#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dme s SER 2 N 0.00 4.93 -0.23 1.61 1.04 -1.26 -4.80 113.70 114.99 2dme s SER 2 Ca 0.00 -1.33 -0.27 0.00 0.48 0.00 0.00 55.95 54.83 2dme s SER 2 Cb 0.00 -2.58 0.12 0.00 0.10 0.00 0.00 66.02 63.66 2dme s SER 2 CO 0.00 -3.12 1.01 -0.55 0.98 0.00 0.00 173.24 171.56 2dme s SER 3 N 7.11 -0.43 -0.59 7.02 0.15 -1.26 -5.12 113.70 120.58 2dme s SER 3 Ca 0.70 0.70 -0.11 0.00 0.70 0.00 0.00 55.95 57.95 2dme s SER 3 Cb -0.03 0.67 0.15 0.00 -1.71 0.00 0.00 66.02 65.11 2dme s SER 3 CO 0.10 -0.23 0.49 -0.83 1.20 0.00 0.00 173.24 173.97 2dme s GLY 4 N -0.27 2.27 -1.20 9.45 0.00 -1.26 -5.00 107.32 111.32 2dme s GLY 4 Ca 0.01 -2.84 -0.12 0.00 0.00 0.00 0.00 44.72 41.77 2dme s GLY 4 CO -0.03 1.16 1.42 -1.26 0.00 0.00 0.00 173.10 174.40 2dme n SER 5 N 4.52 5.30 -4.56 1.64 2.88 -1.26 -4.98 113.62 117.15 2dme n SER 5 Ca -0.01 -3.01 -0.41 0.00 -1.33 0.00 0.00 58.87 54.10 2dme n SER 5 Cb 0.42 -1.52 -0.08 0.00 -0.75 0.00 0.00 64.21 62.28 2dme n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dme s SER 6 N 2.27 6.33 0.00 -3.46 1.04 -1.26 -4.88 113.70 113.74 2dme s SER 6 Ca 0.40 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.85 2dme s SER 6 Cb -0.03 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.82 2dme s SER 6 CO -0.01 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.34 2dme n GLY 7 N 4.76 0.09 3.62 7.32 0.00 -1.26 -5.18 105.19 114.55 2dme n GLY 7 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 2dme n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dme s SER 8 N 1.00 -0.17 0.08 1.61 0.15 -1.26 -5.01 113.70 110.10 2dme s SER 8 Ca 0.00 0.18 -0.15 0.00 0.70 0.00 0.00 55.95 56.69 2dme s SER 8 Cb 0.00 0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 64.42 2dme s SER 8 CO 0.00 -0.15 1.12 0.00 1.20 0.00 0.00 173.24 175.41 2dme n ALA 9 N 0.62 -0.31 -0.30 5.45 0.00 -1.26 0.22 120.51 124.93 2dme n ALA 9 Ca -0.04 0.41 0.04 0.00 0.00 0.00 0.00 53.44 53.85 2dme n ALA 9 Cb 0.58 0.12 0.13 0.00 0.00 0.00 0.00 19.45 20.28 2dme n ALA 9 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2dme h ASP 10 N 0.00 -0.74 -0.86 0.00 2.03 -2.00 0.54 116.42 115.40 2dme h ASP 10 Ca 0.08 0.25 0.05 0.00 -0.73 0.00 0.00 57.03 56.68 2dme h ASP 10 Cb 0.20 0.51 -0.06 0.00 -0.83 0.00 0.00 39.33 39.15 2dme h ASP 10 CO -0.45 -0.28 0.54 -0.61 -1.03 0.00 0.00 179.24 177.42 2dme h GLN 11 N 0.01 1.00 0.63 4.15 5.75 -0.62 -1.81 115.11 124.22 2dme h GLN 11 Ca 0.42 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.83 2dme h GLN 11 Cb 0.68 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 29.00 2dme h GLN 11 CO -0.87 0.66 -0.33 0.82 -2.65 0.00 0.00 178.83 176.47 2dme h ILE 12 N 1.03 0.33 -0.25 2.39 2.04 0.19 -1.93 117.51 121.32 2dme h ILE 12 Ca 0.36 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.28 2dme h ILE 12 Cb 0.08 0.33 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 2dme h ILE 12 CO -0.14 0.00 -0.23 0.03 0.00 0.00 0.00 178.15 177.81 2dme h ARG 13 N -0.88 -0.23 -0.46 2.37 3.08 -1.04 -1.91 114.38 115.31 2dme h ARG 13 Ca -0.08 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.08 2dme h ARG 13 Cb 0.69 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.70 2dme h ARG 13 CO 0.12 -0.15 -0.18 0.37 -1.07 0.00 0.00 179.97 179.06 2dme h GLN 14 N -0.23 -0.08 -0.50 0.04 5.75 -1.25 -1.18 115.11 117.64 2dme h GLN 14 Ca 0.14 0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.74 2dme h GLN 14 Cb 0.45 0.02 -0.08 0.00 1.07 0.00 0.00 27.48 28.93 2dme h GLN 14 CO -0.38 -0.05 0.00 1.03 -2.65 0.00 0.00 178.83 176.78 2dme h SER 15 N -0.08 -0.21 -0.78 -0.69 0.87 -0.60 -1.61 113.55 110.45 2dme h SER 15 Ca 0.22 0.12 0.16 0.00 -1.23 0.00 0.00 61.79 61.06 2dme h SER 15 Cb 0.42 0.21 -0.15 0.00 -0.44 0.00 0.00 62.40 62.45 2dme h SER 15 CO -0.52 -0.07 -0.15 0.58 -0.53 0.00 0.00 176.83 176.14 2dme h VAL 16 N 0.12 0.24 0.01 2.23 2.07 -0.58 -0.96 116.25 119.37 2dme h VAL 16 Ca 0.25 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.77 2dme h VAL 16 Cb 0.38 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2dme h VAL 16 CO -0.42 0.00 -0.01 0.03 0.02 0.00 0.00 177.57 177.19 2dme h ARG 17 N 0.02 -0.02 -0.93 1.57 3.08 -1.15 -1.77 114.38 115.18 2dme h ARG 17 Ca 0.39 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.56 2dme h ARG 17 Cb 0.62 0.01 -0.14 0.00 0.08 0.00 0.00 29.97 30.54 2dme h ARG 17 CO -0.78 -0.02 -0.48 1.25 -1.07 0.00 0.00 179.97 178.87 2dme h HIS 18 N -0.02 -1.45 -0.63 3.04 -0.00 -1.35 0.28 115.15 115.01 2dme h HIS 18 Ca -0.00 0.11 0.09 0.00 -0.00 0.00 0.00 60.37 60.57 2dme h HIS 18 Cb 0.02 0.76 -0.11 0.00 -0.00 0.00 0.00 27.41 28.09 2dme h HIS 18 CO -0.14 -0.40 -0.47 1.03 -0.00 0.00 0.00 177.93 177.95 2dme h SER 19 N -0.04 -1.63 0.06 3.26 0.87 -1.07 0.43 113.55 115.43 2dme h SER 19 Ca 0.24 0.26 0.01 0.00 -1.23 0.00 0.00 61.79 61.08 2dme h SER 19 Cb 0.52 0.73 -0.04 0.00 -0.44 0.00 0.00 62.40 63.17 2dme h SER 19 CO -0.92 -0.33 -0.46 -0.07 -0.53 0.00 0.00 176.83 174.52 2dme h LEU 20 N -0.21 -1.40 -1.67 2.23 3.38 -0.05 -0.37 115.31 117.21 2dme h LEU 20 Ca 0.17 0.15 0.20 0.00 0.09 0.00 0.00 57.88 58.49 2dme h LEU 20 Cb 0.55 0.52 -0.05 0.00 0.09 0.00 0.00 40.66 41.77 2dme h LEU 20 CO -0.73 -0.47 0.56 0.50 0.09 0.00 0.00 178.44 178.39 2dme h LYS 21 N -0.62 0.28 -0.29 1.13 3.64 -0.55 -0.33 116.57 119.82 2dme h LYS 21 Ca 0.00 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2dme h LYS 21 Cb 0.64 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2dme h LYS 21 CO -0.27 0.19 0.19 0.22 -2.27 0.00 0.00 179.45 177.50 2dme h ASP 22 N 0.29 0.32 0.04 4.20 3.58 0.15 0.40 116.42 125.39 2dme h ASP 22 Ca 0.41 -0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.86 2dme h ASP 22 Cb 1.18 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.15 2dme h ASP 22 CO -0.11 0.23 -0.02 0.40 -2.88 0.00 0.00 179.24 176.86 2dme h ILE 23 N 0.38 1.28 0.00 2.25 2.04 -0.34 -2.66 117.51 120.47 2dme h ILE 23 Ca 0.11 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 64.94 2dme h ILE 23 Cb -0.03 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2dme h ILE 23 CO -0.03 0.26 0.00 -0.07 0.00 0.00 0.00 178.15 178.31 2dme h LEU 24 N -0.51 0.00 0.04 1.44 3.38 -1.21 0.16 115.31 118.61 2dme h LEU 24 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 2dme h LEU 24 Cb 0.46 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2dme h LEU 24 CO 0.01 0.00 -0.62 0.24 0.09 0.00 0.00 178.44 178.16 2dme h MET 25 N 0.00 0.35 0.00 1.13 2.86 -0.03 -2.62 114.93 116.62 2dme h MET 25 Ca 0.00 -0.43 -0.05 0.00 -2.06 0.00 0.00 59.70 57.16 2dme h MET 25 Cb 0.21 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2dme h MET 25 CO 0.00 1.12 -0.51 1.57 1.06 0.00 0.00 176.91 180.16 2dme h LYS 26 N -0.23 0.00 0.00 1.72 5.09 -1.11 -2.57 116.57 119.47 2dme h LYS 26 Ca -0.09 0.00 -0.12 0.00 0.09 0.00 0.00 60.65 60.53 2dme h LYS 26 Cb 1.37 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 33.68 2dme h LYS 26 CO 0.12 0.16 -0.57 0.00 -2.09 0.00 0.00 179.45 177.07 2dme h ARG 27 N 0.00 0.00 0.10 0.07 2.47 -0.78 -2.97 114.38 113.27 2dme h ARG 27 Ca -0.02 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.37 2dme h ARG 27 Cb 1.17 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.47 2dme h ARG 27 CO 0.02 0.57 -1.80 1.37 0.56 0.00 0.00 179.97 180.69 2dme h LEU 28 N 0.00 0.35 -1.41 3.04 8.10 -1.51 -3.22 115.31 120.65 2dme h LEU 28 Ca -0.01 -0.86 -0.00 0.00 0.11 0.00 0.00 57.88 57.12 2dme h LEU 28 Cb 1.38 -0.11 -0.03 0.00 -0.44 0.00 0.00 40.66 41.46 2dme h LEU 28 CO 0.07 1.77 0.31 0.00 -4.11 0.00 0.00 178.44 176.49 2dme h THR 29 N -0.16 1.15 -0.15 0.15 1.03 -1.56 -2.63 112.91 110.74 2dme h THR 29 Ca -0.40 -0.34 -0.13 0.00 -0.01 0.00 0.00 66.41 65.53 2dme h THR 29 Cb 1.88 0.42 0.00 0.00 -1.07 0.00 0.00 68.15 69.38 2dme h THR 29 CO 0.03 0.16 -0.43 -0.78 -0.01 0.00 0.00 175.52 174.49 2dme h ASP 30 N 0.72 0.63 -4.17 0.00 3.58 -1.68 -3.46 116.42 112.05 2dme h ASP 30 Ca 0.19 -0.59 -0.45 0.00 0.42 0.00 0.00 57.03 56.60 2dme h ASP 30 Cb -0.02 -0.18 0.15 0.00 1.72 0.00 0.00 39.33 40.99 2dme h ASP 30 CO -0.04 1.11 0.41 -0.44 -2.88 0.00 0.00 179.24 177.41 2dme s SER 31 N -6.61 3.41 -1.49 2.28 0.01 -0.99 -4.93 113.70 105.38 2dme s SER 31 Ca -0.13 0.42 -0.09 0.00 1.31 0.00 0.00 55.95 57.47 2dme s SER 31 Cb 0.06 -0.60 0.01 0.00 0.21 0.00 0.00 66.02 65.70 2dme s SER 31 CO 0.82 -2.56 2.64 -3.20 0.41 0.00 0.00 173.24 171.36 2dme n ASN 32 N -3.68 7.93 -4.19 2.44 5.15 -1.26 -4.87 115.26 116.78 2dme n ASN 32 Ca 0.13 -2.82 -0.36 0.00 -0.60 0.00 0.00 54.58 50.93 2dme n ASN 32 Cb 0.60 -1.49 -0.13 0.00 -0.53 0.00 0.00 39.78 38.22 2dme n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2dme s LEU 33 N -0.48 4.17 -0.08 1.20 1.43 -1.25 -4.95 118.68 118.72 2dme s LEU 33 Ca 0.61 -1.35 0.04 0.00 -1.03 0.00 0.00 54.13 52.40 2dme s LEU 33 Cb 0.17 -1.76 0.24 0.00 0.03 0.00 0.00 46.19 44.87 2dme s LEU 33 CO -0.07 -0.31 0.91 0.29 0.23 0.00 0.00 176.35 177.39 2dme n LYS 34 N 4.66 2.06 -2.44 1.70 5.02 -1.26 -4.76 118.16 123.14 2dme n LYS 34 Ca -0.11 -0.91 -0.34 0.00 -2.02 0.00 0.00 58.31 54.92 2dme n LYS 34 Cb 0.43 -1.69 -0.02 0.00 -0.02 0.00 0.00 35.03 33.74 2dme n LYS 34 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2dme s VAL 35 N -1.46 3.55 1.04 -0.18 -7.23 -1.26 -5.04 120.40 109.82 2dme s VAL 35 Ca 0.16 0.97 -0.13 0.00 -1.81 0.00 0.00 61.98 61.17 2dme s VAL 35 Cb 0.12 -3.39 0.21 0.00 0.56 0.00 0.00 36.38 33.88 2dme s VAL 35 CO 0.04 -0.21 1.10 -2.16 -0.31 0.00 0.00 175.10 173.56 2dme s PRO 36 N -3.25 0.11 0.26 4.82 0.04 -1.26 -4.96 135.00 130.76 2dme s PRO 36 Ca 0.69 0.41 0.06 0.00 0.04 0.00 0.00 61.00 62.20 2dme s PRO 36 Cb -0.19 -1.71 0.33 0.00 0.04 0.00 0.00 34.50 32.96 2dme s PRO 36 CO 0.23 -2.92 1.61 1.49 0.04 0.00 0.00 177.00 177.44 2dme h GLU 37 N -2.03 0.21 -0.89 4.56 4.81 -2.01 -3.10 114.58 116.13 2dme h GLU 37 Ca -0.54 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 58.56 2dme h GLU 37 Cb 1.33 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.68 2dme h GLU 37 CO 0.55 0.70 0.56 1.49 -0.73 0.00 0.00 179.01 181.58 2dme h GLU 38 N 0.16 1.19 -0.37 1.92 4.57 -1.99 -3.05 114.58 117.00 2dme h GLU 38 Ca 0.00 -0.09 0.03 0.00 -1.18 0.00 0.00 59.36 58.12 2dme h GLU 38 Cb 1.02 -0.26 -0.04 0.00 -0.16 0.00 0.00 28.75 29.31 2dme h GLU 38 CO 0.08 0.81 -0.22 1.17 -1.18 0.00 0.00 179.01 179.68 2dme n LYS 39 N -4.43 -0.16 -0.22 1.92 3.00 -1.17 0.17 118.16 117.26 2dme n LYS 39 Ca 0.10 1.15 0.01 0.00 -0.00 0.00 0.00 58.31 59.56 2dme n LYS 39 Cb 0.04 -1.70 0.12 0.00 0.00 0.00 0.00 35.03 33.49 2dme n LYS 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dme h ALA 40 N -0.40 0.88 0.12 3.14 0.00 -1.72 -2.50 119.26 118.79 2dme h ALA 40 Ca 0.06 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dme h ALA 40 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2dme h ALA 40 CO -0.35 -0.12 -0.13 0.00 0.00 0.00 0.00 179.25 178.65 2dme h ALA 41 N 1.43 -0.85 -0.98 0.00 0.00 -0.58 -1.02 119.26 117.26 2dme h ALA 41 Ca 0.33 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.32 2dme h ALA 41 Cb 0.38 0.38 -0.14 0.00 0.00 0.00 0.00 17.79 18.41 2dme h ALA 41 CO -0.29 -0.85 -0.47 1.63 0.00 0.00 0.00 179.25 179.26 2dme n LYS 42 N -3.07 -0.32 -0.06 0.00 5.02 0.13 -0.43 118.16 119.43 2dme n LYS 42 Ca -0.03 1.50 -0.09 0.00 -2.02 0.00 0.00 58.31 57.67 2dme n LYS 42 Cb 0.12 -2.21 -0.03 0.00 -0.02 0.00 0.00 35.03 32.88 2dme n LYS 42 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dme h VAL 43 N 0.00 0.26 -0.04 -0.18 2.07 -1.33 -2.02 116.25 115.01 2dme h VAL 43 Ca 0.26 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.81 2dme h VAL 43 Cb 0.50 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.49 2dme h VAL 43 CO -0.95 0.00 -0.21 0.00 0.02 0.00 0.00 177.57 176.43 2dme h ALA 44 N 0.58 -0.23 -1.17 1.67 0.00 0.62 -0.73 119.26 120.01 2dme h ALA 44 Ca 0.13 0.02 0.33 0.00 0.00 0.00 0.00 54.91 55.39 2dme h ALA 44 Cb 0.54 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.64 2dme h ALA 44 CO -0.44 -0.69 0.81 1.15 0.00 0.00 0.00 179.25 180.08 2dme h THR 45 N -0.31 0.42 0.03 0.00 2.02 -0.15 -0.60 112.91 114.32 2dme h THR 45 Ca 0.07 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2dme h THR 45 Cb 0.41 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2dme h THR 45 CO -0.22 0.02 -0.01 0.11 0.37 0.00 0.00 175.52 175.79 2dme h LYS 46 N 0.12 -0.04 -0.84 6.66 6.56 -0.49 -2.89 116.57 125.65 2dme h LYS 46 Ca 0.60 0.00 0.11 0.00 -1.06 0.00 0.00 60.65 60.30 2dme h LYS 46 Cb 2.09 0.01 -0.12 0.00 -0.57 0.00 0.00 32.23 33.64 2dme h LYS 46 CO -0.12 0.66 -0.40 -0.89 -2.06 0.00 0.00 179.45 176.64 2dme n ILE 47 N -4.72 -0.50 0.10 1.86 2.08 -0.25 0.18 119.36 118.11 2dme n ILE 47 Ca -0.08 1.99 -0.01 0.00 0.56 0.00 0.00 62.75 65.21 2dme n ILE 47 Cb 0.35 -2.56 0.26 0.00 -0.75 0.00 0.00 39.64 36.93 2dme n ILE 47 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2dme h GLU 48 N 0.00 0.23 -0.82 0.38 4.22 -1.65 0.15 114.58 117.09 2dme h GLU 48 Ca 0.23 -0.10 -0.00 0.00 0.08 0.00 0.00 59.36 59.56 2dme h GLU 48 Cb 0.44 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 2dme h GLU 48 CO -0.81 0.56 0.49 -0.22 -2.18 0.00 0.00 179.01 176.85 2dme h LYS 49 N 0.20 1.11 0.12 1.92 3.64 0.21 -1.49 116.57 122.27 2dme h LYS 49 Ca 0.02 -0.10 -0.32 0.00 -1.27 0.00 0.00 60.65 58.99 2dme h LYS 49 Cb 0.73 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2dme h LYS 49 CO 0.06 0.77 -1.68 1.49 -2.27 0.00 0.00 179.45 177.82 2dme h GLU 50 N 1.13 0.25 0.26 1.90 4.57 -0.49 -3.23 114.58 118.97 2dme h GLU 50 Ca 0.29 -0.43 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 2dme h GLU 50 Cb -0.05 0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 2dme h GLU 50 CO -0.06 1.21 -0.44 1.25 -1.18 0.00 0.00 179.01 179.79 2dme h LEU 51 N -0.17 -1.28 -0.61 1.64 5.85 -0.64 0.39 115.31 120.49 2dme h LEU 51 Ca -0.36 0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.56 2dme h LEU 51 Cb 1.88 0.45 -0.07 0.00 0.37 0.00 0.00 40.66 43.29 2dme h LEU 51 CO 0.06 -0.52 0.27 0.15 -0.34 0.00 0.00 178.44 178.06 2dme h PHE 52 N -0.75 0.47 0.00 1.25 3.57 -1.47 0.15 116.94 120.16 2dme h PHE 52 Ca -0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2dme h PHE 52 Cb 0.69 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2dme h PHE 52 CO -0.34 0.16 -0.06 0.77 -2.23 0.00 0.00 178.31 176.61 2dme h SER 53 N 0.48 0.00 0.00 0.41 0.02 -1.48 0.93 113.55 113.91 2dme h SER 53 Ca 0.30 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 2dme h SER 53 Cb 0.32 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 2dme h SER 53 CO -0.27 0.06 -0.07 0.15 -1.14 0.00 0.00 176.83 175.57 2dme h PHE 54 N 0.00 0.00 0.00 3.45 3.57 0.24 -3.34 116.94 120.86 2dme h PHE 54 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2dme h PHE 54 Cb 0.27 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.01 2dme h PHE 54 CO 0.00 0.49 0.00 0.74 -2.23 0.00 0.00 178.31 177.31 2dme h PHE 55 N -1.00 0.00 -3.37 0.41 0.04 -0.99 -3.47 116.94 108.56 2dme h PHE 55 Ca -0.01 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.49 2dme h PHE 55 Cb 0.50 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.62 2dme h PHE 55 CO 0.12 0.00 -0.33 0.54 -0.60 0.00 0.00 178.31 178.03 2dme n ARG 56 N -2.92 -2.03 -3.68 1.51 1.74 0.32 -4.86 116.66 106.75 2dme n ARG 56 Ca 0.03 0.68 0.01 0.00 -0.77 0.00 0.00 57.85 57.80 2dme n ARG 56 Cb 0.43 -5.23 -0.00 0.00 -1.02 0.00 0.00 32.46 26.64 2dme n ARG 56 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dme s ASP 57 N -2.05 -0.05 -0.29 0.55 1.01 -1.24 -5.03 116.67 109.56 2dme s ASP 57 Ca 0.00 -0.17 0.10 0.00 0.71 0.00 0.00 52.55 53.18 2dme s ASP 57 Cb 0.00 0.19 0.54 0.00 1.01 0.00 0.00 42.92 44.65 2dme s ASP 57 CO 0.00 -0.35 1.52 0.35 0.21 0.00 0.00 175.17 176.90 2dme n THR 58 N -0.55 2.60 -0.33 -1.27 -2.24 -1.26 -4.70 114.28 106.53 2dme n THR 58 Ca -0.07 -2.48 -0.18 0.00 -2.27 0.00 0.00 64.05 59.05 2dme n THR 58 Cb 0.62 -0.33 0.17 0.00 -2.10 0.00 0.00 70.33 68.69 2dme n THR 58 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2dme n ASP 59 N -1.00 -2.86 0.06 3.42 2.03 -1.26 -4.68 116.55 112.26 2dme n ASP 59 Ca 0.35 -0.64 0.01 0.00 0.52 0.00 0.00 54.79 55.03 2dme n ASP 59 Cb 1.10 -0.60 0.35 0.00 -0.72 0.00 0.00 41.12 41.25 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dme h ALA 60 N -2.84 1.45 0.00 -1.67 0.00 -2.00 -2.10 119.26 112.11 2dme h ALA 60 Ca -0.24 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2dme h ALA 60 Cb 0.79 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2dme h ALA 60 CO 0.15 0.39 -0.32 1.57 0.00 0.00 0.00 179.25 181.04 2dme h LYS 61 N 0.37 0.00 -0.02 0.00 2.10 -1.97 0.18 116.57 117.22 2dme h LYS 61 Ca 0.08 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.71 2dme h LYS 61 Cb 0.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2dme h LYS 61 CO 0.01 0.32 -0.06 -0.92 -2.00 0.00 0.00 179.45 176.80 2dme h TYR 62 N 0.00 0.11 -0.14 0.07 3.20 -1.66 -3.14 116.97 115.41 2dme h TYR 62 Ca -0.00 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.75 2dme h TYR 62 Cb 0.57 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.82 2dme h TYR 62 CO 0.00 0.67 -0.20 0.87 -1.64 0.00 0.00 178.16 177.85 2dme h LYS 63 N -0.48 0.39 -1.04 1.82 1.57 -1.41 -2.91 116.57 114.51 2dme h LYS 63 Ca -0.00 -0.23 0.31 0.00 -1.87 0.00 0.00 60.65 58.86 2dme h LYS 63 Cb 0.66 0.02 -0.13 0.00 0.08 0.00 0.00 32.23 32.86 2dme h LYS 63 CO 0.01 0.81 0.62 -0.91 -0.57 0.00 0.00 179.45 179.41 2dme h ASN 64 N 0.00 0.51 -0.11 0.86 2.35 -0.75 0.32 115.58 118.77 2dme h ASN 64 Ca 0.02 0.16 -0.17 0.00 -0.55 0.00 0.00 56.30 55.76 2dme h ASN 64 Cb 0.77 0.09 0.01 0.00 0.05 0.00 0.00 38.32 39.24 2dme h ASN 64 CO 0.05 -0.05 -0.58 0.50 -1.65 0.00 0.00 177.43 175.70 2dme h LYS 65 N 0.37 0.59 0.14 0.81 1.63 -1.50 -2.85 116.57 115.76 2dme h LYS 65 Ca 0.70 -0.48 -0.01 0.00 -0.85 0.00 0.00 60.65 60.01 2dme h LYS 65 Cb 1.65 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 33.38 2dme h LYS 65 CO -0.51 1.11 -0.08 -0.92 -3.45 0.00 0.00 179.45 175.60 2dme h TYR 66 N 0.22 -0.21 0.00 1.91 3.20 -0.29 0.16 116.97 121.97 2dme h TYR 66 Ca -0.04 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.83 2dme h TYR 66 Cb 1.22 0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.56 2dme h TYR 66 CO 0.11 -0.13 0.00 2.89 -1.64 0.00 0.00 178.16 179.39 2dme n ARG 67 N -5.19 0.02 -0.10 1.82 -4.01 0.29 -2.92 116.66 106.57 2dme n ARG 67 Ca -0.08 0.36 -0.17 0.00 -1.04 0.00 0.00 57.85 56.92 2dme n ARG 67 Cb 0.11 -1.54 -0.07 0.00 -3.04 0.00 0.00 32.46 27.92 2dme n ARG 67 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 2dme n SER 68 N -1.58 1.87 -0.33 2.89 7.64 -0.47 -2.80 113.62 120.84 2dme n SER 68 Ca 0.02 0.46 0.23 0.00 1.01 0.00 0.00 58.87 60.59 2dme n SER 68 Cb 0.11 -0.89 0.51 0.00 -1.01 0.00 0.00 64.21 62.92 2dme n SER 68 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2dme h LEU 69 N -1.00 0.45 0.00 -3.43 3.38 -0.62 0.69 115.31 114.78 2dme h LEU 69 Ca -0.27 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2dme h LEU 69 Cb 1.09 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2dme h LEU 69 CO -0.17 0.07 -0.83 0.00 0.09 0.00 0.00 178.44 177.60 2dme h MET 70 N 0.39 0.00 -0.82 1.13 -0.00 -1.72 -3.35 114.93 110.57 2dme h MET 70 Ca 0.61 0.00 0.21 0.00 -0.00 0.00 0.00 59.70 60.53 2dme h MET 70 Cb 1.55 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 33.10 2dme h MET 70 CO -0.32 0.00 0.57 0.35 -0.00 0.00 0.00 176.91 177.50 2dme h PHE 71 N 0.00 0.23 0.00 -0.10 3.04 0.57 0.84 116.94 121.53 2dme h PHE 71 Ca 0.00 0.01 -0.28 0.00 3.98 0.00 0.00 57.97 61.68 2dme h PHE 71 Cb 0.92 -0.07 -0.05 0.00 2.56 0.00 0.00 35.95 39.31 2dme h PHE 71 CO 0.00 0.07 -1.66 -0.91 -2.02 0.00 0.00 178.31 173.79 2dme h ASN 72 N 0.18 0.00 -0.47 0.41 2.35 -1.68 -3.24 115.58 113.13 2dme h ASN 72 Ca 0.40 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.10 2dme h ASN 72 Cb 1.31 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.66 2dme h ASN 72 CO -0.08 0.97 0.10 -0.07 -1.65 0.00 0.00 177.43 176.71 2dme h LEU 73 N 0.00 0.78 -0.47 1.61 3.38 -1.03 -1.89 115.31 117.68 2dme h LEU 73 Ca -0.27 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2dme h LEU 73 Cb 1.98 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.52 2dme h LEU 73 CO 0.08 0.78 -0.14 2.29 0.09 0.00 0.00 178.44 181.54 2dme n LYS 74 N -4.26 0.96 -2.75 1.13 2.85 -0.40 -4.85 118.16 110.84 2dme n LYS 74 Ca 0.04 -0.47 -0.42 0.00 -1.05 0.00 0.00 58.31 56.40 2dme n LYS 74 Cb 0.24 -1.49 -0.03 0.00 -0.65 0.00 0.00 35.03 33.10 2dme n LYS 74 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2dme s ASP 75 N -2.37 7.22 0.35 -5.58 2.15 -0.71 -4.93 116.67 112.81 2dme s ASP 75 Ca 0.30 1.49 0.27 0.00 0.43 0.00 0.00 52.55 55.04 2dme s ASP 75 Cb 0.20 -2.54 1.12 0.00 -0.30 0.00 0.00 42.92 41.41 2dme s ASP 75 CO 0.46 -0.37 1.80 1.55 -0.17 0.00 0.00 175.17 178.44 2dme h PRO 76 N 7.03 0.00 -0.08 4.34 0.13 -1.88 -2.99 132.00 138.55 2dme h PRO 76 Ca -0.34 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.56 2dme h PRO 76 Cb 1.17 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 2dme h PRO 76 CO 0.82 0.00 -0.86 0.87 -0.23 0.00 0.00 178.00 178.60 2dme h LYS 77 N 0.00 0.73 -3.52 0.86 1.79 -1.91 -3.38 116.57 111.14 2dme h LYS 77 Ca 0.00 -0.67 -0.73 0.00 -2.18 0.00 0.00 60.65 57.06 2dme h LYS 77 Cb 0.40 0.16 -0.32 0.00 -1.58 0.00 0.00 32.23 30.89 2dme h LYS 77 CO 0.00 1.27 -0.05 1.21 -1.08 0.00 0.00 179.45 180.80 2dme s ASN 78 N -7.14 6.13 -0.64 0.86 3.84 -1.13 -4.91 114.94 111.95 2dme s ASN 78 Ca -0.10 -3.27 -0.02 0.00 0.21 0.00 0.00 52.86 49.67 2dme s ASN 78 Cb 0.07 -2.00 0.32 0.00 -0.55 0.00 0.00 41.25 39.10 2dme s ASN 78 CO 0.90 -0.32 2.15 -3.20 -2.79 0.00 0.00 177.10 173.84 2dme n ASN 79 N 3.02 7.28 0.05 -4.21 5.15 -1.26 -4.34 115.26 120.93 2dme n ASN 79 Ca 0.17 -3.60 0.00 0.00 -0.60 0.00 0.00 54.58 50.54 2dme n ASN 79 Cb 0.39 -1.06 0.00 0.00 -0.53 0.00 0.00 39.78 38.58 2dme n ASN 79 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2dme n ILE 80 N -0.32 0.42 -0.01 -1.44 5.41 -1.26 -4.81 119.36 117.36 2dme n ILE 80 Ca 0.53 0.14 -0.00 0.00 1.00 0.00 0.00 62.75 64.42 2dme n ILE 80 Cb 0.49 -1.17 -0.00 0.00 -0.71 0.00 0.00 39.64 38.25 2dme n ILE 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2dme n LEU 81 N -3.18 -0.02 -0.27 1.39 7.94 -1.26 0.21 117.00 121.80 2dme n LEU 81 Ca 0.00 0.62 0.25 0.00 -1.11 0.00 0.00 56.01 55.78 2dme n LEU 81 Cb 0.15 -0.30 0.47 0.00 0.53 0.00 0.00 43.42 44.27 2dme n LEU 81 CO 0.00 -0.32 0.87 2.22 -1.11 0.00 0.00 177.39 179.05 2dme n PHE 82 N -2.67 0.94 0.09 1.96 -1.74 -1.26 0.22 117.46 115.00 2dme n PHE 82 Ca 0.00 1.00 -0.20 0.00 -0.56 0.00 0.00 57.45 57.69 2dme n PHE 82 Cb 0.00 -1.38 -0.12 0.00 1.52 0.00 0.00 39.48 39.51 2dme n PHE 82 CO 0.00 0.00 0.00 -0.22 -0.56 0.00 0.00 176.76 175.98 2dme h LYS 83 N 0.00 0.55 -0.68 3.97 3.64 0.21 -2.47 116.57 121.80 2dme h LYS 83 Ca 0.69 -0.73 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2dme h LYS 83 Cb 1.80 0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 33.83 2dme h LYS 83 CO -0.67 1.32 0.41 0.87 -2.27 0.00 0.00 179.45 179.12 2dme h LYS 84 N 0.25 0.91 0.00 1.90 1.57 0.70 0.26 116.57 122.15 2dme h LYS 84 Ca -0.17 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.47 2dme h LYS 84 Cb 1.87 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 33.99 2dme h LYS 84 CO 0.22 0.63 -0.28 0.28 -0.57 0.00 0.00 179.45 179.73 2dme h VAL 85 N 0.93 1.55 -0.10 0.50 2.07 -0.83 1.82 116.25 122.18 2dme h VAL 85 Ca 0.24 -1.99 -0.00 0.00 0.82 0.00 0.00 66.70 65.77 2dme h VAL 85 Cb -0.05 2.79 -0.00 0.00 -1.52 0.00 0.00 31.29 32.51 2dme h VAL 85 CO -0.05 0.55 0.05 -0.07 0.02 0.00 0.00 177.57 178.07 2dme h LEU 86 N -0.49 0.13 -0.76 2.57 4.07 -1.25 -2.91 115.31 116.67 2dme h LEU 86 Ca -0.04 -0.10 -0.03 0.00 0.08 0.00 0.00 57.88 57.79 2dme h LEU 86 Cb 1.04 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.72 2dme h LEU 86 CO 0.05 0.19 0.35 0.50 -1.08 0.00 0.00 178.44 178.45 2dme h LYS 87 N 0.06 1.11 0.00 1.13 1.63 -0.61 -3.47 116.57 116.41 2dme h LYS 87 Ca 0.03 -0.17 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 2dme h LYS 87 Cb 0.09 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.53 2dme h LYS 87 CO -0.01 0.87 0.00 0.41 -3.45 0.00 0.00 179.45 177.28 2dme n GLY 88 N -0.95 0.66 0.34 5.01 0.00 -0.78 -5.03 105.19 104.45 2dme n GLY 88 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 2dme n GLY 88 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dme h GLU 89 N 0.00 -0.55 -4.98 1.61 4.39 0.23 -3.39 114.58 111.88 2dme h GLU 89 Ca 0.00 0.04 -0.63 0.00 0.34 0.00 0.00 59.36 59.10 2dme h GLU 89 Cb 0.00 0.13 -0.17 0.00 -0.10 0.00 0.00 28.75 28.61 2dme h GLU 89 CO 0.00 -0.37 -0.52 0.08 -1.16 0.00 0.00 179.01 177.04 2dme s VAL 90 N -6.01 5.23 0.43 3.13 1.01 0.10 -4.94 120.40 119.35 2dme s VAL 90 Ca -0.16 0.14 -0.24 0.00 0.00 0.00 0.00 61.98 61.72 2dme s VAL 90 Cb 0.07 -3.47 -0.08 0.00 0.00 0.00 0.00 36.38 32.90 2dme s VAL 90 CO 0.64 0.30 1.11 0.42 0.00 0.00 0.00 175.10 177.57 2dme s THR 91 N 1.46 3.40 -1.30 3.92 -4.23 -1.26 -4.16 115.64 113.47 2dme s THR 91 Ca 0.07 1.07 0.15 0.00 -1.18 0.00 0.00 61.69 61.79 2dme s THR 91 Cb -0.15 -3.55 0.21 0.00 1.34 0.00 0.00 72.50 70.35 2dme s THR 91 CO 0.08 0.00 1.42 -0.81 -0.54 0.00 0.00 174.62 174.77 2dme n PRO 92 N -0.25 0.14 -0.01 3.99 -0.04 -1.26 -1.51 135.00 136.07 2dme n PRO 92 Ca 0.06 0.18 0.08 0.00 -0.04 0.00 0.00 63.50 63.78 2dme n PRO 92 Cb 0.49 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 2dme n PRO 92 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2dme n ASP 93 N -1.35 1.46 -0.04 3.54 5.68 -1.26 -4.10 116.55 120.48 2dme n ASP 93 Ca 0.06 -0.09 -0.15 0.00 -0.50 0.00 0.00 54.79 54.12 2dme n ASP 93 Cb 0.13 1.62 -0.14 0.00 -1.14 0.00 0.00 41.12 41.59 2dme n ASP 93 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 2dme n HIS 94 N -1.96 0.83 -0.07 2.11 -0.00 -0.93 -4.12 115.22 111.07 2dme n HIS 94 Ca -0.02 0.23 0.24 0.00 0.46 0.00 0.00 57.72 58.63 2dme n HIS 94 Cb 0.38 -1.13 0.52 0.00 -0.12 0.00 0.00 29.99 29.64 2dme n HIS 94 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2dme h LEU 95 N 0.03 0.00 0.17 0.27 5.85 -1.50 1.11 115.31 121.23 2dme h LEU 95 Ca -0.41 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 57.97 2dme h LEU 95 Cb 2.04 0.00 0.01 0.00 0.37 0.00 0.00 40.66 43.07 2dme h LEU 95 CO 0.05 0.00 -1.65 0.40 -0.34 0.00 0.00 178.44 176.90 2dme h ILE 96 N 0.00 1.04 0.00 4.05 2.04 -1.84 -3.30 117.51 119.49 2dme h ILE 96 Ca 0.36 -2.63 0.00 0.00 1.00 0.00 0.00 64.86 63.59 2dme h ILE 96 Cb 2.24 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 41.10 2dme h ILE 96 CO -0.00 0.84 0.00 0.03 0.00 0.00 0.00 178.15 179.01 2dme h ARG 97 N 0.10 0.00 -7.07 2.37 3.08 0.97 -3.45 114.38 110.38 2dme h ARG 97 Ca -0.30 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.24 2dme h ARG 97 Cb 2.08 0.00 0.08 0.00 0.08 0.00 0.00 29.97 32.21 2dme h ARG 97 CO 0.18 0.00 0.46 -1.64 -1.07 0.00 0.00 179.97 177.90 2dme s MET 98 N -3.24 3.37 0.51 0.04 -1.94 0.24 -5.02 119.30 113.25 2dme s MET 98 Ca 0.07 1.71 -0.09 0.00 -1.71 0.00 0.00 55.69 55.68 2dme s MET 98 Cb 0.10 -2.09 -0.05 0.00 2.01 0.00 0.00 34.83 34.80 2dme s MET 98 CO 0.52 -0.86 0.87 -1.54 -0.01 0.00 0.00 175.02 174.00 2dme s SER 99 N -1.61 6.32 0.00 3.03 1.04 -1.26 -4.96 113.70 116.27 2dme s SER 99 Ca 0.72 1.16 0.15 0.00 0.48 0.00 0.00 55.95 58.45 2dme s SER 99 Cb -0.27 -2.35 0.69 0.00 0.10 0.00 0.00 66.02 64.20 2dme s SER 99 CO 0.31 -0.64 1.42 -0.81 0.98 0.00 0.00 173.24 174.50 2dme n PRO 100 N -2.20 0.13 -0.01 4.02 -0.04 -1.26 -2.15 135.00 133.49 2dme n PRO 100 Ca 0.03 0.19 0.10 0.00 -0.04 0.00 0.00 63.50 63.77 2dme n PRO 100 Cb 0.54 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.35 2dme n PRO 100 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dme n GLU 101 N -1.37 0.63 -0.00 0.54 2.13 -1.26 -4.37 120.64 116.94 2dme n GLU 101 Ca 0.06 -0.18 -0.05 0.00 0.66 0.00 0.00 57.16 57.64 2dme n GLU 101 Cb 0.14 -1.49 -0.12 0.00 0.27 0.00 0.00 31.44 30.24 2dme n GLU 101 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2dme n GLU 102 N -2.23 0.63 0.28 5.31 -0.58 -0.92 -3.95 120.64 119.18 2dme n GLU 102 Ca -0.05 0.25 0.18 0.00 -0.42 0.00 0.00 57.16 57.13 2dme n GLU 102 Cb 0.56 -1.78 0.95 0.00 -0.57 0.00 0.00 31.44 30.59 2dme n GLU 102 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2dme h LEU 103 N 0.00 0.00 0.03 -4.62 3.38 -1.63 -0.07 115.31 112.39 2dme h LEU 103 Ca -0.25 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.43 2dme h LEU 103 Cb 1.84 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.56 2dme h LEU 103 CO 0.06 0.00 -1.62 0.00 0.09 0.00 0.00 178.44 176.98 2dme h ALA 104 N 1.75 0.61 -1.70 1.53 0.00 -1.80 -3.46 119.26 116.19 2dme h ALA 104 Ca 0.04 -1.33 -0.68 0.00 0.00 0.00 0.00 54.91 52.93 2dme h ALA 104 Cb 0.36 0.40 0.05 0.00 0.00 0.00 0.00 17.79 18.60 2dme h ALA 104 CO -0.00 1.45 0.50 0.45 0.00 0.00 0.00 179.25 181.65 2dme n SER 105 N -3.19 1.76 -2.58 0.00 2.88 -0.04 -4.90 113.62 107.54 2dme n SER 105 Ca -0.16 1.11 -0.15 0.00 -1.33 0.00 0.00 58.87 58.34 2dme n SER 105 Cb 1.03 -1.20 0.02 0.00 -0.75 0.00 0.00 64.21 63.32 2dme n SER 105 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2dme n LYS 106 N 2.73 2.08 0.11 -1.46 -0.00 -1.26 -4.84 118.16 115.52 2dme n LYS 106 Ca 0.19 -3.75 -0.02 0.00 -0.00 0.00 0.00 58.31 54.74 2dme n LYS 106 Cb 0.19 -1.66 0.04 0.00 -0.00 0.00 0.00 35.03 33.61 2dme n LYS 106 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2dme h GLU 107 N 2.80 0.00 -3.75 -1.58 3.07 -1.98 -3.47 114.58 109.68 2dme h GLU 107 Ca 0.06 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.74 2dme h GLU 107 Cb 1.11 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.00 2dme h GLU 107 CO 0.62 0.71 -0.22 1.28 -1.40 0.00 0.00 179.01 180.00 2dme n LEU 108 N -3.44 -0.79 0.00 1.33 4.32 -1.26 -4.70 117.00 112.46 2dme n LEU 108 Ca 0.00 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.26 2dme n LEU 108 Cb 0.76 -1.77 0.00 0.00 -1.62 0.00 0.00 43.42 40.79 2dme n LEU 108 CO 0.43 -0.15 -0.04 0.00 -1.22 0.00 0.00 177.39 176.41 2dme n ALA 109 N -1.93 1.55 0.08 -1.18 0.00 -1.26 -4.75 120.51 113.02 2dme n ALA 109 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.12 2dme n ALA 109 Cb 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.83 2dme n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dme h ALA 110 N 0.00 -0.05 -1.60 0.00 0.00 -2.01 -3.46 119.26 112.14 2dme h ALA 110 Ca 0.00 -0.86 -0.71 0.00 0.00 0.00 0.00 54.91 53.34 2dme h ALA 110 Cb 0.00 0.22 0.03 0.00 0.00 0.00 0.00 17.79 18.04 2dme h ALA 110 CO 0.00 0.61 0.70 0.91 0.00 0.00 0.00 179.25 181.47 2dme n TRP 111 N -3.91 1.80 -0.76 0.00 7.02 -1.26 -4.88 117.44 115.45 2dme n TRP 111 Ca -0.18 0.59 -0.33 0.00 -1.02 0.00 0.00 57.50 56.56 2dme n TRP 111 Cb 0.96 -2.40 0.14 0.00 -2.42 0.00 0.00 31.31 27.58 2dme n TRP 111 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2dme n ARG 112 N 4.07 -0.90 -3.47 -0.99 1.74 -1.26 -4.95 116.66 110.91 2dme n ARG 112 Ca 0.23 -0.24 -0.38 0.00 -0.77 0.00 0.00 57.85 56.69 2dme n ARG 112 Cb 0.16 -1.70 -0.06 0.00 -1.02 0.00 0.00 32.46 29.84 2dme n ARG 112 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2dme s ARG 113 N -3.38 4.06 -0.07 5.56 1.70 -1.26 -5.08 118.95 120.47 2dme s ARG 113 Ca 0.55 0.37 0.04 0.00 -0.47 0.00 0.00 55.73 56.22 2dme s ARG 113 Cb -0.15 -3.30 -0.01 0.00 -0.57 0.00 0.00 34.95 30.92 2dme s ARG 113 CO 0.68 0.50 -0.20 1.03 -1.08 0.00 0.00 175.30 176.22 2dme s ARG 114 N -0.45 2.72 -0.84 3.89 1.81 -1.26 -5.03 118.95 119.80 2dme s ARG 114 Ca 0.23 -0.82 -0.19 0.00 -1.72 0.00 0.00 55.73 53.23 2dme s ARG 114 Cb -0.16 -2.31 -0.20 0.00 -0.45 0.00 0.00 34.95 31.83 2dme s ARG 114 CO 0.11 0.39 2.23 -1.13 -0.68 0.00 0.00 175.30 176.22 2dme n SER 115 N 2.94 0.53 -4.20 0.23 3.41 -1.26 -4.82 113.62 110.45 2dme n SER 115 Ca -0.18 -1.30 -0.40 0.00 -0.26 0.00 0.00 58.87 56.73 2dme n SER 115 Cb 0.52 -1.26 -0.05 0.00 -0.26 0.00 0.00 64.21 63.16 2dme n SER 115 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dme s GLY 116 N 6.69 2.92 0.33 5.00 0.00 -1.26 -5.06 107.32 115.94 2dme s GLY 116 Ca 0.99 -3.63 -0.28 0.00 0.00 0.00 0.00 44.72 41.80 2dme s GLY 116 CO 0.24 1.22 1.22 2.56 0.00 0.00 0.00 173.10 178.33 2dme s PRO 117 N -0.78 4.37 -0.15 2.90 0.04 -1.26 -5.03 135.00 135.09 2dme s PRO 117 Ca 0.24 2.02 -0.06 0.00 0.04 0.00 0.00 61.00 63.25 2dme s PRO 117 Cb -0.11 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 2dme s PRO 117 CO -0.09 -0.11 0.06 0.45 0.04 0.00 0.00 177.00 177.35 2dme s SER 118 N -0.73 5.62 0.27 6.66 0.15 -1.26 -5.09 113.70 119.32 2dme s SER 118 Ca 0.49 0.15 -0.15 0.00 0.70 0.00 0.00 55.95 57.15 2dme s SER 118 Cb -0.36 -1.85 0.01 0.00 -1.71 0.00 0.00 66.02 62.11 2dme s SER 118 CO 0.47 0.26 0.56 -0.55 1.20 0.00 0.00 173.24 175.18 2dme s SER 119 N -0.18 -0.09 0.00 5.45 0.15 -1.26 -5.36 113.70 112.41 2dme s SER 119 Ca 0.07 -0.88 0.00 0.00 0.70 0.00 0.00 55.95 55.85 2dme s SER 119 Cb -0.12 0.65 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 2dme s SER 119 CO 0.01 -1.24 0.00 0.61 1.20 0.00 0.00 173.24 173.83