#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 3.16 -1.91 1.61 7.64 -1.26 -5.01 113.62 117.85 2dl1 n SER 2 Ca 0.00 -3.35 -0.07 0.00 1.01 0.00 0.00 58.87 56.46 2dl1 n SER 2 Cb 0.00 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 62.61 2dl1 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dl1 n SER 3 N -0.86 -0.66 0.00 6.43 3.41 -1.26 -5.18 113.62 115.51 2dl1 n SER 3 Ca 0.26 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 57.01 2dl1 n SER 3 Cb 0.94 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 66.11 2dl1 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dl1 n GLY 4 N -0.27 0.85 5.03 5.00 0.00 -1.26 -4.39 105.19 110.15 2dl1 n GLY 4 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2dl1 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dl1 n SER 5 N 0.00 0.00 -0.11 1.61 7.64 -1.26 -1.98 113.62 119.52 2dl1 n SER 5 Ca 0.00 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.65 2dl1 n SER 5 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 2dl1 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dl1 n SER 6 N 0.76 1.88 -4.53 6.43 7.64 -1.26 -4.87 113.62 119.66 2dl1 n SER 6 Ca 0.00 0.41 -0.49 0.00 1.01 0.00 0.00 58.87 59.80 2dl1 n SER 6 Cb 0.00 -0.94 -0.06 0.00 -1.01 0.00 0.00 64.21 62.21 2dl1 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dl1 n GLY 7 N 1.41 0.78 3.25 0.23 0.00 -0.84 -4.93 105.19 105.10 2dl1 n GLY 7 Ca -0.35 0.89 -0.13 0.00 0.00 0.00 0.00 46.02 46.43 2dl1 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dl1 s GLU 8 N 5.75 0.65 0.20 1.61 2.02 -1.26 -4.68 118.70 123.00 2dl1 s GLU 8 Ca 1.04 -0.08 -0.30 0.00 0.02 0.00 0.00 54.97 55.66 2dl1 s GLU 8 Cb -0.74 0.29 -0.09 0.00 0.10 0.00 0.00 34.13 33.70 2dl1 s GLU 8 CO 0.48 -0.17 1.30 -1.25 0.02 0.00 0.00 175.26 175.64 2dl1 s PRO 9 N -1.12 4.39 0.51 0.39 0.04 -1.26 -4.83 135.00 133.13 2dl1 s PRO 9 Ca -0.12 2.04 0.40 0.00 0.04 0.00 0.00 61.00 63.36 2dl1 s PRO 9 Cb -0.05 -3.20 1.57 0.00 0.04 0.00 0.00 34.50 32.87 2dl1 s PRO 9 CO 0.04 -0.24 1.64 0.00 0.04 0.00 0.00 177.00 178.48 2dl1 h ALA 10 N 5.32 3.27 0.67 8.56 0.00 -2.01 0.21 119.26 135.28 2dl1 h ALA 10 Ca -0.45 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.44 2dl1 h ALA 10 Cb 1.21 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.17 2dl1 h ALA 10 CO 0.77 -1.82 -0.32 0.93 0.00 0.00 0.00 179.25 178.81 2dl1 h GLU 11 N 0.04 -0.86 -0.32 0.00 3.07 -2.00 -2.24 114.58 112.27 2dl1 h GLU 11 Ca 0.82 0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.73 2dl1 h GLU 11 Cb 3.01 0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 31.10 2dl1 h GLU 11 CO -0.18 -0.56 0.17 0.82 -1.40 0.00 0.00 179.01 177.86 2dl1 h ILE 12 N -0.93 1.14 -0.95 3.13 2.04 -1.01 -2.53 117.51 118.39 2dl1 h ILE 12 Ca -0.09 -0.37 0.23 0.00 1.00 0.00 0.00 64.86 65.63 2dl1 h ILE 12 Cb 0.70 0.80 -0.12 0.00 -0.74 0.00 0.00 36.82 37.46 2dl1 h ILE 12 CO 0.15 0.14 0.51 0.07 0.00 0.00 0.00 178.15 179.02 2dl1 h LYS 13 N 0.39 0.51 0.18 2.37 2.10 -1.24 -0.16 116.57 120.72 2dl1 h LYS 13 Ca 0.11 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.72 2dl1 h LYS 13 Cb 0.07 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.29 2dl1 h LYS 13 CO -0.02 0.34 -0.09 0.82 -2.00 0.00 0.00 179.45 178.50 2dl1 h ILE 14 N 0.53 0.93 -0.93 0.07 2.04 -1.04 -3.07 117.51 116.03 2dl1 h ILE 14 Ca 0.60 -0.72 0.19 0.00 1.00 0.00 0.00 64.86 65.92 2dl1 h ILE 14 Cb 1.10 1.35 -0.08 0.00 -0.74 0.00 0.00 36.82 38.46 2dl1 h ILE 14 CO -0.48 0.16 0.60 0.40 0.00 0.00 0.00 178.15 178.83 2dl1 h ILE 15 N -0.61 0.72 -0.07 -0.67 2.04 -0.85 -0.90 117.51 117.16 2dl1 h ILE 15 Ca -0.02 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.66 2dl1 h ILE 15 Cb 0.45 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 2dl1 h ILE 15 CO 0.04 0.10 -0.06 -0.09 0.00 0.00 0.00 178.15 178.14 2dl1 h ARG 16 N 0.56 -0.07 0.47 2.37 2.43 -0.99 0.43 114.38 119.58 2dl1 h ARG 16 Ca 0.49 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.64 2dl1 h ARG 16 Cb 1.00 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2dl1 h ARG 16 CO -0.23 -0.05 -0.23 1.49 -1.51 0.00 0.00 179.97 179.45 2dl1 h GLU 17 N -0.07 -0.61 -0.95 0.20 4.81 -1.17 -3.08 114.58 113.72 2dl1 h GLU 17 Ca 0.05 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.48 2dl1 h GLU 17 Cb 0.15 0.14 -0.08 0.00 0.63 0.00 0.00 28.75 29.58 2dl1 h GLU 17 CO -0.12 -0.30 0.60 0.00 -0.73 0.00 0.00 179.01 178.46 2dl1 h ALA 18 N -0.61 1.75 -0.26 2.92 0.00 -1.18 0.16 119.26 122.03 2dl1 h ALA 18 Ca -0.06 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.94 2dl1 h ALA 18 Cb 0.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dl1 h ALA 18 CO 0.11 -0.02 0.19 -0.92 0.00 0.00 0.00 179.25 178.60 2dl1 h TYR 19 N 0.77 0.05 0.00 0.00 3.20 -0.07 0.28 116.97 121.19 2dl1 h TYR 19 Ca 0.49 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.36 2dl1 h TYR 19 Cb 0.74 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.99 2dl1 h TYR 19 CO -0.00 0.03 -0.05 -0.22 -1.64 0.00 0.00 178.16 176.27 2dl1 h LYS 20 N 0.05 0.00 -0.88 1.82 3.64 -0.64 -3.22 116.57 117.35 2dl1 h LYS 20 Ca 0.12 0.00 0.21 0.00 -1.27 0.00 0.00 60.65 59.71 2dl1 h LYS 20 Cb 0.42 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.08 2dl1 h LYS 20 CO -0.01 0.00 -0.06 0.87 -2.27 0.00 0.00 179.45 177.98 2dl1 h LYS 21 N -0.16 0.04 -0.06 1.90 1.79 -1.30 1.35 116.57 120.13 2dl1 h LYS 21 Ca 0.00 -0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.49 2dl1 h LYS 21 Cb 0.05 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2dl1 h LYS 21 CO 0.00 0.03 -0.11 0.00 -1.08 0.00 0.00 179.45 178.29 2dl1 h ALA 22 N 1.86 -0.07 0.00 3.86 0.00 -1.14 0.18 119.26 123.96 2dl1 h ALA 22 Ca 0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2dl1 h ALA 22 Cb 0.87 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2dl1 h ALA 22 CO -0.83 -0.58 0.00 1.19 0.00 0.00 0.00 179.25 179.03 2dl1 n PHE 23 N -5.24 0.65 -0.06 0.00 3.72 0.51 -2.98 117.46 114.06 2dl1 n PHE 23 Ca -0.04 0.21 -0.03 0.00 -0.05 0.00 0.00 57.45 57.54 2dl1 n PHE 23 Cb 0.17 -0.85 -0.03 0.00 -0.94 0.00 0.00 39.48 37.83 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 -2.42 4.37 5.85 0.29 -3.25 115.31 120.14 2dl1 h LEU 24 Ca 0.00 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.57 2dl1 h LEU 24 Cb 0.54 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 2dl1 h LEU 24 CO 0.00 0.64 0.12 -0.26 -0.34 0.00 0.00 178.44 178.60 2dl1 h PHE 25 N -1.00 0.00 0.51 1.25 0.04 -0.77 -2.83 116.94 114.14 2dl1 h PHE 25 Ca -0.01 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 2dl1 h PHE 25 Cb 0.27 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.42 2dl1 h PHE 25 CO 0.02 0.00 -0.25 0.28 -0.60 0.00 0.00 178.31 177.76 2dl1 h VAL 26 N 0.00 0.00 -0.98 -0.55 2.07 -1.64 -2.81 116.25 112.33 2dl1 h VAL 26 Ca 0.04 -0.21 0.33 0.00 0.82 0.00 0.00 66.70 67.67 2dl1 h VAL 26 Cb 0.27 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.87 2dl1 h VAL 26 CO -0.00 0.00 0.35 -1.13 0.02 0.00 0.00 177.57 176.81 2dl1 h ASN 27 N -0.90 0.08 -0.47 0.57 -1.24 -1.53 0.72 115.58 112.80 2dl1 h ASN 27 Ca -0.07 0.24 0.01 0.00 0.71 0.00 0.00 56.30 57.20 2dl1 h ASN 27 Cb 0.53 0.31 -0.03 0.00 0.73 0.00 0.00 38.32 39.86 2dl1 h ASN 27 CO 0.12 -0.32 0.29 0.11 -1.29 0.00 0.00 177.43 176.34 2dl1 h LYS 28 N 0.09 0.58 -0.08 6.67 1.57 -1.52 -1.53 116.57 122.35 2dl1 h LYS 28 Ca 0.71 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.45 2dl1 h LYS 28 Cb 1.67 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.85 2dl1 h LYS 28 CO -0.76 0.38 0.01 0.78 -0.57 0.00 0.00 179.45 179.29 2dl1 h GLY 29 N 0.59 0.11 0.95 3.86 0.00 0.70 -2.30 103.07 106.99 2dl1 h GLY 29 Ca 0.18 -0.05 -0.18 0.00 0.00 0.00 0.00 47.33 47.28 2dl1 h GLY 29 CO -0.06 0.04 -0.67 1.41 0.00 0.00 0.00 176.54 177.26 2dl1 h LEU 30 N 0.11 0.70 0.79 3.11 3.38 -0.74 -3.06 115.31 119.59 2dl1 h LEU 30 Ca 0.03 -0.69 -0.04 0.00 0.09 0.00 0.00 57.88 57.27 2dl1 h LEU 30 Cb 0.06 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2dl1 h LEU 30 CO -0.00 1.29 -0.45 -1.13 0.09 0.00 0.00 178.44 178.24 2dl1 h ASN 31 N 0.17 -1.11 -0.64 -0.43 -1.24 -0.87 -2.35 115.58 109.11 2dl1 h ASN 31 Ca -0.07 0.06 0.13 0.00 0.71 0.00 0.00 56.30 57.13 2dl1 h ASN 31 Cb 1.34 0.31 -0.12 0.00 0.73 0.00 0.00 38.32 40.59 2dl1 h ASN 31 CO 0.14 -0.71 -0.12 0.71 -1.29 0.00 0.00 177.43 176.15 2dl1 h THR 32 N -1.15 0.38 -0.86 -3.57 1.35 -1.55 0.36 112.91 107.87 2dl1 h THR 32 Ca -0.10 -0.01 0.15 0.00 -0.55 0.00 0.00 66.41 65.90 2dl1 h THR 32 Cb 0.91 0.36 -0.07 0.00 -1.73 0.00 0.00 68.15 67.63 2dl1 h THR 32 CO 0.13 0.00 0.56 -0.78 -0.25 0.00 0.00 175.52 175.18 2dl1 h ASP 33 N 0.02 0.57 -0.18 5.36 3.58 -1.41 0.30 116.42 124.67 2dl1 h ASP 33 Ca 0.31 0.04 -0.21 0.00 0.42 0.00 0.00 57.03 57.59 2dl1 h ASP 33 Cb 0.49 -0.08 0.01 0.00 1.72 0.00 0.00 39.33 41.48 2dl1 h ASP 33 CO -0.63 0.28 -0.72 1.05 -2.88 0.00 0.00 179.24 176.34 2dl1 h GLU 34 N 0.60 0.80 -0.04 0.28 4.11 0.18 -3.18 114.58 117.34 2dl1 h GLU 34 Ca 0.43 -0.62 -0.11 0.00 0.07 0.00 0.00 59.36 59.13 2dl1 h GLU 34 Cb 0.79 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2dl1 h GLU 34 CO -0.18 1.23 -0.50 -0.07 0.07 0.00 0.00 179.01 179.56 2dl1 h LEU 35 N 0.54 0.11 0.00 3.06 3.38 0.36 -3.47 115.31 119.29 2dl1 h LEU 35 Ca -0.04 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2dl1 h LEU 35 Cb 1.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.07 2dl1 h LEU 35 CO 0.15 0.59 0.00 0.61 0.09 0.00 0.00 178.44 179.88 2dl1 n GLY 36 N -0.05 1.21 3.59 0.83 0.00 0.88 -5.08 105.19 106.57 2dl1 n GLY 36 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 3.09 0.09 1.61 1.11 -0.09 -4.82 119.66 120.66 2dl1 s GLN 37 Ca 0.00 1.38 0.17 0.00 0.01 0.00 0.00 55.36 56.92 2dl1 s GLN 37 Cb 0.00 -4.28 -0.11 0.00 -1.01 0.00 0.00 33.01 27.61 2dl1 s GLN 37 CO 0.00 -2.15 0.91 0.87 0.01 0.00 0.00 175.29 174.93 2dl1 h LYS 38 N 14.06 0.00 0.00 2.91 1.79 -1.94 -3.30 116.57 130.09 2dl1 h LYS 38 Ca -0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 2dl1 h LYS 38 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2dl1 h LYS 38 CO 1.06 0.30 0.00 0.39 -1.08 0.00 0.00 179.45 180.12 2dl1 n GLU 39 N -2.92 0.00 -0.42 3.15 1.02 -1.26 -3.10 120.64 117.11 2dl1 n GLU 39 Ca -0.08 0.44 0.40 0.00 -0.02 0.00 0.00 57.16 57.90 2dl1 n GLU 39 Cb 0.81 -0.94 0.73 0.00 -0.02 0.00 0.00 31.44 32.03 2dl1 n GLU 39 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dl1 h GLU 40 N 0.00 0.00 0.46 3.49 3.07 -1.99 0.83 114.58 120.44 2dl1 h GLU 40 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2dl1 h GLU 40 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2dl1 h GLU 40 CO 0.00 0.00 -0.22 0.00 -1.40 0.00 0.00 179.01 177.39 2dl1 h ALA 41 N 1.12 -0.62 -1.03 3.43 0.00 -1.70 -0.81 119.26 119.66 2dl1 h ALA 41 Ca 0.67 -0.17 0.26 0.00 0.00 0.00 0.00 54.91 55.67 2dl1 h ALA 41 Cb 2.86 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 20.81 2dl1 h ALA 41 CO -0.01 -0.62 0.68 0.87 0.00 0.00 0.00 179.25 180.18 2dl1 h LYS 42 N -1.08 0.32 0.30 0.00 1.57 -0.78 -1.68 116.57 115.22 2dl1 h LYS 42 Ca -0.06 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2dl1 h LYS 42 Cb 0.55 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2dl1 h LYS 42 CO 0.10 0.21 -0.15 -0.97 -0.57 0.00 0.00 179.45 178.08 2dl1 h ASN 43 N 0.33 -0.34 -1.61 0.86 -1.24 -1.41 -2.36 115.58 109.81 2dl1 h ASN 43 Ca 0.56 0.01 0.47 0.00 0.71 0.00 0.00 56.30 58.06 2dl1 h ASN 43 Cb 1.55 0.09 -0.08 0.00 0.73 0.00 0.00 38.32 40.61 2dl1 h ASN 43 CO -0.23 0.10 1.14 1.88 -1.29 0.00 0.00 177.43 179.03 2dl1 h TYR 44 N -1.11 0.11 0.18 0.67 0.05 -0.52 0.72 116.97 117.07 2dl1 h TYR 44 Ca -0.04 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.50 2dl1 h TYR 44 Cb 0.31 -0.03 0.03 0.00 1.01 0.00 0.00 36.73 38.05 2dl1 h TYR 44 CO 0.00 -0.03 -1.06 1.88 -1.05 0.00 0.00 178.16 177.90 2dl1 h TYR 45 N 0.03 0.70 0.00 4.88 0.05 -1.36 -3.10 116.97 118.17 2dl1 h TYR 45 Ca 0.80 -0.51 0.00 0.00 0.05 0.00 0.00 58.73 59.07 2dl1 h TYR 45 Cb 3.06 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 40.77 2dl1 h TYR 45 CO -0.00 1.41 0.26 0.87 -1.05 0.00 0.00 178.16 179.65 2dl1 h LYS 46 N -0.19 0.00 0.00 4.88 1.57 0.10 -1.66 116.57 121.28 2dl1 h LYS 46 Ca -0.19 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 2dl1 h LYS 46 Cb 1.83 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.13 2dl1 h LYS 46 CO 0.20 0.00 -0.98 1.04 -0.57 0.00 0.00 179.45 179.13 2dl1 n GLN 47 N -2.20 0.51 -0.29 3.15 6.02 -1.03 -4.18 117.38 119.35 2dl1 n GLN 47 Ca -0.01 0.41 0.24 0.00 -0.01 0.00 0.00 57.00 57.63 2dl1 n GLN 47 Cb 0.29 -1.60 0.56 0.00 1.02 0.00 0.00 30.24 30.50 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 -1.00 0.88 0.66 1.08 0.00 -1.32 -2.11 103.07 101.26 2dl1 h GLY 48 Ca -0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 2dl1 h GLY 48 CO -0.08 -0.08 -0.41 -2.22 0.00 0.00 0.00 176.54 173.75 2dl1 h ILE 49 N 0.32 0.00 -0.48 2.60 2.04 -1.53 -1.65 117.51 118.81 2dl1 h ILE 49 Ca 0.55 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.50 2dl1 h ILE 49 Cb 1.53 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 37.51 2dl1 h ILE 49 CO -0.21 0.00 -0.21 1.23 0.00 0.00 0.00 178.15 178.97 2dl1 h GLY 50 N -1.01 0.16 0.14 5.37 0.00 -1.55 -1.74 103.07 104.43 2dl1 h GLY 50 Ca -0.09 0.26 0.07 0.00 0.00 0.00 0.00 47.33 47.57 2dl1 h GLY 50 CO 0.09 -0.21 -0.21 0.45 0.00 0.00 0.00 176.54 176.66 2dl1 h HIS 51 N -0.10 -0.54 -0.86 5.60 3.86 -1.42 -1.44 115.15 120.26 2dl1 h HIS 51 Ca 0.23 0.04 0.19 0.00 -1.16 0.00 0.00 60.37 59.67 2dl1 h HIS 51 Cb 0.45 0.28 -0.16 0.00 1.06 0.00 0.00 27.41 29.05 2dl1 h HIS 51 CO -0.48 -0.29 -0.10 -0.07 0.86 0.00 0.00 177.93 177.85 2dl1 h LEU 52 N -0.19 -0.60 -1.30 2.43 3.38 -0.37 1.04 115.31 119.70 2dl1 h LEU 52 Ca 0.15 0.24 -0.07 0.00 0.09 0.00 0.00 57.88 58.30 2dl1 h LEU 52 Cb 0.42 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 2dl1 h LEU 52 CO -0.40 -0.27 -0.29 -0.07 0.09 0.00 0.00 178.44 177.50 2dl1 h LEU 53 N 0.03 0.09 -1.37 1.67 3.38 -1.09 -0.71 115.31 117.32 2dl1 h LEU 53 Ca 0.45 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.38 2dl1 h LEU 53 Cb 0.78 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2dl1 h LEU 53 CO -0.83 0.38 0.23 -0.09 0.09 0.00 0.00 178.44 178.23 2dl1 h ARG 54 N 0.08 0.66 0.00 1.13 2.43 0.20 0.73 114.38 119.61 2dl1 h ARG 54 Ca 0.01 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2dl1 h ARG 54 Cb 0.56 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 2dl1 h ARG 54 CO 0.04 0.51 -1.20 0.41 -1.51 0.00 0.00 179.97 178.23 2dl1 n GLY 55 N -1.24 -1.19 0.02 2.80 0.00 -0.80 -4.10 105.19 100.68 2dl1 n GLY 55 Ca 0.04 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.07 0.07 -1.76 -0.61 5.41 -0.31 -4.34 119.36 115.77 2dl1 n ILE 56 Ca 0.01 -0.24 -0.36 0.00 1.00 0.00 0.00 62.75 63.15 2dl1 n ILE 56 Cb 0.47 0.39 0.05 0.00 -0.71 0.00 0.00 39.64 39.84 2dl1 n ILE 56 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2dl1 n SER 57 N -1.91 7.26 -4.97 4.38 2.88 0.25 -4.99 113.62 116.53 2dl1 n SER 57 Ca 0.01 -3.81 -0.21 0.00 -1.33 0.00 0.00 58.87 53.53 2dl1 n SER 57 Cb 0.44 -0.96 -0.02 0.00 -0.75 0.00 0.00 64.21 62.93 2dl1 n SER 57 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2dl1 s ILE 58 N -5.00 5.21 0.01 2.46 -1.09 -1.26 -4.96 121.20 116.56 2dl1 s ILE 58 Ca 0.56 -0.91 -0.12 0.00 -2.23 0.00 0.00 60.65 57.95 2dl1 s ILE 58 Cb 0.46 -3.85 -0.07 0.00 -1.58 0.00 0.00 42.46 37.42 2dl1 s ILE 58 CO -0.23 -0.36 0.90 -1.28 -1.23 0.00 0.00 174.94 172.73 2dl1 h SER 59 N 1.10 -0.37 -6.39 3.58 0.87 -1.96 -3.48 113.55 106.90 2dl1 h SER 59 Ca -0.52 0.01 -0.26 0.00 -1.23 0.00 0.00 61.79 59.80 2dl1 h SER 59 Cb 1.23 0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.30 2dl1 h SER 59 CO 0.61 -0.20 -1.11 -1.54 -0.53 0.00 0.00 176.83 174.05 2dl1 n SER 60 N -3.54 -5.99 0.00 6.23 3.41 -1.26 -4.84 113.62 107.63 2dl1 n SER 60 Ca -0.05 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 2dl1 n SER 60 Cb 0.17 -1.99 0.00 0.00 -0.26 0.00 0.00 64.21 62.13 2dl1 n SER 60 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2dl1 n LYS 61 N 0.19 0.00 0.03 4.33 3.00 -1.26 -5.02 118.16 119.43 2dl1 n LYS 61 Ca -0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.25 2dl1 n LYS 61 Cb 0.61 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.63 2dl1 n LYS 61 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2dl1 h GLU 62 N 0.00 -0.09 -6.85 1.64 4.57 -2.03 -3.43 114.58 108.39 2dl1 h GLU 62 Ca 0.00 0.01 -0.57 0.00 -1.18 0.00 0.00 59.36 57.62 2dl1 h GLU 62 Cb 0.00 0.02 0.14 0.00 -0.16 0.00 0.00 28.75 28.75 2dl1 h GLU 62 CO 0.00 -0.06 0.35 0.45 -1.18 0.00 0.00 179.01 178.57 2dl1 n SER 63 N -2.35 1.81 -4.38 1.04 2.88 -1.26 -4.98 113.62 106.39 2dl1 n SER 63 Ca -0.01 0.97 -0.29 0.00 -1.33 0.00 0.00 58.87 58.21 2dl1 n SER 63 Cb 0.04 -1.46 0.20 0.00 -0.75 0.00 0.00 64.21 62.24 2dl1 n SER 63 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2dl1 s GLU 64 N -2.51 -0.26 -0.52 -1.46 2.02 -1.26 -5.02 118.70 109.70 2dl1 s GLU 64 Ca 0.68 0.30 0.07 0.00 0.02 0.00 0.00 54.97 56.05 2dl1 s GLU 64 Cb -0.47 -1.68 0.29 0.00 0.10 0.00 0.00 34.13 32.37 2dl1 s GLU 64 CO 0.52 -3.15 0.73 0.72 0.02 0.00 0.00 175.26 174.11 2dl1 n HIS 65 N -4.43 2.18 -5.04 1.61 8.25 -1.26 -4.94 115.22 111.59 2dl1 n HIS 65 Ca 0.08 -3.92 -0.32 0.00 -0.26 0.00 0.00 57.72 53.30 2dl1 n HIS 65 Cb 0.58 -0.47 -0.16 0.00 1.12 0.00 0.00 29.99 31.06 2dl1 n HIS 65 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2dl1 s THR 66 N -2.61 2.31 0.00 1.59 -4.23 -1.26 -5.00 115.64 106.45 2dl1 s THR 66 Ca 0.41 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 2dl1 s THR 66 Cb 0.22 -1.91 0.00 0.00 1.34 0.00 0.00 72.50 72.14 2dl1 s THR 66 CO -0.08 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.16 2dl1 n GLY 67 N 3.59 -0.92 2.98 3.99 0.00 -1.26 -4.58 105.19 108.98 2dl1 n GLY 67 Ca -0.19 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.95 1.51 0.02 1.61 -0.04 -1.26 -4.11 135.00 131.78 2dl1 n PRO 68 Ca 0.00 -1.63 0.00 0.00 -0.04 0.00 0.00 63.50 61.83 2dl1 n PRO 68 Cb 0.00 -2.73 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 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 4.32 -0.03 0.09 0.55 0.00 -1.26 -4.84 105.19 104.02 2dl1 n GLY 69 Ca 0.46 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.53 2dl1 n GLY 69 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2dl1 n TRP 70 N -3.15 0.81 -0.25 1.61 7.02 -1.26 -4.24 117.44 117.99 2dl1 n TRP 70 Ca 0.00 0.26 -0.11 0.00 -1.02 0.00 0.00 57.50 56.62 2dl1 n TRP 70 Cb 0.27 -0.97 -0.08 0.00 -2.42 0.00 0.00 31.31 28.11 2dl1 n TRP 70 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2dl1 h GLU 71 N 0.00 -0.22 -0.39 -0.99 3.07 -1.88 0.58 114.58 114.75 2dl1 h GLU 71 Ca -0.11 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.77 2dl1 h GLU 71 Cb 1.35 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 29.29 2dl1 h GLU 71 CO 0.02 -0.15 0.25 0.77 -1.40 0.00 0.00 179.01 178.50 2dl1 h SER 72 N -0.23 0.45 -0.44 1.42 0.02 -1.91 -1.76 113.55 111.11 2dl1 h SER 72 Ca 0.13 -0.03 0.07 0.00 -0.84 0.00 0.00 61.79 61.13 2dl1 h SER 72 Cb 0.53 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2dl1 h SER 72 CO -0.74 0.35 0.30 0.00 -1.14 0.00 0.00 176.83 175.60 2dl1 h ALA 73 N 1.13 2.05 0.00 3.77 0.00 -1.28 0.17 119.26 125.10 2dl1 h ALA 73 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dl1 h ALA 73 Cb -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2dl1 h ALA 73 CO -0.03 -0.14 -0.07 0.00 0.00 0.00 0.00 179.25 179.00 2dl1 h ARG 74 N 0.28 0.00 0.08 0.00 3.08 0.83 -3.17 114.38 115.47 2dl1 h ARG 74 Ca 0.20 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.04 2dl1 h ARG 74 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2dl1 h ARG 74 CO -0.04 0.00 -1.05 -0.56 -1.07 0.00 0.00 179.97 177.25 2dl1 h GLN 75 N 0.00 0.16 -0.43 0.04 3.07 0.12 -3.28 115.11 114.79 2dl1 h GLN 75 Ca 0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 58.65 58.45 2dl1 h GLN 75 Cb 0.82 0.10 -0.02 0.00 0.08 0.00 0.00 27.48 28.46 2dl1 h GLN 75 CO 0.00 1.13 0.24 0.52 0.09 0.00 0.00 178.83 180.81 2dl1 h MET 76 N -0.57 0.58 0.20 0.06 2.86 -1.33 -2.77 114.93 113.97 2dl1 h MET 76 Ca -0.23 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 2dl1 h MET 76 Cb 1.52 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 33.06 2dl1 h MET 76 CO 0.01 0.43 -0.10 1.96 1.06 0.00 0.00 176.91 180.27 2dl1 h GLN 77 N 0.59 -0.26 -0.20 1.72 4.20 -1.68 -2.80 115.11 116.68 2dl1 h GLN 77 Ca 0.15 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.93 2dl1 h GLN 77 Cb 0.01 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 27.78 2dl1 h GLN 77 CO -0.03 -0.12 -0.43 0.37 -0.67 0.00 0.00 178.83 177.96 2dl1 h GLN 78 N -0.35 -0.44 -0.65 1.46 4.15 -1.55 -1.82 115.11 115.91 2dl1 h GLN 78 Ca -0.03 0.03 0.12 0.00 0.77 0.00 0.00 58.65 59.54 2dl1 h GLN 78 Cb 0.27 0.10 -0.12 0.00 0.21 0.00 0.00 27.48 27.94 2dl1 h GLN 78 CO 0.05 -0.29 -0.31 -0.22 -1.93 0.00 0.00 178.83 176.13 2dl1 h LYS 79 N -0.46 -0.11 -0.44 1.69 3.64 -1.49 -0.25 116.57 119.15 2dl1 h LYS 79 Ca 0.09 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.57 2dl1 h LYS 79 Cb 0.62 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.37 2dl1 h LYS 79 CO -0.45 -0.07 -0.25 0.52 -2.27 0.00 0.00 179.45 176.93 2dl1 h MET 80 N -0.12 -0.15 -0.38 1.90 2.86 -1.07 -0.23 114.93 117.74 2dl1 h MET 80 Ca 0.27 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.99 2dl1 h MET 80 Cb 0.55 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 32.17 2dl1 h MET 80 CO -0.72 -0.10 -0.12 0.87 1.06 0.00 0.00 176.91 177.90 2dl1 h LYS 81 N -0.16 -0.03 -0.04 1.72 1.57 -0.51 0.15 116.57 119.28 2dl1 h LYS 81 Ca 0.21 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2dl1 h LYS 81 Cb 0.48 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 2dl1 h LYS 81 CO -0.54 -0.02 0.03 0.93 -0.57 0.00 0.00 179.45 179.28 2dl1 h GLU 82 N -0.03 0.00 0.00 3.15 5.08 -0.41 -0.95 114.58 121.41 2dl1 h GLU 82 Ca 0.19 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.38 2dl1 h GLU 82 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2dl1 h GLU 82 CO -0.41 0.00 -0.77 1.15 -1.00 0.00 0.00 179.01 177.98 2dl1 h THR 83 N 0.00 1.41 0.43 1.13 2.02 0.88 -3.15 112.91 115.63 2dl1 h THR 83 Ca 0.02 -2.77 -0.02 0.00 0.77 0.00 0.00 66.41 64.41 2dl1 h THR 83 Cb 0.08 2.55 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 2dl1 h THR 83 CO -0.00 0.75 -0.21 0.25 0.37 0.00 0.00 175.52 176.69 2dl1 h LEU 84 N 0.00 -0.49 -2.00 2.58 5.85 0.52 0.95 115.31 122.72 2dl1 h LEU 84 Ca -0.01 -0.10 0.10 0.00 0.84 0.00 0.00 57.88 58.71 2dl1 h LEU 84 Cb 1.49 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 2dl1 h LEU 84 CO 0.10 -0.13 0.25 0.06 -0.34 0.00 0.00 178.44 178.37 2dl1 h GLN 85 N -0.89 0.00 0.13 1.25 3.07 -1.61 0.68 115.11 117.74 2dl1 h GLN 85 Ca -0.06 0.00 -0.28 0.00 0.09 0.00 0.00 58.65 58.40 2dl1 h GLN 85 Cb 0.56 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.14 2dl1 h GLN 85 CO 0.10 0.00 -1.24 -0.91 0.09 0.00 0.00 178.83 176.87 2dl1 h ASN 86 N 0.00 0.53 0.13 0.06 4.21 -1.48 -3.31 115.58 115.72 2dl1 h ASN 86 Ca 0.16 -0.54 -0.01 0.00 1.21 0.00 0.00 56.30 57.13 2dl1 h ASN 86 Cb 0.65 -0.17 0.00 0.00 -1.12 0.00 0.00 38.32 37.68 2dl1 h ASN 86 CO -0.00 1.40 -0.06 0.58 -1.29 0.00 0.00 177.43 178.06 2dl1 h VAL 87 N 0.12 1.04 -1.23 2.81 2.07 0.69 -3.15 116.25 118.60 2dl1 h VAL 87 Ca -0.15 -1.03 0.39 0.00 0.82 0.00 0.00 66.70 66.74 2dl1 h VAL 87 Cb 1.94 1.65 -0.12 0.00 -1.52 0.00 0.00 31.29 33.23 2dl1 h VAL 87 CO 0.21 0.23 0.78 0.03 0.02 0.00 0.00 177.57 178.84 2dl1 h ARG 88 N -0.69 0.15 -0.37 1.57 3.08 -1.07 0.68 114.38 117.74 2dl1 h ARG 88 Ca -0.02 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.95 2dl1 h ARG 88 Cb 0.51 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2dl1 h ARG 88 CO 0.03 0.10 -0.05 1.15 -1.07 0.00 0.00 179.97 180.13 2dl1 h THR 89 N 0.16 1.27 -0.64 2.04 2.02 -1.63 -1.81 112.91 114.31 2dl1 h THR 89 Ca 0.77 -1.09 -0.08 0.00 0.77 0.00 0.00 66.41 66.79 2dl1 h THR 89 Cb 2.29 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 69.91 2dl1 h THR 89 CO -0.42 0.36 0.10 0.03 0.37 0.00 0.00 175.52 175.96 2dl1 h ARG 90 N 0.48 1.06 0.00 6.66 2.47 0.34 -1.89 114.38 123.50 2dl1 h ARG 90 Ca 0.10 -0.27 -0.05 0.00 -1.26 0.00 0.00 59.98 58.49 2dl1 h ARG 90 Cb 0.54 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.73 2dl1 h ARG 90 CO 0.03 0.97 -0.26 1.25 0.56 0.00 0.00 179.97 182.52 2dl1 h LEU 91 N 0.99 0.00 0.01 3.04 5.85 -1.08 -2.49 115.31 121.63 2dl1 h LEU 91 Ca 0.20 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.66 2dl1 h LEU 91 Cb 0.43 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.46 2dl1 h LEU 91 CO 0.01 0.26 -1.13 -0.33 -0.34 0.00 0.00 178.44 176.90 2dl1 h GLU 92 N 0.00 0.38 0.00 1.25 4.39 -0.81 -3.11 114.58 116.68 2dl1 h GLU 92 Ca -0.00 -0.52 -0.00 0.00 0.34 0.00 0.00 59.36 59.18 2dl1 h GLU 92 Cb 0.68 0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.50 2dl1 h GLU 92 CO 0.03 1.20 -0.01 0.82 -1.16 0.00 0.00 179.01 179.89 2dl1 h ILE 93 N 0.16 0.03 0.01 3.13 2.04 -1.16 -2.66 117.51 119.05 2dl1 h ILE 93 Ca -0.12 -0.78 -0.12 0.00 1.00 0.00 0.00 64.86 64.84 2dl1 h ILE 93 Cb 1.82 1.75 0.01 0.00 -0.74 0.00 0.00 36.82 39.66 2dl1 h ILE 93 CO 0.20 0.01 -0.49 -0.07 0.00 0.00 0.00 178.15 177.80 2dl1 h LEU 94 N 0.00 0.41 0.46 1.44 3.38 -1.45 -2.83 115.31 116.71 2dl1 h LEU 94 Ca -0.00 -0.79 -0.02 0.00 0.09 0.00 0.00 57.88 57.16 2dl1 h LEU 94 Cb 0.75 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2dl1 h LEU 94 CO 0.00 1.15 -0.22 -0.33 0.09 0.00 0.00 178.44 179.13 2dl1 h GLU 95 N -0.28 -0.59 -1.01 1.13 4.39 -1.55 -2.79 114.58 113.89 2dl1 h GLU 95 Ca -0.06 0.04 0.23 0.00 0.34 0.00 0.00 59.36 59.91 2dl1 h GLU 95 Cb 1.23 0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 29.92 2dl1 h GLU 95 CO 0.10 -0.29 0.63 1.57 -1.16 0.00 0.00 179.01 179.85 2dl1 h LYS 96 N -1.02 0.53 0.00 2.33 2.10 -1.63 0.39 116.57 119.27 2dl1 h LYS 96 Ca -0.06 -0.03 -0.07 0.00 -2.00 0.00 0.00 60.65 58.48 2dl1 h LYS 96 Cb 0.57 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 31.77 2dl1 h LYS 96 CO 0.10 0.35 -0.34 0.78 -2.00 0.00 0.00 179.45 178.35 2dl1 h GLY 97 N 0.55 0.00 0.00 0.07 0.00 -1.47 -3.29 103.07 98.93 2dl1 h GLY 97 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.92 2dl1 h GLY 97 CO -0.35 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.09 2dl1 n LEU 98 N -4.08 0.00 0.00 3.11 -0.00 0.14 -4.80 117.00 111.37 2dl1 n LEU 98 Ca -0.02 0.92 0.00 0.00 -0.00 0.00 0.00 56.01 56.91 2dl1 n LEU 98 Cb 0.38 -0.42 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 2dl1 n LEU 98 CO 0.38 -0.42 0.00 0.00 -0.00 0.00 0.00 177.39 177.35 2dl1 n ALA 99 N -2.22 0.00 -2.52 1.96 0.00 -1.24 -4.77 120.51 111.72 2dl1 n ALA 99 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2dl1 n ALA 99 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2dl1 n ALA 99 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2dl1 n THR 100 N 0.00 -1.18 -4.29 0.00 -1.04 -1.26 -4.98 114.28 101.53 2dl1 n THR 100 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.86 2dl1 n THR 100 Cb 0.00 -3.03 -0.10 0.00 -1.82 0.00 0.00 70.33 65.38 2dl1 n THR 100 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2dl1 s SER 101 N -2.21 1.38 0.31 8.00 1.04 -1.26 -5.03 113.70 115.92 2dl1 s SER 101 Ca 0.06 -1.24 0.08 0.00 0.48 0.00 0.00 55.95 55.33 2dl1 s SER 101 Cb -0.03 0.10 0.84 0.00 0.10 0.00 0.00 66.02 67.03 2dl1 s SER 101 CO 0.08 -0.60 1.75 0.25 0.98 0.00 0.00 173.24 175.70 2dl1 h LEU 102 N 2.55 0.71-10.06 2.42 5.85 -2.04 -3.40 115.31 111.34 2dl1 h LEU 102 Ca -0.38 0.12 -0.53 0.00 0.84 0.00 0.00 57.88 57.93 2dl1 h LEU 102 Cb 1.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2dl1 h LEU 102 CO 0.63 0.17 -0.35 -1.10 -0.34 0.00 0.00 178.44 177.45 2dl1 s GLN 103 N -5.80 3.51 -0.16 1.25 -0.21 -1.26 -5.11 119.66 111.88 2dl1 s GLN 103 Ca -0.11 -0.38 -0.07 0.00 0.02 0.00 0.00 55.36 54.82 2dl1 s GLN 103 Cb 0.26 -2.85 0.07 0.00 1.00 0.00 0.00 33.01 31.49 2dl1 s GLN 103 CO 0.80 0.41 0.36 -0.80 -2.12 0.00 0.00 175.29 173.94 2dl1 s ASN 104 N -3.19 -0.22 0.57 5.90 0.01 -1.26 -4.78 114.94 111.97 2dl1 s ASN 104 Ca 0.38 0.81 0.08 0.00 -0.71 0.00 0.00 52.86 53.42 2dl1 s ASN 104 Cb -0.11 0.88 0.07 0.00 0.41 0.00 0.00 41.25 42.51 2dl1 s ASN 104 CO 0.29 -0.21 0.66 -0.62 -1.51 0.00 0.00 177.10 175.71 2dl1 s ASP 105 N 1.96 4.92 0.22 -1.22 2.15 -1.26 -5.15 116.67 118.30 2dl1 s ASP 105 Ca -0.05 -1.00 -0.06 0.00 0.43 0.00 0.00 52.55 51.87 2dl1 s ASP 105 Cb -0.11 0.37 -0.03 0.00 -0.30 0.00 0.00 42.92 42.86 2dl1 s ASP 105 CO -0.11 -1.28 0.27 -1.48 -0.17 0.00 0.00 175.17 172.40 2dl1 s LEU 106 N -4.54 0.83 0.00 -1.34 0.05 -1.26 -5.08 118.68 107.35 2dl1 s LEU 106 Ca 0.52 -1.22 0.04 0.00 0.05 0.00 0.00 54.13 53.52 2dl1 s LEU 106 Cb -0.04 0.94 -0.02 0.00 -2.05 0.00 0.00 46.19 45.02 2dl1 s LEU 106 CO 0.33 -0.97 0.15 0.00 -0.55 0.00 0.00 176.35 175.31 2dl1 n GLN 107 N -0.32 0.58 -3.80 1.48 10.64 -1.26 -5.16 117.38 119.55 2dl1 n GLN 107 Ca 0.01 -3.14 -0.16 0.00 -1.83 0.00 0.00 57.00 51.88 2dl1 n GLN 107 Cb 0.64 1.79 -0.06 0.00 -0.86 0.00 0.00 30.24 31.75 2dl1 n GLN 107 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 2dl1 n GLU 108 N -0.81 0.34 -4.06 2.61 0.00 -1.26 -5.18 120.64 112.27 2dl1 n GLU 108 Ca -0.04 -2.68 -0.07 0.00 0.00 0.00 0.00 57.16 54.36 2dl1 n GLU 108 Cb 0.56 2.18 -0.10 0.00 0.00 0.00 0.00 31.44 34.07 2dl1 n GLU 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2dl1 s VAL 109 N -3.08 0.20 0.64 3.84 -7.23 -1.26 -5.16 120.40 108.35 2dl1 s VAL 109 Ca 0.32 -1.61 -0.16 0.00 -1.81 0.00 0.00 61.98 58.72 2dl1 s VAL 109 Cb 0.02 -1.24 -0.01 0.00 0.56 0.00 0.00 36.38 35.70 2dl1 s VAL 109 CO 0.22 -0.89 1.11 -2.16 -0.31 0.00 0.00 175.10 173.08 2dl1 s PRO 110 N -3.38 2.89 0.38 4.82 0.04 -1.26 -5.06 135.00 133.43 2dl1 s PRO 110 Ca 0.02 1.42 0.08 0.00 0.04 0.00 0.00 61.00 62.55 2dl1 s PRO 110 Cb 0.04 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 2dl1 s PRO 110 CO -0.08 -1.18 0.32 -1.12 0.04 0.00 0.00 177.00 174.98 2dl1 s SER 111 N -2.47 5.12 0.00 6.66 0.01 -1.26 -5.07 113.70 116.68 2dl1 s SER 111 Ca 0.68 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2dl1 s SER 111 Cb -0.21 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.27 2dl1 s SER 111 CO 0.39 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 174.15 2dl1 n GLY 112 N -1.45 -1.84 3.61 3.44 0.00 -1.26 -5.18 105.19 102.52 2dl1 n GLY 112 Ca 0.01 0.79 -0.30 0.00 0.00 0.00 0.00 46.02 46.52 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 0.00 -0.98 0.23 1.61 0.04 -1.26 -5.10 135.00 129.54 2dl1 s PRO 113 Ca 0.00 0.02 -0.18 0.00 0.04 0.00 0.00 61.00 60.88 2dl1 s PRO 113 Cb 0.00 -1.62 0.02 0.00 0.04 0.00 0.00 34.50 32.94 2dl1 s PRO 113 CO 0.00 -3.57 0.57 0.45 0.04 0.00 0.00 177.00 174.49 2dl1 s SER 114 N -3.82 -0.23 -0.76 6.66 0.15 -1.26 -5.10 113.70 109.33 2dl1 s SER 114 Ca 0.70 -0.61 0.03 0.00 0.70 0.00 0.00 55.95 56.77 2dl1 s SER 114 Cb -0.11 0.63 0.23 0.00 -1.71 0.00 0.00 66.02 65.05 2dl1 s SER 114 CO 0.56 -1.16 0.76 -1.20 1.20 0.00 0.00 173.24 173.40 2dl1 n SER 115 N -0.39 3.92 0.00 5.45 7.64 -1.26 -5.38 113.62 123.61 2dl1 n SER 115 Ca -0.06 -3.31 0.00 0.00 1.01 0.00 0.00 58.87 56.51 2dl1 n SER 115 Cb 0.61 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 2dl1 n SER 115 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64