#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cdm s THR 5 N 0.00 2.17 0.14 1.96 -4.23 -1.26 -4.82 115.64 109.61 1cdm s THR 5 Ca 0.00 0.06 -0.16 0.00 -1.18 0.00 0.00 61.69 60.41 1cdm s THR 5 Cb 0.00 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.70 1cdm s THR 5 CO 0.00 -0.07 1.73 -0.08 -0.54 0.00 0.00 174.62 175.66 1cdm h GLU 6 N -2.02 0.58 -0.20 3.99 4.81 -2.05 -2.20 114.58 117.49 1cdm h GLU 6 Ca -0.49 -0.08 -0.06 0.00 -0.13 0.00 0.00 59.36 58.60 1cdm h GLU 6 Cb 1.28 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.54 1cdm h GLU 6 CO 0.45 0.49 -0.14 1.05 -0.73 0.00 0.00 179.01 180.14 1cdm h GLU 7 N 0.52 0.34 -0.25 1.92 4.11 -1.98 -2.03 114.58 117.21 1cdm h GLU 7 Ca 0.14 -0.09 -0.05 0.00 0.07 0.00 0.00 59.36 59.43 1cdm h GLU 7 Cb 0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1cdm h GLU 7 CO -0.02 0.48 -0.04 1.96 0.07 0.00 0.00 179.01 181.46 1cdm h GLN 8 N 0.32 0.47 -0.39 1.06 4.20 -1.83 0.10 115.11 119.04 1cdm h GLN 8 Ca 0.06 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.58 1cdm h GLN 8 Cb 0.44 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1cdm h GLN 8 CO 0.03 0.67 0.13 0.82 -0.67 0.00 0.00 178.83 179.80 1cdm h ILE 9 N 0.22 1.16 -0.04 2.54 2.04 -1.18 -0.18 117.51 122.07 1cdm h ILE 9 Ca 0.07 -0.54 -0.14 0.00 1.00 0.00 0.00 64.86 65.25 1cdm h ILE 9 Cb 0.48 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1cdm h ILE 9 CO 0.02 0.20 -0.61 0.00 0.00 0.00 0.00 178.15 177.76 1cdm h ALA 10 N 1.60 0.90 -0.14 1.87 0.00 -1.09 -0.09 119.26 122.30 1cdm h ALA 10 Ca 0.13 -0.55 -0.21 0.00 0.00 0.00 0.00 54.91 54.28 1cdm h ALA 10 Cb 0.16 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1cdm h ALA 10 CO -0.01 0.75 -0.73 0.93 0.00 0.00 0.00 179.25 180.19 1cdm h GLU 11 N 0.10 0.74 0.00 0.00 5.08 -0.32 -2.48 114.58 117.71 1cdm h GLU 11 Ca -0.01 -0.61 -0.07 0.00 -1.00 0.00 0.00 59.36 57.67 1cdm h GLU 11 Cb 1.10 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1cdm h GLU 11 CO 0.09 1.22 -0.36 0.74 -1.00 0.00 0.00 179.01 179.70 1cdm h PHE 12 N 0.45 0.00 -0.34 4.33 0.05 -0.93 -1.25 116.94 119.26 1cdm h PHE 12 Ca -0.05 0.00 -0.18 0.00 3.82 0.00 0.00 57.97 61.56 1cdm h PHE 12 Cb 1.36 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 39.31 1cdm h PHE 12 CO 0.09 0.36 -0.47 -0.22 -0.18 0.00 0.00 178.31 177.89 1cdm h LYS 13 N 0.00 0.91 -0.27 1.51 3.64 -0.95 -0.96 116.57 120.45 1cdm h LYS 13 Ca -0.00 -0.53 -0.01 0.00 -1.27 0.00 0.00 60.65 58.83 1cdm h LYS 13 Cb 0.68 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1cdm h LYS 13 CO 0.05 1.18 0.12 1.49 -2.27 0.00 0.00 179.45 180.02 1cdm h GLU 14 N 0.72 0.39 -0.29 1.90 4.57 -0.93 -1.83 114.58 119.11 1cdm h GLU 14 Ca 0.04 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1cdm h GLU 14 Cb 1.08 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.58 1cdm h GLU 14 CO 0.11 0.40 0.18 0.00 -1.18 0.00 0.00 179.01 178.52 1cdm h ALA 15 N 0.98 0.37 -0.65 2.92 0.00 -1.19 -2.52 119.26 119.16 1cdm h ALA 15 Ca 0.09 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1cdm h ALA 15 Cb 0.14 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 1cdm h ALA 15 CO -0.01 -0.18 0.23 0.35 0.00 0.00 0.00 179.25 179.64 1cdm h PHE 16 N 0.38 0.39 0.00 0.00 3.04 -1.01 -0.22 116.94 119.52 1cdm h PHE 16 Ca 0.11 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.07 1cdm h PHE 16 Cb -0.03 -0.08 -0.00 0.00 2.56 0.00 0.00 35.95 38.41 1cdm h PHE 16 CO -0.07 0.06 -0.12 0.77 -2.02 0.00 0.00 178.31 176.93 1cdm h SER 17 N 0.39 0.00 0.71 0.41 0.02 -0.93 -1.15 113.55 113.01 1cdm h SER 17 Ca 0.34 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 61.10 1cdm h SER 17 Cb 0.47 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 1cdm h SER 17 CO -0.36 0.12 -0.87 -0.07 -1.14 0.00 0.00 176.83 174.52 1cdm h LEU 18 N 0.00 0.13 0.12 5.07 3.38 -0.65 -3.27 115.31 120.10 1cdm h LEU 18 Ca -0.00 -0.11 -0.29 0.00 0.09 0.00 0.00 57.88 57.56 1cdm h LEU 18 Cb 0.29 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1cdm h LEU 18 CO 0.02 0.93 -1.41 -0.26 0.09 0.00 0.00 178.44 177.80 1cdm h PHE 19 N 0.05 0.48 0.00 1.13 0.04 -1.26 -3.39 116.94 113.99 1cdm h PHE 19 Ca -0.03 -0.35 -0.43 0.00 2.80 0.00 0.00 57.97 59.96 1cdm h PHE 19 Cb 1.50 -0.02 0.02 0.00 2.20 0.00 0.00 35.95 39.66 1cdm h PHE 19 CO 0.02 1.34 2.66 -3.47 -0.60 0.00 0.00 178.31 178.25 1cdm n ASP 20 N -3.48 4.85 -0.35 2.17 4.64 -0.47 -4.75 116.55 119.16 1cdm n ASP 20 Ca -0.13 -2.39 0.05 0.00 -1.38 0.00 0.00 54.79 50.94 1cdm n ASP 20 Cb 1.04 -1.13 0.12 0.00 -1.04 0.00 0.00 41.12 40.10 1cdm n ASP 20 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1cdm n LYS 21 N 4.53 -0.11 0.09 -0.67 4.76 -1.26 -0.04 118.16 125.45 1cdm n LYS 21 Ca 0.47 1.51 0.13 0.00 -2.87 0.00 0.00 58.31 57.56 1cdm n LYS 21 Cb 0.17 -2.26 0.44 0.00 -1.84 0.00 0.00 35.03 31.55 1cdm n LYS 21 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1cdm n ASP 22 N -5.56 0.67 -2.75 4.39 3.85 -1.26 -4.95 116.55 110.94 1cdm n ASP 22 Ca 0.15 0.57 -0.12 0.00 -0.71 0.00 0.00 54.79 54.68 1cdm n ASP 22 Cb 0.47 -0.75 0.06 0.00 -1.35 0.00 0.00 41.12 39.55 1cdm n ASP 22 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1cdm n GLY 23 N 1.24 -0.24 0.41 6.12 0.00 0.94 -4.94 105.19 108.73 1cdm n GLY 23 Ca 0.06 0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.15 1cdm n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cdm n ASP 24 N -2.58 2.44 0.00 1.61 5.75 -1.26 -4.96 116.55 117.55 1cdm n ASP 24 Ca -0.17 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 1cdm n ASP 24 Cb 0.61 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1cdm n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cdm n GLY 25 N 0.24 0.92 3.10 6.12 0.00 -1.26 -5.03 105.19 109.29 1cdm n GLY 25 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1cdm n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cdm s THR 26 N -3.50 0.92 -0.32 2.61 -4.23 -1.26 -3.92 115.64 105.94 1cdm s THR 26 Ca 0.00 -0.87 -0.08 0.00 -1.18 0.00 0.00 61.69 59.56 1cdm s THR 26 Cb 0.00 -0.85 0.01 0.00 1.34 0.00 0.00 72.50 73.01 1cdm s THR 26 CO 0.00 -0.02 0.11 -0.63 -0.54 0.00 0.00 174.62 173.54 1cdm s ILE 27 N -0.79 4.10 0.53 2.99 1.01 -0.42 -4.75 121.20 123.86 1cdm s ILE 27 Ca 0.00 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 59.93 1cdm s ILE 27 Cb -0.07 -3.17 0.04 0.00 0.01 0.00 0.00 42.46 39.27 1cdm s ILE 27 CO 0.01 -0.01 0.73 0.42 0.00 0.00 0.00 174.94 176.09 1cdm s THR 28 N 1.50 2.68 0.33 2.92 -4.23 -1.26 -2.43 115.64 115.16 1cdm s THR 28 Ca 0.02 -0.79 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1cdm s THR 28 Cb -0.18 -2.89 0.18 0.00 1.34 0.00 0.00 72.50 70.95 1cdm s THR 28 CO 0.04 0.00 1.90 0.71 -0.54 0.00 0.00 174.62 176.72 1cdm h THR 29 N 0.20 1.19 -0.53 3.99 1.35 -1.92 -1.83 112.91 115.36 1cdm h THR 29 Ca -0.40 -0.68 0.02 0.00 -0.55 0.00 0.00 66.41 64.80 1cdm h THR 29 Cb 1.29 0.78 -0.03 0.00 -1.73 0.00 0.00 68.15 68.45 1cdm h THR 29 CO 0.48 0.25 0.33 0.11 -0.25 0.00 0.00 175.52 176.44 1cdm h LYS 30 N 0.60 0.65 -0.48 4.72 1.57 -1.99 -0.32 116.57 121.32 1cdm h LYS 30 Ca 0.14 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 1cdm h LYS 30 Cb 0.24 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1cdm h LYS 30 CO -0.00 0.43 -0.13 0.93 -0.57 0.00 0.00 179.45 180.10 1cdm h GLU 31 N 0.67 0.91 0.03 3.15 5.08 -1.74 -0.06 114.58 122.62 1cdm h GLU 31 Ca 0.21 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1cdm h GLU 31 Cb -0.02 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1cdm h GLU 31 CO -0.07 0.99 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.84 1cdm h LEU 32 N 0.81 -0.03 0.01 1.33 3.38 -0.87 -2.37 115.31 117.57 1cdm h LEU 32 Ca 0.13 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1cdm h LEU 32 Cb 0.67 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1cdm h LEU 32 CO 0.05 0.08 -0.03 1.23 0.09 0.00 0.00 178.44 179.85 1cdm h GLY 33 N -0.14 -0.04 0.29 0.83 0.00 -0.95 0.41 103.07 103.47 1cdm h GLY 33 Ca -0.00 0.04 0.09 0.00 0.00 0.00 0.00 47.33 47.45 1cdm h GLY 33 CO 0.01 -0.04 0.03 -0.84 0.00 0.00 0.00 176.54 175.70 1cdm h THR 34 N -0.06 0.67 -0.28 4.70 2.02 -0.96 0.91 112.91 119.91 1cdm h THR 34 Ca 0.01 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 67.06 1cdm h THR 34 Cb 0.07 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1cdm h THR 34 CO -0.03 0.03 -0.16 0.58 0.37 0.00 0.00 175.52 176.31 1cdm h VAL 35 N 0.15 1.30 0.00 3.16 2.07 -1.31 -2.21 116.25 119.41 1cdm h VAL 35 Ca 0.23 -1.26 -0.04 0.00 0.82 0.00 0.00 66.70 66.45 1cdm h VAL 35 Cb 0.34 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1cdm h VAL 35 CO -0.36 0.40 -0.18 0.24 0.02 0.00 0.00 177.57 177.68 1cdm h MET 36 N 0.33 0.00 0.01 1.57 2.86 -0.41 -2.30 114.93 116.99 1cdm h MET 36 Ca 0.06 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.51 1cdm h MET 36 Cb 0.68 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1cdm h MET 36 CO 0.04 0.18 -0.91 0.00 1.06 0.00 0.00 176.91 177.29 1cdm h ARG 37 N 0.00 0.03 0.00 1.72 3.08 -0.65 0.24 114.38 118.79 1cdm h ARG 37 Ca -0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1cdm h ARG 37 Cb 0.39 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1cdm h ARG 37 CO 0.02 0.91 -0.04 0.66 -1.07 0.00 0.00 179.97 180.46 1cdm h SER 38 N 0.01 0.00 -0.58 7.04 4.64 -0.82 -2.07 113.55 121.78 1cdm h SER 38 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1cdm h SER 38 Cb 1.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 1cdm h SER 38 CO 0.12 0.04 0.00 0.18 -0.87 0.00 0.00 176.83 176.30 1cdm n LEU 39 N -3.17 4.00 0.00 5.97 4.77 -1.11 -4.96 117.00 122.49 1cdm n LEU 39 Ca -0.00 -2.23 0.00 0.00 -0.03 0.00 0.00 56.01 53.75 1cdm n LEU 39 Cb 0.29 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1cdm n LEU 39 CO 0.27 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.79 1cdm n GLY 40 N 1.04 0.62 4.00 -0.72 0.00 -0.78 -5.07 105.19 104.30 1cdm n GLY 40 Ca 0.22 -0.45 -0.17 0.00 0.00 0.00 0.00 46.02 45.61 1cdm n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1cdm s GLN 41 N -0.95 2.81 -0.40 1.61 2.00 0.84 -5.00 119.66 120.57 1cdm s GLN 41 Ca 0.00 -1.26 0.09 0.00 -2.00 0.00 0.00 55.36 52.19 1cdm s GLN 41 Cb 0.00 -2.73 0.31 0.00 0.80 0.00 0.00 33.01 31.39 1cdm s GLN 41 CO 0.00 -0.26 0.75 0.09 -0.50 0.00 0.00 175.29 175.37 1cdm n ASN 42 N -1.82 -0.19 -4.75 6.67 3.02 -1.26 -3.98 115.26 112.94 1cdm n ASN 42 Ca 0.08 -3.07 -0.37 0.00 -0.03 0.00 0.00 54.58 51.19 1cdm n ASN 42 Cb 0.59 0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.82 1cdm n ASN 42 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1cdm s PRO 43 N -1.38 2.88 0.38 3.52 0.04 -1.26 -5.02 135.00 134.16 1cdm s PRO 43 Ca 0.35 1.95 -0.02 0.00 0.04 0.00 0.00 61.00 63.32 1cdm s PRO 43 Cb 0.28 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.83 1cdm s PRO 43 CO -0.10 -1.31 0.62 0.95 0.04 0.00 0.00 177.00 177.20 1cdm s THR 44 N -1.49 5.03 0.46 1.26 -4.23 -1.26 -4.94 115.64 110.47 1cdm s THR 44 Ca 0.78 -0.19 0.14 0.00 -1.18 0.00 0.00 61.69 61.24 1cdm s THR 44 Cb -0.34 -3.85 0.31 0.00 1.34 0.00 0.00 72.50 69.97 1cdm s THR 44 CO 0.37 -0.62 2.03 1.05 -0.54 0.00 0.00 174.62 176.91 1cdm h GLU 45 N 0.70 0.30 -0.28 3.99 9.09 -1.99 -1.02 114.58 125.36 1cdm h GLU 45 Ca -0.49 -0.02 -0.13 0.00 0.05 0.00 0.00 59.36 58.78 1cdm h GLU 45 Cb 1.21 -0.07 -0.00 0.00 -1.65 0.00 0.00 28.75 28.24 1cdm h GLU 45 CO 0.62 0.20 -0.31 0.00 0.05 0.00 0.00 179.01 179.56 1cdm h ALA 46 N 1.77 0.42 -0.13 1.06 0.00 -1.98 0.01 119.26 120.40 1cdm h ALA 46 Ca 0.20 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 1cdm h ALA 46 Cb 0.39 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1cdm h ALA 46 CO -0.04 0.45 -0.35 0.93 0.00 0.00 0.00 179.25 180.24 1cdm h GLU 47 N 0.45 0.28 -0.21 0.00 5.08 -1.71 -0.74 114.58 117.73 1cdm h GLU 47 Ca 0.04 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 1cdm h GLU 47 Cb 0.89 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1cdm h GLU 47 CO 0.08 0.60 -0.39 -0.07 -1.00 0.00 0.00 179.01 178.22 1cdm h LEU 48 N 0.24 0.71 -0.90 1.33 3.38 -1.07 -2.02 115.31 116.98 1cdm h LEU 48 Ca 0.03 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.44 1cdm h LEU 48 Cb 0.74 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 1cdm h LEU 48 CO 0.06 1.12 0.48 -0.61 0.09 0.00 0.00 178.44 179.57 1cdm h GLN 49 N 0.33 1.26 -0.19 1.13 5.75 -0.73 -2.32 115.11 120.35 1cdm h GLN 49 Ca 0.01 -0.16 -0.10 0.00 -0.15 0.00 0.00 58.65 58.26 1cdm h GLN 49 Cb 0.99 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 29.29 1cdm h GLN 49 CO 0.09 0.93 -0.31 -0.44 -2.65 0.00 0.00 178.83 176.45 1cdm h ASP 50 N 1.26 0.38 -0.06 -0.69 3.45 -1.05 0.19 116.42 119.89 1cdm h ASP 50 Ca 0.31 -0.14 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 1cdm h ASP 50 Cb 0.05 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 38.71 1cdm h ASP 50 CO -0.05 0.67 0.01 0.24 -1.57 0.00 0.00 179.24 178.55 1cdm h MET 51 N 0.32 0.10 -0.26 3.56 2.86 -0.88 0.16 114.93 120.80 1cdm h MET 51 Ca 0.04 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1cdm h MET 51 Cb 0.71 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1cdm h MET 51 CO 0.05 0.31 0.15 0.82 1.06 0.00 0.00 176.91 179.31 1cdm h ILE 52 N -0.13 1.10 -0.69 -1.22 1.08 -1.30 -2.96 117.51 113.40 1cdm h ILE 52 Ca 0.02 -0.24 0.05 0.00 -0.39 0.00 0.00 64.86 64.30 1cdm h ILE 52 Cb 0.26 0.79 -0.05 0.00 -3.07 0.00 0.00 36.82 34.75 1cdm h ILE 52 CO 0.00 0.10 0.40 0.78 -0.69 0.00 0.00 178.15 178.74 1cdm h ASN 53 N 0.32 0.62 0.29 1.72 -0.26 -0.78 -1.68 115.58 115.81 1cdm h ASN 53 Ca 0.09 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.85 1cdm h ASN 53 Cb 0.02 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.18 1cdm h ASN 53 CO -0.02 0.41 0.00 1.21 -1.06 0.00 0.00 177.43 177.97 1cdm n GLU 54 N -4.74 0.04 -0.11 0.81 2.13 0.03 -3.16 120.64 115.63 1cdm n GLU 54 Ca 0.08 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1cdm n GLU 54 Cb 0.15 -1.59 0.00 0.00 0.27 0.00 0.00 31.44 30.27 1cdm n GLU 54 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 1cdm n VAL 55 N -1.67 0.08 -3.00 6.31 0.24 -1.02 -5.00 118.33 114.28 1cdm n VAL 55 Ca 0.02 -0.09 -0.44 0.00 -2.04 0.00 0.00 64.34 61.78 1cdm n VAL 55 Cb 0.10 0.84 -0.03 0.00 -1.47 0.00 0.00 33.84 33.29 1cdm n VAL 55 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1cdm s ASP 56 N -0.32 6.61 0.09 -1.34 2.15 -0.66 -4.80 116.67 118.39 1cdm s ASP 56 Ca 0.01 -2.07 -0.36 0.00 0.43 0.00 0.00 52.55 50.56 1cdm s ASP 56 Cb 0.00 -2.36 -0.17 0.00 -0.30 0.00 0.00 42.92 40.09 1cdm s ASP 56 CO 0.00 -1.00 1.57 0.00 -0.17 0.00 0.00 175.17 175.57 1cdm h ALA 57 N 8.71 -1.11 -0.03 3.66 0.00 -1.90 -2.93 119.26 125.66 1cdm h ALA 57 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1cdm h ALA 57 Cb 1.03 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.52 1cdm h ALA 57 CO 1.05 -1.16 0.00 -0.40 0.00 0.00 0.00 179.25 178.74 1cdm n ASP 58 N -5.56 0.93 -3.93 0.00 5.75 -1.26 -4.92 116.55 107.56 1cdm n ASP 58 Ca -0.12 -2.03 -0.31 0.00 -0.01 0.00 0.00 54.79 52.31 1cdm n ASP 58 Cb 0.46 -0.37 -0.04 0.00 -1.03 0.00 0.00 41.12 40.14 1cdm n ASP 58 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cdm n GLY 59 N 0.19 -0.44 0.60 6.12 0.00 -1.11 -4.83 105.19 105.72 1cdm n GLY 59 Ca 0.01 0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.25 1cdm n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cdm n ASN 60 N -2.34 1.87 0.00 1.61 6.94 -1.26 -4.95 115.26 117.13 1cdm n ASN 60 Ca 0.07 -1.64 0.00 0.00 -0.02 0.00 0.00 54.58 52.99 1cdm n ASN 60 Cb 0.49 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.89 1cdm n ASN 60 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cdm n GLY 61 N 1.22 1.42 3.11 4.83 0.00 -1.26 -5.02 105.19 109.49 1cdm n GLY 61 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1cdm n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cdm s THR 62 N -3.20 0.57 -0.19 2.61 -4.23 -1.26 -4.72 115.64 105.21 1cdm s THR 62 Ca 0.00 -1.50 -0.10 0.00 -1.18 0.00 0.00 61.69 58.91 1cdm s THR 62 Cb 0.00 -1.13 -0.05 0.00 1.34 0.00 0.00 72.50 72.66 1cdm s THR 62 CO 0.00 -0.65 0.15 -0.63 -0.54 0.00 0.00 174.62 172.96 1cdm s ILE 63 N -2.55 5.40 0.49 2.99 1.01 -1.02 -4.91 121.20 122.61 1cdm s ILE 63 Ca 0.01 0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.97 1cdm s ILE 63 Cb -0.02 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 38.98 1cdm s ILE 63 CO -0.03 0.44 0.51 1.51 0.00 0.00 0.00 174.94 177.37 1cdm s ASP 64 N 0.32 5.04 0.16 3.58 1.47 -1.26 -1.30 116.67 124.68 1cdm s ASP 64 Ca 0.09 -0.86 -0.15 0.00 1.18 0.00 0.00 52.55 52.82 1cdm s ASP 64 Cb -0.11 -0.12 0.09 0.00 -0.34 0.00 0.00 42.92 42.44 1cdm s ASP 64 CO -0.01 -0.95 1.74 0.15 0.68 0.00 0.00 175.17 176.78 1cdm h PHE 65 N 0.70 0.19 -0.88 2.11 -0.00 -2.00 -1.55 116.94 115.51 1cdm h PHE 65 Ca -0.37 0.02 0.09 0.00 -0.00 0.00 0.00 57.97 57.71 1cdm h PHE 65 Cb 1.28 -0.03 -0.07 0.00 -0.00 0.00 0.00 35.95 37.14 1cdm h PHE 65 CO 0.60 0.06 0.54 -1.35 -0.00 0.00 0.00 178.31 178.15 1cdm h PRO 66 N 0.25 0.90 -0.60 6.41 0.11 -1.96 -0.03 132.00 137.09 1cdm h PRO 66 Ca 0.18 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.16 1cdm h PRO 66 Cb 0.19 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 1cdm h PRO 66 CO -0.21 0.59 0.07 0.93 -0.21 0.00 0.00 178.00 179.17 1cdm h GLU 67 N 0.92 1.01 -0.58 1.05 5.08 -1.76 -2.29 114.58 118.01 1cdm h GLU 67 Ca 0.41 -0.29 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1cdm h GLU 67 Cb 0.30 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 1cdm h GLU 67 CO -0.22 0.96 0.35 0.35 -1.00 0.00 0.00 179.01 179.45 1cdm h PHE 68 N 0.91 0.64 -0.37 4.33 3.57 -0.62 -1.32 116.94 124.07 1cdm h PHE 68 Ca 0.18 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.75 1cdm h PHE 68 Cb 0.46 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 1cdm h PHE 68 CO 0.03 0.36 0.06 -0.07 -2.23 0.00 0.00 178.31 176.47 1cdm h LEU 69 N 0.68 -0.02 -0.53 0.59 4.07 -0.63 0.19 115.31 119.65 1cdm h LEU 69 Ca 0.24 0.07 -0.01 0.00 0.08 0.00 0.00 57.88 58.25 1cdm h LEU 69 Cb 0.04 0.10 -0.03 0.00 1.08 0.00 0.00 40.66 41.85 1cdm h LEU 69 CO -0.11 0.03 0.29 0.74 -1.08 0.00 0.00 178.44 178.30 1cdm h THR 70 N 0.18 1.18 0.42 0.22 2.02 -0.86 0.27 112.91 116.34 1cdm h THR 70 Ca 0.18 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 1cdm h THR 70 Cb 0.22 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1cdm h THR 70 CO -0.25 0.20 -0.42 -0.03 0.37 0.00 0.00 175.52 175.39 1cdm h MET 71 N 0.72 -0.83 -0.94 6.66 1.85 -0.61 -2.87 114.93 118.90 1cdm h MET 71 Ca 0.19 0.06 0.12 0.00 -0.61 0.00 0.00 59.70 59.45 1cdm h MET 71 Cb 0.06 0.19 -0.07 0.00 0.43 0.00 0.00 31.60 32.21 1cdm h MET 71 CO -0.03 -0.55 0.60 0.52 -0.40 0.00 0.00 176.91 177.05 1cdm h MET 72 N -0.86 0.87 -2.84 0.39 2.07 -0.64 -3.52 114.93 110.40 1cdm h MET 72 Ca -0.04 -0.05 -0.02 0.00 -2.07 0.00 0.00 59.70 57.51 1cdm h MET 72 Cb 0.77 -0.20 -0.01 0.00 -1.87 0.00 0.00 31.60 30.29 1cdm h MET 72 CO -0.07 0.58 0.37 0.00 1.07 0.00 0.00 176.91 178.86 1cdm n ALA 73 N -2.39 1.71 0.00 6.32 0.00 0.06 -5.10 120.51 121.11 1cdm n ALA 73 Ca 0.17 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1cdm n ALA 73 Cb 0.36 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1cdm n ALA 73 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1cdm n GLU 84 N 2.90 0.00 -0.03 0.00 2.13 -1.26 -5.08 120.64 119.29 1cdm n GLU 84 Ca 0.05 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.73 1cdm n GLU 84 Cb 0.12 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.72 1cdm n GLU 84 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1cdm h ILE 85 N 0.00 1.54 -0.76 6.31 2.04 -2.02 -2.85 117.51 121.77 1cdm h ILE 85 Ca 0.00 -1.88 0.08 0.00 1.00 0.00 0.00 64.86 64.06 1cdm h ILE 85 Cb 0.00 2.72 -0.05 0.00 -0.74 0.00 0.00 36.82 38.75 1cdm h ILE 85 CO 0.00 0.51 0.50 -0.09 0.00 0.00 0.00 178.15 179.07 1cdm h ARG 86 N -0.51 0.73 -0.39 2.37 9.65 -1.98 0.38 114.38 124.63 1cdm h ARG 86 Ca -0.02 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.69 1cdm h ARG 86 Cb 0.95 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1cdm h ARG 86 CO 0.04 0.48 -0.23 0.93 2.80 0.00 0.00 179.97 184.00 1cdm h GLU 87 N 0.75 0.84 -0.30 0.20 4.39 -2.00 -1.32 114.58 117.14 1cdm h GLU 87 Ca 0.34 -0.38 -0.14 0.00 0.34 0.00 0.00 59.36 59.51 1cdm h GLU 87 Cb 0.33 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1cdm h GLU 87 CO -0.12 1.02 -0.38 0.00 -1.16 0.00 0.00 179.01 178.38 1cdm h ALA 88 N 0.80 0.76 -0.80 3.43 0.00 -1.05 -3.04 119.26 119.36 1cdm h ALA 88 Ca 0.08 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.57 1cdm h ALA 88 Cb 0.79 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1cdm h ALA 88 CO 0.06 0.66 0.52 0.35 0.00 0.00 0.00 179.25 180.84 1cdm h PHE 89 N 0.59 0.98 0.00 0.00 3.57 0.07 -1.80 116.94 120.35 1cdm h PHE 89 Ca 0.05 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1cdm h PHE 89 Cb 0.91 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.32 1cdm h PHE 89 CO 0.05 0.59 -0.10 -0.09 -2.23 0.00 0.00 178.31 176.52 1cdm h ARG 90 N 1.03 0.00 -0.11 1.11 2.43 -1.14 0.28 114.38 117.98 1cdm h ARG 90 Ca 0.31 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.31 1cdm h ARG 90 Cb -0.05 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1cdm h ARG 90 CO -0.09 0.10 -0.63 0.28 -1.51 0.00 0.00 179.97 178.12 1cdm h VAL 91 N 0.00 1.36 0.04 0.20 2.07 -1.25 -3.33 116.25 115.35 1cdm h VAL 91 Ca -0.00 -1.98 -0.11 0.00 0.82 0.00 0.00 66.70 65.43 1cdm h VAL 91 Cb 0.21 1.98 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1cdm h VAL 91 CO 0.01 0.60 -0.53 -0.26 0.02 0.00 0.00 177.57 177.41 1cdm h PHE 92 N 0.29 0.17 -0.10 1.57 0.04 -1.28 -3.39 116.94 114.23 1cdm h PHE 92 Ca -0.01 -0.12 -0.66 0.00 2.80 0.00 0.00 57.97 59.98 1cdm h PHE 92 Cb 1.18 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.31 1cdm h PHE 92 CO 0.04 1.21 2.61 -3.47 -0.60 0.00 0.00 178.31 178.09 1cdm n ASP 93 N -4.40 3.37 -0.18 2.17 4.64 0.01 -4.65 116.55 117.51 1cdm n ASP 93 Ca -0.16 -2.77 -0.01 0.00 -1.38 0.00 0.00 54.79 50.46 1cdm n ASP 93 Cb 0.63 -1.45 0.09 0.00 -1.04 0.00 0.00 41.12 39.35 1cdm n ASP 93 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1cdm h LYS 94 N 7.10 0.30 -0.00 -0.67 1.57 -1.77 -0.49 116.57 122.61 1cdm h LYS 94 Ca 0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1cdm h LYS 94 Cb 0.69 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1cdm h LYS 94 CO 1.85 0.20 0.00 -0.40 -0.57 0.00 0.00 179.45 180.52 1cdm n ASP 95 N -5.06 0.20 -0.82 0.86 5.68 -1.26 -4.93 116.55 111.21 1cdm n ASP 95 Ca 0.07 -1.11 -0.11 0.00 -0.50 0.00 0.00 54.79 53.14 1cdm n ASP 95 Cb 0.26 -0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.19 1cdm n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1cdm n GLY 96 N 1.00 1.11 0.00 6.12 0.00 -0.19 -4.89 105.19 108.35 1cdm n GLY 96 Ca 0.22 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1cdm n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cdm n ASN 97 N -0.70 0.00 0.00 1.61 6.94 -1.26 -4.87 115.26 116.98 1cdm n ASN 97 Ca -0.11 -1.19 0.00 0.00 -0.02 0.00 0.00 54.58 53.27 1cdm n ASN 97 Cb 0.49 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.91 1cdm n ASN 97 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cdm n GLY 98 N 0.78 0.58 2.92 4.83 0.00 -1.26 -5.04 105.19 108.01 1cdm n GLY 98 Ca 0.17 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 1cdm n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cdm s TYR 99 N -2.00 -0.12 -0.16 1.61 2.02 -1.26 -3.91 117.35 113.53 1cdm s TYR 99 Ca 0.00 0.36 -0.16 0.00 -0.37 0.00 0.00 57.07 56.90 1cdm s TYR 99 Cb 0.00 -0.06 -0.04 0.00 -0.40 0.00 0.00 41.96 41.46 1cdm s TYR 99 CO 0.00 -0.12 0.37 0.42 -1.57 0.00 0.00 175.55 174.66 1cdm s ILE 100 N 0.75 5.25 0.35 2.71 1.01 0.43 -4.82 121.20 126.87 1cdm s ILE 100 Ca -0.06 0.71 0.08 0.00 0.00 0.00 0.00 60.65 61.38 1cdm s ILE 100 Cb -0.08 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1cdm s ILE 100 CO -0.03 0.34 0.20 -0.94 0.00 0.00 0.00 174.94 174.50 1cdm s SER 101 N 0.65 4.81 0.26 3.58 1.04 -1.26 -1.40 113.70 121.37 1cdm s SER 101 Ca 0.20 -0.75 -0.02 0.00 0.48 0.00 0.00 55.95 55.86 1cdm s SER 101 Cb -0.14 -0.73 0.49 0.00 0.10 0.00 0.00 66.02 65.73 1cdm s SER 101 CO 0.07 -0.37 1.77 0.00 0.98 0.00 0.00 173.24 175.69 1cdm h ALA 102 N 1.42 1.23 -0.70 5.32 0.00 -1.92 -0.60 119.26 124.01 1cdm h ALA 102 Ca -0.44 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 1cdm h ALA 102 Cb 1.25 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1cdm h ALA 102 CO 0.62 -0.04 0.25 0.00 0.00 0.00 0.00 179.25 180.08 1cdm h ALA 103 N 1.52 1.12 -0.28 0.00 0.00 -1.98 0.36 119.26 120.01 1cdm h ALA 103 Ca 0.44 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 1cdm h ALA 103 Cb 0.56 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1cdm h ALA 103 CO -0.33 0.62 -0.19 0.93 0.00 0.00 0.00 179.25 180.28 1cdm h GLU 104 N 1.03 0.62 0.02 0.00 5.08 -1.60 -2.41 114.58 117.31 1cdm h GLU 104 Ca 0.23 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1cdm h GLU 104 Cb 0.24 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1cdm h GLU 104 CO -0.01 0.88 -0.01 1.25 -1.00 0.00 0.00 179.01 180.12 1cdm h LEU 105 N 0.35 -0.02 -1.66 1.33 5.85 -0.78 -1.67 115.31 118.71 1cdm h LEU 105 Ca 0.05 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.86 1cdm h LEU 105 Cb 0.73 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.74 1cdm h LEU 105 CO 0.05 -0.01 0.37 -0.09 -0.34 0.00 0.00 178.44 178.43 1cdm h ARG 106 N -0.03 0.39 0.07 1.25 2.43 -0.30 -1.83 114.38 116.37 1cdm h ARG 106 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1cdm h ARG 106 Cb 0.02 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1cdm h ARG 106 CO 0.00 0.26 -0.04 0.45 -1.51 0.00 0.00 179.97 179.13 1cdm h HIS 107 N 0.40 -0.09 -0.40 2.20 3.86 -0.79 -2.05 115.15 118.28 1cdm h HIS 107 Ca 0.25 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.48 1cdm h HIS 107 Cb 0.47 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 1cdm h HIS 107 CO -0.00 0.15 0.24 0.28 0.86 0.00 0.00 177.93 179.46 1cdm h VAL 108 N -0.33 1.05 -0.04 2.45 2.07 -0.98 -0.86 116.25 119.62 1cdm h VAL 108 Ca -0.01 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1cdm h VAL 108 Cb 0.28 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1cdm h VAL 108 CO 0.02 0.09 -0.14 0.24 0.02 0.00 0.00 177.57 177.80 1cdm h MET 109 N 0.49 -0.20 -0.68 1.57 2.07 -1.32 0.45 114.93 117.30 1cdm h MET 109 Ca 0.16 0.01 0.01 0.00 -2.07 0.00 0.00 59.70 57.81 1cdm h MET 109 Cb -0.01 0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.74 1cdm h MET 109 CO -0.07 -0.13 0.45 1.15 1.07 0.00 0.00 176.91 179.38 1cdm h THR 110 N -0.21 1.17 -0.23 2.22 2.02 -1.21 0.11 112.91 116.79 1cdm h THR 110 Ca 0.06 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1cdm h THR 110 Cb 0.29 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 1cdm h THR 110 CO -0.16 0.17 0.01 -1.13 0.37 0.00 0.00 175.52 174.77 1cdm h ASN 111 N 0.92 0.31 -0.07 4.18 -1.24 0.03 0.31 115.58 120.02 1cdm h ASN 111 Ca 0.25 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.22 1cdm h ASN 111 Cb -0.10 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 38.87 1cdm h ASN 111 CO -0.06 0.36 0.00 0.18 -1.29 0.00 0.00 177.43 176.62 1cdm n LEU 112 N -4.36 0.40 0.00 0.34 4.77 0.29 -4.83 117.00 113.61 1cdm n LEU 112 Ca 0.00 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1cdm n LEU 112 Cb 0.19 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1cdm n LEU 112 CO 0.37 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1cdm n GLY 113 N 0.63 2.12 3.73 -0.72 0.00 0.11 -4.99 105.19 106.08 1cdm n GLY 113 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1cdm n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cdm s GLU 114 N -0.23 4.42 -0.29 1.61 2.02 -0.54 -4.93 118.70 120.76 1cdm s GLU 114 Ca 0.00 1.97 -0.01 0.00 0.02 0.00 0.00 54.97 56.95 1cdm s GLU 114 Cb 0.00 -3.23 0.05 0.00 0.10 0.00 0.00 34.13 31.05 1cdm s GLU 114 CO 0.00 -0.21 -0.02 0.15 0.02 0.00 0.00 175.26 175.21 1cdm s LYS 115 N 0.03 2.40 0.13 1.61 -0.14 -1.26 -3.22 119.74 119.29 1cdm s LYS 115 Ca 0.56 -1.28 0.01 0.00 -1.36 0.00 0.00 55.97 53.90 1cdm s LYS 115 Cb -0.34 -3.13 -0.04 0.00 -1.68 0.00 0.00 37.83 32.63 1cdm s LYS 115 CO 0.36 -0.61 -0.00 -0.48 -0.76 0.00 0.00 175.35 173.86 1cdm s LEU 116 N 1.23 2.17 0.31 3.17 0.05 -1.26 -5.13 118.68 119.22 1cdm s LEU 116 Ca -0.06 -1.12 -0.20 0.00 0.05 0.00 0.00 54.13 52.80 1cdm s LEU 116 Cb -0.20 0.06 -0.09 0.00 -2.05 0.00 0.00 46.19 43.91 1cdm s LEU 116 CO -0.02 -0.59 0.82 -0.89 -0.55 0.00 0.00 176.35 175.13 1cdm s THR 117 N -3.78 4.48 0.41 5.48 2.01 -1.26 -4.94 115.64 118.05 1cdm s THR 117 Ca 0.19 1.36 0.15 0.00 0.31 0.00 0.00 61.69 63.70 1cdm s THR 117 Cb 0.06 -3.78 0.36 0.00 0.01 0.00 0.00 72.50 69.15 1cdm s THR 117 CO -0.00 -0.00 1.89 0.44 -0.69 0.00 0.00 174.62 176.25 1cdm h ASP 118 N 2.79 0.45 -0.39 3.53 5.19 -2.01 0.47 116.42 126.45 1cdm h ASP 118 Ca -0.48 0.03 0.02 0.00 -0.62 0.00 0.00 57.03 55.99 1cdm h ASP 118 Cb 1.19 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 40.61 1cdm h ASP 118 CO 0.64 0.22 0.21 -0.08 -3.12 0.00 0.00 179.24 177.11 1cdm h GLU 119 N 0.47 0.42 -0.52 3.56 4.57 -1.98 0.98 114.58 122.07 1cdm h GLU 119 Ca 0.42 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.51 1cdm h GLU 119 Cb 0.92 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.40 1cdm h GLU 119 CO -0.16 0.28 0.06 0.93 -1.18 0.00 0.00 179.01 178.95 1cdm h GLU 120 N 0.43 0.88 -0.53 1.92 5.08 -0.51 -0.03 114.58 121.82 1cdm h GLU 120 Ca 0.16 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1cdm h GLU 120 Cb 0.04 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1cdm h GLU 120 CO -0.09 0.88 0.24 0.28 -1.00 0.00 0.00 179.01 179.31 1cdm h VAL 121 N 0.76 1.19 -0.35 3.13 2.07 -0.85 -0.66 116.25 121.53 1cdm h VAL 121 Ca 0.16 -0.55 -0.13 0.00 0.82 0.00 0.00 66.70 66.99 1cdm h VAL 121 Cb 0.44 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1cdm h VAL 121 CO 0.01 0.22 -0.30 -0.78 0.02 0.00 0.00 177.57 176.74 1cdm h ASP 122 N 0.75 0.87 -0.29 0.57 -0.00 -0.22 -1.94 116.42 116.16 1cdm h ASP 122 Ca 0.19 -0.45 -0.08 0.00 -0.00 0.00 0.00 57.03 56.69 1cdm h ASP 122 Cb 0.11 -0.25 -0.02 0.00 -0.00 0.00 0.00 39.33 39.18 1cdm h ASP 122 CO -0.02 1.15 -0.07 -0.33 -0.00 0.00 0.00 179.24 179.97 1cdm h GLU 123 N 0.61 0.68 -0.34 0.28 5.08 -0.43 -0.89 114.58 119.57 1cdm h GLU 123 Ca 0.06 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 1cdm h GLU 123 Cb 0.88 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1cdm h GLU 123 CO 0.08 0.74 0.10 0.52 -1.00 0.00 0.00 179.01 179.45 1cdm h MET 124 N 0.63 0.53 -0.33 2.33 2.86 -0.97 -0.38 114.93 119.60 1cdm h MET 124 Ca 0.12 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1cdm h MET 124 Cb 0.49 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1cdm h MET 124 CO 0.03 0.57 0.16 0.82 1.06 0.00 0.00 176.91 179.55 1cdm h ILE 125 N 0.39 0.99 -0.67 -1.22 1.08 -1.11 -2.42 117.51 114.55 1cdm h ILE 125 Ca 0.11 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.52 1cdm h ILE 125 Cb 0.27 0.62 -0.04 0.00 -3.07 0.00 0.00 36.82 34.60 1cdm h ILE 125 CO -0.00 0.06 0.44 0.03 -0.69 0.00 0.00 178.15 177.99 1cdm h ARG 126 N 0.34 0.69 -0.73 2.37 3.08 -0.80 0.11 114.38 119.44 1cdm h ARG 126 Ca 0.14 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.09 1cdm h ARG 126 Cb 0.05 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 1cdm h ARG 126 CO -0.09 0.45 0.24 0.93 -1.07 0.00 0.00 179.97 180.43 1cdm h GLU 127 N 0.71 1.11 0.00 0.04 4.39 -0.57 -3.23 114.58 117.03 1cdm h GLU 127 Ca 0.28 -0.22 -0.16 0.00 0.34 0.00 0.00 59.36 59.60 1cdm h GLU 127 Cb 0.21 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.67 1cdm h GLU 127 CO -0.09 0.93 -1.38 0.00 -1.16 0.00 0.00 179.01 177.32 1cdm h ALA 128 N 1.19 0.65 -1.62 3.43 0.00 -1.23 -3.46 119.26 118.23 1cdm h ALA 128 Ca 0.24 -0.82 -0.51 0.00 0.00 0.00 0.00 54.91 53.82 1cdm h ALA 128 Cb 0.27 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1cdm h ALA 128 CO -0.01 0.89 1.43 0.34 0.00 0.00 0.00 179.25 181.90 1cdm s ASP 129 N -5.80 5.15 -0.12 0.00 2.15 0.34 -4.83 116.67 113.56 1cdm s ASP 129 Ca -0.03 0.80 -0.20 0.00 0.43 0.00 0.00 52.55 53.55 1cdm s ASP 129 Cb 0.09 -2.52 -0.18 0.00 -0.30 0.00 0.00 42.92 40.00 1cdm s ASP 129 CO 0.81 -2.38 0.56 0.40 -0.17 0.00 0.00 175.17 174.39 1cdm h ILE 130 N 7.11 1.26 0.00 4.11 2.04 -1.87 -3.36 117.51 126.80 1cdm h ILE 130 Ca -0.28 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 63.67 1cdm h ILE 130 Cb 1.20 2.36 0.00 0.00 -0.74 0.00 0.00 36.82 39.64 1cdm h ILE 130 CO 1.15 0.42 0.00 -0.90 0.00 0.00 0.00 178.15 178.83 1cdm n ASP 131 N -4.67 0.20 -0.49 1.72 3.85 -1.26 -4.95 116.55 110.96 1cdm n ASP 131 Ca -0.07 0.53 -0.04 0.00 -0.71 0.00 0.00 54.79 54.49 1cdm n ASP 131 Cb 0.33 -0.58 -0.00 0.00 -1.35 0.00 0.00 41.12 39.52 1cdm n ASP 131 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1cdm n GLY 132 N 1.10 0.23 0.05 6.12 0.00 -1.26 -4.95 105.19 106.48 1cdm n GLY 132 Ca 0.06 -0.72 0.13 0.00 0.00 0.00 0.00 46.02 45.49 1cdm n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cdm n ASP 133 N 1.18 0.44 0.00 1.61 3.85 -1.26 -4.93 116.55 117.44 1cdm n ASP 133 Ca -0.05 -0.20 0.00 0.00 -0.71 0.00 0.00 54.79 53.83 1cdm n ASP 133 Cb 0.51 0.01 0.00 0.00 -1.35 0.00 0.00 41.12 40.29 1cdm n ASP 133 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1cdm n GLY 134 N 1.45 0.75 3.28 6.12 0.00 -1.26 -5.05 105.19 110.47 1cdm n GLY 134 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 1cdm n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cdm s GLN 135 N -0.84 1.29 -0.27 1.61 -0.21 -1.26 -4.67 119.66 115.31 1cdm s GLN 135 Ca 0.00 -1.58 -0.02 0.00 0.02 0.00 0.00 55.36 53.78 1cdm s GLN 135 Cb 0.00 0.31 0.03 0.00 1.00 0.00 0.00 33.01 34.35 1cdm s GLN 135 CO 0.00 -0.45 -0.03 0.08 -2.12 0.00 0.00 175.29 172.77 1cdm s VAL 136 N -4.09 3.03 0.55 1.09 1.01 -0.50 -4.68 120.40 116.81 1cdm s VAL 136 Ca 0.36 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1cdm s VAL 136 Cb 0.05 -2.59 0.12 0.00 0.00 0.00 0.00 36.38 33.96 1cdm s VAL 136 CO 0.12 0.11 0.75 -0.46 0.00 0.00 0.00 175.10 175.62 1cdm n ASN 137 N 4.68 0.65 -0.10 3.32 0.23 -1.26 -0.43 115.26 122.35 1cdm n ASN 137 Ca -0.15 -1.63 -0.10 0.00 -0.53 0.00 0.00 54.58 52.17 1cdm n ASN 137 Cb 0.46 -0.52 -0.03 0.00 -2.08 0.00 0.00 39.78 37.62 1cdm n ASN 137 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1cdm h TYR 138 N -0.85 0.48 -0.61 -2.53 3.20 -2.00 -1.77 116.97 112.89 1cdm h TYR 138 Ca -0.25 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.57 1cdm h TYR 138 Cb 0.82 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 1cdm h TYR 138 CO 0.00 0.49 0.36 0.93 -1.64 0.00 0.00 178.16 178.31 1cdm h GLU 139 N 0.33 0.83 -0.08 1.82 3.07 -1.95 -0.83 114.58 117.77 1cdm h GLU 139 Ca 0.10 -0.07 -0.16 0.00 -0.50 0.00 0.00 59.36 58.73 1cdm h GLU 139 Cb 0.23 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 1cdm h GLU 139 CO -0.00 0.58 -0.65 0.93 -1.40 0.00 0.00 179.01 178.47 1cdm h GLU 140 N 0.84 0.32 -0.46 2.33 5.08 -1.87 -1.91 114.58 118.92 1cdm h GLU 140 Ca 0.22 -0.23 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1cdm h GLU 140 Cb -0.03 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1cdm h GLU 140 CO -0.04 0.86 -0.07 0.35 -1.00 0.00 0.00 179.01 179.10 1cdm h PHE 141 N 0.23 0.95 0.36 4.33 3.04 -0.39 -2.34 116.94 123.13 1cdm h PHE 141 Ca -0.01 -0.19 -0.02 0.00 3.98 0.00 0.00 57.97 61.73 1cdm h PHE 141 Cb 1.18 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 39.46 1cdm h PHE 141 CO 0.03 0.93 -0.17 0.28 -2.02 0.00 0.00 178.31 177.36 1cdm h VAL 142 N 0.69 0.65 -0.80 1.41 2.07 -1.12 -2.86 116.25 116.30 1cdm h VAL 142 Ca 0.12 -0.29 0.15 0.00 0.82 0.00 0.00 66.70 67.51 1cdm h VAL 142 Cb 0.60 0.80 -0.10 0.00 -1.52 0.00 0.00 31.29 31.07 1cdm h VAL 142 CO 0.04 0.06 0.35 -0.61 0.02 0.00 0.00 177.57 177.42 1cdm h GLN 143 N -0.65 0.47 0.00 1.57 5.75 -1.34 0.70 115.11 121.61 1cdm h GLN 143 Ca -0.05 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 1cdm h GLN 143 Cb 0.47 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.91 1cdm h GLN 143 CO 0.08 0.31 -0.03 0.52 -2.65 0.00 0.00 178.83 177.07 1cdm h MET 144 N 0.49 0.00 -0.02 1.69 2.86 -1.27 -1.54 114.93 117.14 1cdm h MET 144 Ca 0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.09 1cdm h MET 144 Cb 0.69 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.35 1cdm h MET 144 CO -0.41 0.03 -0.13 -1.33 1.06 0.00 0.00 176.91 176.12 1cdm n MET 145 N -3.68 1.69 0.00 1.72 2.81 0.22 -5.11 117.12 114.77 1cdm n MET 145 Ca -0.03 -1.44 0.00 0.00 -1.81 0.00 0.00 57.70 54.43 1cdm n MET 145 Cb 0.12 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 1cdm n MET 145 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73