#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl1 s SER 2 N 0.00 3.76 -0.19 1.61 1.04 -1.26 -5.17 113.70 113.50 2dl1 s SER 2 Ca 0.00 -1.71 -0.18 0.00 0.48 0.00 0.00 55.95 54.54 2dl1 s SER 2 Cb 0.00 0.64 0.05 0.00 0.10 0.00 0.00 66.02 66.81 2dl1 s SER 2 CO 0.00 -0.94 0.52 -0.94 0.98 0.00 0.00 173.24 172.86 2dl1 s SER 3 N -3.82 -0.53 0.00 7.02 1.04 -1.26 -5.13 113.70 111.02 2dl1 s SER 3 Ca 0.08 1.01 0.00 0.00 0.48 0.00 0.00 55.95 57.52 2dl1 s SER 3 Cb 0.01 1.03 0.00 0.00 0.10 0.00 0.00 66.02 67.15 2dl1 s SER 3 CO 0.05 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.68 2dl1 n GLY 4 N 2.70 -0.30 0.46 7.32 0.00 -1.26 -5.06 105.19 109.06 2dl1 n GLY 4 Ca -0.14 0.75 -0.15 0.00 0.00 0.00 0.00 46.02 46.48 2dl1 n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dl1 h SER 5 N 0.00 -1.68 0.00 1.61 4.64 -2.00 -3.46 113.55 112.66 2dl1 h SER 5 Ca 0.00 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2dl1 h SER 5 Cb 0.00 0.65 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 2dl1 h SER 5 CO 0.00 -0.49 0.00 -0.24 -0.87 0.00 0.00 176.83 175.23 2dl1 n SER 6 N -5.44 0.00 -3.58 4.97 2.88 -1.26 -5.14 113.62 106.05 2dl1 n SER 6 Ca -0.06 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.32 2dl1 n SER 6 Cb 0.38 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.78 2dl1 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dl1 s GLY 7 N 0.00 -0.46 0.05 0.46 0.00 -1.26 -5.17 107.32 100.93 2dl1 s GLY 7 Ca 0.00 0.96 0.09 0.00 0.00 0.00 0.00 44.72 45.77 2dl1 s GLY 7 CO 0.00 0.64 -0.24 -0.54 0.00 0.00 0.00 173.10 172.97 2dl1 s GLU 8 N -1.49 1.88 0.26 2.90 2.02 -1.26 -5.11 118.70 117.90 2dl1 s GLU 8 Ca -0.10 -1.07 -0.29 0.00 0.02 0.00 0.00 54.97 53.52 2dl1 s GLU 8 Cb -0.01 -2.05 -0.09 0.00 0.10 0.00 0.00 34.13 32.08 2dl1 s GLU 8 CO 0.06 0.52 1.26 -1.25 0.02 0.00 0.00 175.26 175.87 2dl1 s PRO 9 N -1.32 4.43 0.54 0.39 0.04 -1.26 -4.90 135.00 132.92 2dl1 s PRO 9 Ca 0.13 2.05 0.36 0.00 0.04 0.00 0.00 61.00 63.58 2dl1 s PRO 9 Cb -0.10 -3.15 1.95 0.00 0.04 0.00 0.00 34.50 33.24 2dl1 s PRO 9 CO 0.03 -0.13 2.11 0.00 0.04 0.00 0.00 177.00 179.05 2dl1 h ALA 10 N 4.34 1.00 -0.13 8.56 0.00 -2.01 -1.12 119.26 129.91 2dl1 h ALA 10 Ca -0.47 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.31 2dl1 h ALA 10 Cb 1.22 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2dl1 h ALA 10 CO 0.71 0.00 -0.49 0.93 0.00 0.00 0.00 179.25 180.40 2dl1 h GLU 11 N 0.00 0.34 0.25 0.00 3.07 -1.95 -3.23 114.58 113.06 2dl1 h GLU 11 Ca 0.00 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.36 58.66 2dl1 h GLU 11 Cb 0.02 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 2dl1 h GLU 11 CO 0.00 0.75 -0.12 0.82 -1.40 0.00 0.00 179.01 179.06 2dl1 h ILE 12 N 0.27 0.00 -1.39 3.13 2.04 -1.55 -2.96 117.51 117.05 2dl1 h ILE 12 Ca 0.01 -0.27 0.43 0.00 1.00 0.00 0.00 64.86 66.03 2dl1 h ILE 12 Cb 0.96 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.95 2dl1 h ILE 12 CO 0.08 0.00 0.96 2.29 0.00 0.00 0.00 178.15 181.48 2dl1 n LYS 13 N -3.66 -0.01 -0.03 2.37 2.85 -1.22 0.20 118.16 118.66 2dl1 n LYS 13 Ca -0.04 0.94 -0.14 0.00 -1.05 0.00 0.00 58.31 58.02 2dl1 n LYS 13 Cb 0.13 -2.02 -0.10 0.00 -0.65 0.00 0.00 35.03 32.40 2dl1 n LYS 13 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 177.40 178.17 2dl1 h ILE 14 N 0.00 1.46 -0.43 0.58 2.04 -1.56 -3.15 117.51 116.45 2dl1 h ILE 14 Ca 0.74 -1.62 0.12 0.00 1.00 0.00 0.00 64.86 65.11 2dl1 h ILE 14 Cb 2.72 2.41 -0.02 0.00 -0.74 0.00 0.00 36.82 41.20 2dl1 h ILE 14 CO -0.18 0.45 0.33 0.40 0.00 0.00 0.00 178.15 179.15 2dl1 h ILE 15 N -0.37 0.70 0.34 -0.67 2.04 0.25 -1.55 117.51 118.25 2dl1 h ILE 15 Ca -0.01 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 2dl1 h ILE 15 Cb 0.81 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 2dl1 h ILE 15 CO 0.04 0.00 -0.16 0.03 0.00 0.00 0.00 178.15 178.05 2dl1 h ARG 16 N 0.00 -0.44 -0.92 2.37 3.08 -1.37 -0.16 114.38 116.94 2dl1 h ARG 16 Ca 0.20 0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.46 2dl1 h ARG 16 Cb 0.86 0.10 -0.08 0.00 0.08 0.00 0.00 29.97 30.93 2dl1 h ARG 16 CO -0.00 -0.29 0.59 1.49 -1.07 0.00 0.00 179.97 180.69 2dl1 h GLU 17 N -0.58 0.56 0.00 0.04 4.81 -1.50 0.51 114.58 118.43 2dl1 h GLU 17 Ca -0.05 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 2dl1 h GLU 17 Cb 0.35 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 2dl1 h GLU 17 CO 0.08 0.37 -0.11 0.00 -0.73 0.00 0.00 179.01 178.61 2dl1 h ALA 18 N 1.61 0.99 0.14 2.92 0.00 -1.27 -2.03 119.26 121.61 2dl1 h ALA 18 Ca 0.49 -0.10 -0.32 0.00 0.00 0.00 0.00 54.91 54.98 2dl1 h ALA 18 Cb 0.96 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2dl1 h ALA 18 CO -0.23 0.14 -1.58 -0.92 0.00 0.00 0.00 179.25 176.67 2dl1 h TYR 19 N 0.00 0.54 0.03 0.00 3.20 0.19 -3.15 116.97 117.77 2dl1 h TYR 19 Ca -0.00 -0.39 -0.00 0.00 3.14 0.00 0.00 58.73 61.47 2dl1 h TYR 19 Cb 0.73 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.98 2dl1 h TYR 19 CO 0.00 1.46 -0.01 -0.22 -1.64 0.00 0.00 178.16 177.74 2dl1 h LYS 20 N 0.08 -0.04 -1.20 1.82 3.64 -1.01 -2.86 116.57 117.00 2dl1 h LYS 20 Ca -0.27 0.00 0.34 0.00 -1.27 0.00 0.00 60.65 59.46 2dl1 h LYS 20 Cb 2.04 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 33.80 2dl1 h LYS 20 CO 0.17 -0.03 0.83 0.87 -2.27 0.00 0.00 179.45 179.02 2dl1 h LYS 21 N -0.15 0.13 -0.38 1.90 1.57 -1.59 0.75 116.57 118.80 2dl1 h LYS 21 Ca -0.00 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2dl1 h LYS 21 Cb 0.03 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2dl1 h LYS 21 CO 0.01 0.09 -0.06 0.00 -0.57 0.00 0.00 179.45 178.91 2dl1 h ALA 22 N 1.48 0.52 0.00 3.86 0.00 -1.65 -1.16 119.26 122.30 2dl1 h ALA 22 Ca 0.63 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2dl1 h ALA 22 Cb 2.15 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.80 2dl1 h ALA 22 CO -0.15 0.35 -0.37 1.19 0.00 0.00 0.00 179.25 180.28 2dl1 n PHE 23 N -4.40 0.44 -0.07 0.00 3.72 0.13 -3.32 117.46 113.97 2dl1 n PHE 23 Ca -0.01 0.13 -0.09 0.00 -0.05 0.00 0.00 57.45 57.42 2dl1 n PHE 23 Cb 0.33 -0.61 -0.07 0.00 -0.94 0.00 0.00 39.48 38.19 2dl1 n PHE 23 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2dl1 h LEU 24 N 0.00 0.00 -2.05 4.37 5.85 0.46 -3.14 115.31 120.79 2dl1 h LEU 24 Ca 0.00 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 2dl1 h LEU 24 Cb 0.66 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 2dl1 h LEU 24 CO 0.00 0.86 -0.09 -0.26 -0.34 0.00 0.00 178.44 178.61 2dl1 h PHE 25 N -1.00 0.00 -0.19 1.25 0.04 -1.36 -2.56 116.94 113.12 2dl1 h PHE 25 Ca -0.04 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.64 2dl1 h PHE 25 Cb 0.64 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.79 2dl1 h PHE 25 CO 0.12 0.09 -0.25 0.28 -0.60 0.00 0.00 178.31 177.94 2dl1 h VAL 26 N 0.00 1.34 -0.07 -0.55 2.07 -1.67 -2.60 116.25 114.77 2dl1 h VAL 26 Ca -0.00 -1.45 0.02 0.00 0.82 0.00 0.00 66.70 66.09 2dl1 h VAL 26 Cb 0.22 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2dl1 h VAL 26 CO 0.01 0.44 0.14 -1.13 0.02 0.00 0.00 177.57 177.06 2dl1 h ASN 27 N 0.17 0.00 0.68 0.57 -0.00 -1.40 0.39 115.58 115.99 2dl1 h ASN 27 Ca 0.02 0.00 -0.25 0.00 -0.00 0.00 0.00 56.30 56.08 2dl1 h ASN 27 Cb 0.82 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.10 2dl1 h ASN 27 CO 0.06 0.00 -1.46 0.11 -0.00 0.00 0.00 177.43 176.14 2dl1 h LYS 28 N 0.00 0.00 -0.29 6.67 6.56 -1.50 -3.29 116.57 124.72 2dl1 h LYS 28 Ca 0.03 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.57 2dl1 h LYS 28 Cb 0.32 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.97 2dl1 h LYS 28 CO -0.00 0.57 -0.05 0.78 -2.06 0.00 0.00 179.45 178.69 2dl1 h GLY 29 N 3.43 0.59 1.12 3.86 0.00 -0.54 -2.75 103.07 108.77 2dl1 h GLY 29 Ca -0.20 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.61 2dl1 h GLY 29 CO 0.08 0.43 0.24 1.41 0.00 0.00 0.00 176.54 178.70 2dl1 h LEU 30 N 0.31 1.04 0.47 3.11 3.38 -1.63 -2.92 115.31 119.07 2dl1 h LEU 30 Ca 0.08 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2dl1 h LEU 30 Cb 0.51 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2dl1 h LEU 30 CO 0.02 0.96 -0.29 -1.13 0.09 0.00 0.00 178.44 178.09 2dl1 h ASN 31 N 1.07 -0.73 -0.75 -0.43 -1.24 -1.61 -2.66 115.58 109.23 2dl1 h ASN 31 Ca 0.24 0.04 0.08 0.00 0.71 0.00 0.00 56.30 57.36 2dl1 h ASN 31 Cb 0.28 0.21 -0.11 0.00 0.73 0.00 0.00 38.32 39.44 2dl1 h ASN 31 CO -0.01 -0.44 -0.57 0.71 -1.29 0.00 0.00 177.43 175.83 2dl1 h THR 32 N -0.71 0.00 -0.97 -3.57 1.35 -1.51 0.39 112.91 107.89 2dl1 h THR 32 Ca -0.06 0.00 0.33 0.00 -0.55 0.00 0.00 66.41 66.12 2dl1 h THR 32 Cb 0.57 0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 66.83 2dl1 h THR 32 CO 0.06 0.00 0.41 -0.78 -0.25 0.00 0.00 175.52 174.96 2dl1 h ASP 33 N -0.17 0.20 -0.60 5.36 3.58 -1.50 0.87 116.42 124.16 2dl1 h ASP 33 Ca 0.13 0.23 -0.09 0.00 0.42 0.00 0.00 57.03 57.72 2dl1 h ASP 33 Cb 0.50 0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 2dl1 h ASP 33 CO -0.80 -0.26 0.02 1.05 -2.88 0.00 0.00 179.24 176.37 2dl1 h GLU 34 N 0.15 1.04 0.00 0.28 4.11 0.10 -2.79 114.58 117.47 2dl1 h GLU 34 Ca 0.71 -0.32 -0.11 0.00 0.07 0.00 0.00 59.36 59.71 2dl1 h GLU 34 Cb 1.66 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.79 2dl1 h GLU 34 CO -0.71 1.01 -0.52 -0.07 0.07 0.00 0.00 179.01 178.78 2dl1 h LEU 35 N 0.93 0.00 0.00 3.06 3.38 0.16 -3.47 115.31 119.37 2dl1 h LEU 35 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2dl1 h LEU 35 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2dl1 h LEU 35 CO 0.03 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.69 2dl1 n GLY 36 N -0.00 1.33 3.40 0.83 0.00 0.77 -5.05 105.19 106.47 2dl1 n GLY 36 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 2dl1 n GLY 36 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dl1 n GLN 37 N -0.23 3.36 -0.27 1.61 6.02 -0.87 -4.80 117.38 122.21 2dl1 n GLN 37 Ca 0.00 -3.71 0.02 0.00 -0.01 0.00 0.00 57.00 53.29 2dl1 n GLN 37 Cb 0.00 -3.10 0.23 0.00 1.02 0.00 0.00 30.24 28.39 2dl1 n GLN 37 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2dl1 h LYS 38 N 7.02 1.03 0.68 -1.09 6.56 -1.89 -0.69 116.57 128.18 2dl1 h LYS 38 Ca 0.35 -0.06 -0.03 0.00 -1.06 0.00 0.00 60.65 59.84 2dl1 h LYS 38 Cb 0.84 -0.23 0.01 0.00 -0.57 0.00 0.00 32.23 32.28 2dl1 h LYS 38 CO 1.33 0.68 -0.33 0.93 -2.06 0.00 0.00 179.45 180.00 2dl1 h GLU 39 N 1.06 -0.88 -0.79 3.15 5.08 -1.99 -1.57 114.58 118.64 2dl1 h GLU 39 Ca 0.33 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.88 2dl1 h GLU 39 Cb 0.02 0.20 -0.09 0.00 0.50 0.00 0.00 28.75 29.38 2dl1 h GLU 39 CO -0.10 -0.59 0.39 0.93 -1.00 0.00 0.00 179.01 178.65 2dl1 h GLU 40 N -0.96 0.58 0.19 2.33 3.07 -1.95 -1.87 114.58 115.97 2dl1 h GLU 40 Ca -0.09 -0.04 0.01 0.00 -0.50 0.00 0.00 59.36 58.74 2dl1 h GLU 40 Cb 0.70 -0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 28.44 2dl1 h GLU 40 CO 0.15 0.39 -0.36 0.00 -1.40 0.00 0.00 179.01 177.80 2dl1 h ALA 41 N 1.51 -0.66 -0.59 3.43 0.00 -1.06 0.15 119.26 122.05 2dl1 h ALA 41 Ca 0.42 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.35 2dl1 h ALA 41 Cb 0.54 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 2dl1 h ALA 41 CO -0.33 -0.93 0.18 0.87 0.00 0.00 0.00 179.25 179.04 2dl1 h LYS 42 N -0.63 0.32 0.56 0.00 1.57 -0.72 -1.33 116.57 116.34 2dl1 h LYS 42 Ca 0.01 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2dl1 h LYS 42 Cb 0.63 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.87 2dl1 h LYS 42 CO -0.16 0.21 -0.27 -0.97 -0.57 0.00 0.00 179.45 177.69 2dl1 h ASN 43 N 0.33 -0.63 -0.64 0.86 -1.24 -0.88 -0.07 115.58 113.30 2dl1 h ASN 43 Ca 0.30 0.02 0.14 0.00 0.71 0.00 0.00 56.30 57.46 2dl1 h ASN 43 Cb 0.40 0.16 -0.11 0.00 0.73 0.00 0.00 38.32 39.50 2dl1 h ASN 43 CO -0.34 -0.45 -0.06 1.88 -1.29 0.00 0.00 177.43 177.18 2dl1 h TYR 44 N -0.76 -0.15 -0.69 0.67 0.05 -0.29 0.65 116.97 116.45 2dl1 h TYR 44 Ca -0.08 0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.70 2dl1 h TYR 44 Cb 0.58 0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.46 2dl1 h TYR 44 CO -0.03 -0.22 0.23 1.88 -1.05 0.00 0.00 178.16 178.97 2dl1 h TYR 45 N 0.07 1.10 0.00 4.88 0.05 -1.09 -1.51 116.97 120.47 2dl1 h TYR 45 Ca 0.33 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 59.01 2dl1 h TYR 45 Cb 0.54 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 37.95 2dl1 h TYR 45 CO -0.43 0.88 0.00 1.63 -1.05 0.00 0.00 178.16 179.19 2dl1 n LYS 46 N -4.32 0.16 -0.08 4.88 5.02 0.09 -1.40 118.16 122.51 2dl1 n LYS 46 Ca 0.05 0.54 -0.23 0.00 -2.02 0.00 0.00 58.31 56.66 2dl1 n LYS 46 Cb 0.21 -1.92 -0.12 0.00 -0.02 0.00 0.00 35.03 33.18 2dl1 n LYS 46 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2dl1 n GLN 47 N -2.25 0.64 -0.17 1.97 6.02 -0.42 -4.04 117.38 119.12 2dl1 n GLN 47 Ca 0.00 0.39 -0.10 0.00 -0.01 0.00 0.00 57.00 57.28 2dl1 n GLN 47 Cb 0.12 -1.67 0.00 0.00 1.02 0.00 0.00 30.24 29.71 2dl1 n GLN 47 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 2dl1 h GLY 48 N -0.08 0.91 0.38 1.08 0.00 -1.05 -2.94 103.07 101.37 2dl1 h GLY 48 Ca -0.46 -0.67 0.09 0.00 0.00 0.00 0.00 47.33 46.29 2dl1 h GLY 48 CO -0.15 0.61 0.15 -2.22 0.00 0.00 0.00 176.54 174.93 2dl1 h ILE 49 N 0.70 0.74 0.00 2.60 2.04 -1.44 0.81 117.51 122.96 2dl1 h ILE 49 Ca 0.14 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 2dl1 h ILE 49 Cb 0.50 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2dl1 h ILE 49 CO 0.02 0.05 -0.16 1.23 0.00 0.00 0.00 178.15 179.30 2dl1 h GLY 50 N 0.30 0.00 1.35 5.37 0.00 -1.68 -2.65 103.07 105.75 2dl1 h GLY 50 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.30 2dl1 h GLY 50 CO -0.31 0.00 -1.26 0.45 0.00 0.00 0.00 176.54 175.42 2dl1 h HIS 51 N 0.00 0.88 0.18 5.60 3.86 -0.88 -3.15 115.15 121.63 2dl1 h HIS 51 Ca -0.00 -0.57 0.01 0.00 -1.16 0.00 0.00 60.37 58.64 2dl1 h HIS 51 Cb 0.31 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.70 2dl1 h HIS 51 CO 0.00 1.42 -0.25 -0.07 0.86 0.00 0.00 177.93 179.90 2dl1 h LEU 52 N 0.22 -0.68 -0.18 2.43 3.38 -0.58 -2.80 115.31 117.10 2dl1 h LEU 52 Ca -0.18 0.07 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2dl1 h LEU 52 Cb 1.94 0.25 -0.05 0.00 0.09 0.00 0.00 40.66 42.88 2dl1 h LEU 52 CO 0.23 -0.35 -0.13 -0.07 0.09 0.00 0.00 178.44 178.22 2dl1 h LEU 53 N -0.49 -0.40 -1.43 1.67 3.38 -1.64 0.74 115.31 117.15 2dl1 h LEU 53 Ca 0.01 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.11 2dl1 h LEU 53 Cb 0.48 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2dl1 h LEU 53 CO -0.10 -0.16 0.59 -0.09 0.09 0.00 0.00 178.44 178.77 2dl1 h ARG 54 N -0.12 0.00 0.00 1.13 2.43 -1.46 0.62 114.38 116.98 2dl1 h ARG 54 Ca 0.11 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.96 2dl1 h ARG 54 Cb 0.29 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.78 2dl1 h ARG 54 CO -0.26 0.00 -1.98 0.41 -1.51 0.00 0.00 179.97 176.63 2dl1 n GLY 55 N -1.37 -0.98 0.04 2.80 0.00 0.18 -4.16 105.19 101.70 2dl1 n GLY 55 Ca 0.02 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 46.01 2dl1 n GLY 55 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dl1 n ILE 56 N -2.95 0.24 -1.75 -0.61 5.41 0.17 -4.01 119.36 115.86 2dl1 n ILE 56 Ca -0.24 -0.18 -0.35 0.00 1.00 0.00 0.00 62.75 62.98 2dl1 n ILE 56 Cb 1.09 -0.07 0.05 0.00 -0.71 0.00 0.00 39.64 40.00 2dl1 n ILE 56 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2dl1 n SER 57 N -1.91 7.08 0.00 4.38 7.64 0.14 -4.78 113.62 126.17 2dl1 n SER 57 Ca 0.04 -3.80 0.00 0.00 1.01 0.00 0.00 58.87 56.12 2dl1 n SER 57 Cb 0.40 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 2dl1 n SER 57 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2dl1 n ILE 58 N -0.70 0.00 0.00 0.44 2.08 -1.26 -4.96 119.36 114.97 2dl1 n ILE 58 Ca 0.55 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.86 2dl1 n ILE 58 Cb 0.51 -0.20 0.00 0.00 -0.75 0.00 0.00 39.64 39.21 2dl1 n ILE 58 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 2dl1 n SER 59 N 0.00 0.00 -2.89 4.38 2.88 -1.26 -5.10 113.62 111.63 2dl1 n SER 59 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2dl1 n SER 59 Cb 0.00 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 2dl1 n SER 59 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dl1 n SER 60 N 0.00 -1.74 -4.28 -3.46 3.41 -1.26 -4.92 113.62 101.37 2dl1 n SER 60 Ca 0.00 -3.23 -0.34 0.00 -0.26 0.00 0.00 58.87 55.04 2dl1 n SER 60 Cb 0.00 1.07 0.11 0.00 -0.26 0.00 0.00 64.21 65.13 2dl1 n SER 60 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dl1 n LYS 61 N 1.18 -0.47 -0.06 4.33 4.01 -1.26 -4.98 118.16 120.92 2dl1 n LYS 61 Ca 0.13 -0.11 -0.03 0.00 -0.51 0.00 0.00 58.31 57.78 2dl1 n LYS 61 Cb 0.63 -1.60 -0.01 0.00 -0.51 0.00 0.00 35.03 33.53 2dl1 n LYS 61 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 2dl1 h GLU 62 N -1.52 0.00 -6.57 1.97 3.07 -2.01 -3.45 114.58 106.08 2dl1 h GLU 62 Ca -0.45 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 57.82 2dl1 h GLU 62 Cb 1.31 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 29.30 2dl1 h GLU 62 CO 0.32 0.00 0.53 0.45 -1.40 0.00 0.00 179.01 178.91 2dl1 n SER 63 N -4.23 2.49 -3.22 1.42 2.88 -1.26 -3.09 113.62 108.61 2dl1 n SER 63 Ca -0.05 1.15 -0.08 0.00 -1.33 0.00 0.00 58.87 58.56 2dl1 n SER 63 Cb 0.20 -1.40 0.02 0.00 -0.75 0.00 0.00 64.21 62.28 2dl1 n SER 63 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dl1 n GLU 64 N 1.71 -1.58 -3.13 -1.46 1.02 -1.26 -4.98 120.64 110.95 2dl1 n GLU 64 Ca 0.11 1.19 -0.21 0.00 -0.02 0.00 0.00 57.16 58.23 2dl1 n GLU 64 Cb 0.31 -5.40 -0.04 0.00 -0.02 0.00 0.00 31.44 26.30 2dl1 n GLU 64 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2dl1 n HIS 65 N -2.43 1.23 -5.14 -0.32 -0.00 -1.18 -5.02 115.22 102.36 2dl1 n HIS 65 Ca -0.05 -3.86 -0.29 0.00 0.46 0.00 0.00 57.72 53.98 2dl1 n HIS 65 Cb 0.55 -0.44 -0.16 0.00 -0.12 0.00 0.00 29.99 29.83 2dl1 n HIS 65 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 2dl1 s THR 66 N -2.88 1.82 0.00 3.57 -4.23 -1.26 -5.00 115.64 107.65 2dl1 s THR 66 Ca 0.42 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.95 2dl1 s THR 66 Cb 0.32 -1.51 0.00 0.00 1.34 0.00 0.00 72.50 72.64 2dl1 s THR 66 CO -0.10 0.51 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 2dl1 n GLY 67 N 2.56 4.10 0.00 3.99 0.00 -1.26 -4.93 105.19 109.65 2dl1 n GLY 67 Ca -0.16 -0.92 0.07 0.00 0.00 0.00 0.00 46.02 45.01 2dl1 n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl1 n PRO 68 N -1.50 0.25 -0.02 1.61 -0.04 -1.26 -3.36 135.00 130.66 2dl1 n PRO 68 Ca 0.00 0.13 -0.02 0.00 -0.04 0.00 0.00 63.50 63.57 2dl1 n PRO 68 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 2dl1 n PRO 68 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dl1 n GLY 69 N -0.04 -0.67 0.46 0.55 0.00 -1.26 -4.23 105.19 99.99 2dl1 n GLY 69 Ca 0.08 -0.06 0.25 0.00 0.00 0.00 0.00 46.02 46.28 2dl1 n GLY 69 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2dl1 h TRP 70 N -0.34 0.00 0.08 1.61 4.06 -1.92 0.56 115.95 120.00 2dl1 h TRP 70 Ca 0.00 0.00 0.01 0.00 2.06 0.00 0.00 58.89 60.96 2dl1 h TRP 70 Cb 0.18 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 2dl1 h TRP 70 CO -0.08 0.00 -0.11 1.49 -3.56 0.00 0.00 178.44 176.19 2dl1 h GLU 71 N 0.00 -0.21 -0.34 0.49 4.81 -1.73 0.55 114.58 118.13 2dl1 h GLU 71 Ca 0.34 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 2dl1 h GLU 71 Cb 1.88 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 31.30 2dl1 h GLU 71 CO -0.00 -0.14 -0.22 1.03 -0.73 0.00 0.00 179.01 178.95 2dl1 h SER 72 N -0.22 0.79 -0.83 1.04 0.87 -1.07 -0.75 113.55 113.39 2dl1 h SER 72 Ca 0.02 -0.43 0.05 0.00 -1.23 0.00 0.00 61.79 60.20 2dl1 h SER 72 Cb 0.23 -0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 2dl1 h SER 72 CO -0.05 1.05 0.54 0.00 -0.53 0.00 0.00 176.83 177.83 2dl1 h ALA 73 N 0.77 1.55 0.12 6.23 0.00 -1.30 0.89 119.26 127.53 2dl1 h ALA 73 Ca 0.07 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.67 2dl1 h ALA 73 Cb 0.77 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2dl1 h ALA 73 CO 0.06 0.34 -1.22 -0.09 0.00 0.00 0.00 179.25 178.33 2dl1 h ARG 74 N 0.96 0.40 -0.51 0.00 2.43 -0.77 -2.42 114.38 114.46 2dl1 h ARG 74 Ca 0.35 -0.60 -0.06 0.00 -0.81 0.00 0.00 59.98 58.86 2dl1 h ARG 74 Cb 0.15 0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 2dl1 h ARG 74 CO -0.12 1.26 0.08 -0.56 -1.51 0.00 0.00 179.97 179.12 2dl1 h GLN 75 N 0.15 0.85 -0.04 0.20 -0.00 -0.50 -2.52 115.11 113.26 2dl1 h GLN 75 Ca -0.15 -0.23 -0.16 0.00 -0.00 0.00 0.00 58.65 58.11 2dl1 h GLN 75 Cb 1.92 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.48 29.29 2dl1 h GLN 75 CO 0.21 0.84 -0.68 0.00 -0.00 0.00 0.00 178.83 179.21 2dl1 h MET 76 N 0.73 0.18 -0.83 0.06 -0.00 -0.93 -3.11 114.93 111.03 2dl1 h MET 76 Ca 0.16 -0.14 -0.02 0.00 -0.00 0.00 0.00 59.70 59.69 2dl1 h MET 76 Cb 0.41 0.03 -0.04 0.00 -0.00 0.00 0.00 31.60 31.99 2dl1 h MET 76 CO 0.01 0.79 0.43 0.37 -0.00 0.00 0.00 176.91 178.50 2dl1 h GLN 77 N 0.12 1.18 -0.06 -0.10 4.15 -1.22 -2.79 115.11 116.39 2dl1 h GLN 77 Ca -0.01 -0.16 -0.01 0.00 0.77 0.00 0.00 58.65 59.24 2dl1 h GLN 77 Cb 1.21 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 28.68 2dl1 h GLN 77 CO 0.10 0.89 0.01 0.37 -1.93 0.00 0.00 178.83 178.28 2dl1 h GLN 78 N 1.17 0.10 -0.41 1.69 4.15 -1.42 -2.47 115.11 117.92 2dl1 h GLN 78 Ca 0.29 -0.03 0.12 0.00 0.77 0.00 0.00 58.65 59.80 2dl1 h GLN 78 Cb 0.08 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 2dl1 h GLN 78 CO -0.04 0.31 0.42 -0.22 -1.93 0.00 0.00 178.83 177.37 2dl1 h LYS 79 N -0.12 0.00 0.10 1.69 3.64 -1.45 -2.07 116.57 118.36 2dl1 h LYS 79 Ca 0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2dl1 h LYS 79 Cb 0.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2dl1 h LYS 79 CO 0.00 0.00 -0.05 0.52 -2.27 0.00 0.00 179.45 177.65 2dl1 h MET 80 N 0.00 -0.13 -1.00 1.90 2.86 -1.19 -2.75 114.93 114.62 2dl1 h MET 80 Ca 0.20 0.01 0.33 0.00 -2.06 0.00 0.00 59.70 58.17 2dl1 h MET 80 Cb 1.04 0.03 -0.18 0.00 0.06 0.00 0.00 31.60 32.55 2dl1 h MET 80 CO -0.00 0.19 0.22 -0.22 1.06 0.00 0.00 176.91 178.16 2dl1 h LYS 81 N -0.99 0.01 -0.26 1.72 3.64 -0.97 1.01 116.57 120.73 2dl1 h LYS 81 Ca -0.01 -0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 2dl1 h LYS 81 Cb 0.39 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2dl1 h LYS 81 CO 0.02 0.01 -0.54 0.93 -2.27 0.00 0.00 179.45 177.60 2dl1 h GLU 82 N 0.01 0.83 0.00 1.90 4.39 -1.61 -3.00 114.58 117.09 2dl1 h GLU 82 Ca 0.69 -0.54 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 2dl1 h GLU 82 Cb 1.61 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 30.33 2dl1 h GLU 82 CO -0.87 1.17 -0.09 1.15 -1.16 0.00 0.00 179.01 179.22 2dl1 h THR 83 N 0.59 0.30 0.00 1.13 2.02 0.11 -3.11 112.91 113.95 2dl1 h THR 83 Ca 0.01 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.60 2dl1 h THR 83 Cb 1.15 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 2dl1 h THR 83 CO 0.12 0.09 0.00 -0.11 0.37 0.00 0.00 175.52 175.99 2dl1 n LEU 84 N -3.32 0.16 -0.48 2.58 7.94 0.14 -1.02 117.00 122.99 2dl1 n LEU 84 Ca -0.01 0.74 0.40 0.00 -1.11 0.00 0.00 56.01 56.03 2dl1 n LEU 84 Cb 0.28 -0.43 0.70 0.00 0.53 0.00 0.00 43.42 44.50 2dl1 n LEU 84 CO 0.28 -0.43 1.32 0.06 -1.11 0.00 0.00 177.39 177.51 2dl1 h GLN 85 N 0.00 0.07 -0.05 1.96 3.07 -1.62 1.38 115.11 119.93 2dl1 h GLN 85 Ca 0.00 -0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.52 2dl1 h GLN 85 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 27.48 27.55 2dl1 h GLN 85 CO 0.00 0.05 -0.87 -0.97 0.09 0.00 0.00 178.83 177.13 2dl1 h ASN 86 N 0.07 0.63 0.22 0.06 -0.73 -1.54 -3.14 115.58 111.14 2dl1 h ASN 86 Ca 0.79 -0.46 -0.16 0.00 1.87 0.00 0.00 56.30 58.34 2dl1 h ASN 86 Cb 2.75 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 41.15 2dl1 h ASN 86 CO -0.23 1.24 -0.61 0.58 -0.37 0.00 0.00 177.43 178.04 2dl1 h VAL 87 N 0.31 1.36 0.10 2.57 2.07 0.35 -3.00 116.25 120.00 2dl1 h VAL 87 Ca -0.07 -1.95 -0.00 0.00 0.82 0.00 0.00 66.70 65.50 2dl1 h VAL 87 Cb 1.49 1.94 -0.00 0.00 -1.52 0.00 0.00 31.29 33.20 2dl1 h VAL 87 CO 0.16 0.59 -0.06 0.03 0.02 0.00 0.00 177.57 178.31 2dl1 h ARG 88 N 0.29 -0.14 0.00 1.57 3.08 -0.89 -1.29 114.38 117.00 2dl1 h ARG 88 Ca -0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2dl1 h ARG 88 Cb 1.15 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2dl1 h ARG 88 CO 0.10 -0.10 0.00 1.15 -1.07 0.00 0.00 179.97 180.06 2dl1 h THR 89 N -0.15 0.00 0.17 2.04 2.02 -1.58 0.97 112.91 116.38 2dl1 h THR 89 Ca -0.01 -0.18 -0.26 0.00 0.77 0.00 0.00 66.41 66.73 2dl1 h THR 89 Cb 0.12 0.87 0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2dl1 h THR 89 CO 0.01 0.00 -1.21 0.03 0.37 0.00 0.00 175.52 174.72 2dl1 h ARG 90 N 0.00 0.37 0.00 6.66 -0.00 -1.14 -3.20 114.38 117.06 2dl1 h ARG 90 Ca 0.00 -0.63 -0.13 0.00 -0.50 0.00 0.00 59.98 58.73 2dl1 h ARG 90 Cb 0.25 0.23 -0.02 0.00 0.00 0.00 0.00 29.97 30.44 2dl1 h ARG 90 CO 0.00 1.30 -0.83 1.25 0.00 0.00 0.00 179.97 181.69 2dl1 h LEU 91 N -0.17 0.00 -0.38 3.04 5.85 -0.94 -3.33 115.31 119.38 2dl1 h LEU 91 Ca -0.23 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 2dl1 h LEU 91 Cb 1.86 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.88 2dl1 h LEU 91 CO 0.17 0.53 0.04 1.05 -0.34 0.00 0.00 178.44 179.90 2dl1 h GLU 92 N 0.00 0.64 -0.82 1.25 -0.00 -0.94 -2.27 114.58 112.44 2dl1 h GLU 92 Ca -0.06 -0.18 0.11 0.00 -0.00 0.00 0.00 59.36 59.23 2dl1 h GLU 92 Cb 1.46 -0.07 -0.06 0.00 -0.00 0.00 0.00 28.75 30.08 2dl1 h GLU 92 CO 0.06 0.71 0.53 0.82 -0.00 0.00 0.00 179.01 181.14 2dl1 h ILE 93 N 0.48 0.91 0.25 -1.06 2.04 -1.66 -2.55 117.51 115.92 2dl1 h ILE 93 Ca 0.11 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2dl1 h ILE 93 Cb 0.39 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2dl1 h ILE 93 CO 0.01 0.13 -0.12 -0.07 0.00 0.00 0.00 178.15 178.10 2dl1 h LEU 94 N 0.70 -0.28 -1.13 1.44 3.38 -1.64 1.42 115.31 119.21 2dl1 h LEU 94 Ca 0.39 -0.25 0.37 0.00 0.09 0.00 0.00 57.88 58.48 2dl1 h LEU 94 Cb 0.54 0.07 -0.15 0.00 0.09 0.00 0.00 40.66 41.22 2dl1 h LEU 94 CO -0.16 0.19 0.64 -0.33 0.09 0.00 0.00 178.44 178.88 2dl1 h GLU 95 N -0.87 0.19 0.00 1.13 5.08 -1.07 0.54 114.58 119.58 2dl1 h GLU 95 Ca -0.03 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2dl1 h GLU 95 Cb 0.51 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2dl1 h GLU 95 CO 0.06 0.12 -1.90 0.36 -1.00 0.00 0.00 179.01 176.65 2dl1 n LYS 96 N -4.98 0.66 0.00 2.33 2.85 -0.99 -4.15 118.16 113.87 2dl1 n LYS 96 Ca 0.34 -0.11 0.10 0.00 -1.05 0.00 0.00 58.31 57.59 2dl1 n LYS 96 Cb 1.17 -1.57 0.53 0.00 -0.65 0.00 0.00 35.03 34.51 2dl1 n LYS 96 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2dl1 n GLY 97 N 1.32 -0.84 3.67 2.58 0.00 0.49 -4.75 105.19 107.66 2dl1 n GLY 97 Ca -0.08 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 2dl1 n GLY 97 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dl1 s LEU 98 N -2.39 4.24 -0.44 0.99 2.96 -0.48 -4.98 118.68 118.58 2dl1 s LEU 98 Ca 0.23 1.85 -0.09 0.00 -0.22 0.00 0.00 54.13 55.90 2dl1 s LEU 98 Cb 0.13 -3.54 0.10 0.00 0.50 0.00 0.00 46.19 43.38 2dl1 s LEU 98 CO 0.28 -0.75 0.30 0.00 -1.32 0.00 0.00 176.35 174.86 2dl1 s ALA 99 N 3.20 3.33 -0.42 5.97 0.00 -1.26 -5.04 121.76 127.54 2dl1 s ALA 99 Ca 0.59 -2.38 -0.44 0.00 0.00 0.00 0.00 51.96 49.73 2dl1 s ALA 99 Cb -0.25 -2.72 -0.18 0.00 0.00 0.00 0.00 23.12 19.97 2dl1 s ALA 99 CO 0.20 -1.79 1.72 0.25 0.00 0.00 0.00 175.76 176.13 2dl1 n THR 100 N 4.89 0.12 0.00 0.00 -2.24 -1.26 -4.88 114.28 110.91 2dl1 n THR 100 Ca -0.08 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2dl1 n THR 100 Cb 0.42 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 2dl1 n THR 100 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dl1 n SER 101 N 4.99 0.00 -4.52 3.42 7.64 -1.26 -5.08 113.62 118.81 2dl1 n SER 101 Ca 0.32 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.91 2dl1 n SER 101 Cb 0.02 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.08 2dl1 n SER 101 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2dl1 n LEU 102 N 0.00 0.46 -3.88 -3.43 4.32 -1.26 -4.85 117.00 108.35 2dl1 n LEU 102 Ca 0.00 -0.50 -0.30 0.00 -0.02 0.00 0.00 56.01 55.19 2dl1 n LEU 102 Cb 0.00 -1.08 -0.16 0.00 -1.62 0.00 0.00 43.42 40.56 2dl1 n LEU 102 CO 0.00 -1.48 -0.40 0.00 -1.22 0.00 0.00 177.39 174.29 2dl1 s GLN 103 N 8.25 1.32 0.00 3.23 -2.07 -1.26 -5.13 119.66 124.00 2dl1 s GLN 103 Ca 1.19 -0.85 0.00 0.00 -1.82 0.00 0.00 55.36 53.88 2dl1 s GLN 103 Cb -0.70 -2.45 0.00 0.00 -1.09 0.00 0.00 33.01 28.77 2dl1 s GLN 103 CO 0.39 -0.63 0.00 -1.71 -1.32 0.00 0.00 175.29 172.02 2dl1 n ASN 104 N 4.78 0.00 -1.72 12.60 2.85 -1.26 -5.12 115.26 127.39 2dl1 n ASN 104 Ca -0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.36 2dl1 n ASN 104 Cb 0.45 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.47 2dl1 n ASN 104 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2dl1 n ASP 105 N 0.00 1.70 -4.30 1.20 9.92 -1.26 -5.15 116.55 118.66 2dl1 n ASP 105 Ca 0.00 -0.93 -0.19 0.00 -0.53 0.00 0.00 54.79 53.14 2dl1 n ASP 105 Cb 0.00 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.38 2dl1 n ASP 105 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2dl1 s LEU 106 N 0.00 1.82 0.56 0.64 1.02 -1.26 -5.14 118.68 116.32 2dl1 s LEU 106 Ca 0.00 -1.42 -0.20 0.00 0.02 0.00 0.00 54.13 52.53 2dl1 s LEU 106 Cb 0.00 -0.09 -0.05 0.00 0.02 0.00 0.00 46.19 46.08 2dl1 s LEU 106 CO 0.00 -0.73 1.20 -1.58 0.02 0.00 0.00 176.35 175.26 2dl1 s GLN 107 N -3.94 3.18 -0.18 1.70 0.74 -1.26 -5.05 119.66 114.86 2dl1 s GLN 107 Ca 0.36 1.81 -0.16 0.00 0.05 0.00 0.00 55.36 57.42 2dl1 s GLN 107 Cb 0.07 -2.04 0.05 0.00 1.10 0.00 0.00 33.01 32.19 2dl1 s GLN 107 CO 0.15 -1.03 0.47 -1.21 -0.55 0.00 0.00 175.29 173.11 2dl1 s GLU 108 N -3.19 0.54 -0.07 1.67 2.02 -1.26 -5.17 118.70 113.23 2dl1 s GLU 108 Ca 0.74 0.66 -0.26 0.00 0.02 0.00 0.00 54.97 56.13 2dl1 s GLU 108 Cb -0.30 0.25 0.06 0.00 0.10 0.00 0.00 34.13 34.24 2dl1 s GLU 108 CO 0.33 -0.07 0.59 0.14 0.02 0.00 0.00 175.26 176.27 2dl1 s VAL 109 N 0.32 0.01 0.23 2.63 -7.23 -1.26 -5.04 120.40 110.07 2dl1 s VAL 109 Ca -0.01 -0.10 0.22 0.00 -1.81 0.00 0.00 61.98 60.28 2dl1 s VAL 109 Cb -0.04 -0.90 0.20 0.00 0.56 0.00 0.00 36.38 36.21 2dl1 s VAL 109 CO -0.00 -0.06 1.86 1.55 -0.31 0.00 0.00 175.10 178.14 2dl1 h PRO 110 N 3.52 0.00 -6.62 4.82 0.13 -2.06 -3.47 132.00 128.31 2dl1 h PRO 110 Ca -0.28 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.36 2dl1 h PRO 110 Cb 1.15 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.30 2dl1 h PRO 110 CO 0.35 0.26 -0.96 0.43 -0.23 0.00 0.00 178.00 177.85 2dl1 n SER 111 N -3.56 -4.85 0.00 1.44 7.64 -1.26 -4.87 113.62 108.16 2dl1 n SER 111 Ca -0.01 -1.07 0.00 0.00 1.01 0.00 0.00 58.87 58.80 2dl1 n SER 111 Cb 0.41 -2.30 0.00 0.00 -1.01 0.00 0.00 64.21 61.31 2dl1 n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dl1 n GLY 112 N -1.85 -1.79 2.94 0.23 0.00 -1.26 -5.06 105.19 98.40 2dl1 n GLY 112 Ca -0.16 0.73 -0.34 0.00 0.00 0.00 0.00 46.02 46.25 2dl1 n GLY 112 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dl1 n PRO 113 N 0.00 1.56 -3.73 1.61 -0.04 -1.26 -4.74 135.00 128.40 2dl1 n PRO 113 Ca 0.00 -1.60 0.02 0.00 -0.04 0.00 0.00 63.50 61.87 2dl1 n PRO 113 Cb 0.00 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 30.77 2dl1 n PRO 113 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dl1 s SER 114 N 4.55 -0.04 -0.12 3.54 1.04 -1.26 -5.17 113.70 116.24 2dl1 s SER 114 Ca 0.49 -0.17 -0.05 0.00 0.48 0.00 0.00 55.95 56.69 2dl1 s SER 114 Cb 0.12 0.17 0.06 0.00 0.10 0.00 0.00 66.02 66.47 2dl1 s SER 114 CO 0.07 -0.32 0.26 -0.44 0.98 0.00 0.00 173.24 173.79 2dl1 s SER 115 N -3.23 0.05 0.00 7.02 0.01 -1.26 -5.19 113.70 111.10 2dl1 s SER 115 Ca 0.19 0.58 0.25 0.00 1.31 0.00 0.00 55.95 58.28 2dl1 s SER 115 Cb 0.03 0.58 0.45 0.00 0.21 0.00 0.00 66.02 67.29 2dl1 s SER 115 CO -0.03 -0.21 1.41 0.61 0.41 0.00 0.00 173.24 175.43