 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.01 1dl3 h GLU 113 CO 0.07 1.08 0.54 -0.09 -1.00 0.00 0.00 179.01 179.61 1dl3 h ARG 114 N 0.80 0.97 -0.71 2.33 2.43 -1.08 -2.22 114.38 116.90 1dl3 h ARG 114 Ca 0.10 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1dl3 h ARG 114 Cb 0.83 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 1dl3 h ARG 114 CO 0.07 0.64 0.25 0.00 -1.51 0.00 0.00 179.97 179.43 1dl3 h ALA 115 N 1.39 1.11 -0.18 2.80 0.00 -0.52 -2.68 119.26 121.18 1dl3 h ALA 115 Ca 0.37 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1dl3 h ALA 115 Cb 0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1dl3 h ALA 115 CO -0.16 0.62 0.22 -0.07 0.00 0.00 0.00 179.25 179.86 1dl3 h LEU 116 N 1.04 0.00 -0.69 0.00 3.38 -0.62 0.94 115.31 119.35 1dl3 h LEU 116 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1dl3 h LEU 116 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1dl3 h LEU 116 CO -0.01 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.11 1dl3 n ASN 117 N -3.70 0.46 -0.23 -0.43 3.02 -1.01 -1.46 115.26 111.91 1dl3 n ASN 117 Ca 0.02 0.64 0.08 0.00 -0.03 0.00 0.00 54.58 55.29 1dl3 n ASN 117 Cb 0.34 -0.73 0.14 0.00 -0.61 0.00 0.00 39.78 38.91 1dl3 n ASN 117 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1dl3 n TYR 118 N -2.04 0.00 0.17 3.10 4.01 0.32 -4.81 117.16 117.91 1dl3 n TYR 118 Ca 0.01 -0.98 0.18 0.00 -0.16 0.00 0.00 57.90 56.95 1dl3 n TYR 118 Cb 0.15 -0.16 0.80 0.00 -0.31 0.00 0.00 39.34 39.82 1dl3 n TYR 118 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 1dl3 h ARG 119 N 0.19 0.00 0.00 -0.72 0.11 -1.19 -1.50 114.38 111.27 1dl3 h ARG 119 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1dl3 h ARG 119 Cb 1.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.14 1dl3 h ARG 119 CO 0.00 0.00 0.00 -0.85 0.10 0.00 0.00 179.97 179.22 1dl3 n GLU 120 N -3.83 0.11 -4.30 0.08 0.28 -1.26 -4.19 120.64 107.54 1dl3 n GLU 120 Ca 0.03 0.35 -0.28 0.00 -0.16 0.00 0.00 57.16 57.10 1dl3 n GLU 120 Cb 0.39 -1.72 -0.10 0.00 1.43 0.00 0.00 31.44 31.44 1dl3 n GLU 120 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1dl3 s PHE 121 N -3.19 2.59 0.17 -1.84 0.08 -0.57 -5.03 117.98 110.20 1dl3 s PHE 121 Ca 0.05 -0.24 -0.33 0.00 0.12 0.00 0.00 56.93 56.54 1dl3 s PHE 121 Cb 0.09 -1.31 -0.13 0.00 -0.57 0.00 0.00 43.02 41.11 1dl3 s PHE 121 CO 0.34 0.46 1.67 -2.30 -0.10 0.00 0.00 175.22 175.29 1dl3 n PRO 122 N 0.36 2.48 -3.95 0.24 -0.02 -1.26 -4.73 135.00 128.13 1dl3 n PRO 122 Ca -0.13 0.90 -0.35 0.00 -2.02 0.00 0.00 63.50 61.90 1dl3 n PRO 122 Cb 0.54 -2.71 -0.08 0.00 -0.02 0.00 0.00 33.50 31.23 1dl3 n PRO 122 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1dl3 s ILE 123 N 1.23 5.07 -0.29 4.25 -1.09 -1.05 -0.96 121.20 128.36 1dl3 s ILE 123 Ca 0.78 0.06 -0.02 0.00 -2.23 0.00 0.00 60.65 59.23 1dl3 s ILE 123 Cb -0.59 -3.25 0.04 0.00 -1.58 0.00 0.00 42.46 37.08 1dl3 s ILE 123 CO 0.36 0.52 -0.01 -0.22 -1.23 0.00 0.00 174.94 174.35 1dl3 s LEU 124 N -0.17 3.75 -0.24 2.97 0.20 0.14 0.17 118.68 125.50 1dl3 s LEU 124 Ca 0.09 -1.17 -0.24 0.00 0.69 0.00 0.00 54.13 53.50 1dl3 s LEU 124 Cb -0.12 -1.71 -0.01 0.00 -0.43 0.00 0.00 46.19 43.92 1dl3 s LEU 124 CO 0.01 -0.23 0.79 -0.76 -0.29 0.00 0.00 176.35 175.87 1dl3 s LEU 125 N 1.28 4.09 -1.18 -0.68 1.43 0.62 -1.84 118.68 122.40 1dl3 s LEU 125 Ca -0.04 0.99 -0.13 0.00 -1.03 0.00 0.00 54.13 53.92 1dl3 s LEU 125 Cb -0.19 -3.13 0.20 0.00 0.03 0.00 0.00 46.19 43.10 1dl3 s LEU 125 CO -0.02 -0.48 1.34 -1.81 0.23 0.00 0.00 176.35 175.61 1dl3 s ASP 126 N 1.34 7.14 0.00 2.29 1.11 -0.60 -1.51 116.67 126.44 1dl3 s ASP 126 Ca 0.33 -3.15 0.00 0.00 0.18 0.00 0.00 52.55 49.91 1dl3 s ASP 126 Cb -0.15 -2.35 0.00 0.00 1.07 0.00 0.00 42.92 41.49 1dl3 s ASP 126 CO 0.08 -0.62 0.00 0.41 1.18 0.00 0.00 175.17 176.22 1dl3 n THR 127 N 4.09 0.00 -0.84 -1.27 -1.04 -0.42 -2.21 114.28 112.58 1dl3 n THR 127 Ca 0.33 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.34 1dl3 n THR 127 Cb 0.42 -0.79 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 1dl3 n THR 127 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1dl3 n ASP 140 N 0.00 0.00 0.07 8.00 5.68 -1.26 -4.69 116.55 124.35 1dl3 n ASP 140 Ca 0.00 0.51 0.10 0.00 -0.50 0.00 0.00 54.79 54.90 1dl3 n ASP 140 Cb 0.00 -0.76 -0.04 0.00 -1.14 0.00 0.00 41.12 39.17 1dl3 n ASP 140 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1dl3 n TRP 141 N 1.25 0.76 -0.32 2.11 5.03 -1.26 -4.46 117.44 120.55 1dl3 n TRP 141 Ca 0.00 0.22 0.07 0.00 3.03 0.00 0.00 57.50 60.83 1dl3 n TRP 141 Cb 0.00 -0.87 0.16 0.00 -1.03 0.00 0.00 31.31 29.57 1dl3 n TRP 141 CO 0.00 0.00 0.00 -1.13 -0.03 0.00 0.00 177.69 176.53 1dl3 n SER 142 N -2.61 -0.27 -0.17 -0.99 3.41 -1.26 -1.46 113.62 110.28 1dl3 n SER 142 Ca -0.02 1.55 0.14 0.00 -0.26 0.00 0.00 58.87 60.28 1dl3 n SER 142 Cb 0.58 -0.49 0.60 0.00 -0.26 0.00 0.00 64.21 64.64 1dl3 n SER 142 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dl3 n LEU 143 N -5.44 0.63 0.10 1.04 -0.00 -1.26 -3.80 117.00 108.28 1dl3 n LEU 143 Ca 0.16 -0.09 -0.04 0.00 -0.00 0.00 0.00 56.01 56.04 1dl3 n LEU 143 Cb 0.51 -0.14 0.06 0.00 -0.00 0.00 0.00 43.42 43.85 1dl3 n LEU 143 CO -0.10 0.11 0.35 0.40 -0.00 0.00 0.00 177.39 178.16 1dl3 h ILE 144 N 0.82 1.53 -0.89 1.47 2.04 -1.54 -3.37 117.51 117.56 1dl3 h ILE 144 Ca 0.00 -2.58 0.09 0.00 1.00 0.00 0.00 64.86 63.38 1dl3 h ILE 144 Cb 0.36 2.39 -0.12 0.00 -0.74 0.00 0.00 36.82 38.72 1dl3 h ILE 144 CO 0.00 0.74 -0.55 -0.07 0.00 0.00 0.00 178.15 178.27 1dl3 h LEU 145 N 0.02 -1.98 0.00 1.44 3.38 -1.69 0.00 115.31 116.48 1dl3 h LEU 145 Ca -0.01 0.31 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1dl3 h LEU 145 Cb 1.35 0.88 0.00 0.00 0.09 0.00 0.00 40.66 42.99 1dl3 h LEU 145 CO 0.10 -0.27 0.00 -0.81 0.09 0.00 0.00 178.44 177.55 1dl3 n PRO 146 N -5.31 0.08 0.00 1.13 -0.04 -1.26 -2.33 135.00 127.27 1dl3 n PRO 146 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1dl3 n PRO 146 Cb 0.30 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 1dl3 n PRO 146 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1dl3 n TYR 147 N -0.99 0.00 -0.12 0.54 4.01 -0.15 -4.88 117.16 115.57 1dl3 n TYR 147 Ca 0.02 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.80 1dl3 n TYR 147 Cb 0.01 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.13 1dl3 n TYR 147 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1dl3 n ARG 148 N -1.34 -0.03 -0.22 -0.72 0.00 -0.41 0.10 116.66 114.05 1dl3 n ARG 148 Ca 0.00 0.50 0.00 0.00 -0.00 0.00 0.00 57.85 58.36 1dl3 n ARG 148 Cb 0.12 -0.79 0.09 0.00 0.00 0.00 0.00 32.46 31.88 1dl3 n ARG 148 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1dl3 n ASP 149 N -4.31 2.28 -0.04 6.15 8.00 -1.26 -3.44 116.55 123.92 1dl3 n ASP 149 Ca 0.07 -2.24 0.01 0.00 0.71 0.00 0.00 54.79 53.34 1dl3 n ASP 149 Cb 0.24 -0.55 -0.11 0.00 -0.02 0.00 0.00 41.12 40.68 1dl3 n ASP 149 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1dl3 n ARG 150 N 0.14 1.05 -3.34 -1.24 5.12 0.12 -5.00 116.66 113.51 1dl3 n ARG 150 Ca 0.08 -0.08 -0.38 0.00 -1.93 0.00 0.00 57.85 55.54 1dl3 n ARG 150 Cb 0.52 -1.36 -0.06 0.00 -1.16 0.00 0.00 32.46 30.40 1dl3 n ARG 150 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1dl3 s PHE 151 N -2.72 3.74 0.00 -1.55 0.08 -1.22 -4.98 117.98 111.34 1dl3 s PHE 151 Ca -0.06 1.15 0.00 0.00 0.12 0.00 0.00 56.93 58.13 1dl3 s PHE 151 Cb 0.07 -2.45 0.00 0.00 -0.57 0.00 0.00 43.02 40.07 1dl3 s PHE 151 CO 0.61 0.54 0.65 0.54 -0.10 0.00 0.00 175.22 177.46 1dl3 n ARG 152 N 2.04 0.00 -3.80 0.44 1.74 -1.26 -4.53 116.66 111.29 1dl3 n ARG 152 Ca -0.11 0.22 -0.30 0.00 -0.77 0.00 0.00 57.85 56.90 1dl3 n ARG 152 Cb 0.51 -1.15 -0.14 0.00 -1.02 0.00 0.00 32.46 30.66 1dl3 n ARG 152 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1dl3 s TYR 153 N -1.59 2.33 0.13 -1.55 2.02 -1.26 -5.00 117.35 112.43 1dl3 s TYR 153 Ca 0.00 -2.36 -0.30 0.00 -0.37 0.00 0.00 57.07 54.04 1dl3 s TYR 153 Cb 0.00 -2.11 -0.06 0.00 -0.40 0.00 0.00 41.96 39.38 1dl3 s TYR 153 CO 0.00 -0.84 0.95 -1.17 -1.57 0.00 0.00 175.55 172.91 1dl3 s LEU 154 N 0.85 4.53 -0.07 -1.29 2.96 -1.26 -2.52 118.68 121.87 1dl3 s LEU 154 Ca 0.14 1.81 0.05 0.00 -0.22 0.00 0.00 54.13 55.91 1dl3 s LEU 154 Cb -0.21 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.90 1dl3 s LEU 154 CO -0.10 -0.02 -0.24 -0.69 -1.32 0.00 0.00 176.35 173.98 1dl3 s VAL 155 N -0.25 1.99 -0.13 1.68 1.01 0.13 -1.67 120.40 123.17 1dl3 s VAL 155 Ca 0.45 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1dl3 s VAL 155 Cb -0.24 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1dl3 s VAL 155 CO 0.30 0.55 0.03 -0.22 0.00 0.00 0.00 175.10 175.76 1dl3 s LEU 156 N 0.06 3.69 0.05 3.92 2.96 -0.94 -0.28 118.68 128.14 1dl3 s LEU 156 Ca -0.10 0.12 -0.09 0.00 -0.22 0.00 0.00 54.13 53.85 1dl3 s LEU 156 Cb -0.15 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.65 1dl3 s LEU 156 CO 0.06 0.29 0.18 -0.55 -1.32 0.00 0.00 176.35 175.00 1dl3 s SER 157 N -0.33 0.08 0.00 3.68 0.15 -0.57 0.10 113.70 116.81 1dl3 s SER 157 Ca 0.08 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1dl3 s SER 157 Cb -0.12 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 1dl3 s SER 157 CO 0.02 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.49 1dl3 n GLY 158 N 0.55 2.58 2.35 9.45 0.00 -1.26 -1.30 105.19 117.55 1dl3 n GLY 158 Ca -0.18 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 1dl3 n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dl3 n GLY 159 N 0.00 0.89 3.78 -0.02 0.00 -1.26 -4.90 105.19 103.68 1dl3 n GLY 159 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1dl3 n GLY 159 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dl3 s LEU 160 N -2.49 3.51 0.22 0.99 1.43 -1.26 -4.99 118.68 116.10 1dl3 s LEU 160 Ca 0.00 1.98 -0.22 0.00 -1.03 0.00 0.00 54.13 54.86 1dl3 s LEU 160 Cb 0.00 -4.55 0.06 0.00 0.03 0.00 0.00 46.19 41.73 1dl3 s LEU 160 CO 0.00 -1.37 0.92 0.54 0.23 0.00 0.00 176.35 176.67 1dl3 s ASN 161 N -2.45 -0.10 0.24 2.29 2.20 -1.26 -4.06 114.94 111.79 1dl3 s ASN 161 Ca 0.67 -0.65 -0.06 0.00 -0.94 0.00 0.00 52.86 51.88 1dl3 s ASN 161 Cb -0.20 0.59 0.43 0.00 -2.00 0.00 0.00 41.25 40.08 1dl3 s ASN 161 CO 0.36 -1.14 1.68 -0.65 -2.94 0.00 0.00 177.10 174.42 1dl3 h PRO 162 N 2.00 0.25 -0.76 3.55 0.11 -1.88 -2.26 132.00 133.01 1dl3 h PRO 162 Ca -0.26 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.83 1dl3 h PRO 162 Cb 1.23 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1dl3 h PRO 162 CO 0.31 0.16 0.45 0.93 -0.21 0.00 0.00 178.00 179.64 1dl3 h GLU 163 N 0.25 1.04 -0.01 1.05 3.07 -1.96 -3.30 114.58 114.73 1dl3 h GLU 163 Ca 0.40 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1dl3 h GLU 163 Cb 0.67 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 1dl3 h GLU 163 CO -0.50 0.75 -0.66 0.27 -1.40 0.00 0.00 179.01 177.47 1dl3 n ASN 164 N -4.48 1.66 0.01 1.42 0.23 -1.07 -4.60 115.26 108.42 1dl3 n ASN 164 Ca 0.07 -1.33 -0.10 0.00 -0.53 0.00 0.00 54.58 52.69 1dl3 n ASN 164 Cb 0.07 0.66 -0.03 0.00 -2.08 0.00 0.00 39.78 38.40 1dl3 n ASN 164 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 1dl3 h VAL 165 N 1.57 0.67 -0.72 3.53 -1.51 -1.49 -1.56 116.25 116.74 1dl3 h VAL 165 Ca 0.00 0.00 0.16 0.00 -1.23 0.00 0.00 66.70 65.63 1dl3 h VAL 165 Cb 0.66 0.67 -0.12 0.00 -2.13 0.00 0.00 31.29 30.38 1dl3 h VAL 165 CO 0.00 0.00 0.09 0.03 -1.23 0.00 0.00 177.57 176.46 1dl3 h ARG 166 N -0.15 0.18 -0.45 5.19 2.47 -1.81 0.15 114.38 119.96 1dl3 h ARG 166 Ca 0.08 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.77 1dl3 h ARG 166 Cb 0.26 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 1dl3 h ARG 166 CO -0.20 0.12 0.20 0.77 0.56 0.00 0.00 179.97 181.42 1dl3 h SER 167 N 0.18 0.60 0.09 7.04 0.02 -1.75 -1.46 113.55 118.28 1dl3 h SER 167 Ca 0.40 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1dl3 h SER 167 Cb 0.70 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1dl3 h SER 167 CO -0.57 0.58 -0.04 0.00 -1.14 0.00 0.00 176.83 175.65 1dl3 h ALA 168 N 1.05 -0.12 0.10 3.77 0.00 -0.10 -2.99 119.26 120.96 1dl3 h ALA 168 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1dl3 h ALA 168 Cb 0.15 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1dl3 h ALA 168 CO -0.02 -0.53 -0.06 0.82 0.00 0.00 0.00 179.25 179.47 1dl3 h ILE 169 N -0.21 0.87 -0.90 0.00 2.04 -0.67 -2.37 117.51 116.27 1dl3 h ILE 169 Ca -0.01 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.01 1dl3 h ILE 169 Cb 0.17 0.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.05 1dl3 h ILE 169 CO 0.02 0.00 0.58 0.44 0.00 0.00 0.00 178.15 179.19 1dl3 h ASP 170 N -0.15 0.61 0.08 1.72 3.32 -1.28 0.49 116.42 121.21 1dl3 h ASP 170 Ca -0.01 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1dl3 h ASP 170 Cb 0.13 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1dl3 h ASP 170 CO 0.01 0.29 -0.04 0.58 -1.72 0.00 0.00 179.24 178.35 1dl3 h VAL 171 N 0.63 0.88 0.06 -1.35 2.07 -1.38 -3.40 116.25 113.77 1dl3 h VAL 171 Ca 0.47 -1.42 -0.28 0.00 0.82 0.00 0.00 66.70 66.28 1dl3 h VAL 171 Cb 0.84 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1dl3 h VAL 171 CO -0.22 0.27 -1.49 0.58 0.02 0.00 0.00 177.57 176.73 1dl3 h VAL 172 N -0.94 1.16 -6.08 2.57 2.07 -1.28 -3.49 116.25 110.26 1dl3 h VAL 172 Ca -0.01 -2.88 -0.37 0.00 0.82 0.00 0.00 66.70 64.26 1dl3 h VAL 172 Cb 0.52 2.67 0.09 0.00 -1.52 0.00 0.00 31.29 33.06 1dl3 h VAL 172 CO 0.02 0.77 -0.86 0.54 0.02 0.00 0.00 177.57 178.06 1dl3 n ARG 173 N -3.32 -1.38 -2.48 1.57 1.74 0.17 -4.98 116.66 107.98 1dl3 n ARG 173 Ca -0.14 0.62 -0.28 0.00 -0.77 0.00 0.00 57.85 57.29 1dl3 n ARG 173 Cb 1.02 -4.37 0.01 0.00 -1.02 0.00 0.00 32.46 28.10 1dl3 n ARG 173 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1dl3 s PRO 174 N -5.43 3.43 0.13 5.56 0.04 -1.26 -5.02 135.00 132.45 1dl3 s PRO 174 Ca 0.40 0.24 -0.19 0.00 0.04 0.00 0.00 61.00 61.49 1dl3 s PRO 174 Cb -0.13 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 1dl3 s PRO 174 CO 0.84 -0.35 1.74 0.35 0.04 0.00 0.00 177.00 179.62 1dl3 h PHE 175 N 0.07 0.09 -4.37 0.56 3.57 -1.65 -3.45 116.94 111.75 1dl3 h PHE 175 Ca -0.46 0.01 -0.18 0.00 3.53 0.00 0.00 57.97 60.87 1dl3 h PHE 175 Cb 1.21 -0.01 -0.14 0.00 2.79 0.00 0.00 35.95 39.80 1dl3 h PHE 175 CO 0.57 0.03 -0.57 0.00 -2.23 0.00 0.00 178.31 176.11 1dl3 s ALA 176 N -6.18 0.79 0.02 2.41 0.00 -1.13 -1.99 121.76 115.67 1dl3 s ALA 176 Ca -0.13 -1.43 0.07 0.00 0.00 0.00 0.00 51.96 50.47 1dl3 s ALA 176 Cb 0.10 1.03 -0.02 0.00 0.00 0.00 0.00 23.12 24.23 1dl3 s ALA 176 CO 0.69 -0.56 -0.22 0.54 0.00 0.00 0.00 175.76 176.21 1dl3 s VAL 177 N -4.07 1.78 0.01 0.00 0.11 -0.07 -2.22 120.40 115.95 1dl3 s VAL 177 Ca 0.28 -1.12 0.08 0.00 -2.93 0.00 0.00 61.98 58.29 1dl3 s VAL 177 Cb 0.06 -1.51 -0.02 0.00 -1.53 0.00 0.00 36.38 33.38 1dl3 s VAL 177 CO 0.05 0.35 -0.25 -0.62 -3.33 0.00 0.00 175.10 171.30 1dl3 s ASP 178 N -0.91 3.00 0.10 3.54 2.15 0.11 -0.97 116.67 123.70 1dl3 s ASP 178 Ca 0.09 -0.52 -0.13 0.00 0.43 0.00 0.00 52.55 52.42 1dl3 s ASP 178 Cb -0.09 -0.30 0.02 0.00 -0.30 0.00 0.00 42.92 42.25 1dl3 s ASP 178 CO 0.01 0.28 0.30 0.54 -0.17 0.00 0.00 175.17 176.12 1dl3 s VAL 179 N -0.70 0.10 0.00 1.11 0.11 -0.91 -4.34 120.40 115.78 1dl3 s VAL 179 Ca 0.10 -0.84 0.00 0.00 -2.93 0.00 0.00 61.98 58.32 1dl3 s VAL 179 Cb -0.10 -1.21 0.00 0.00 -1.53 0.00 0.00 36.38 33.54 1dl3 s VAL 179 CO 0.01 -0.46 0.00 -0.24 -3.33 0.00 0.00 175.10 171.07 1dl3 n SER 180 N -0.06 0.00 0.26 3.54 2.88 -1.26 -0.12 113.62 118.86 1dl3 n SER 180 Ca -0.16 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.55 1dl3 n SER 180 Cb 0.63 0.05 0.65 0.00 -0.75 0.00 0.00 64.21 64.79 1dl3 n SER 180 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1dl3 h SER 181 N 0.00 0.00 0.24 -3.46 4.64 -1.91 -2.90 113.55 110.16 1dl3 h SER 181 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dl3 h SER 181 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1dl3 h SER 181 CO 0.00 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 177.19 1dl3 h GLY 182 N 2.12 0.00 -3.54 -0.77 0.00 -1.93 -2.82 103.07 96.14 1dl3 h GLY 182 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 1dl3 h GLY 182 CO 0.00 0.00 -0.86 3.33 0.00 0.00 0.00 176.54 179.01 1dl3 n VAL 183 N -2.32 1.84 -4.16 4.60 0.24 -1.09 -4.62 118.33 112.81 1dl3 n VAL 183 Ca -0.00 -3.31 -0.28 0.00 -2.04 0.00 0.00 64.34 58.70 1dl3 n VAL 183 Cb 0.10 -0.08 -0.08 0.00 -1.47 0.00 0.00 33.84 32.31 1dl3 n VAL 183 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1dl3 s GLU 184 N -3.15 2.48 -0.05 7.34 2.02 -1.07 0.02 118.70 126.29 1dl3 s GLU 184 Ca 0.40 -0.96 0.13 0.00 0.02 0.00 0.00 54.97 54.56 1dl3 s GLU 184 Cb 0.38 -2.45 -0.23 0.00 0.10 0.00 0.00 34.13 31.92 1dl3 s GLU 184 CO -0.03 0.50 0.63 0.00 0.02 0.00 0.00 175.26 176.38 1dl3 n ALA 185 N 0.23 1.51 -3.62 5.21 0.00 -0.03 -4.58 120.51 119.23 1dl3 n ALA 185 Ca -0.10 -0.80 -0.04 0.00 0.00 0.00 0.00 53.44 52.50 1dl3 n ALA 185 Cb 0.53 -0.81 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 1dl3 n ALA 185 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1dl3 s PHE 186 N -2.60 -0.10 -0.12 0.00 -0.12 -1.21 -5.06 117.98 108.77 1dl3 s PHE 186 Ca -0.05 0.11 -0.32 0.00 -0.05 0.00 0.00 56.93 56.62 1dl3 s PHE 186 Cb 0.08 0.50 -0.15 0.00 -0.63 0.00 0.00 43.02 42.82 1dl3 s PHE 186 CO 0.83 -0.14 0.94 -2.30 -0.05 0.00 0.00 175.22 174.50 1dl3 n PRO 187 N 0.16 0.00 0.00 1.99 -0.02 -1.26 -0.94 135.00 134.93 1dl3 n PRO 187 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1dl3 n PRO 187 Cb 0.58 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.91 1dl3 n PRO 187 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dl3 n GLY 188 N 1.74 2.96 3.34 -1.23 0.00 -1.26 -4.98 105.19 105.76 1dl3 n GLY 188 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1dl3 n GLY 188 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dl3 s LYS 189 N -0.12 3.39 0.16 1.61 2.47 -0.12 -4.10 119.74 123.04 1dl3 s LYS 189 Ca 0.00 -0.64 -0.21 0.00 -1.56 0.00 0.00 55.97 53.56 1dl3 s LYS 189 Cb 0.00 -2.87 -0.08 0.00 -1.46 0.00 0.00 37.83 33.43 1dl3 s LYS 189 CO 0.00 -0.04 0.68 0.15 0.16 0.00 0.00 175.35 176.31 1dl3 s LYS 190 N 1.03 4.31 -0.55 4.03 -0.14 -1.26 -0.85 119.74 126.31 1dl3 s LYS 190 Ca -0.00 0.89 -0.24 0.00 -1.36 0.00 0.00 55.97 55.26 1dl3 s LYS 190 Cb -0.15 -3.09 0.04 0.00 -1.68 0.00 0.00 37.83 32.96 1dl3 s LYS 190 CO -0.01 0.52 0.91 0.34 -0.76 0.00 0.00 175.35 176.35 1dl3 s ASP 191 N -1.37 6.32 0.36 2.83 -1.08 0.10 -4.61 116.67 119.22 1dl3 s ASP 191 Ca 0.37 -0.42 0.12 0.00 -0.52 0.00 0.00 52.55 52.10 1dl3 s ASP 191 Cb -0.19 -2.42 0.94 0.00 -1.46 0.00 0.00 42.92 39.78 1dl3 s ASP 191 CO 0.22 -1.20 1.78 0.45 0.52 0.00 0.00 175.17 176.94 1dl3 h HIS 192 N 9.29 0.84 -0.12 -5.34 3.86 -1.96 0.81 115.15 122.53 1dl3 h HIS 192 Ca -0.26 0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 58.88 1dl3 h HIS 192 Cb 1.08 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.28 1dl3 h HIS 192 CO 0.90 0.14 -0.35 0.22 0.86 0.00 0.00 177.93 179.70 1dl3 h ASP 193 N 0.56 0.25 0.34 2.45 3.58 -1.96 -2.64 116.42 118.99 1dl3 h ASP 193 Ca 0.57 -0.09 -0.19 0.00 0.42 0.00 0.00 57.03 57.74 1dl3 h ASP 193 Cb 1.18 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 42.16 1dl3 h ASP 193 CO -0.33 0.59 -0.79 0.28 -2.88 0.00 0.00 179.24 176.11 1dl3 h SER 194 N 0.21 0.44 -0.42 2.28 0.02 -1.21 -2.31 113.55 112.57 1dl3 h SER 194 Ca 0.02 -0.31 -0.07 0.00 -0.84 0.00 0.00 61.79 60.60 1dl3 h SER 194 Cb 0.73 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1dl3 h SER 194 CO 0.06 1.06 0.00 0.40 -1.14 0.00 0.00 176.83 177.21 1dl3 h ILE 195 N 0.23 1.26 0.12 3.27 2.04 -1.14 0.36 117.51 123.65 1dl3 h ILE 195 Ca -0.04 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.80 1dl3 h ILE 195 Cb 1.38 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1dl3 h ILE 195 CO 0.13 0.35 -0.09 0.50 0.00 0.00 0.00 178.15 179.04 1dl3 h LYS 196 N 0.57 -0.20 -0.80 2.37 3.64 -1.46 -1.84 116.57 118.85 1dl3 h LYS 196 Ca 0.12 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1dl3 h LYS 196 Cb 0.48 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 1dl3 h LYS 196 CO 0.02 -0.14 0.35 0.52 -2.27 0.00 0.00 179.45 177.94 1dl3 h MET 197 N -0.21 1.17 -0.22 1.90 2.86 -1.35 -0.54 114.93 118.55 1dl3 h MET 197 Ca -0.01 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 1dl3 h MET 197 Cb 0.19 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1dl3 h MET 197 CO -0.00 0.93 0.09 0.35 1.06 0.00 0.00 176.91 179.34 1dl3 h PHE 198 N 1.14 0.33 -0.33 -0.22 3.04 -0.71 -0.68 116.94 119.52 1dl3 h PHE 198 Ca 0.27 -0.02 -0.17 0.00 3.98 0.00 0.00 57.97 62.03 1dl3 h PHE 198 Cb 0.17 -0.10 -0.00 0.00 2.56 0.00 0.00 35.95 38.58 1dl3 h PHE 198 CO 0.02 0.35 -0.45 0.82 -2.02 0.00 0.00 178.31 177.02 1dl3 h ILE 199 N 0.21 1.28 0.29 1.41 2.04 -1.27 -0.90 117.51 120.57 1dl3 h ILE 199 Ca 0.07 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 64.30 1dl3 h ILE 199 Cb 0.16 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 1dl3 h ILE 199 CO -0.01 0.54 -0.37 0.50 0.00 0.00 0.00 178.15 178.81 1dl3 h LYS 200 N 0.68 -0.68 -0.04 2.37 3.64 -0.92 -1.57 116.57 120.06 1dl3 h LYS 200 Ca 0.04 0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1dl3 h LYS 200 Cb 1.04 0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1dl3 h LYS 200 CO 0.10 -0.45 0.03 -0.91 -2.27 0.00 0.00 179.45 175.95 1dl3 h ASN 201 N -0.71 0.05 -0.10 4.20 4.21 -1.13 -2.32 115.58 119.79 1dl3 h ASN 201 Ca -0.01 -0.05 0.04 0.00 1.21 0.00 0.00 56.30 57.49 1dl3 h ASN 201 Cb 0.66 -0.01 -0.06 0.00 -1.12 0.00 0.00 38.32 37.79 1dl3 h ASN 201 CO -0.11 0.09 -0.42 0.00 -1.29 0.00 0.00 177.43 175.69 1dl3 h ALA 202 N 0.96 -0.62 -0.00 -0.83 0.00 -0.94 -2.44 119.26 115.39 1dl3 h ALA 202 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1dl3 h ALA 202 Cb 0.05 0.79 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1dl3 h ALA 202 CO -0.00 -0.94 -0.07 1.63 0.00 0.00 0.00 179.25 179.87 1dl3 n LYS 203 N -5.44 0.33 -1.98 0.00 5.02 -0.61 -4.90 118.16 110.59 1dl3 n LYS 203 Ca -0.05 -0.05 -0.02 0.00 -2.02 0.00 0.00 58.31 56.17 1dl3 n LYS 203 Cb 0.36 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 1dl3 n LYS 203 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dl3 n GLY 204 N 1.36 -0.84 0.42 0.72 0.00 -0.92 -4.91 105.19 101.02 1dl3 n GLY 204 Ca 0.12 0.29 0.05 0.00 0.00 0.00 0.00 46.02 46.48 1dl3 n GLY 204 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36