#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h0d n ASN 3 N 0.00 0.00 -4.66 -2.24 4.05 -1.26 -5.07 115.26 106.09 1h0d n ASN 3 Ca 0.00 0.00 -0.29 0.00 0.45 0.00 0.00 54.58 54.74 1h0d n ASN 3 Cb 0.00 0.00 0.14 0.00 1.23 0.00 0.00 39.78 41.15 1h0d n ASN 3 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1h0d s SER 4 N -1.00 3.58 0.38 1.20 1.04 -1.26 -4.89 113.70 112.75 1h0d s SER 4 Ca 0.00 0.78 0.10 0.00 0.48 0.00 0.00 55.95 57.31 1h0d s SER 4 Cb 0.00 -1.23 0.74 0.00 0.10 0.00 0.00 66.02 65.64 1h0d s SER 4 CO 0.00 -2.49 1.88 0.03 0.98 0.00 0.00 173.24 173.64 1h0d h ARG 5 N -1.46 0.18 -0.41 4.02 3.08 -1.94 -2.08 114.38 115.78 1h0d h ARG 5 Ca -0.48 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.46 1h0d h ARG 5 Cb 1.31 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.33 1h0d h ARG 5 CO 0.58 0.39 0.02 -0.92 -1.07 0.00 0.00 179.97 178.97 1h0d h TYR 6 N 0.17 0.77 -0.40 3.04 3.20 -1.86 -0.02 116.97 121.87 1h0d h TYR 6 Ca 0.03 -0.13 -0.09 0.00 3.14 0.00 0.00 58.73 61.69 1h0d h TYR 6 Cb 0.48 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 1h0d h TYR 6 CO 0.01 0.77 -0.11 1.79 -1.64 0.00 0.00 178.16 178.97 1h0d h THR 7 N 0.54 1.25 -0.38 1.81 1.35 -1.81 -1.98 112.91 113.69 1h0d h THR 7 Ca 0.12 -1.14 -0.11 0.00 -0.55 0.00 0.00 66.41 64.73 1h0d h THR 7 Cb 0.45 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.93 1h0d h THR 7 CO 0.02 0.38 -0.23 0.45 -0.25 0.00 0.00 175.52 175.89 1h0d h HIS 8 N 0.64 0.86 -0.78 4.73 3.86 -1.15 -2.02 115.15 121.29 1h0d h HIS 8 Ca 0.11 -0.20 0.07 0.00 -1.16 0.00 0.00 60.37 59.19 1h0d h HIS 8 Cb 0.57 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.77 1h0d h HIS 8 CO 0.03 0.91 0.46 0.35 0.86 0.00 0.00 177.93 180.54 1h0d h PHE 9 N 0.66 0.84 -0.31 2.45 3.57 -0.43 0.16 116.94 123.88 1h0d h PHE 9 Ca 0.09 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 1h0d h PHE 9 Cb 0.74 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1h0d h PHE 9 CO 0.04 0.40 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.29 1h0d h LEU 10 N 0.82 0.67 -0.84 0.59 4.07 -1.03 0.24 115.31 119.83 1h0d h LEU 10 Ca 0.36 -0.41 -0.12 0.00 0.08 0.00 0.00 57.88 57.79 1h0d h LEU 10 Cb 0.23 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1h0d h LEU 10 CO -0.20 0.93 -0.42 0.71 -1.08 0.00 0.00 178.44 178.39 1h0d h THR 11 N 0.41 1.31 0.00 0.22 1.35 -0.94 -1.97 112.91 113.29 1h0d h THR 11 Ca 0.07 -1.56 -0.22 0.00 -0.55 0.00 0.00 66.41 64.15 1h0d h THR 11 Cb 0.68 1.65 -0.04 0.00 -1.73 0.00 0.00 68.15 68.71 1h0d h THR 11 CO 0.05 0.47 -1.25 1.56 -0.25 0.00 0.00 175.52 176.10 1h0d h GLN 12 N 0.29 0.00 0.00 4.72 4.20 -0.95 -3.42 115.11 119.95 1h0d h GLN 12 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1h0d h GLN 12 Cb 0.86 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.64 1h0d h GLN 12 CO 0.07 0.66 -0.13 0.72 -0.67 0.00 0.00 178.83 179.48 1h0d n HIS 13 N -3.16 0.00 -4.77 2.96 8.25 0.83 -4.78 115.22 114.54 1h0d n HIS 13 Ca -0.07 -0.15 -0.25 0.00 -0.26 0.00 0.00 57.72 56.98 1h0d n HIS 13 Cb 0.94 -0.03 -0.16 0.00 1.12 0.00 0.00 29.99 31.86 1h0d n HIS 13 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1h0d s TYR 14 N -0.37 1.61 -0.31 4.41 5.04 -0.74 0.22 117.35 127.20 1h0d s TYR 14 Ca 0.02 -0.46 0.03 0.00 -2.44 0.00 0.00 57.07 54.23 1h0d s TYR 14 Cb 0.02 -1.09 0.17 0.00 0.35 0.00 0.00 41.96 41.41 1h0d s TYR 14 CO 0.00 -0.16 0.45 0.34 -1.34 0.00 0.00 175.55 174.84 1h0d s ASP 15 N 0.07 0.10 0.08 4.32 2.15 -0.21 -4.79 116.67 118.39 1h0d s ASP 15 Ca -0.04 -0.55 -0.29 0.00 0.43 0.00 0.00 52.55 52.11 1h0d s ASP 15 Cb -0.11 1.21 -0.12 0.00 -0.30 0.00 0.00 42.92 43.59 1h0d s ASP 15 CO 0.02 -0.32 1.45 0.00 -0.17 0.00 0.00 175.17 176.16 1h0d h ALA 16 N 7.87 -0.95 -3.36 3.66 0.00 -1.76 -3.36 119.26 121.37 1h0d h ALA 16 Ca -0.04 -0.10 -0.64 0.00 0.00 0.00 0.00 54.91 54.13 1h0d h ALA 16 Cb 1.12 0.79 -0.41 0.00 0.00 0.00 0.00 17.79 19.30 1h0d h ALA 16 CO 0.23 -1.04 -0.68 0.15 0.00 0.00 0.00 179.25 177.91 1h0d s LYS 17 N -5.27 1.67 0.18 0.00 1.02 -1.26 -2.74 119.74 113.34 1h0d s LYS 17 Ca -0.14 -2.26 -0.30 0.00 0.02 0.00 0.00 55.97 53.29 1h0d s LYS 17 Cb 0.05 -3.03 -0.08 0.00 -0.52 0.00 0.00 37.83 34.25 1h0d s LYS 17 CO 0.50 -1.08 1.06 -2.14 -0.92 0.00 0.00 175.35 172.77 1h0d s PRO 18 N 0.18 4.64 -0.99 -1.68 0.02 -1.26 -4.95 135.00 130.96 1h0d s PRO 18 Ca 0.15 1.66 -0.04 0.00 0.02 0.00 0.00 61.00 62.80 1h0d s PRO 18 Cb -0.24 -3.29 0.16 0.00 0.02 0.00 0.00 34.50 31.16 1h0d s PRO 18 CO -0.03 0.14 2.35 1.04 -0.33 0.00 0.00 177.00 180.18 1h0d n GLN 19 N 2.29 4.01 0.00 5.54 1.13 -1.26 -4.81 117.38 124.28 1h0d n GLN 19 Ca 0.02 -3.40 0.00 0.00 -1.94 0.00 0.00 57.00 51.68 1h0d n GLN 19 Cb 0.47 -2.44 0.00 0.00 0.11 0.00 0.00 30.24 28.38 1h0d n GLN 19 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1h0d n GLY 20 N 0.95 3.28 1.81 1.08 0.00 -1.26 -5.00 105.19 106.05 1h0d n GLY 20 Ca 0.55 -1.40 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 1h0d n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h0d n ARG 21 N 0.74 3.02 -0.58 1.61 1.74 -1.26 -4.63 116.66 117.30 1h0d n ARG 21 Ca 0.00 -3.81 0.00 0.00 -0.77 0.00 0.00 57.85 53.27 1h0d n ARG 21 Cb 0.00 -2.15 0.00 0.00 -1.02 0.00 0.00 32.46 29.29 1h0d n ARG 21 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1h0d n ASP 22 N -0.84 0.00 0.10 0.55 5.75 -1.26 -4.70 116.55 116.15 1h0d n ASP 22 Ca 0.43 -0.91 0.03 0.00 -0.01 0.00 0.00 54.79 54.33 1h0d n ASP 22 Cb 0.90 0.00 0.43 0.00 -1.03 0.00 0.00 41.12 41.42 1h0d n ASP 22 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1h0d h ASP 23 N 0.00 0.28 -0.65 -1.12 3.32 -1.91 -1.84 116.42 114.51 1h0d h ASP 23 Ca 0.00 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 1h0d h ASP 23 Cb 0.00 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 1h0d h ASP 23 CO 0.00 0.33 0.18 0.03 -1.72 0.00 0.00 179.24 178.07 1h0d h ARG 24 N 0.30 1.04 -0.54 3.56 3.08 -1.94 -1.93 114.38 117.96 1h0d h ARG 24 Ca 0.07 -0.23 0.07 0.00 0.07 0.00 0.00 59.98 59.96 1h0d h ARG 24 Cb 0.21 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 1h0d h ARG 24 CO 0.00 0.91 0.23 -0.92 -1.07 0.00 0.00 179.97 179.12 1h0d h TYR 25 N 1.00 0.41 -0.48 3.04 3.20 -1.60 -1.40 116.97 121.15 1h0d h TYR 25 Ca 0.21 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 1h0d h TYR 25 Cb 0.32 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 1h0d h TYR 25 CO 0.02 0.16 0.09 0.00 -1.64 0.00 0.00 178.16 176.79 1h0d h GLU 27 N 0.66 0.86 0.11 0.00 4.39 -0.83 -1.92 114.58 117.85 1h0d h GLU 27 Ca 0.15 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.79 1h0d h GLU 27 Cb 0.37 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1h0d h GLU 27 CO 0.01 0.57 -0.05 1.03 -1.16 0.00 0.00 179.01 179.40 1h0d h SER 28 N 0.88 -0.12 -0.77 1.42 0.87 -1.00 -3.26 113.55 111.57 1h0d h SER 28 Ca 0.39 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 1h0d h SER 28 Cb 0.27 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 1h0d h SER 28 CO -0.21 0.48 0.45 -0.29 -0.53 0.00 0.00 176.83 176.73 1h0d h ILE 29 N -0.83 1.22 -0.76 2.23 6.09 -0.80 -0.65 117.51 124.02 1h0d h ILE 29 Ca -0.02 -0.51 0.01 0.00 -1.37 0.00 0.00 64.86 62.98 1h0d h ILE 29 Cb 0.56 0.16 -0.04 0.00 0.47 0.00 0.00 36.82 37.98 1h0d h ILE 29 CO 0.02 0.24 0.50 0.24 -3.07 0.00 0.00 178.15 176.08 1h0d h MET 30 N 1.06 0.99 -0.08 2.19 2.86 -1.50 -0.64 114.93 119.81 1h0d h MET 30 Ca 0.28 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.79 1h0d h MET 30 Cb -0.02 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.42 1h0d h MET 30 CO -0.05 0.65 -0.20 -0.09 1.06 0.00 0.00 176.91 178.28 1h0d h ARG 31 N 1.02 0.27 -0.83 1.72 2.43 -1.48 -0.02 114.38 117.49 1h0d h ARG 31 Ca 0.28 -0.19 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1h0d h ARG 31 Cb -0.11 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.43 1h0d h ARG 31 CO -0.06 0.80 0.54 0.00 -1.51 0.00 0.00 179.97 179.74 1h0d h ARG 32 N -0.21 1.10 -0.48 0.20 3.08 -0.60 -2.00 114.38 115.48 1h0d h ARG 32 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1h0d h ARG 32 Cb 0.81 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1h0d h ARG 32 CO 0.04 0.73 0.00 0.54 -1.07 0.00 0.00 179.97 180.22 1h0d n ARG 33 N -4.40 1.99 -3.02 0.04 5.12 -0.30 -4.91 116.66 111.17 1h0d n ARG 33 Ca 0.09 -1.15 -0.17 0.00 -1.93 0.00 0.00 57.85 54.70 1h0d n ARG 33 Cb 0.03 -1.42 0.04 0.00 -1.16 0.00 0.00 32.46 29.95 1h0d n ARG 33 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1h0d n GLY 34 N 0.74 -0.19 1.38 -0.13 0.00 -0.75 -4.94 105.19 101.31 1h0d n GLY 34 Ca 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 1h0d n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h0d n LEU 35 N -3.38 4.79 -0.28 0.99 4.77 -0.02 -4.53 117.00 119.34 1h0d n LEU 35 Ca -0.05 -3.33 0.03 0.00 -0.03 0.00 0.00 56.01 52.63 1h0d n LEU 35 Cb 0.57 -0.65 0.04 0.00 -2.33 0.00 0.00 43.42 41.05 1h0d n LEU 35 CO 0.40 0.90 0.41 0.35 -1.33 0.00 0.00 177.39 178.13 1h0d n THR 36 N -0.61 0.28 -3.90 -5.08 -2.24 -1.24 -1.92 114.28 99.56 1h0d n THR 36 Ca 0.33 -0.64 -0.29 0.00 -2.27 0.00 0.00 64.05 61.18 1h0d n THR 36 Cb 1.13 0.95 -0.13 0.00 -2.10 0.00 0.00 70.33 70.18 1h0d n THR 36 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1h0d s SER 37 N -0.65 4.43 1.03 3.42 0.15 -1.26 -2.21 113.70 118.60 1h0d s SER 37 Ca 0.09 -3.34 -0.14 0.00 0.70 0.00 0.00 55.95 53.25 1h0d s SER 37 Cb 0.06 -1.58 0.20 0.00 -1.71 0.00 0.00 66.02 62.98 1h0d s SER 37 CO 0.08 -0.17 1.09 -0.81 1.20 0.00 0.00 173.24 174.63 1h0d n PRO 38 N 2.66 -1.31 -1.87 5.44 -0.04 -1.26 -5.05 135.00 133.57 1h0d n PRO 38 Ca 0.12 -1.69 -0.42 0.00 -0.04 0.00 0.00 63.50 61.46 1h0d n PRO 38 Cb 0.34 -1.18 -0.03 0.00 -0.04 0.00 0.00 33.50 32.59 1h0d n PRO 38 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h0d s LYS 40 N 4.78 4.43 0.23 0.00 2.20 -0.81 -4.95 119.74 125.62 1h0d s LYS 40 Ca 0.82 2.06 -0.05 0.00 -0.36 0.00 0.00 55.97 58.45 1h0d s LYS 40 Cb -0.34 -3.14 0.24 0.00 -1.51 0.00 0.00 37.83 33.08 1h0d s LYS 40 CO 0.34 -0.12 1.74 0.38 -0.36 0.00 0.00 175.35 177.33 1h0d h ASP 41 N 4.22 0.91 -4.61 1.43 2.03 -1.93 -3.41 116.42 115.07 1h0d h ASP 41 Ca -0.47 -0.21 -0.08 0.00 -0.73 0.00 0.00 57.03 55.55 1h0d h ASP 41 Cb 1.22 -0.24 -0.20 0.00 -0.83 0.00 0.00 39.33 39.27 1h0d h ASP 41 CO 0.70 0.92 0.02 -0.51 -1.03 0.00 0.00 179.24 179.34 1h0d s ILE 42 N -5.14 0.01 -0.27 4.15 2.07 -1.26 -1.43 121.20 119.33 1h0d s ILE 42 Ca -0.11 -0.10 -0.11 0.00 -1.41 0.00 0.00 60.65 58.92 1h0d s ILE 42 Cb 0.15 -0.86 0.10 0.00 0.13 0.00 0.00 42.46 41.98 1h0d s ILE 42 CO 0.83 -0.05 0.61 0.21 -1.91 0.00 0.00 174.94 174.63 1h0d s ASN 43 N -0.65 -0.93 -0.15 4.50 2.47 -0.61 -5.01 114.94 114.56 1h0d s ASN 43 Ca -0.07 1.43 -0.06 0.00 0.42 0.00 0.00 52.86 54.58 1h0d s ASN 43 Cb -0.03 1.80 -0.04 0.00 -1.45 0.00 0.00 41.25 41.53 1h0d s ASN 43 CO 0.05 -0.23 0.06 -0.89 -3.72 0.00 0.00 177.10 172.38 1h0d s THR 44 N 2.38 4.83 -0.11 -5.21 2.01 -1.26 -1.54 115.64 116.74 1h0d s THR 44 Ca -0.07 -0.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.88 1h0d s THR 44 Cb -0.10 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 1h0d s THR 44 CO -0.18 0.52 -0.05 -0.36 -0.69 0.00 0.00 174.62 173.86 1h0d s PHE 45 N -0.14 3.00 -0.10 4.92 0.08 -0.19 -4.50 117.98 121.05 1h0d s PHE 45 Ca 0.07 -0.14 -0.10 0.00 0.12 0.00 0.00 56.93 56.88 1h0d s PHE 45 Cb -0.12 -1.84 -0.05 0.00 -0.57 0.00 0.00 43.02 40.44 1h0d s PHE 45 CO 0.01 0.15 0.22 0.42 -0.10 0.00 0.00 175.22 175.91 1h0d s ILE 46 N -0.20 5.37 0.51 0.64 1.01 0.13 -1.77 121.20 126.88 1h0d s ILE 46 Ca 0.03 0.39 0.06 0.00 0.00 0.00 0.00 60.65 61.13 1h0d s ILE 46 Cb -0.13 -3.50 0.02 0.00 0.01 0.00 0.00 42.46 38.86 1h0d s ILE 46 CO 0.02 0.58 0.41 -1.00 0.00 0.00 0.00 174.94 174.95 1h0d s HIS 47 N -0.80 1.94 0.00 3.97 3.76 -0.18 -1.05 115.29 122.93 1h0d s HIS 47 Ca 0.17 -0.73 0.00 0.00 -0.15 0.00 0.00 55.06 54.34 1h0d s HIS 47 Cb -0.13 -2.00 0.00 0.00 1.11 0.00 0.00 32.58 31.56 1h0d s HIS 47 CO 0.06 -0.39 0.00 0.41 -0.85 0.00 0.00 174.74 173.96 1h0d n GLY 48 N -1.71 -1.81 3.86 -2.22 0.00 -1.11 -4.63 105.19 97.57 1h0d n GLY 48 Ca 0.01 -1.79 -0.31 0.00 0.00 0.00 0.00 46.02 43.93 1h0d n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h0d s ASN 49 N -4.00 6.53 0.18 1.61 2.20 -1.26 -4.35 114.94 115.84 1h0d s ASN 49 Ca 0.00 1.34 -0.08 0.00 -0.94 0.00 0.00 52.86 53.19 1h0d s ASN 49 Cb 0.00 -2.42 0.08 0.00 -2.00 0.00 0.00 41.25 36.91 1h0d s ASN 49 CO 0.00 -0.54 1.59 0.11 -2.94 0.00 0.00 177.10 175.32 1h0d h LYS 50 N 0.90 0.93 -0.31 3.55 1.57 -2.00 -3.17 116.57 118.04 1h0d h LYS 50 Ca -0.47 -0.38 0.07 0.00 -1.87 0.00 0.00 60.65 58.00 1h0d h LYS 50 Cb 1.19 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.44 1h0d h LYS 50 CO 0.62 1.04 0.22 0.07 -0.57 0.00 0.00 179.45 180.83 1h0d h ARG 51 N 0.81 0.11 -0.07 3.15 0.11 -1.99 -0.42 114.38 116.08 1h0d h ARG 51 Ca 0.11 -0.01 -0.11 0.00 0.10 0.00 0.00 59.98 60.08 1h0d h ARG 51 Cb 0.76 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.80 1h0d h ARG 51 CO 0.06 0.07 -0.44 0.77 0.10 0.00 0.00 179.97 180.53 1h0d h SER 52 N 0.11 0.17 -0.00 0.08 0.02 -1.97 -0.68 113.55 111.28 1h0d h SER 52 Ca 0.14 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1h0d h SER 52 Cb 0.43 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1h0d h SER 52 CO -0.02 0.59 -0.02 0.40 -1.14 0.00 0.00 176.83 176.65 1h0d h ILE 53 N 0.13 1.63 -0.74 3.27 2.04 -1.25 -3.23 117.51 119.35 1h0d h ILE 53 Ca 0.01 -1.87 0.13 0.00 1.00 0.00 0.00 64.86 64.13 1h0d h ILE 53 Cb 0.84 2.89 -0.05 0.00 -0.74 0.00 0.00 36.82 39.76 1h0d h ILE 53 CO 0.06 0.49 0.49 0.11 0.00 0.00 0.00 178.15 179.31 1h0d h LYS 54 N -0.77 0.48 0.00 2.37 1.57 -1.07 -0.47 116.57 118.67 1h0d h LYS 54 Ca -0.00 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1h0d h LYS 54 Cb 0.81 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 1h0d h LYS 54 CO 0.00 0.32 -0.03 0.00 -0.57 0.00 0.00 179.45 179.17 1h0d h ALA 55 N 1.64 1.63 -0.30 3.86 0.00 -1.13 -1.49 119.26 123.47 1h0d h ALA 55 Ca 0.36 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1h0d h ALA 55 Cb 0.71 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 1h0d h ALA 55 CO -0.12 0.04 0.20 0.82 0.00 0.00 0.00 179.25 180.18 1h0d h ILE 56 N 0.00 1.04 -0.01 0.00 2.04 -1.14 -2.98 117.51 116.47 1h0d h ILE 56 Ca -0.00 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1h0d h ILE 56 Cb 0.07 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1h0d h ILE 56 CO 0.00 0.06 -0.54 0.00 0.00 0.00 0.00 178.15 177.68 1h0d n GLU 58 N -0.63 0.78 -4.40 0.00 0.28 -1.13 -4.14 120.64 111.40 1h0d n GLU 58 Ca 0.08 0.30 -0.20 0.00 -0.16 0.00 0.00 57.16 57.19 1h0d n GLU 58 Cb 0.40 -2.06 -0.10 0.00 1.43 0.00 0.00 31.44 31.11 1h0d n GLU 58 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1h0d s ASN 59 N -1.25 2.78 0.10 -1.84 0.02 -1.26 -4.99 114.94 108.50 1h0d s ASN 59 Ca 0.75 -1.09 -0.27 0.00 -1.02 0.00 0.00 52.86 51.23 1h0d s ASN 59 Cb -0.42 -0.17 -0.10 0.00 0.02 0.00 0.00 41.25 40.58 1h0d s ASN 59 CO 0.48 -0.22 1.66 0.07 0.02 0.00 0.00 177.10 179.11 1h0d h LYS 60 N 2.40 -0.41 0.00 -0.60 5.09 -2.00 -3.46 116.57 117.59 1h0d h LYS 60 Ca -0.39 0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.38 1h0d h LYS 60 Cb 1.23 0.09 0.00 0.00 0.10 0.00 0.00 32.23 33.65 1h0d h LYS 60 CO 0.64 -0.28 0.00 0.27 -2.09 0.00 0.00 179.45 177.99 1h0d n ASN 61 N -5.34 1.43 -0.82 7.07 0.23 -1.26 -5.07 115.26 111.50 1h0d n ASN 61 Ca -0.07 -0.56 0.07 0.00 -0.53 0.00 0.00 54.58 53.49 1h0d n ASN 61 Cb 0.25 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.16 1h0d n ASN 61 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1h0d n GLY 62 N 3.58 3.16 3.69 4.83 0.00 -1.26 -5.00 105.19 114.19 1h0d n GLY 62 Ca 0.00 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 1h0d n GLY 62 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h0d s ASN 63 N -1.28 6.46 0.06 1.61 0.02 -1.26 -4.86 114.94 115.68 1h0d s ASN 63 Ca 0.32 2.70 -0.37 0.00 -1.02 0.00 0.00 52.86 54.49 1h0d s ASN 63 Cb 0.21 -2.56 -0.17 0.00 0.02 0.00 0.00 41.25 38.74 1h0d s ASN 63 CO 0.15 -0.98 1.29 -2.65 0.02 0.00 0.00 177.10 174.93 1h0d n PRO 64 N 5.74 0.92 -4.01 -0.60 -0.02 -1.26 -4.99 135.00 130.77 1h0d n PRO 64 Ca 0.17 0.33 -0.08 0.00 -2.02 0.00 0.00 63.50 61.90 1h0d n PRO 64 Cb 0.39 -1.95 -0.11 0.00 -0.02 0.00 0.00 33.50 31.81 1h0d n PRO 64 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1h0d s HIS 65 N 0.43 0.33 0.80 6.00 3.76 -1.26 -5.15 115.29 120.20 1h0d s HIS 65 Ca 0.86 -0.67 -0.13 0.00 -0.15 0.00 0.00 55.06 54.97 1h0d s HIS 65 Cb -1.02 -0.24 0.08 0.00 1.11 0.00 0.00 32.58 32.51 1h0d s HIS 65 CO 0.49 -0.25 1.16 -0.98 -0.85 0.00 0.00 174.74 174.32 1h0d s ARG 66 N -2.15 1.79 0.44 1.40 1.70 -1.26 -4.67 118.95 116.20 1h0d s ARG 66 Ca -0.10 1.57 -0.24 0.00 -0.47 0.00 0.00 55.73 56.49 1h0d s ARG 66 Cb -0.05 -1.81 -0.08 0.00 -0.57 0.00 0.00 34.95 32.44 1h0d s ARG 66 CO -0.03 -2.06 1.25 -2.00 -1.08 0.00 0.00 175.30 171.37 1h0d s GLU 67 N -4.34 3.82 0.10 3.89 2.12 -1.26 -4.91 118.70 118.11 1h0d s GLU 67 Ca 0.69 2.01 -0.06 0.00 0.36 0.00 0.00 54.97 57.97 1h0d s GLU 67 Cb -0.25 -2.58 -0.02 0.00 0.26 0.00 0.00 34.13 31.54 1h0d s GLU 67 CO 0.51 -0.57 0.14 0.54 -0.54 0.00 0.00 175.26 175.34 1h0d s ASN 68 N -1.00 0.22 -0.05 -1.70 4.22 -0.72 -4.95 114.94 110.96 1h0d s ASN 68 Ca 0.61 -0.83 -0.17 0.00 -2.14 0.00 0.00 52.86 50.33 1h0d s ASN 68 Cb -0.35 0.32 -0.05 0.00 1.28 0.00 0.00 41.25 42.45 1h0d s ASN 68 CO 0.43 -0.72 0.47 -0.76 -2.04 0.00 0.00 177.10 174.48 1h0d s LEU 69 N -2.91 4.38 0.01 3.54 1.43 -1.26 -0.34 118.68 123.53 1h0d s LEU 69 Ca 0.09 0.94 0.02 0.00 -1.03 0.00 0.00 54.13 54.15 1h0d s LEU 69 Cb 0.06 -2.70 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 1h0d s LEU 69 CO -0.08 0.15 -0.05 -0.13 0.23 0.00 0.00 176.35 176.47 1h0d s ARG 70 N -0.22 0.40 -0.27 1.70 0.52 -0.45 -4.98 118.95 115.64 1h0d s ARG 70 Ca 0.26 -0.32 -0.10 0.00 -0.52 0.00 0.00 55.73 55.04 1h0d s ARG 70 Cb -0.16 -0.32 -0.05 0.00 0.52 0.00 0.00 34.95 34.94 1h0d s ARG 70 CO 0.13 0.08 0.17 0.42 0.02 0.00 0.00 175.30 176.12 1h0d s ILE 71 N -0.47 5.18 0.63 1.52 1.01 -1.26 -1.94 121.20 125.87 1h0d s ILE 71 Ca -0.02 0.12 -0.19 0.00 0.00 0.00 0.00 60.65 60.57 1h0d s ILE 71 Cb -0.04 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 1h0d s ILE 71 CO -0.00 0.27 1.31 -1.54 0.00 0.00 0.00 174.94 174.98 1h0d n SER 72 N 4.98 2.19 -0.03 3.58 3.41 -0.48 -4.95 113.62 122.32 1h0d n SER 72 Ca -0.14 0.85 -0.16 0.00 -0.26 0.00 0.00 58.87 59.16 1h0d n SER 72 Cb 0.52 -1.56 -0.09 0.00 -0.26 0.00 0.00 64.21 62.82 1h0d n SER 72 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1h0d h LYS 73 N 0.68 0.45 -6.50 4.33 1.57 -1.95 -3.43 116.57 111.71 1h0d h LYS 73 Ca -0.51 -0.37 -0.43 0.00 -1.87 0.00 0.00 60.65 57.47 1h0d h LYS 73 Cb 1.33 0.08 0.02 0.00 0.08 0.00 0.00 32.23 33.74 1h0d h LYS 73 CO 0.54 1.00 -0.22 -1.54 -0.57 0.00 0.00 179.45 178.66 1h0d s SER 74 N -6.57 5.55 0.34 0.86 1.04 -1.26 -5.03 113.70 108.63 1h0d s SER 74 Ca -0.13 -0.42 -0.01 0.00 0.48 0.00 0.00 55.95 55.86 1h0d s SER 74 Cb 0.05 -0.58 -0.04 0.00 0.10 0.00 0.00 66.02 65.55 1h0d s SER 74 CO 0.81 -0.87 0.57 -0.44 0.98 0.00 0.00 173.24 174.29 1h0d s SER 75 N -4.39 6.33 0.08 7.02 0.01 -1.26 -4.43 113.70 117.06 1h0d s SER 75 Ca 0.56 0.56 0.05 0.00 1.31 0.00 0.00 55.95 58.43 1h0d s SER 75 Cb -0.10 -2.08 -0.03 0.00 0.21 0.00 0.00 66.02 64.02 1h0d s SER 75 CO 0.34 -0.29 -0.14 -0.36 0.41 0.00 0.00 173.24 173.21 1h0d s PHE 76 N -2.28 1.21 -0.24 2.43 0.08 0.96 -4.83 117.98 115.32 1h0d s PHE 76 Ca 0.42 -0.49 -0.25 0.00 0.12 0.00 0.00 56.93 56.73 1h0d s PHE 76 Cb -0.10 -0.67 -0.00 0.00 -0.57 0.00 0.00 43.02 41.67 1h0d s PHE 76 CO 0.35 0.06 0.84 -0.65 -0.10 0.00 0.00 175.22 175.72 1h0d s GLN 77 N -1.95 4.19 0.22 0.44 -1.52 -1.26 -1.20 119.66 118.58 1h0d s GLN 77 Ca -0.00 0.97 0.05 0.00 -1.95 0.00 0.00 55.36 54.43 1h0d s GLN 77 Cb -0.09 -3.64 -0.05 0.00 -0.22 0.00 0.00 33.01 29.01 1h0d s GLN 77 CO 0.02 -0.51 -0.05 0.14 -0.25 0.00 0.00 175.29 174.64 1h0d s VAL 78 N 2.83 1.27 -0.04 1.09 -7.23 -0.15 -1.01 120.40 117.17 1h0d s VAL 78 Ca 0.35 -2.08 -0.02 0.00 -1.81 0.00 0.00 61.98 58.43 1h0d s VAL 78 Cb -0.15 -2.24 0.03 0.00 0.56 0.00 0.00 36.38 34.58 1h0d s VAL 78 CO 0.07 -0.43 0.05 -0.89 -0.31 0.00 0.00 175.10 173.60 1h0d s THR 79 N -3.26 -0.10 -0.22 5.32 2.01 -0.73 -0.82 115.64 117.84 1h0d s THR 79 Ca 0.26 0.38 -0.06 0.00 0.31 0.00 0.00 61.69 62.57 1h0d s THR 79 Cb 0.04 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.39 1h0d s THR 79 CO 0.08 0.16 0.03 -0.89 -0.69 0.00 0.00 174.62 173.31 1h0d s THR 80 N 1.90 4.16 -0.27 -0.82 2.01 -0.32 -1.02 115.64 121.27 1h0d s THR 80 Ca 0.01 -0.23 -0.13 0.00 0.31 0.00 0.00 61.69 61.65 1h0d s THR 80 Cb -0.12 -2.91 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 1h0d s THR 80 CO -0.03 0.40 0.30 0.00 -0.69 0.00 0.00 174.62 174.60 1h0d s LYS 82 N 1.90 3.05 0.39 0.00 1.02 -0.44 -1.57 119.74 124.10 1h0d s LYS 82 Ca 0.12 -0.78 -0.27 0.00 0.02 0.00 0.00 55.97 55.05 1h0d s LYS 82 Cb -0.16 -2.43 -0.10 0.00 -0.52 0.00 0.00 37.83 34.62 1h0d s LYS 82 CO 0.10 0.28 1.45 -1.17 -0.92 0.00 0.00 175.35 175.09 1h0d s LEU 83 N 0.15 4.28 -0.05 3.17 2.96 -0.51 -1.80 118.68 126.87 1h0d s LEU 83 Ca -0.10 2.98 0.01 0.00 -0.22 0.00 0.00 54.13 56.81 1h0d s LEU 83 Cb -0.16 -3.73 0.02 0.00 0.50 0.00 0.00 46.19 42.82 1h0d s LEU 83 CO 0.06 -0.91 -0.07 -2.28 -1.32 0.00 0.00 176.35 171.83 1h0d s HIS 84 N -1.14 0.98 0.00 5.38 5.65 -0.09 -4.82 115.29 121.24 1h0d s HIS 84 Ca 0.54 -0.32 0.00 0.00 0.25 0.00 0.00 55.06 55.53 1h0d s HIS 84 Cb -0.45 -0.81 0.00 0.00 -1.18 0.00 0.00 32.58 30.14 1h0d s HIS 84 CO 0.60 -0.24 0.00 0.41 -0.65 0.00 0.00 174.74 174.87 1h0d n GLY 85 N 4.07 0.78 2.23 1.59 0.00 -1.26 -4.39 105.19 108.20 1h0d n GLY 85 Ca -0.23 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.74 1h0d n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h0d n GLY 86 N -2.00 0.77 3.64 -0.02 0.00 -1.26 -4.97 105.19 101.35 1h0d n GLY 86 Ca 0.00 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1h0d n GLY 86 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h0d s SER 87 N -2.71 6.21 0.21 1.61 1.04 -1.26 -4.86 113.70 113.93 1h0d s SER 87 Ca 0.00 2.20 0.23 0.00 0.48 0.00 0.00 55.95 58.86 1h0d s SER 87 Cb 0.00 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 63.65 1h0d s SER 87 CO 0.00 -1.31 1.10 1.55 0.98 0.00 0.00 173.24 175.56 1h0d h PRO 88 N 11.64 0.00 -4.91 4.02 0.13 -1.93 -3.44 132.00 137.51 1h0d h PRO 88 Ca -0.43 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.41 1h0d h PRO 88 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 1h0d h PRO 88 CO 0.96 0.00 -0.71 -1.58 -0.23 0.00 0.00 178.00 176.44 1h0d s TRP 89 N -3.34 1.11 0.45 1.56 0.51 -1.26 -1.76 118.94 116.21 1h0d s TRP 89 Ca 0.01 -0.80 -0.22 0.00 -2.12 0.00 0.00 56.10 52.96 1h0d s TRP 89 Cb 0.10 -0.59 -0.11 0.00 -0.81 0.00 0.00 33.47 32.06 1h0d s TRP 89 CO 0.78 -0.01 0.73 -2.30 -0.51 0.00 0.00 176.95 175.64 1h0d n PRO 90 N -0.06 0.84 -2.48 4.98 -0.02 -1.26 -3.96 135.00 133.04 1h0d n PRO 90 Ca -0.12 0.31 -0.43 0.00 -2.02 0.00 0.00 63.50 61.24 1h0d n PRO 90 Cb 0.60 -1.76 -0.02 0.00 -0.02 0.00 0.00 33.50 32.31 1h0d n PRO 90 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1h0d s PRO 91 N -1.87 3.92 0.06 0.52 0.04 -1.26 -5.13 135.00 131.28 1h0d s PRO 91 Ca 0.65 1.13 -0.31 0.00 0.04 0.00 0.00 61.00 62.51 1h0d s PRO 91 Cb -0.56 -3.86 -0.06 0.00 0.04 0.00 0.00 34.50 30.07 1h0d s PRO 91 CO 0.56 -1.11 1.24 0.00 0.04 0.00 0.00 177.00 177.73 1h0d s GLN 93 N 1.25 4.12 0.23 0.00 -1.52 -1.26 -4.95 119.66 117.53 1h0d s GLN 93 Ca 0.60 -0.01 0.05 0.00 -1.95 0.00 0.00 55.36 54.05 1h0d s GLN 93 Cb -0.30 -3.55 -0.05 0.00 -0.22 0.00 0.00 33.01 28.89 1h0d s GLN 93 CO 0.29 -0.02 -0.04 0.71 -0.25 0.00 0.00 175.29 175.98 1h0d s TYR 94 N 1.27 1.64 -0.02 0.91 2.02 -1.26 -0.91 117.35 121.00 1h0d s TYR 94 Ca 0.14 -0.83 0.01 0.00 -0.37 0.00 0.00 57.07 56.02 1h0d s TYR 94 Cb -0.14 -0.93 0.01 0.00 -0.40 0.00 0.00 41.96 40.50 1h0d s TYR 94 CO 0.07 0.08 -0.03 1.03 -1.57 0.00 0.00 175.55 175.13 1h0d s ARG 95 N -3.80 0.39 -0.02 -0.62 0.52 -0.75 -4.85 118.95 109.82 1h0d s ARG 95 Ca 0.27 -0.07 -0.13 0.00 -0.52 0.00 0.00 55.73 55.28 1h0d s ARG 95 Cb 0.05 -0.44 -0.05 0.00 0.52 0.00 0.00 34.95 35.03 1h0d s ARG 95 CO 0.09 -0.00 0.35 0.00 0.02 0.00 0.00 175.30 175.76 1h0d s ALA 96 N 0.37 3.74 -0.22 2.13 0.00 -1.26 -1.32 121.76 125.20 1h0d s ALA 96 Ca -0.04 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.61 1h0d s ALA 96 Cb -0.07 -2.29 0.05 0.00 0.00 0.00 0.00 23.12 20.82 1h0d s ALA 96 CO -0.01 0.52 -0.07 0.99 0.00 0.00 0.00 175.76 177.19 1h0d s THR 97 N -1.10 1.57 0.31 0.00 2.01 -0.06 -4.79 115.64 113.57 1h0d s THR 97 Ca 0.23 -1.15 -0.16 0.00 0.31 0.00 0.00 61.69 60.92 1h0d s THR 97 Cb -0.15 -1.77 -0.09 0.00 0.01 0.00 0.00 72.50 70.50 1h0d s THR 97 CO 0.12 -0.01 0.74 0.00 -0.69 0.00 0.00 174.62 174.78 1h0d s ALA 98 N 1.39 3.33 0.25 7.40 0.00 -1.26 -1.18 121.76 131.69 1h0d s ALA 98 Ca -0.04 0.07 -0.15 0.00 0.00 0.00 0.00 51.96 51.84 1h0d s ALA 98 Cb -0.18 -2.79 0.00 0.00 0.00 0.00 0.00 23.12 20.16 1h0d s ALA 98 CO -0.07 0.33 0.52 0.20 0.00 0.00 0.00 175.76 176.74 1h0d s GLY 99 N -2.16 0.35 -0.24 0.00 0.00 -0.00 -4.98 107.32 100.30 1h0d s GLY 99 Ca 0.52 -0.71 -0.04 0.00 0.00 0.00 0.00 44.72 44.50 1h0d s GLY 99 CO 0.18 -0.50 0.10 -0.12 0.00 0.00 0.00 173.10 172.77 1h0d s PHE 100 N -3.98 0.43 0.28 1.90 2.19 -1.25 -0.98 117.98 116.57 1h0d s PHE 100 Ca 0.19 -0.72 -0.20 0.00 0.33 0.00 0.00 56.93 56.53 1h0d s PHE 100 Cb -0.02 -0.89 0.06 0.00 -1.31 0.00 0.00 43.02 40.86 1h0d s PHE 100 CO 0.07 -0.69 0.87 -0.98 1.83 0.00 0.00 175.22 176.32 1h0d s ARG 101 N 2.06 1.78 0.66 10.12 1.70 -0.34 -4.81 118.95 130.12 1h0d s ARG 101 Ca 0.06 -1.10 -0.11 0.00 -0.47 0.00 0.00 55.73 54.10 1h0d s ARG 101 Cb -0.16 0.52 -0.01 0.00 -0.57 0.00 0.00 34.95 34.73 1h0d s ARG 101 CO -0.23 -0.83 1.06 0.54 -1.08 0.00 0.00 175.30 174.76 1h0d s ASN 102 N -3.12 5.80 0.12 -2.89 2.20 -1.26 -0.02 114.94 115.77 1h0d s ASN 102 Ca 0.16 1.35 0.07 0.00 -0.94 0.00 0.00 52.86 53.50 1h0d s ASN 102 Cb -0.04 -2.28 -0.04 0.00 -2.00 0.00 0.00 41.25 36.89 1h0d s ASN 102 CO 0.08 -1.14 -0.17 0.68 -2.94 0.00 0.00 177.10 173.61 1h0d s VAL 103 N -3.22 1.54 -0.17 3.54 -7.23 -1.26 -4.91 120.40 108.70 1h0d s VAL 103 Ca 0.57 -1.67 -0.03 0.00 -1.81 0.00 0.00 61.98 59.03 1h0d s VAL 103 Cb -0.12 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 1h0d s VAL 103 CO 0.53 -0.27 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.30 1h0d s VAL 104 N -1.74 3.49 0.07 1.32 1.01 -1.26 -1.38 120.40 121.90 1h0d s VAL 104 Ca 0.09 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1h0d s VAL 104 Cb -0.07 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 1h0d s VAL 104 CO 0.04 0.48 -0.05 0.68 0.00 0.00 0.00 175.10 176.25 1h0d s VAL 105 N 0.68 0.46 0.00 2.92 -7.23 -0.82 -0.98 120.40 115.43 1h0d s VAL 105 Ca -0.04 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.33 1h0d s VAL 105 Cb -0.15 -1.37 -0.05 0.00 0.56 0.00 0.00 36.38 35.37 1h0d s VAL 105 CO 0.02 -0.83 0.34 0.00 -0.31 0.00 0.00 175.10 174.33 1h0d s ALA 106 N -3.26 3.76 -0.02 1.32 0.00 -0.03 -1.33 121.76 122.19 1h0d s ALA 106 Ca 0.05 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 51.69 1h0d s ALA 106 Cb 0.03 -2.24 -0.01 0.00 0.00 0.00 0.00 23.12 20.89 1h0d s ALA 106 CO -0.06 0.55 -0.21 0.00 0.00 0.00 0.00 175.76 176.05 1h0d s GLU 108 N -0.40 0.60 -1.50 0.00 2.12 -0.63 -1.75 118.70 117.14 1h0d s GLU 108 Ca 0.06 0.85 -0.04 0.00 0.36 0.00 0.00 54.97 56.20 1h0d s GLU 108 Cb -0.09 0.21 0.02 0.00 0.26 0.00 0.00 34.13 34.53 1h0d s GLU 108 CO -0.00 -0.11 0.38 0.09 -0.54 0.00 0.00 175.26 175.08 1h0d n ASN 109 N 3.37 -5.39 0.00 -1.70 3.02 -1.26 -1.42 115.26 111.89 1h0d n ASN 109 Ca -0.17 -0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.20 1h0d n ASN 109 Cb 0.56 -4.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.32 1h0d n ASN 109 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h0d n GLY 110 N -1.27 0.60 3.39 7.41 0.00 -1.26 -5.02 105.19 109.05 1h0d n GLY 110 Ca -0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1h0d n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h0d s LEU 111 N 0.00 2.34 0.05 0.99 1.43 -0.50 -4.15 118.68 118.84 1h0d s LEU 111 Ca 0.00 -0.68 -0.30 0.00 -1.03 0.00 0.00 54.13 52.12 1h0d s LEU 111 Cb 0.00 -1.28 -0.05 0.00 0.03 0.00 0.00 46.19 44.89 1h0d s LEU 111 CO 0.00 0.20 1.02 -2.16 0.23 0.00 0.00 176.35 175.64 1h0d s PRO 112 N -1.85 4.58 0.00 1.29 0.04 -1.26 -1.61 135.00 136.19 1h0d s PRO 112 Ca 0.14 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.70 1h0d s PRO 112 Cb -0.10 -3.40 0.02 0.00 0.04 0.00 0.00 34.50 31.05 1h0d s PRO 112 CO 0.06 0.01 0.65 1.33 0.04 0.00 0.00 177.00 179.08 1h0d n VAL 113 N 3.46 0.22 -3.64 -0.36 0.24 -0.42 -4.24 118.33 113.60 1h0d n VAL 113 Ca 0.05 -0.61 -0.05 0.00 -2.04 0.00 0.00 64.34 61.69 1h0d n VAL 113 Cb 0.49 0.91 -0.07 0.00 -1.47 0.00 0.00 33.84 33.71 1h0d n VAL 113 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1h0d s HIS 114 N -0.31 -0.28 -0.12 6.34 5.65 -1.25 -4.76 115.29 120.57 1h0d s HIS 114 Ca 0.02 0.67 -0.05 0.00 0.25 0.00 0.00 55.06 55.95 1h0d s HIS 114 Cb 0.01 0.39 -0.04 0.00 -1.18 0.00 0.00 32.58 31.77 1h0d s HIS 114 CO 0.02 -0.14 0.07 -1.17 -0.65 0.00 0.00 174.74 172.87 1h0d s LEU 115 N 0.29 3.97 -0.99 8.88 2.96 -1.26 -0.85 118.68 131.69 1h0d s LEU 115 Ca 0.03 0.28 -0.22 0.00 -0.22 0.00 0.00 54.13 54.00 1h0d s LEU 115 Cb -0.05 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.76 1h0d s LEU 115 CO -0.11 0.36 1.37 -0.62 -1.32 0.00 0.00 176.35 176.03 1h0d s ASP 116 N -0.75 6.51 0.47 3.68 3.68 -0.16 -4.82 116.67 125.29 1h0d s ASP 116 Ca 0.12 -1.54 0.21 0.00 2.13 0.00 0.00 52.55 53.47 1h0d s ASP 116 Cb -0.12 -2.53 1.15 0.00 -1.45 0.00 0.00 42.92 39.98 1h0d s ASP 116 CO 0.03 -1.42 1.98 -0.61 0.13 0.00 0.00 175.17 175.28 1h0d h GLN 117 N 9.59 0.00 0.00 4.34 5.75 -1.96 -3.15 115.11 129.69 1h0d h GLN 117 Ca 0.17 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.65 1h0d h GLN 117 Cb 1.02 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.56 1h0d h GLN 117 CO 1.35 0.20 -0.08 0.66 -2.65 0.00 0.00 178.83 178.31 1h0d h SER 118 N 0.00 0.00 0.70 -0.69 4.64 -2.00 -2.76 113.55 113.45 1h0d h SER 118 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h0d h SER 118 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1h0d h SER 118 CO 0.03 0.08 0.00 0.16 -0.87 0.00 0.00 176.83 176.23 1h0d h ILE 119 N 0.00 0.00 -0.01 0.95 3.07 -1.97 -2.63 117.51 116.92 1h0d h ILE 119 Ca -0.00 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 66.16 1h0d h ILE 119 Cb 0.17 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 37.71 1h0d h ILE 119 CO 0.01 0.00 -0.07 0.49 -1.05 0.00 0.00 178.15 177.53 1h0d n PHE 120 N -2.36 0.00 -0.24 0.16 3.72 -1.04 -4.06 117.46 113.64 1h0d n PHE 120 Ca 0.02 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1h0d n PHE 120 Cb 0.22 -0.04 0.10 0.00 -0.94 0.00 0.00 39.48 38.82 1h0d n PHE 120 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1h0d h ARG 121 N 1.78 1.09 0.00 -1.08 3.08 -1.63 -3.47 114.38 114.15 1h0d h ARG 121 Ca 0.00 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.83 1h0d h ARG 121 Cb 0.45 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1h0d h ARG 121 CO 0.00 0.92 0.00 0.54 -1.07 0.00 0.00 179.97 180.36 1h0d n ARG 122 N -4.26 0.00 0.00 0.04 1.74 -1.26 -5.19 116.66 107.73 1h0d n ARG 122 Ca 0.06 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.24 1h0d n ARG 122 Cb 0.21 0.00 0.60 0.00 -1.02 0.00 0.00 32.46 32.26 1h0d n ARG 122 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81