#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl1 n SER 2 N 0.00 1.75 -4.58 1.61 2.88 -1.26 -4.98 113.62 109.04 2dl1 n SER 2 Ca 0.00 0.29 -0.54 0.00 -1.33 0.00 0.00 58.87 57.29 2dl1 n SER 2 Cb 0.00 -0.65 -0.06 0.00 -0.75 0.00 0.00 64.21 62.74 2dl1 n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dl1 n SER 3 N -4.24 1.32 0.00 -3.46 7.64 -1.26 -4.81 113.62 108.81 2dl1 n SER 3 Ca -0.12 1.13 0.00 0.00 1.01 0.00 0.00 58.87 60.89 2dl1 n SER 3 Cb 0.42 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 2dl1 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dl1 n GLY 4 N 2.38 1.76 0.00 0.23 0.00 -1.26 -5.19 105.19 103.11 2dl1 n GLY 4 Ca 0.19 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2dl1 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dl1 n SER 5 N 0.00 0.00 -2.70 1.61 3.41 -1.26 -5.11 113.62 109.57 2dl1 n SER 5 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 2dl1 n SER 5 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 2dl1 n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2dl1 n SER 6 N 0.00 -1.94 -4.82 4.04 7.64 -1.26 -5.17 113.62 112.12 2dl1 n SER 6 Ca 0.00 -2.42 -0.22 0.00 1.01 0.00 0.00 58.87 57.24 2dl1 n SER 6 Cb 0.00 1.19 0.08 0.00 -1.01 0.00 0.00 64.21 64.46 2dl1 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dl1 s GLY 7 N -0.83 1.78 0.12 0.23 0.00 -1.26 -5.13 107.32 102.24 2dl1 s GLY 7 Ca 0.28 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 43.48 2dl1 s GLY 7 CO -0.15 -1.13 -0.13 -0.54 0.00 0.00 0.00 173.10 171.15 2dl1 s GLU 8 N -4.97 1.01 0.00 2.90 2.02 -1.26 -5.02 118.70 113.39 2dl1 s GLU 8 Ca 0.62 -1.26 0.15 0.00 0.02 0.00 0.00 54.97 54.50 2dl1 s GLU 8 Cb -0.07 -0.83 0.87 0.00 0.10 0.00 0.00 34.13 34.19 2dl1 s GLU 8 CO 0.42 0.15 1.37 -0.35 0.02 0.00 0.00 175.26 176.87 2dl1 n PRO 9 N 0.42 0.39 0.00 0.39 -0.04 -1.26 -4.85 135.00 130.05 2dl1 n PRO 9 Ca -0.15 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2dl1 n PRO 9 Cb 0.58 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 2dl1 n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dl1 n ALA 10 N -1.10 0.00 -0.03 0.55 0.00 -1.26 -4.66 120.51 114.01 2dl1 n ALA 10 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 2dl1 n ALA 10 Cb 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.44 2dl1 n ALA 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dl1 h GLU 11 N 0.00 0.17 0.83 0.00 3.07 -2.01 -3.26 114.58 113.38 2dl1 h GLU 11 Ca 0.00 -0.11 -0.04 0.00 -0.50 0.00 0.00 59.36 58.71 2dl1 h GLU 11 Cb 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2dl1 h GLU 11 CO 0.00 0.67 -0.46 0.82 -1.40 0.00 0.00 179.01 178.65 2dl1 h ILE 12 N -0.31 0.00 -1.35 3.13 2.04 -1.96 -2.16 117.51 116.90 2dl1 h ILE 12 Ca 0.00 0.00 0.44 0.00 1.00 0.00 0.00 64.86 66.30 2dl1 h ILE 12 Cb 0.66 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.64 2dl1 h ILE 12 CO 0.02 0.00 0.91 2.29 0.00 0.00 0.00 178.15 181.37 2dl1 n LYS 13 N -5.37 -0.02 -0.05 2.37 2.85 -1.25 0.13 118.16 116.81 2dl1 n LYS 13 Ca -0.15 1.03 -0.14 0.00 -1.05 0.00 0.00 58.31 58.00 2dl1 n LYS 13 Cb 0.48 -2.12 -0.12 0.00 -0.65 0.00 0.00 35.03 32.62 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 1.66 -0.04 0.58 2.04 -1.47 -3.26 117.51 117.02 2dl1 h ILE 14 Ca 0.77 -1.97 0.03 0.00 1.00 0.00 0.00 64.86 64.69 2dl1 h ILE 14 Cb 2.70 2.99 -0.03 0.00 -0.74 0.00 0.00 36.82 41.74 2dl1 h ILE 14 CO -0.27 0.51 -0.14 0.40 0.00 0.00 0.00 178.15 178.65 2dl1 h ILE 15 N -0.80 0.63 -1.08 -0.67 2.04 0.16 0.10 117.51 117.90 2dl1 h ILE 15 Ca -0.00 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.16 2dl1 h ILE 15 Cb 0.86 0.63 -0.12 0.00 -0.74 0.00 0.00 36.82 37.46 2dl1 h ILE 15 CO 0.01 0.00 0.67 0.08 0.00 0.00 0.00 178.15 178.90 2dl1 h ARG 16 N -0.22 0.35 0.03 2.37 0.11 -1.18 0.65 114.38 116.48 2dl1 h ARG 16 Ca 0.06 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 60.12 2dl1 h ARG 16 Cb 0.31 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.31 2dl1 h ARG 16 CO -0.17 0.23 -0.01 1.49 0.10 0.00 0.00 179.97 181.61 2dl1 h GLU 17 N 0.36 -0.04 -0.28 0.08 4.81 -1.35 -3.05 114.58 115.12 2dl1 h GLU 17 Ca 0.68 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.99 2dl1 h GLU 17 Cb 1.69 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 31.06 2dl1 h GLU 17 CO -0.42 -0.02 0.48 0.00 -0.73 0.00 0.00 179.01 178.31 2dl1 h ALA 18 N -1.17 1.87 0.09 2.92 0.00 -0.33 0.42 119.26 123.07 2dl1 h ALA 18 Ca -0.00 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2dl1 h ALA 18 Cb 0.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2dl1 h ALA 18 CO 0.01 -0.62 -1.16 -0.92 0.00 0.00 0.00 179.25 176.56 2dl1 h TYR 19 N 0.00 0.52 0.00 0.00 3.20 0.21 -2.69 116.97 118.21 2dl1 h TYR 19 Ca 0.13 -0.35 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 2dl1 h TYR 19 Cb 1.08 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.32 2dl1 h TYR 19 CO 0.00 1.24 -0.02 -0.22 -1.64 0.00 0.00 178.16 177.52 2dl1 h LYS 20 N 0.11 0.00 -0.64 1.82 3.64 -0.13 -2.98 116.57 118.39 2dl1 h LYS 20 Ca -0.12 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.42 2dl1 h LYS 20 Cb 1.86 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.64 2dl1 h LYS 20 CO 0.19 0.09 0.44 0.87 -2.27 0.00 0.00 179.45 178.77 2dl1 h LYS 21 N -1.00 0.18 -0.00 1.90 1.57 -1.22 0.57 116.57 118.57 2dl1 h LYS 21 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2dl1 h LYS 21 Cb 0.10 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 2dl1 h LYS 21 CO -0.00 0.12 -0.00 0.00 -0.57 0.00 0.00 179.45 179.00 2dl1 h ALA 22 N 1.69 0.00 0.00 3.86 0.00 -1.59 -3.02 119.26 120.20 2dl1 h ALA 22 Ca 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2dl1 h ALA 22 Cb 0.97 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2dl1 h ALA 22 CO -0.05 -0.29 0.00 1.19 0.00 0.00 0.00 179.25 180.10 2dl1 n PHE 23 N -4.89 0.35 -0.00 0.00 3.72 -0.65 -2.82 117.46 113.17 2dl1 n PHE 23 Ca -0.08 0.11 -0.13 0.00 -0.05 0.00 0.00 57.45 57.30 2dl1 n PHE 23 Cb 0.22 -0.67 -0.10 0.00 -0.94 0.00 0.00 39.48 37.99 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 -0.03 -0.40 4.37 5.85 0.22 -2.72 115.31 122.60 2dl1 h LEU 24 Ca 0.00 -0.50 -0.17 0.00 0.84 0.00 0.00 57.88 58.06 2dl1 h LEU 24 Cb 0.55 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2dl1 h LEU 24 CO 0.00 0.49 -0.80 -0.26 -0.34 0.00 0.00 178.44 177.53 2dl1 h PHE 25 N -0.56 0.01 -0.60 1.25 0.04 -1.59 -3.25 116.94 112.25 2dl1 h PHE 25 Ca -0.00 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 2dl1 h PHE 25 Cb 0.52 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.64 2dl1 h PHE 25 CO 0.10 0.80 0.35 0.28 -0.60 0.00 0.00 178.31 179.25 2dl1 h VAL 26 N 0.00 1.18 -0.09 -0.55 2.07 -1.57 0.25 116.25 117.55 2dl1 h VAL 26 Ca -0.01 -0.42 -0.04 0.00 0.82 0.00 0.00 66.70 67.06 2dl1 h VAL 26 Cb 1.41 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2dl1 h VAL 26 CO 0.10 0.19 -0.11 -1.13 0.02 0.00 0.00 177.57 176.64 2dl1 h ASN 27 N 0.81 0.12 0.27 0.57 -1.24 -1.51 -2.10 115.58 112.50 2dl1 h ASN 27 Ca 0.21 -0.02 -0.34 0.00 0.71 0.00 0.00 56.30 56.87 2dl1 h ASN 27 Cb -0.00 -0.03 0.03 0.00 0.73 0.00 0.00 38.32 39.04 2dl1 h ASN 27 CO -0.04 0.26 -1.53 0.11 -1.29 0.00 0.00 177.43 174.94 2dl1 h LYS 28 N 0.13 0.50 0.00 6.67 1.57 -1.43 -3.16 116.57 120.85 2dl1 h LYS 28 Ca 0.03 -0.85 -0.02 0.00 -1.87 0.00 0.00 60.65 57.94 2dl1 h LYS 28 Cb 0.28 0.32 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 2dl1 h LYS 28 CO 0.02 1.41 -0.08 0.78 -0.57 0.00 0.00 179.45 181.00 2dl1 h GLY 29 N 0.36 0.00 1.18 3.86 0.00 -0.23 -2.67 103.07 105.58 2dl1 h GLY 29 Ca -0.27 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 46.73 2dl1 h GLY 29 CO 0.25 0.00 -1.48 1.41 0.00 0.00 0.00 176.54 176.73 2dl1 h LEU 30 N 0.00 0.81 0.55 3.11 3.38 -1.45 -3.26 115.31 118.44 2dl1 h LEU 30 Ca -0.00 -0.92 -0.03 0.00 0.09 0.00 0.00 57.88 57.02 2dl1 h LEU 30 Cb 0.30 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.80 2dl1 h LEU 30 CO 0.01 1.71 -0.26 -1.13 0.09 0.00 0.00 178.44 178.85 2dl1 h ASN 31 N 0.11 -0.62 -0.96 -0.43 -1.24 -1.45 -2.91 115.58 108.09 2dl1 h ASN 31 Ca -0.26 0.02 0.15 0.00 0.71 0.00 0.00 56.30 56.92 2dl1 h ASN 31 Cb 2.13 0.16 -0.15 0.00 0.73 0.00 0.00 38.32 41.19 2dl1 h ASN 31 CO 0.26 -0.42 -0.40 0.71 -1.29 0.00 0.00 177.43 176.29 2dl1 h THR 32 N -0.78 0.02 -1.05 -3.57 1.35 -1.66 1.17 112.91 108.39 2dl1 h THR 32 Ca -0.08 0.00 0.27 0.00 -0.55 0.00 0.00 66.41 66.06 2dl1 h THR 32 Cb 0.56 0.02 -0.09 0.00 -1.73 0.00 0.00 68.15 66.91 2dl1 h THR 32 CO 0.12 0.00 0.69 -0.78 -0.25 0.00 0.00 175.52 175.30 2dl1 h ASP 33 N -0.02 0.38 -0.10 5.36 3.58 -1.59 0.32 116.42 124.35 2dl1 h ASP 33 Ca 0.33 0.07 -0.22 0.00 0.42 0.00 0.00 57.03 57.63 2dl1 h ASP 33 Cb 0.58 0.01 0.01 0.00 1.72 0.00 0.00 39.33 41.66 2dl1 h ASP 33 CO -0.96 0.08 -0.79 1.05 -2.88 0.00 0.00 179.24 175.74 2dl1 h GLU 34 N 0.34 0.70 -0.01 0.28 4.11 0.16 -3.20 114.58 116.96 2dl1 h GLU 34 Ca 0.58 -0.63 -0.09 0.00 0.07 0.00 0.00 59.36 59.29 2dl1 h GLU 34 Cb 1.58 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.97 2dl1 h GLU 34 CO -0.25 1.23 -0.44 -0.07 0.07 0.00 0.00 179.01 179.56 2dl1 h LEU 35 N 0.39 0.02 0.00 3.06 3.38 0.71 -3.46 115.31 119.40 2dl1 h LEU 35 Ca -0.07 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2dl1 h LEU 35 Cb 1.43 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.18 2dl1 h LEU 35 CO 0.16 0.45 0.00 0.61 0.09 0.00 0.00 178.44 179.75 2dl1 n GLY 36 N -0.26 1.01 3.46 0.83 0.00 0.81 -5.07 105.19 105.97 2dl1 n GLY 36 Ca -0.02 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 1.20 0.00 0.00 0.00 173.32 174.52 2dl1 s GLN 37 N 0.00 3.59 -0.02 1.61 -1.52 -0.47 -4.86 119.66 117.98 2dl1 s GLN 37 Ca 0.00 -1.68 -0.23 0.00 -1.95 0.00 0.00 55.36 51.50 2dl1 s GLN 37 Cb 0.00 -4.95 -0.17 0.00 -0.22 0.00 0.00 33.01 27.67 2dl1 s GLN 37 CO 0.00 -1.82 1.07 0.87 -0.25 0.00 0.00 175.29 175.16 2dl1 h LYS 38 N 8.95 -0.25 -0.32 2.91 1.79 -1.91 -2.50 116.57 125.24 2dl1 h LYS 38 Ca 0.15 0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.67 2dl1 h LYS 38 Cb 1.02 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 31.69 2dl1 h LYS 38 CO 1.14 0.15 -0.25 0.93 -1.08 0.00 0.00 179.45 180.34 2dl1 h GLU 39 N -0.77 -0.08 -0.59 3.15 5.08 -1.97 -0.07 114.58 119.34 2dl1 h GLU 39 Ca -0.03 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.45 2dl1 h GLU 39 Cb 0.51 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 2dl1 h GLU 39 CO 0.04 -0.05 0.14 0.93 -1.00 0.00 0.00 179.01 179.07 2dl1 h GLU 40 N -0.08 0.27 -0.21 2.33 3.07 -1.99 -2.64 114.58 115.33 2dl1 h GLU 40 Ca 0.05 -0.02 0.03 0.00 -0.50 0.00 0.00 59.36 58.93 2dl1 h GLU 40 Cb 0.22 -0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.01 2dl1 h GLU 40 CO -0.34 0.18 -0.38 0.00 -1.40 0.00 0.00 179.01 177.06 2dl1 h ALA 41 N 1.46 -0.68 -0.70 3.43 0.00 -0.60 -0.14 119.26 122.03 2dl1 h ALA 41 Ca 0.31 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.33 2dl1 h ALA 41 Cb 0.45 0.95 -0.13 0.00 0.00 0.00 0.00 17.79 19.06 2dl1 h ALA 41 CO -0.38 -0.84 -0.26 0.87 0.00 0.00 0.00 179.25 178.63 2dl1 h LYS 42 N -0.32 -0.07 -0.19 0.00 1.57 -0.81 -0.18 116.57 116.57 2dl1 h LYS 42 Ca 0.04 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 2dl1 h LYS 42 Cb 0.43 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 2dl1 h LYS 42 CO -0.37 -0.04 -0.21 -0.97 -0.57 0.00 0.00 179.45 177.28 2dl1 h ASN 43 N -0.07 -0.68 -0.12 0.86 -1.24 -1.05 0.30 115.58 113.58 2dl1 h ASN 43 Ca 0.31 0.12 0.04 0.00 0.71 0.00 0.00 56.30 57.48 2dl1 h ASN 43 Cb 0.55 0.32 -0.07 0.00 0.73 0.00 0.00 38.32 39.86 2dl1 h ASN 43 CO -0.75 -0.26 -0.45 1.88 -1.29 0.00 0.00 177.43 176.57 2dl1 h TYR 44 N -0.24 -1.29 -0.16 0.67 0.05 0.72 -0.71 116.97 116.01 2dl1 h TYR 44 Ca 0.12 0.05 0.05 0.00 0.05 0.00 0.00 58.73 59.00 2dl1 h TYR 44 Cb 0.42 0.58 -0.05 0.00 1.01 0.00 0.00 36.73 38.69 2dl1 h TYR 44 CO -0.35 -0.49 -0.14 1.88 -1.05 0.00 0.00 178.16 178.01 2dl1 h TYR 45 N -0.52 -0.35 -0.87 4.88 0.05 -0.95 -0.27 116.97 118.93 2dl1 h TYR 45 Ca 0.07 0.02 0.24 0.00 0.05 0.00 0.00 58.73 59.10 2dl1 h TYR 45 Cb 0.64 0.18 -0.05 0.00 1.01 0.00 0.00 36.73 38.52 2dl1 h TYR 45 CO -0.50 -0.21 0.61 0.87 -1.05 0.00 0.00 178.16 177.88 2dl1 h LYS 46 N -0.16 0.13 0.00 4.88 1.57 -0.35 0.64 116.57 123.28 2dl1 h LYS 46 Ca 0.10 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.76 2dl1 h LYS 46 Cb 0.31 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2dl1 h LYS 46 CO -0.26 0.08 -0.54 1.96 -0.57 0.00 0.00 179.45 180.13 2dl1 h GLN 47 N 0.13 0.00 0.15 3.15 4.20 0.42 -3.31 115.11 119.85 2dl1 h GLN 47 Ca 0.43 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.91 2dl1 h GLN 47 Cb 1.49 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.29 2dl1 h GLN 47 CO -0.06 0.54 -1.09 0.78 -0.67 0.00 0.00 178.83 178.32 2dl1 h GLY 48 N 3.30 0.35 -0.01 3.46 0.00 0.12 -3.35 103.07 106.95 2dl1 h GLY 48 Ca -0.01 -0.90 0.01 0.00 0.00 0.00 0.00 47.33 46.43 2dl1 h GLY 48 CO 0.07 0.79 -0.21 -2.22 0.00 0.00 0.00 176.54 174.97 2dl1 h ILE 49 N -0.29 0.00 -0.93 2.60 2.04 -1.00 0.11 117.51 120.04 2dl1 h ILE 49 Ca -0.21 0.00 0.30 0.00 1.00 0.00 0.00 64.86 65.95 2dl1 h ILE 49 Cb 1.74 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 37.65 2dl1 h ILE 49 CO 0.13 0.00 0.18 0.61 0.00 0.00 0.00 178.15 179.08 2dl1 n GLY 50 N -1.17 -1.07 0.10 5.37 0.00 -1.24 0.01 105.19 107.19 2dl1 n GLY 50 Ca -0.03 0.86 -0.13 0.00 0.00 0.00 0.00 46.02 46.72 2dl1 n GLY 50 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2dl1 h HIS 51 N 0.00 -0.14 -0.72 1.61 3.86 -1.46 -3.01 115.15 115.29 2dl1 h HIS 51 Ca 0.64 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.91 2dl1 h HIS 51 Cb 1.48 0.05 -0.09 0.00 1.06 0.00 0.00 27.41 29.91 2dl1 h HIS 51 CO -0.32 0.24 -0.43 1.28 0.86 0.00 0.00 177.93 179.57 2dl1 n LEU 52 N -4.97 -0.77 -0.01 2.43 4.77 0.10 -1.10 117.00 117.46 2dl1 n LEU 52 Ca -0.09 1.55 -0.12 0.00 -0.03 0.00 0.00 56.01 57.32 2dl1 n LEU 52 Cb 0.23 -0.30 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 2dl1 n LEU 52 CO 0.32 -1.18 0.59 -0.07 -1.33 0.00 0.00 177.39 175.72 2dl1 h LEU 53 N 0.00 -1.30 -1.54 2.23 3.38 -1.54 0.12 115.31 116.66 2dl1 h LEU 53 Ca 0.12 0.17 0.44 0.00 0.09 0.00 0.00 57.88 58.70 2dl1 h LEU 53 Cb 0.30 0.53 -0.11 0.00 0.09 0.00 0.00 40.66 41.46 2dl1 h LEU 53 CO -0.68 -0.42 0.93 -0.09 0.09 0.00 0.00 178.44 178.27 2dl1 h ARG 54 N -0.48 0.08 0.11 1.13 2.43 -0.96 1.80 114.38 118.49 2dl1 h ARG 54 Ca 0.08 -0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.94 2dl1 h ARG 54 Cb 0.62 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 2dl1 h ARG 54 CO -0.40 0.05 -1.54 0.78 -1.51 0.00 0.00 179.97 177.35 2dl1 h GLY 55 N 0.08 0.27 -0.20 2.80 0.00 0.22 -3.31 103.07 102.93 2dl1 h GLY 55 Ca 0.81 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2dl1 h GLY 55 CO -0.32 0.61 -0.03 1.39 0.00 0.00 0.00 176.54 178.19 2dl1 n ILE 56 N -3.44 0.00 -1.65 2.60 5.41 0.22 -3.93 119.36 118.57 2dl1 n ILE 56 Ca -0.17 -0.21 -0.27 0.00 1.00 0.00 0.00 62.75 63.10 2dl1 n ILE 56 Cb 1.04 0.38 0.06 0.00 -0.71 0.00 0.00 39.64 40.42 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 -0.07 5.97 0.00 4.38 7.64 0.55 -4.84 113.62 127.25 2dl1 n SER 57 Ca 0.18 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.30 2dl1 n SER 57 Cb 0.33 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 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 -0.85 0.00 0.15 0.44 2.08 -1.25 -4.94 119.36 114.99 2dl1 n ILE 58 Ca 0.52 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.83 2dl1 n ILE 58 Cb 0.85 -0.07 0.00 0.00 -0.75 0.00 0.00 39.64 39.67 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 -2.72 -3.87 4.38 2.88 -1.26 -5.02 113.62 108.01 2dl1 n SER 59 Ca 0.00 0.61 -0.29 0.00 -1.33 0.00 0.00 58.87 57.86 2dl1 n SER 59 Cb 0.00 2.69 -0.05 0.00 -0.75 0.00 0.00 64.21 66.09 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 -3.11 -1.55 -4.91 -3.46 3.41 -1.26 -4.89 113.62 97.86 2dl1 n SER 60 Ca 0.00 -0.69 -0.20 0.00 -0.26 0.00 0.00 58.87 57.72 2dl1 n SER 60 Cb 0.00 -1.39 -0.02 0.00 -0.26 0.00 0.00 64.21 62.53 2dl1 n SER 60 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2dl1 s LYS 61 N -6.47 2.71 -0.53 4.33 -2.85 -1.26 -4.99 119.74 110.68 2dl1 s LYS 61 Ca 0.57 -1.35 -0.40 0.00 -1.00 0.00 0.00 55.97 53.78 2dl1 s LYS 61 Cb -0.33 -2.53 -0.17 0.00 -2.06 0.00 0.00 37.83 32.73 2dl1 s LYS 61 CO 0.70 -0.10 2.23 -1.91 0.10 0.00 0.00 175.35 176.36 2dl1 n GLU 62 N -1.57 0.26 -3.11 1.78 2.13 -1.26 -4.88 120.64 113.99 2dl1 n GLU 62 Ca 0.03 0.06 -0.12 0.00 0.66 0.00 0.00 57.16 57.79 2dl1 n GLU 62 Cb 0.60 -1.75 -0.03 0.00 0.27 0.00 0.00 31.44 30.53 2dl1 n GLU 62 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2dl1 n SER 63 N 8.56 1.05 -0.24 4.31 7.64 -1.26 -5.05 113.62 128.63 2dl1 n SER 63 Ca 0.53 -2.00 0.12 0.00 1.01 0.00 0.00 58.87 58.53 2dl1 n SER 63 Cb 0.04 0.48 0.15 0.00 -1.01 0.00 0.00 64.21 63.87 2dl1 n SER 63 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dl1 n GLU 64 N -0.42 0.67 -0.58 1.43 4.71 -1.26 -4.97 120.64 120.22 2dl1 n GLU 64 Ca -0.03 -0.48 -0.29 0.00 -0.01 0.00 0.00 57.16 56.35 2dl1 n GLU 64 Cb 0.28 -1.49 0.19 0.00 -1.01 0.00 0.00 31.44 29.41 2dl1 n GLU 64 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2dl1 n HIS 65 N -0.74 -1.76 0.00 -0.32 8.25 -1.26 -5.05 115.22 114.34 2dl1 n HIS 65 Ca 0.09 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2dl1 n HIS 65 Cb 0.38 -1.52 0.00 0.00 1.12 0.00 0.00 29.99 29.97 2dl1 n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2dl1 n THR 66 N -4.64 0.00 0.00 1.59 -2.24 -1.26 -5.17 114.28 102.57 2dl1 n THR 66 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2dl1 n THR 66 Cb 0.57 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 2dl1 n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dl1 n GLY 67 N -0.01 2.94 0.22 3.38 0.00 -1.26 -4.90 105.19 105.56 2dl1 n GLY 67 Ca 0.00 -1.81 0.09 0.00 0.00 0.00 0.00 46.02 44.30 2dl1 n GLY 67 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dl1 h PRO 68 N 0.00 0.00 -0.71 1.61 0.13 -2.03 -3.18 132.00 127.83 2dl1 h PRO 68 Ca 0.00 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.24 2dl1 h PRO 68 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.05 2dl1 h PRO 68 CO 0.00 0.26 0.32 0.78 -0.23 0.00 0.00 178.00 179.13 2dl1 h GLY 69 N 1.69 1.06 2.00 1.56 0.00 -2.01 0.96 103.07 108.31 2dl1 h GLY 69 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2dl1 h GLY 69 CO 0.03 0.01 0.00 1.49 0.00 0.00 0.00 176.54 178.07 2dl1 h TRP 70 N 0.53 0.00 0.24 5.60 4.06 -1.91 -2.70 115.95 121.78 2dl1 h TRP 70 Ca 0.36 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.30 2dl1 h TRP 70 Cb 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 2dl1 h TRP 70 CO -0.13 0.00 -0.11 1.49 -3.56 0.00 0.00 178.44 176.13 2dl1 h GLU 71 N 0.00 -0.31 -0.46 0.49 4.81 -0.91 -2.14 114.58 116.07 2dl1 h GLU 71 Ca 0.00 0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.12 2dl1 h GLU 71 Cb 0.62 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 2dl1 h GLU 71 CO 0.00 0.03 -0.22 0.77 -0.73 0.00 0.00 179.01 178.86 2dl1 h SER 72 N -0.69 0.99 -0.43 1.04 0.02 -1.50 -2.73 113.55 110.25 2dl1 h SER 72 Ca -0.03 -0.40 0.04 0.00 -0.84 0.00 0.00 61.79 60.56 2dl1 h SER 72 Cb 0.48 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 2dl1 h SER 72 CO 0.05 1.17 0.29 0.00 -1.14 0.00 0.00 176.83 177.21 2dl1 h ALA 73 N 0.85 1.87 -0.00 3.77 0.00 -1.53 -1.03 119.26 123.19 2dl1 h ALA 73 Ca 0.10 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 2dl1 h ALA 73 Cb 0.80 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2dl1 h ALA 73 CO 0.07 0.07 -0.79 0.00 0.00 0.00 0.00 179.25 178.59 2dl1 h ARG 74 N 0.43 0.09 0.42 0.00 3.08 -1.17 -3.26 114.38 113.97 2dl1 h ARG 74 Ca 0.18 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 2dl1 h ARG 74 Cb 0.18 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2dl1 h ARG 74 CO -0.04 0.84 -0.20 1.96 -1.07 0.00 0.00 179.97 181.45 2dl1 h GLN 75 N 0.06 -0.55 -1.15 0.04 1.08 -0.91 -2.97 115.11 110.71 2dl1 h GLN 75 Ca -0.02 0.04 0.33 0.00 -1.45 0.00 0.00 58.65 57.55 2dl1 h GLN 75 Cb 1.39 0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 28.90 2dl1 h GLN 75 CO 0.11 -0.24 0.88 0.52 -0.95 0.00 0.00 178.83 179.15 2dl1 h MET 76 N -0.93 0.00 0.40 1.46 2.86 -1.49 -0.03 114.93 117.20 2dl1 h MET 76 Ca -0.06 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 2dl1 h MET 76 Cb 0.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.23 2dl1 h MET 76 CO 0.10 0.00 -0.19 0.37 1.06 0.00 0.00 176.91 178.24 2dl1 h GLN 77 N 0.00 -0.52 -0.46 1.72 4.15 -1.56 -3.21 115.11 115.23 2dl1 h GLN 77 Ca 0.55 0.04 0.07 0.00 0.77 0.00 0.00 58.65 60.07 2dl1 h GLN 77 Cb 2.30 0.12 -0.09 0.00 0.21 0.00 0.00 27.48 30.02 2dl1 h GLN 77 CO -0.01 -0.21 -0.48 0.37 -1.93 0.00 0.00 178.83 176.57 2dl1 h GLN 78 N -0.85 -0.31 -0.94 1.69 5.75 -0.93 -0.96 115.11 118.57 2dl1 h GLN 78 Ca -0.06 0.02 0.15 0.00 -0.15 0.00 0.00 58.65 58.62 2dl1 h GLN 78 Cb 0.55 0.07 -0.16 0.00 1.07 0.00 0.00 27.48 29.01 2dl1 h GLN 78 CO 0.09 -0.21 -0.34 1.17 -2.65 0.00 0.00 178.83 176.90 2dl1 n LYS 79 N -5.40 -0.19 -0.12 1.69 0.00 -1.14 0.58 118.16 113.59 2dl1 n LYS 79 Ca -0.01 1.45 -0.05 0.00 0.00 0.00 0.00 58.31 59.70 2dl1 n LYS 79 Cb 0.35 -2.15 0.03 0.00 0.00 0.00 0.00 35.03 33.26 2dl1 n LYS 79 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 2dl1 h MET 80 N 0.00 0.11 0.18 1.64 2.86 -1.18 -1.73 114.93 116.81 2dl1 h MET 80 Ca 0.35 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 58.00 2dl1 h MET 80 Cb 0.59 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.18 2dl1 h MET 80 CO -0.94 0.07 -0.48 0.87 1.06 0.00 0.00 176.91 177.49 2dl1 h LYS 81 N 0.11 -0.73 -0.46 1.72 1.57 0.54 0.44 116.57 119.76 2dl1 h LYS 81 Ca 0.19 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 59.12 2dl1 h LYS 81 Cb 0.27 0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.65 2dl1 h LYS 81 CO -0.32 -0.49 -0.24 0.93 -0.57 0.00 0.00 179.45 178.76 2dl1 h GLU 82 N -0.76 -0.14 -0.26 3.15 4.39 -0.97 0.13 114.58 120.12 2dl1 h GLU 82 Ca -0.00 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 2dl1 h GLU 82 Cb 0.75 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.41 2dl1 h GLU 82 CO -0.23 -0.09 0.04 1.15 -1.16 0.00 0.00 179.01 178.71 2dl1 h THR 83 N -0.14 1.14 0.01 1.13 2.02 -0.90 -3.18 112.91 112.99 2dl1 h THR 83 Ca 0.22 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 2dl1 h THR 83 Cb 0.48 0.90 -0.00 0.00 -1.74 0.00 0.00 68.15 67.79 2dl1 h THR 83 CO -0.55 0.18 -0.01 0.25 0.37 0.00 0.00 175.52 175.76 2dl1 h LEU 84 N 0.38 -0.03 -1.78 2.58 6.46 0.26 0.40 115.31 123.59 2dl1 h LEU 84 Ca 0.09 0.00 0.51 0.00 -0.12 0.00 0.00 57.88 58.36 2dl1 h LEU 84 Cb 0.19 0.01 -0.10 0.00 -0.73 0.00 0.00 40.66 40.04 2dl1 h LEU 84 CO 0.00 -0.01 1.17 0.06 -0.62 0.00 0.00 178.44 179.03 2dl1 h GLN 85 N -0.02 0.02 0.14 1.25 3.07 -1.47 1.76 115.11 119.85 2dl1 h GLN 85 Ca -0.00 -0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.46 2dl1 h GLN 85 Cb 0.02 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.59 2dl1 h GLN 85 CO -0.00 0.01 -1.25 -0.97 0.09 0.00 0.00 178.83 176.71 2dl1 h ASN 86 N 0.02 0.52 0.58 0.06 -1.24 -1.35 -3.32 115.58 110.84 2dl1 h ASN 86 Ca 0.87 -0.54 -0.03 0.00 0.71 0.00 0.00 56.30 57.32 2dl1 h ASN 86 Cb 3.24 -0.17 0.01 0.00 0.73 0.00 0.00 38.32 42.13 2dl1 h ASN 86 CO -0.17 1.41 -0.28 0.58 -1.29 0.00 0.00 177.43 177.69 2dl1 h VAL 87 N 0.11 0.00 -0.78 2.57 2.07 0.71 -2.69 116.25 118.23 2dl1 h VAL 87 Ca -0.15 -0.16 0.12 0.00 0.82 0.00 0.00 66.70 67.32 2dl1 h VAL 87 Cb 1.97 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.61 2dl1 h VAL 87 CO 0.21 0.00 -0.32 0.54 0.02 0.00 0.00 177.57 178.03 2dl1 n ARG 88 N -4.53 -0.20 -0.21 1.57 1.74 -0.62 0.15 116.66 114.57 2dl1 n ARG 88 Ca -0.10 1.20 -0.02 0.00 -0.77 0.00 0.00 57.85 58.16 2dl1 n ARG 88 Cb 0.31 -1.78 0.09 0.00 -1.02 0.00 0.00 32.46 30.06 2dl1 n ARG 88 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2dl1 h THR 89 N 0.00 0.91 -0.11 0.55 2.02 -1.65 0.88 112.91 115.51 2dl1 h THR 89 Ca 0.26 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.26 2dl1 h THR 89 Cb 0.45 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 2dl1 h THR 89 CO -0.77 0.10 0.04 0.03 0.37 0.00 0.00 175.52 175.29 2dl1 h ARG 90 N 0.56 0.10 0.00 6.66 -0.00 0.18 -1.45 114.38 120.43 2dl1 h ARG 90 Ca 0.29 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.76 2dl1 h ARG 90 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.18 2dl1 h ARG 90 CO -0.21 0.06 0.00 1.25 0.00 0.00 0.00 179.97 181.07 2dl1 h LEU 91 N 0.10 0.00 -0.01 3.04 5.85 -0.48 -1.81 115.31 122.01 2dl1 h LEU 91 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2dl1 h LEU 91 Cb 0.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2dl1 h LEU 91 CO -0.05 0.00 0.00 -0.33 -0.34 0.00 0.00 178.44 177.72 2dl1 h GLU 92 N 0.00 0.00 0.07 1.25 4.39 0.22 -3.13 114.58 117.39 2dl1 h GLU 92 Ca 0.00 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.33 2dl1 h GLU 92 Cb 0.40 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.01 2dl1 h GLU 92 CO 0.00 0.00 -2.13 -0.89 -1.16 0.00 0.00 179.01 174.83 2dl1 n ILE 93 N -2.50 1.66 -0.28 3.13 5.41 -0.71 -3.37 119.36 122.70 2dl1 n ILE 93 Ca 0.05 -0.65 -0.06 0.00 1.00 0.00 0.00 62.75 63.09 2dl1 n ILE 93 Cb 0.46 -1.52 0.06 0.00 -0.71 0.00 0.00 39.64 37.93 2dl1 n ILE 93 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2dl1 h LEU 94 N 0.04 1.01 0.32 1.39 3.38 -1.55 -1.47 115.31 118.43 2dl1 h LEU 94 Ca -0.46 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.35 2dl1 h LEU 94 Cb 2.00 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2dl1 h LEU 94 CO 0.03 0.87 -0.15 -0.33 0.09 0.00 0.00 178.44 178.95 2dl1 h GLU 95 N 1.09 -0.41 -0.16 1.13 4.39 -1.73 -2.82 114.58 116.07 2dl1 h GLU 95 Ca 0.26 0.03 0.05 0.00 0.34 0.00 0.00 59.36 60.04 2dl1 h GLU 95 Cb 0.13 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2dl1 h GLU 95 CO -0.03 -0.27 0.56 1.57 -1.16 0.00 0.00 179.01 179.68 2dl1 h LYS 96 N -0.85 0.00 0.23 2.33 5.09 -1.60 0.26 116.57 122.03 2dl1 h LYS 96 Ca -0.04 0.00 -0.33 0.00 0.09 0.00 0.00 60.65 60.36 2dl1 h LYS 96 Cb 0.33 0.00 0.04 0.00 0.10 0.00 0.00 32.23 32.70 2dl1 h LYS 96 CO 0.07 0.00 -1.45 0.78 -2.09 0.00 0.00 179.45 176.77 2dl1 h GLY 97 N 0.00 0.64 -4.09 0.07 0.00 -1.22 -3.46 103.07 95.02 2dl1 h GLY 97 Ca 0.07 -1.59 -0.53 0.00 0.00 0.00 0.00 47.33 45.28 2dl1 h GLY 97 CO -0.00 1.39 0.81 -2.27 0.00 0.00 0.00 176.54 176.47 2dl1 s LEU 98 N -7.65 4.34 0.00 3.11 1.98 0.91 -4.58 118.68 116.78 2dl1 s LEU 98 Ca -0.09 2.98 0.00 0.00 -2.89 0.00 0.00 54.13 54.13 2dl1 s LEU 98 Cb 0.04 -3.65 0.00 0.00 0.66 0.00 0.00 46.19 43.24 2dl1 s LEU 98 CO 0.95 -0.87 0.00 0.00 -1.89 0.00 0.00 176.35 174.54 2dl1 n ALA 99 N 1.20 0.00 -2.45 5.97 0.00 -1.26 -5.00 120.51 118.97 2dl1 n ALA 99 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.21 2dl1 n ALA 99 Cb 0.39 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.72 2dl1 n ALA 99 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2dl1 s THR 100 N 0.00 2.54 0.20 0.00 -1.32 -1.26 -5.15 115.64 110.64 2dl1 s THR 100 Ca 0.00 -1.93 -0.10 0.00 -1.21 0.00 0.00 61.69 58.45 2dl1 s THR 100 Cb 0.00 -2.22 -0.01 0.00 -1.51 0.00 0.00 72.50 68.77 2dl1 s THR 100 CO 0.00 -0.10 0.36 -0.44 -2.21 0.00 0.00 174.62 172.23 2dl1 s SER 101 N -2.65 -0.03 -0.23 8.08 0.01 -1.26 -5.05 113.70 112.57 2dl1 s SER 101 Ca 0.21 -0.89 0.14 0.00 1.31 0.00 0.00 55.95 56.72 2dl1 s SER 101 Cb -0.08 0.50 0.56 0.00 0.21 0.00 0.00 66.02 67.20 2dl1 s SER 101 CO 0.11 -0.99 1.50 0.18 0.41 0.00 0.00 173.24 174.45 2dl1 n LEU 102 N -0.29 4.32 -1.01 2.44 4.32 -1.26 -4.92 117.00 120.60 2dl1 n LEU 102 Ca -0.05 -3.25 -0.12 0.00 -0.02 0.00 0.00 56.01 52.58 2dl1 n LEU 102 Cb 0.63 -0.60 -0.05 0.00 -1.62 0.00 0.00 43.42 41.78 2dl1 n LEU 102 CO 0.24 0.84 -0.11 0.00 -1.22 0.00 0.00 177.39 177.14 2dl1 n GLN 103 N -0.62 -1.58 -2.14 3.23 1.13 -1.26 -4.85 117.38 111.28 2dl1 n GLN 103 Ca 0.28 0.82 -0.37 0.00 -1.94 0.00 0.00 57.00 55.79 2dl1 n GLN 103 Cb 1.01 -5.08 -0.03 0.00 0.11 0.00 0.00 30.24 26.25 2dl1 n GLN 103 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2dl1 s ASN 104 N -2.20 5.43 1.30 1.08 -0.87 -1.26 -4.97 114.94 113.45 2dl1 s ASN 104 Ca 0.00 -0.07 -0.16 0.00 -1.57 0.00 0.00 52.86 51.07 2dl1 s ASN 104 Cb 0.00 -2.54 0.24 0.00 -0.02 0.00 0.00 41.25 38.93 2dl1 s ASN 104 CO 0.00 -2.33 0.55 -0.90 -2.57 0.00 0.00 177.10 171.85 2dl1 n ASP 105 N 12.33 -3.40 -4.70 -1.22 3.85 -1.26 -4.94 116.55 117.21 2dl1 n ASP 105 Ca 0.22 -0.56 -0.33 0.00 -0.71 0.00 0.00 54.79 53.42 2dl1 n ASP 105 Cb 0.51 -0.64 0.13 0.00 -1.35 0.00 0.00 41.12 39.76 2dl1 n ASP 105 CO 0.00 0.00 0.00 -1.48 -1.01 0.00 0.00 177.20 174.71 2dl1 s LEU 106 N 0.00 3.09 -0.33 -2.12 0.05 -1.26 -4.99 118.68 113.12 2dl1 s LEU 106 Ca 0.43 2.26 0.17 0.00 0.05 0.00 0.00 54.13 57.04 2dl1 s LEU 106 Cb -0.08 -4.58 0.46 0.00 -2.05 0.00 0.00 46.19 39.94 2dl1 s LEU 106 CO 0.36 -2.64 0.99 1.67 -0.55 0.00 0.00 176.35 176.17 2dl1 n GLN 107 N -3.45 1.16 -1.90 1.48 -0.06 -1.26 -5.10 117.38 108.24 2dl1 n GLN 107 Ca 0.13 -3.13 -0.42 0.00 -2.00 0.00 0.00 57.00 51.57 2dl1 n GLN 107 Cb 0.51 -1.15 -0.03 0.00 -4.06 0.00 0.00 30.24 25.51 2dl1 n GLN 107 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 2dl1 s GLU 108 N -2.86 4.20 0.03 3.69 2.56 -1.26 -5.00 118.70 120.06 2dl1 s GLU 108 Ca 0.27 2.38 -0.02 0.00 0.00 0.00 0.00 54.97 57.60 2dl1 s GLU 108 Cb 0.45 -3.34 -0.02 0.00 2.00 0.00 0.00 34.13 33.22 2dl1 s GLU 108 CO 0.03 -0.68 0.00 0.14 -0.56 0.00 0.00 175.26 174.20 2dl1 s VAL 109 N 1.78 0.15 0.49 3.70 -7.23 -1.26 -5.15 120.40 112.88 2dl1 s VAL 109 Ca 0.72 -1.23 -0.22 0.00 -1.81 0.00 0.00 61.98 59.45 2dl1 s VAL 109 Cb -0.43 -0.81 -0.07 0.00 0.56 0.00 0.00 36.38 35.64 2dl1 s VAL 109 CO 0.32 -0.68 1.15 -2.16 -0.31 0.00 0.00 175.10 173.42 2dl1 s PRO 110 N -2.49 3.60 -0.92 4.82 0.04 -1.26 -3.97 135.00 134.81 2dl1 s PRO 110 Ca -0.06 1.71 -0.04 0.00 0.04 0.00 0.00 61.00 62.64 2dl1 s PRO 110 Cb -0.02 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 2dl1 s PRO 110 CO -0.05 -0.67 0.80 0.45 0.04 0.00 0.00 177.00 177.58 2dl1 n SER 111 N -0.81 -5.32 -3.71 6.66 2.88 -1.26 -5.03 113.62 107.02 2dl1 n SER 111 Ca 0.09 -0.60 -0.15 0.00 -1.33 0.00 0.00 58.87 56.89 2dl1 n SER 111 Cb 0.49 -4.54 0.07 0.00 -0.75 0.00 0.00 64.21 59.48 2dl1 n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dl1 n GLY 112 N -1.24 0.94 3.77 0.46 0.00 -1.25 -5.08 105.19 102.78 2dl1 n GLY 112 Ca -0.09 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.56 2dl1 n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dl1 s PRO 113 N -4.07 2.59 0.11 1.61 0.04 -1.26 -4.99 135.00 129.03 2dl1 s PRO 113 Ca 0.42 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.76 2dl1 s PRO 113 Cb -0.03 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2dl1 s PRO 113 CO 0.28 -1.40 0.00 0.43 0.04 0.00 0.00 177.00 176.35 2dl1 n SER 114 N -2.86 -0.21 -1.15 6.66 7.64 -1.26 -5.17 113.62 117.27 2dl1 n SER 114 Ca 0.10 0.19 0.15 0.00 1.01 0.00 0.00 58.87 60.31 2dl1 n SER 114 Cb 0.52 0.30 -0.05 0.00 -1.01 0.00 0.00 64.21 63.97 2dl1 n SER 114 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dl1 n SER 115 N -2.84 -6.91 0.00 6.43 2.88 -1.26 -5.36 113.62 106.57 2dl1 n SER 115 Ca 0.00 0.71 0.00 0.00 -1.33 0.00 0.00 58.87 58.25 2dl1 n SER 115 Cb 0.00 -3.66 0.00 0.00 -0.75 0.00 0.00 64.21 59.80 2dl1 n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42