#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hde s SER 3 N 0.00 1.53 -0.28 1.61 0.15 -1.26 -5.03 113.70 110.42 2hde s SER 3 Ca 0.00 -0.54 0.09 0.00 0.70 0.00 0.00 55.95 56.19 2hde s SER 3 Cb 0.00 -0.06 0.66 0.00 -1.71 0.00 0.00 66.02 64.91 2hde s SER 3 CO 0.00 -0.05 1.67 1.41 1.20 0.00 0.00 173.24 177.47 2hde n HIS 4 N 1.55 2.16 0.00 3.44 8.25 -1.26 -4.31 115.22 125.05 2hde n HIS 4 Ca -0.20 -1.05 0.00 0.00 -0.26 0.00 0.00 57.72 56.21 2hde n HIS 4 Cb 0.54 -0.62 0.00 0.00 1.12 0.00 0.00 29.99 31.03 2hde n HIS 4 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 2hde n MET 5 N -0.05 0.00 -4.68 -0.41 0.00 -1.26 -5.09 117.12 105.63 2hde n MET 5 Ca 0.35 0.00 -0.30 0.00 -0.00 0.00 0.00 57.70 57.76 2hde n MET 5 Cb 1.26 -0.37 -0.14 0.00 0.00 0.00 0.00 33.22 33.97 2hde n MET 5 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 2hde s ARG 6 N -1.90 1.64 0.58 2.12 6.06 -1.26 -5.15 118.95 121.05 2hde s ARG 6 Ca 0.00 -1.21 0.09 0.00 -2.50 0.00 0.00 55.73 52.11 2hde s ARG 6 Cb 0.00 -1.95 0.09 0.00 0.06 0.00 0.00 34.95 33.15 2hde s ARG 6 CO 0.00 0.49 0.78 0.08 -2.50 0.00 0.00 175.30 174.14 2hde s VAL 7 N -0.92 2.05 0.19 7.11 1.01 -1.26 -4.38 120.40 124.19 2hde s VAL 7 Ca 0.13 -1.04 0.08 0.00 0.00 0.00 0.00 61.98 61.15 2hde s VAL 7 Cb -0.10 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2hde s VAL 7 CO 0.04 0.00 -0.16 0.28 0.00 0.00 0.00 175.10 175.26 2hde s THR 8 N -2.70 1.75 -0.00 3.92 -1.32 -1.26 -5.06 115.64 110.97 2hde s THR 8 Ca 0.60 -2.09 -0.17 0.00 -1.21 0.00 0.00 61.69 58.82 2hde s THR 8 Cb -0.05 -1.95 -0.34 0.00 -1.51 0.00 0.00 72.50 68.65 2hde s THR 8 CO 0.38 -0.50 0.93 1.56 -2.21 0.00 0.00 174.62 174.78 2hde h GLN 9 N 2.83 0.46 -4.88 7.08 7.50 -2.06 -3.43 115.11 122.59 2hde h GLN 9 Ca -0.39 -0.79 -0.67 0.00 0.50 0.00 0.00 58.65 57.30 2hde h GLN 9 Cb 1.22 0.29 -0.29 0.00 0.05 0.00 0.00 27.48 28.75 2hde h GLN 9 CO 0.58 1.38 -0.69 -1.21 -1.50 0.00 0.00 178.83 177.39 2hde s GLU 10 N -2.55 3.06 0.00 1.46 0.41 -1.26 -4.91 118.70 114.92 2hde s GLU 10 Ca -0.11 -0.85 0.00 0.00 -0.41 0.00 0.00 54.97 53.60 2hde s GLU 10 Cb 0.03 -3.15 0.00 0.00 -1.78 0.00 0.00 34.13 29.23 2hde s GLU 10 CO 0.90 -0.37 0.88 -0.85 -0.49 0.00 0.00 175.26 175.33 2hde n GLU 11 N 4.78 0.00 -3.78 1.61 0.28 -1.26 -5.06 120.64 117.22 2hde n GLU 11 Ca -0.16 -0.83 -0.24 0.00 -0.16 0.00 0.00 57.16 55.77 2hde n GLU 11 Cb 0.48 -0.45 -0.17 0.00 1.43 0.00 0.00 31.44 32.73 2hde n GLU 11 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 2hde s ILE 12 N 0.00 0.44 -0.37 3.84 1.01 -1.26 -5.08 121.20 119.77 2hde s ILE 12 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 60.65 60.68 2hde s ILE 12 Cb 0.00 -0.63 0.15 0.00 0.01 0.00 0.00 42.46 41.99 2hde s ILE 12 CO 0.00 0.21 0.25 -0.75 0.00 0.00 0.00 174.94 174.65 2hde s LYS 13 N 1.94 0.66 -0.06 2.79 2.36 -1.26 -5.11 119.74 121.06 2hde s LYS 13 Ca 0.04 -1.57 -0.29 0.00 -2.55 0.00 0.00 55.97 51.61 2hde s LYS 13 Cb -0.13 -1.34 0.06 0.00 -1.05 0.00 0.00 37.83 35.38 2hde s LYS 13 CO -0.06 -1.27 0.64 0.15 1.55 0.00 0.00 175.35 176.36 2hde s LYS 14 N 0.76 0.99 0.31 4.03 -0.14 -1.26 -5.17 119.74 119.26 2hde s LYS 14 Ca 0.23 0.26 -0.08 0.00 -1.36 0.00 0.00 55.97 55.02 2hde s LYS 14 Cb -0.15 0.47 -0.06 0.00 -1.68 0.00 0.00 37.83 36.41 2hde s LYS 14 CO -0.06 -0.30 0.62 -1.21 -0.76 0.00 0.00 175.35 173.65 2hde s GLU 15 N -1.09 3.72 0.61 1.68 8.01 -1.26 -5.07 118.70 125.29 2hde s GLU 15 Ca -0.11 0.21 -0.16 0.00 0.01 0.00 0.00 54.97 54.92 2hde s GLU 15 Cb -0.01 -2.56 -0.03 0.00 -4.31 0.00 0.00 34.13 27.22 2hde s GLU 15 CO 0.09 0.16 1.10 -1.25 0.01 0.00 0.00 175.26 175.36 2hde s PRO 16 N -3.49 3.10 -0.19 0.39 0.04 -1.26 -5.00 135.00 128.59 2hde s PRO 16 Ca 0.47 1.39 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 2hde s PRO 16 Cb -0.11 -1.99 -0.21 0.00 0.04 0.00 0.00 34.50 32.24 2hde s PRO 16 CO 0.28 -1.01 0.13 -1.91 0.04 0.00 0.00 177.00 174.54 2hde n GLU 17 N -2.01 0.66 -3.19 4.56 0.00 -1.26 -4.95 120.64 114.46 2hde n GLU 17 Ca 0.10 0.34 -0.31 0.00 0.00 0.00 0.00 57.16 57.29 2hde n GLU 17 Cb 0.52 -1.66 -0.05 0.00 0.00 0.00 0.00 31.44 30.25 2hde n GLU 17 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2hde s LYS 18 N -2.49 3.82 0.00 5.31 -0.14 -1.26 -5.09 119.74 119.89 2hde s LYS 18 Ca -0.28 0.38 0.00 0.00 -1.36 0.00 0.00 55.97 54.70 2hde s LYS 18 Cb 0.08 -2.53 0.00 0.00 -1.68 0.00 0.00 37.83 33.70 2hde s LYS 18 CO 0.65 0.17 0.00 -0.35 -0.76 0.00 0.00 175.35 175.06 2hde n PRO 19 N -0.63 -0.54 -2.51 -1.68 -0.04 -1.26 -4.97 135.00 123.38 2hde n PRO 19 Ca 0.01 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 2hde n PRO 19 Cb 0.53 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.95 2hde n PRO 19 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2hde s ILE 20 N -0.74 3.94 -0.14 0.52 1.01 -1.26 -4.99 121.20 119.54 2hde s ILE 20 Ca 0.00 1.61 -0.29 0.00 0.00 0.00 0.00 60.65 61.97 2hde s ILE 20 Cb 0.00 -4.03 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 2hde s ILE 20 CO 0.00 0.25 1.21 -1.81 0.00 0.00 0.00 174.94 174.59 2hde s ASP 21 N 0.12 7.00 0.59 3.58 1.11 -1.26 -4.89 116.67 122.91 2hde s ASP 21 Ca 0.51 1.69 0.30 0.00 0.18 0.00 0.00 52.55 55.22 2hde s ASP 21 Cb -0.29 -2.54 1.39 0.00 1.07 0.00 0.00 42.92 42.55 2hde s ASP 21 CO 0.34 -0.69 1.77 0.03 1.18 0.00 0.00 175.17 177.80 2hde h ARG 22 N 7.88 0.00 0.00 8.23 -0.00 -1.94 0.50 114.38 129.05 2hde h ARG 22 Ca -0.28 0.00 -0.39 0.00 -0.50 0.00 0.00 59.98 58.81 2hde h ARG 22 Cb 1.12 0.00 -0.06 0.00 0.00 0.00 0.00 29.97 31.02 2hde h ARG 22 CO 0.94 0.00 -2.37 0.39 0.00 0.00 0.00 179.97 178.94 2hde n GLU 23 N -3.70 0.56 -0.69 0.04 1.02 -1.26 -4.47 120.64 112.13 2hde n GLU 23 Ca 0.14 0.19 -0.13 0.00 -0.02 0.00 0.00 57.16 57.34 2hde n GLU 23 Cb 0.92 -1.43 0.11 0.00 -0.02 0.00 0.00 31.44 31.02 2hde n GLU 23 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2hde n LYS 24 N -3.68 1.79 -1.83 3.49 4.76 -0.87 -4.94 118.16 116.86 2hde n LYS 24 Ca -0.46 -1.72 -0.31 0.00 -2.87 0.00 0.00 58.31 52.96 2hde n LYS 24 Cb 0.89 -1.69 0.03 0.00 -1.84 0.00 0.00 35.03 32.42 2hde n LYS 24 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2hde s THR 25 N -1.89 4.30 -0.12 -0.18 -1.32 0.17 -4.53 115.64 112.07 2hde s THR 25 Ca 0.32 0.75 -0.03 0.00 -1.21 0.00 0.00 61.69 61.51 2hde s THR 25 Cb 0.27 -3.70 -0.03 0.00 -1.51 0.00 0.00 72.50 67.53 2hde s THR 25 CO 0.06 -0.97 0.01 -0.44 -2.21 0.00 0.00 174.62 171.07 2hde s SER 26 N -4.17 5.25 0.33 8.08 0.01 -1.26 -5.03 113.70 116.89 2hde s SER 26 Ca 0.56 0.08 -0.26 0.00 1.31 0.00 0.00 55.95 57.64 2hde s SER 26 Cb -0.11 -1.66 -0.10 0.00 0.21 0.00 0.00 66.02 64.36 2hde s SER 26 CO 0.54 0.29 0.95 -2.16 0.41 0.00 0.00 173.24 173.27 2hde s PRO 27 N -0.37 4.57 0.05 12.44 0.04 -1.26 -4.51 135.00 145.96 2hde s PRO 27 Ca 0.07 1.35 -0.00 0.00 0.04 0.00 0.00 61.00 62.46 2hde s PRO 27 Cb -0.12 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.58 2hde s PRO 27 CO 0.02 0.26 -0.04 -0.48 0.04 0.00 0.00 177.00 176.80 2hde s LEU 28 N -2.06 2.44 -0.09 -3.56 0.05 0.59 -4.91 118.68 111.14 2hde s LEU 28 Ca 0.50 -0.90 -0.30 0.00 0.05 0.00 0.00 54.13 53.49 2hde s LEU 28 Cb -0.19 0.12 -0.02 0.00 -2.05 0.00 0.00 46.19 44.05 2hde s LEU 28 CO 0.24 -0.51 1.12 -0.22 -0.55 0.00 0.00 176.35 176.44 2hde s LEU 29 N -2.64 4.25 0.03 1.48 2.96 -1.26 -2.02 118.68 121.49 2hde s LEU 29 Ca 0.03 1.67 0.06 0.00 -0.22 0.00 0.00 54.13 55.68 2hde s LEU 29 Cb 0.04 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.15 2hde s LEU 29 CO -0.07 -0.55 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.00 2hde s LEU 30 N 2.30 2.15 -0.35 -0.68 1.98 -0.95 -4.58 118.68 118.55 2hde s LEU 30 Ca 0.52 -0.47 -0.13 0.00 -2.89 0.00 0.00 54.13 51.17 2hde s LEU 30 Cb -0.21 -0.85 -0.01 0.00 0.66 0.00 0.00 46.19 45.77 2hde s LEU 30 CO 0.19 0.13 0.24 -0.13 -1.89 0.00 0.00 176.35 174.89 2hde s ARG 31 N -1.04 3.39 -0.04 1.98 0.52 -1.26 -2.62 118.95 119.88 2hde s ARG 31 Ca 0.06 -0.71 0.07 0.00 -0.52 0.00 0.00 55.73 54.62 2hde s ARG 31 Cb -0.08 -3.82 -0.01 0.00 0.52 0.00 0.00 34.95 31.56 2hde s ARG 31 CO 0.01 -0.49 -0.25 0.14 0.02 0.00 0.00 175.30 174.73 2hde s VAL 32 N 1.71 1.99 -0.30 3.52 -7.23 -1.07 -2.78 120.40 116.25 2hde s VAL 32 Ca 0.06 -1.05 -0.08 0.00 -1.81 0.00 0.00 61.98 59.10 2hde s VAL 32 Cb -0.18 -1.67 -0.00 0.00 0.56 0.00 0.00 36.38 35.09 2hde s VAL 32 CO 0.10 0.56 0.12 -0.36 -0.31 0.00 0.00 175.10 175.21 2hde s PHE 33 N -0.30 3.16 -0.15 2.82 0.40 -0.17 -0.37 117.98 123.36 2hde s PHE 33 Ca 0.01 -0.71 -0.01 0.00 -0.60 0.00 0.00 56.93 55.61 2hde s PHE 33 Cb -0.12 -2.30 -0.02 0.00 0.51 0.00 0.00 43.02 41.09 2hde s PHE 33 CO 0.02 -0.49 -0.10 0.95 0.70 0.00 0.00 175.22 176.30 2hde s THR 34 N 1.57 3.26 0.28 0.64 -4.23 -1.08 0.28 115.64 116.37 2hde s THR 34 Ca 0.04 -0.57 0.11 0.00 -1.18 0.00 0.00 61.69 60.08 2hde s THR 34 Cb -0.17 -2.40 -0.05 0.00 1.34 0.00 0.00 72.50 71.22 2hde s THR 34 CO 0.04 0.50 -0.09 0.28 -0.54 0.00 0.00 174.62 174.82 2hde s THR 35 N 0.55 2.96 -0.44 3.99 -1.32 -1.08 -4.75 115.64 115.55 2hde s THR 35 Ca -0.06 -2.13 0.04 0.00 -1.21 0.00 0.00 61.69 58.32 2hde s THR 35 Cb -0.15 -2.61 0.52 0.00 -1.51 0.00 0.00 72.50 68.75 2hde s THR 35 CO 0.03 -0.37 1.69 -3.20 -2.21 0.00 0.00 174.62 170.57 2hde n ASN 36 N -0.78 4.67 0.00 8.08 5.15 -1.25 -0.87 115.26 130.27 2hde n ASN 36 Ca -0.06 -3.74 0.00 0.00 -0.60 0.00 0.00 54.58 50.18 2hde n ASN 36 Cb 0.60 -0.74 0.00 0.00 -0.53 0.00 0.00 39.78 39.11 2hde n ASN 36 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2hde n ASN 37 N -1.01 0.30 -3.66 1.20 2.85 -0.33 -4.54 115.26 110.07 2hde n ASN 37 Ca 0.50 -1.03 -0.21 0.00 -0.11 0.00 0.00 54.58 53.72 2hde n ASN 37 Cb 1.07 0.00 0.05 0.00 1.24 0.00 0.00 39.78 42.14 2hde n ASN 37 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2hde n GLY 38 N -0.02 -0.33 3.06 8.20 0.00 0.31 -4.80 105.19 111.62 2hde n GLY 38 Ca 0.00 0.13 -0.08 0.00 0.00 0.00 0.00 46.02 46.07 2hde n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hde s ARG 39 N -5.90 0.53 -0.06 1.61 1.81 -1.26 -4.92 118.95 110.76 2hde s ARG 39 Ca 0.07 -1.00 0.10 0.00 -1.72 0.00 0.00 55.73 53.17 2hde s ARG 39 Cb -0.03 0.19 0.38 0.00 -0.45 0.00 0.00 34.95 35.04 2hde s ARG 39 CO 0.79 -0.10 1.23 0.72 -0.68 0.00 0.00 175.30 177.26 2hde n HIS 40 N 0.58 0.78 -0.40 -0.53 8.25 -1.26 -4.47 115.22 118.18 2hde n HIS 40 Ca -0.17 -0.31 0.38 0.00 -0.26 0.00 0.00 57.72 57.35 2hde n HIS 40 Cb 0.59 -0.14 0.59 0.00 1.12 0.00 0.00 29.99 32.15 2hde n HIS 40 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2hde h HIS 41 N 2.20 0.00 0.00 4.41 2.07 -2.00 -3.19 115.15 118.64 2hde h HIS 41 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2hde h HIS 41 Cb 0.86 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.84 2hde h HIS 41 CO 0.40 0.00 0.00 -2.13 -3.07 0.00 0.00 177.93 173.13 2hde n ARG 42 N -3.52 0.00 -0.14 5.12 0.00 -1.26 0.46 116.66 117.32 2hde n ARG 42 Ca 0.31 0.00 -0.06 0.00 -0.00 0.00 0.00 57.85 58.10 2hde n ARG 42 Cb 1.70 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 34.11 2hde n ARG 42 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.63 178.15 2hde h MET 43 N 0.00 -0.10 0.00 -0.14 2.86 -1.81 -0.33 114.93 115.41 2hde h MET 43 Ca 0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2hde h MET 43 Cb 0.00 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2hde h MET 43 CO 0.00 -0.07 -0.26 -0.25 1.06 0.00 0.00 176.91 177.40 2hde n ASP 44 N -4.10 0.27 0.07 1.22 9.92 0.17 -4.25 116.55 119.85 2hde n ASP 44 Ca -0.00 0.12 -0.03 0.00 -0.53 0.00 0.00 54.79 54.35 2hde n ASP 44 Cb 0.15 -0.12 -0.01 0.00 -0.64 0.00 0.00 41.12 40.50 2hde n ASP 44 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2hde h GLU 45 N 0.00 -0.18 -2.96 -1.24 4.39 0.03 -3.47 114.58 111.14 2hde h GLU 45 Ca 0.00 0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.56 2hde h GLU 45 Cb 0.51 0.04 -0.26 0.00 -0.10 0.00 0.00 28.75 28.94 2hde h GLU 45 CO 0.00 -0.12 -0.36 -0.59 -1.16 0.00 0.00 179.01 176.77 2hde s PHE 46 N -2.46 -0.36 0.00 4.33 -0.12 -0.28 -5.01 117.98 114.07 2hde s PHE 46 Ca -0.03 0.87 0.00 0.00 -0.05 0.00 0.00 56.93 57.72 2hde s PHE 46 Cb 0.00 0.12 0.00 0.00 -0.63 0.00 0.00 43.02 42.51 2hde s PHE 46 CO 0.08 -0.19 0.00 0.43 -0.05 0.00 0.00 175.22 175.49 2hde n SER 47 N 3.21 0.00 0.15 1.98 7.64 -1.26 -4.63 113.62 120.72 2hde n SER 47 Ca -0.16 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.84 2hde n SER 47 Cb 0.57 0.17 0.54 0.00 -1.01 0.00 0.00 64.21 64.48 2hde n SER 47 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2hde n ARG 48 N -2.36 0.18 -1.33 1.43 5.12 -1.26 -4.85 116.66 113.58 2hde n ARG 48 Ca 0.00 0.53 0.00 0.00 -1.93 0.00 0.00 57.85 56.45 2hde n ARG 48 Cb 0.00 -1.92 0.00 0.00 -1.16 0.00 0.00 32.46 29.38 2hde n ARG 48 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2hde n GLY 49 N -0.59 0.75 2.76 -0.13 0.00 -1.26 -5.00 105.19 101.72 2hde n GLY 49 Ca 0.00 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 2hde n GLY 49 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2hde n ASN 50 N 0.23 7.06 -3.47 1.61 6.94 -1.26 -4.89 115.26 121.48 2hde n ASN 50 Ca 0.00 -3.81 0.02 0.00 -0.02 0.00 0.00 54.58 50.76 2hde n ASN 50 Cb 0.29 -0.95 -0.05 0.00 -2.36 0.00 0.00 39.78 36.71 2hde n ASN 50 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2hde s VAL 51 N -5.11 -0.10 -1.02 3.53 0.11 -1.26 -5.03 120.40 111.52 2hde s VAL 51 Ca 0.53 0.00 0.26 0.00 -2.93 0.00 0.00 61.98 59.84 2hde s VAL 51 Cb 0.44 -1.00 0.23 0.00 -1.53 0.00 0.00 36.38 34.52 2hde s VAL 51 CO -0.33 0.00 1.83 -0.81 -3.33 0.00 0.00 175.10 172.47 2hde n PRO 52 N 3.95 0.02 -0.62 1.54 -0.04 -1.26 -3.18 135.00 135.41 2hde n PRO 52 Ca -0.13 0.05 0.06 0.00 -0.04 0.00 0.00 63.50 63.45 2hde n PRO 52 Cb 0.56 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.83 2hde n PRO 52 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2hde n SER 53 N -1.49 4.40 0.00 3.54 7.64 -1.26 -4.63 113.62 121.81 2hde n SER 53 Ca 0.07 -2.56 0.00 0.00 1.01 0.00 0.00 58.87 57.38 2hde n SER 53 Cb 0.30 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 62.91 2hde n SER 53 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2hde n SER 54 N 0.68 0.00 -4.74 6.43 3.41 -1.19 -4.55 113.62 113.65 2hde n SER 54 Ca 0.22 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.43 2hde n SER 54 Cb 0.89 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.79 2hde n SER 54 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2hde s GLU 55 N 0.00 4.51 0.03 4.33 -1.05 -1.25 -2.62 118.70 122.65 2hde s GLU 55 Ca 0.00 1.10 0.07 0.00 -0.15 0.00 0.00 54.97 56.00 2hde s GLU 55 Cb 0.00 -3.37 -0.02 0.00 -0.44 0.00 0.00 34.13 30.29 2hde s GLU 55 CO 0.00 0.25 -0.21 -0.48 0.95 0.00 0.00 175.26 175.78 2hde s LEU 56 N 0.03 2.14 -0.10 1.83 2.34 0.50 -4.89 118.68 120.53 2hde s LEU 56 Ca 0.40 -0.49 -0.26 0.00 0.06 0.00 0.00 54.13 53.84 2hde s LEU 56 Cb -0.21 -1.00 -0.02 0.00 -0.56 0.00 0.00 46.19 44.40 2hde s LEU 56 CO 0.24 0.18 0.84 -1.10 -1.06 0.00 0.00 176.35 175.45 2hde s GLN 57 N -1.01 4.40 -0.06 1.48 1.11 -1.26 -2.58 119.66 121.73 2hde s GLN 57 Ca 0.08 1.10 -0.00 0.00 0.01 0.00 0.00 55.36 56.54 2hde s GLN 57 Cb -0.09 -3.51 0.02 0.00 -1.01 0.00 0.00 33.01 28.42 2hde s GLN 57 CO 0.01 -0.17 -0.03 0.96 0.01 0.00 0.00 175.29 176.07 2hde s ILE 58 N 1.55 0.52 -1.26 1.08 -4.36 -1.08 -4.96 121.20 112.70 2hde s ILE 58 Ca 0.42 -0.04 -0.17 0.00 -0.26 0.00 0.00 60.65 60.59 2hde s ILE 58 Cb -0.18 -0.60 0.09 0.00 1.25 0.00 0.00 42.46 43.02 2hde s ILE 58 CO 0.17 0.25 1.66 -0.31 0.24 0.00 0.00 174.94 176.96 2hde s TYR 59 N 1.41 2.92 0.44 1.37 2.02 -1.25 -2.24 117.35 122.02 2hde s TYR 59 Ca -0.03 -1.69 0.05 0.00 -0.37 0.00 0.00 57.07 55.02 2hde s TYR 59 Cb -0.13 -4.66 0.05 0.00 -0.40 0.00 0.00 41.96 36.81 2hde s TYR 59 CO -0.03 -1.73 0.41 -2.37 -1.57 0.00 0.00 175.55 170.26 2hde n THR 60 N 6.05 0.00 -4.03 -0.71 5.66 -0.85 -4.58 114.28 115.82 2hde n THR 60 Ca 0.46 -1.69 -0.18 0.00 -3.05 0.00 0.00 64.05 59.59 2hde n THR 60 Cb 0.46 -0.25 -0.16 0.00 -1.55 0.00 0.00 70.33 68.82 2hde n THR 60 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 175.07 170.36 2hde s TRP 61 N -2.09 0.51 0.21 1.09 -2.14 -1.26 -0.30 118.94 114.95 2hde s TRP 61 Ca 0.31 -0.09 0.13 0.00 2.66 0.00 0.00 56.10 59.11 2hde s TRP 61 Cb -0.02 -0.52 0.75 0.00 -3.10 0.00 0.00 33.47 30.58 2hde s TRP 61 CO 0.20 -0.16 0.85 -1.33 -2.66 0.00 0.00 176.95 173.85 2hde n MET 62 N 4.10 -0.03 -1.23 3.25 2.81 -1.26 0.29 117.12 125.05 2hde n MET 62 Ca -0.26 0.73 -0.24 0.00 -1.81 0.00 0.00 57.70 56.12 2hde n MET 62 Cb 0.51 -1.34 0.18 0.00 -0.71 0.00 0.00 33.22 31.85 2hde n MET 62 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2hde n ASP 63 N -4.09 3.92 -4.78 7.83 9.92 -1.26 -1.13 116.55 126.96 2hde n ASP 63 Ca 0.21 -3.62 -0.39 0.00 -0.53 0.00 0.00 54.79 50.46 2hde n ASP 63 Cb 0.74 -0.84 -0.06 0.00 -0.64 0.00 0.00 41.12 40.32 2hde n ASP 63 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2hde s ALA 64 N -3.32 3.45 0.50 2.24 0.00 0.84 -4.73 121.76 120.74 2hde s ALA 64 Ca 0.57 0.34 -0.18 0.00 0.00 0.00 0.00 51.96 52.69 2hde s ALA 64 Cb 0.48 -2.95 -0.08 0.00 0.00 0.00 0.00 23.12 20.57 2hde s ALA 64 CO 0.10 0.28 1.00 0.95 0.00 0.00 0.00 175.76 178.10 2hde s THR 65 N -1.05 4.17 0.52 0.00 -4.23 -1.26 0.08 115.64 113.86 2hde s THR 65 Ca 0.36 1.19 0.35 0.00 -1.18 0.00 0.00 61.69 62.40 2hde s THR 65 Cb -0.23 -3.56 0.54 0.00 1.34 0.00 0.00 72.50 70.60 2hde s THR 65 CO 0.26 -0.45 1.77 -0.07 -0.54 0.00 0.00 174.62 175.58 2hde h LEU 66 N 1.22 0.08 0.03 4.79 -0.00 0.62 0.12 115.31 122.17 2hde h LEU 66 Ca -0.48 0.02 -0.00 0.00 -0.00 0.00 0.00 57.88 57.42 2hde h LEU 66 Cb 1.20 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.87 2hde h LEU 66 CO 0.60 0.00 -0.01 0.07 -0.00 0.00 0.00 178.44 179.10 2hde h LYS 67 N 0.06 -0.04 -0.93 1.13 2.10 -1.73 -2.24 116.57 114.94 2hde h LYS 67 Ca 0.62 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 59.42 2hde h LYS 67 Cb 2.31 0.01 -0.08 0.00 -0.90 0.00 0.00 32.23 33.57 2hde h LYS 67 CO -0.07 0.12 0.59 0.93 -2.00 0.00 0.00 179.45 179.02 2hde h GLU 68 N -0.19 0.73 0.00 0.07 5.08 -1.08 0.35 114.58 119.53 2hde h GLU 68 Ca -0.00 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 2hde h GLU 68 Cb 0.18 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2hde h GLU 68 CO 0.01 0.48 -0.31 -0.07 -1.00 0.00 0.00 179.01 178.12 2hde h LEU 69 N 0.75 0.00 -1.13 1.33 -0.00 -1.34 -1.38 115.31 113.55 2hde h LEU 69 Ca 0.47 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.28 2hde h LEU 69 Cb 0.72 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.36 2hde h LEU 69 CO -0.24 0.31 -0.18 0.74 -0.00 0.00 0.00 178.44 179.07 2hde h THR 70 N 0.00 1.23 0.13 0.22 2.02 0.29 -2.47 112.91 114.34 2hde h THR 70 Ca -0.00 -1.07 -0.23 0.00 0.77 0.00 0.00 66.41 65.88 2hde h THR 70 Cb 0.70 1.27 0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2hde h THR 70 CO 0.04 0.34 -1.11 0.28 0.37 0.00 0.00 175.52 175.44 2hde h SER 71 N 0.36 0.44 -0.47 4.18 0.02 -1.18 -2.96 113.55 113.95 2hde h SER 71 Ca 0.06 -0.90 0.09 0.00 -0.84 0.00 0.00 61.79 60.20 2hde h SER 71 Cb 0.53 -0.14 -0.10 0.00 0.14 0.00 0.00 62.40 62.83 2hde h SER 71 CO 0.03 1.51 -0.35 -0.07 -1.14 0.00 0.00 176.83 176.81 2hde h LEU 72 N -0.33 -1.18 -0.65 5.07 3.38 -1.18 0.45 115.31 120.88 2hde h LEU 72 Ca -0.22 0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2hde h LEU 72 Cb 1.71 0.55 -0.03 0.00 0.09 0.00 0.00 40.66 42.99 2hde h LEU 72 CO 0.11 -0.32 0.25 0.58 0.09 0.00 0.00 178.44 179.15 2hde h VAL 73 N -0.23 1.24 -0.95 1.22 2.07 -1.59 -2.65 116.25 115.35 2hde h VAL 73 Ca 0.19 -0.77 0.07 0.00 0.82 0.00 0.00 66.70 67.00 2hde h VAL 73 Cb 0.55 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2hde h VAL 73 CO -0.59 0.30 0.60 0.11 0.02 0.00 0.00 177.57 178.01 2hde h LYS 74 N 0.92 1.05 0.00 1.57 6.56 -0.73 0.66 116.57 126.60 2hde h LYS 74 Ca 0.22 -0.06 -0.06 0.00 -1.06 0.00 0.00 60.65 59.69 2hde h LYS 74 Cb 0.23 -0.24 -0.01 0.00 -0.57 0.00 0.00 32.23 31.64 2hde h LYS 74 CO -0.02 0.70 -0.27 0.93 -2.06 0.00 0.00 179.45 178.74 2hde h GLU 75 N 1.09 0.00 -0.14 3.15 4.39 0.12 -2.63 114.58 120.55 2hde h GLU 75 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 2hde h GLU 75 Cb 0.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2hde h GLU 75 CO -0.18 0.27 0.00 1.33 -1.16 0.00 0.00 179.01 179.26 2hde n VAL 76 N -3.70 0.18 -3.47 3.13 0.24 -0.17 -4.87 118.33 109.67 2hde n VAL 76 Ca -0.01 -0.59 -0.12 0.00 -2.04 0.00 0.00 64.34 61.58 2hde n VAL 76 Cb 0.38 1.27 -0.10 0.00 -1.47 0.00 0.00 33.84 33.91 2hde n VAL 76 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2hde s TYR 77 N -1.61 -0.64 0.10 6.34 6.14 0.21 -5.04 117.35 122.85 2hde s TYR 77 Ca 0.28 0.82 -0.13 0.00 0.64 0.00 0.00 57.07 58.68 2hde s TYR 77 Cb 0.19 -0.03 -0.14 0.00 0.42 0.00 0.00 41.96 42.40 2hde s TYR 77 CO 0.27 -0.61 1.33 -1.35 0.64 0.00 0.00 175.55 175.83 2hde h PRO 78 N 8.23 0.81 0.00 4.97 0.11 -1.86 -3.13 132.00 141.12 2hde h PRO 78 Ca -0.18 -0.61 0.00 0.00 0.11 0.00 0.00 66.00 65.33 2hde h PRO 78 Cb 1.14 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2hde h PRO 78 CO 0.23 1.22 0.02 1.49 -0.21 0.00 0.00 178.00 180.76 2hde h GLU 79 N 0.55 0.00 0.00 1.05 4.57 -1.96 -1.25 114.58 117.54 2hde h GLU 79 Ca -0.03 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 57.89 2hde h GLU 79 Cb 1.31 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.86 2hde h GLU 79 CO 0.14 0.00 -1.41 0.00 -1.18 0.00 0.00 179.01 176.57 2hde h ALA 80 N 1.95 0.60 0.00 2.92 0.00 -1.89 -3.31 119.26 119.53 2hde h ALA 80 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 54.91 53.68 2hde h ALA 80 Cb 0.05 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2hde h ALA 80 CO 0.00 1.45 0.04 0.00 0.00 0.00 0.00 179.25 180.73 2hde h ARG 81 N 0.00 0.00 -6.62 0.00 3.08 -1.26 -3.44 114.38 106.14 2hde h ARG 81 Ca -0.17 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.31 2hde h ARG 81 Cb 1.91 0.00 0.08 0.00 0.08 0.00 0.00 29.97 32.04 2hde h ARG 81 CO 0.10 0.00 0.68 1.17 -1.07 0.00 0.00 179.97 180.85 2hde n LYS 82 N -2.51 2.18 -2.07 0.04 3.00 -1.25 -4.91 118.16 112.64 2hde n LYS 82 Ca -0.02 0.78 -0.41 0.00 -0.00 0.00 0.00 58.31 58.65 2hde n LYS 82 Cb 0.08 -2.47 -0.02 0.00 0.00 0.00 0.00 35.03 32.62 2hde n LYS 82 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2hde s LYS 83 N -0.31 4.30 0.00 1.64 1.02 -1.26 -2.79 119.74 122.34 2hde s LYS 83 Ca 0.68 2.23 0.00 0.00 0.02 0.00 0.00 55.97 58.91 2hde s LYS 83 Cb -0.62 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 33.56 2hde s LYS 83 CO 0.48 -0.36 0.00 0.41 -0.92 0.00 0.00 175.35 174.96 2hde n GLY 84 N 2.13 0.75 3.57 -3.33 0.00 -1.26 -4.82 105.19 102.24 2hde n GLY 84 Ca 0.06 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 2hde n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hde s THR 85 N -2.00 4.44 -0.39 2.61 2.01 -1.12 -3.99 115.64 117.20 2hde s THR 85 Ca 0.00 0.85 -0.20 0.00 0.31 0.00 0.00 61.69 62.64 2hde s THR 85 Cb 0.00 -4.45 0.01 0.00 0.01 0.00 0.00 72.50 68.07 2hde s THR 85 CO 0.00 -0.84 0.62 -2.28 -0.69 0.00 0.00 174.62 171.42 2hde s HIS 86 N 3.84 3.12 -0.06 4.92 2.46 -0.47 -2.58 115.29 126.52 2hde s HIS 86 Ca 0.39 0.16 0.05 0.00 0.47 0.00 0.00 55.06 56.12 2hde s HIS 86 Cb -0.10 -3.19 -0.02 0.00 -0.13 0.00 0.00 32.58 29.15 2hde s HIS 86 CO 0.27 -0.71 -0.20 -0.59 -2.47 0.00 0.00 174.74 171.04 2hde s PHE 87 N 2.70 2.55 -0.18 3.88 -0.12 -0.86 0.32 117.98 126.28 2hde s PHE 87 Ca 0.23 -0.47 -0.04 0.00 -0.05 0.00 0.00 56.93 56.60 2hde s PHE 87 Cb -0.14 -1.62 -0.02 0.00 -0.63 0.00 0.00 43.02 40.60 2hde s PHE 87 CO 0.16 -0.05 -0.03 -0.80 -0.05 0.00 0.00 175.22 174.45 2hde s ASN 88 N -0.37 4.68 -0.09 1.98 -0.87 0.13 -0.49 114.94 119.91 2hde s ASN 88 Ca 0.03 -0.20 -0.21 0.00 -1.57 0.00 0.00 52.86 50.90 2hde s ASN 88 Cb -0.12 -1.78 -0.04 0.00 -0.02 0.00 0.00 41.25 39.29 2hde s ASN 88 CO 0.02 0.11 0.62 -0.36 -2.57 0.00 0.00 177.10 174.92 2hde s PHE 89 N 0.71 3.55 0.30 2.20 0.40 0.16 -0.08 117.98 125.21 2hde s PHE 89 Ca -0.02 1.11 0.02 0.00 -0.60 0.00 0.00 56.93 57.44 2hde s PHE 89 Cb -0.14 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.65 2hde s PHE 89 CO 0.02 0.11 0.31 0.00 0.70 0.00 0.00 175.22 176.36 2hde s ALA 90 N 0.78 1.30 -0.18 5.36 0.00 -0.84 -0.95 121.76 127.24 2hde s ALA 90 Ca 0.33 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.52 2hde s ALA 90 Cb -0.17 1.35 0.04 0.00 0.00 0.00 0.00 23.12 24.34 2hde s ALA 90 CO 0.15 -0.69 -0.10 0.42 0.00 0.00 0.00 175.76 175.54 2hde s ILE 91 N -3.52 1.48 0.23 0.00 1.01 0.96 0.08 121.20 121.45 2hde s ILE 91 Ca 0.37 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 60.27 2hde s ILE 91 Cb 0.02 -1.54 -0.05 0.00 0.01 0.00 0.00 42.46 40.90 2hde s ILE 91 CO 0.21 0.23 -0.08 0.68 0.00 0.00 0.00 174.94 175.98 2hde s VAL 92 N 1.48 1.52 0.01 2.92 -7.23 -1.04 -2.75 120.40 115.32 2hde s VAL 92 Ca 0.01 -2.13 0.02 0.00 -1.81 0.00 0.00 61.98 58.07 2hde s VAL 92 Cb -0.15 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.54 2hde s VAL 92 CO -0.09 -0.45 -0.07 0.72 -0.31 0.00 0.00 175.10 174.90 2hde s PHE 93 N -3.10 0.65 0.98 2.82 -0.12 -1.26 -4.54 117.98 113.41 2hde s PHE 93 Ca 0.26 -0.21 -0.12 0.00 -0.05 0.00 0.00 56.93 56.80 2hde s PHE 93 Cb 0.02 -0.41 0.18 0.00 -0.63 0.00 0.00 43.02 42.19 2hde s PHE 93 CO 0.09 -0.02 1.11 -0.08 -0.05 0.00 0.00 175.22 176.26 2hde s THR 94 N -0.47 2.00 0.23 -4.49 -1.32 -1.26 -4.95 115.64 105.38 2hde s THR 94 Ca -0.00 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.20 2hde s THR 94 Cb -0.05 -2.57 -0.09 0.00 -1.51 0.00 0.00 72.50 68.29 2hde s THR 94 CO 0.00 0.00 0.89 -1.81 -2.21 0.00 0.00 174.62 171.49 2hde s ASP 95 N -3.63 7.53 0.29 8.08 1.11 -1.26 -4.93 116.67 123.85 2hde s ASP 95 Ca 0.65 1.84 0.00 0.00 0.18 0.00 0.00 52.55 55.22 2hde s ASP 95 Cb -0.17 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.24 2hde s ASP 95 CO 0.56 0.14 0.00 1.33 1.18 0.00 0.00 175.17 178.38 2hde n VAL 96 N 1.37 0.00 -0.05 -1.27 0.24 -1.26 -5.02 118.33 112.35 2hde n VAL 96 Ca -0.02 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.18 2hde n VAL 96 Cb 0.48 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.43 2hde n VAL 96 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2hde n LYS 97 N -3.38 0.20 -3.89 7.34 4.01 -1.26 -5.10 118.16 116.08 2hde n LYS 97 Ca 0.00 0.08 -0.09 0.00 -0.51 0.00 0.00 58.31 57.79 2hde n LYS 97 Cb 0.00 -0.86 -0.07 0.00 -0.51 0.00 0.00 35.03 33.60 2hde n LYS 97 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2hde s ARG 98 N -2.17 1.10 0.01 1.97 1.81 -1.26 -5.10 118.95 115.31 2hde s ARG 98 Ca -0.13 -1.06 -0.02 0.00 -1.72 0.00 0.00 55.73 52.81 2hde s ARG 98 Cb 0.05 0.39 -0.01 0.00 -0.45 0.00 0.00 34.95 34.93 2hde s ARG 98 CO 0.17 -0.40 1.03 -1.35 -0.68 0.00 0.00 175.30 174.07 2hde h PRO 99 N 2.54 -0.03 -4.53 3.54 0.11 -1.99 -3.46 132.00 128.18 2hde h PRO 99 Ca -0.32 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.41 2hde h PRO 99 Cb 1.23 0.01 0.07 0.00 0.11 0.00 0.00 31.00 32.42 2hde h PRO 99 CO 0.49 -0.02 -0.59 0.41 -0.21 0.00 0.00 178.00 178.08 2hde n GLY 100 N -1.02 -0.46 3.46 -0.55 0.00 -1.26 -4.80 105.19 100.56 2hde n GLY 100 Ca -0.00 0.11 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 2hde n GLY 100 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2hde n TYR 101 N -4.55 1.08 -2.35 1.61 4.19 -1.26 -4.68 117.16 111.19 2hde n TYR 101 Ca -0.08 0.35 0.02 0.00 3.31 0.00 0.00 57.90 61.49 2hde n TYR 101 Cb 0.60 -2.46 0.00 0.00 0.49 0.00 0.00 39.34 37.97 2hde n TYR 101 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 2hde n ARG 102 N 8.40 0.00 -2.81 2.98 0.00 -1.26 -5.10 116.66 118.87 2hde n ARG 102 Ca 0.52 -1.68 -0.38 0.00 -0.00 0.00 0.00 57.85 56.31 2hde n ARG 102 Cb 0.18 0.04 -0.06 0.00 0.00 0.00 0.00 32.46 32.62 2hde n ARG 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2hde s VAL 103 N 0.00 4.21 0.20 5.15 0.11 -1.26 -4.98 120.40 123.83 2hde s VAL 103 Ca 0.24 1.85 -0.17 0.00 -2.93 0.00 0.00 61.98 60.97 2hde s VAL 103 Cb 0.28 -4.08 0.02 0.00 -1.53 0.00 0.00 36.38 31.06 2hde s VAL 103 CO -0.12 0.25 0.50 -0.54 -3.33 0.00 0.00 175.10 171.87 2hde s LYS 104 N -1.79 1.37 -0.00 1.54 1.02 -1.11 -4.98 119.74 115.79 2hde s LYS 104 Ca 0.47 -0.91 0.01 0.00 0.02 0.00 0.00 55.97 55.56 2hde s LYS 104 Cb -0.20 0.51 -0.04 0.00 -0.52 0.00 0.00 37.83 37.58 2hde s LYS 104 CO 0.26 -0.58 0.03 -2.00 -0.92 0.00 0.00 175.35 172.14 2hde s GLU 105 N -3.89 2.87 -0.03 1.68 2.12 -1.26 -0.03 118.70 120.17 2hde s GLU 105 Ca 0.10 -0.58 0.12 0.00 0.36 0.00 0.00 54.97 54.98 2hde s GLU 105 Cb -0.01 -2.73 -0.18 0.00 0.26 0.00 0.00 34.13 31.47 2hde s GLU 105 CO -0.02 0.63 0.24 0.44 -0.54 0.00 0.00 175.26 176.01 2hde n ILE 106 N 1.31 0.09 0.00 -3.70 -6.64 -0.12 -4.95 119.36 105.34 2hde n ILE 106 Ca -0.14 -0.30 0.00 0.00 -1.77 0.00 0.00 62.75 60.54 2hde n ILE 106 Cb 0.53 0.12 0.00 0.00 -1.44 0.00 0.00 39.64 38.85 2hde n ILE 106 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 2hde n GLY 107 N 1.87 1.87 3.18 3.28 0.00 -1.18 -5.01 105.19 109.20 2hde n GLY 107 Ca -0.04 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 2hde n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hde s SER 108 N 0.00 2.28 0.00 1.61 1.04 -1.26 0.38 113.70 117.75 2hde s SER 108 Ca 0.00 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.07 2hde s SER 108 Cb 0.00 -0.38 0.00 0.00 0.10 0.00 0.00 66.02 65.74 2hde s SER 108 CO 0.00 0.21 0.00 0.35 0.98 0.00 0.00 173.24 174.78 2hde n THR 109 N 2.77 0.00 -4.09 2.02 -2.24 0.36 -4.63 114.28 108.47 2hde n THR 109 Ca -0.16 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 2hde n THR 109 Cb 0.53 -0.43 -0.09 0.00 -2.10 0.00 0.00 70.33 68.24 2hde n THR 109 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2hde s MET 110 N -1.81 1.11 -1.38 -0.78 -1.94 -1.25 -2.02 119.30 111.23 2hde s MET 110 Ca 0.00 -1.39 -0.15 0.00 -1.71 0.00 0.00 55.69 52.44 2hde s MET 110 Cb 0.00 0.31 0.03 0.00 2.01 0.00 0.00 34.83 37.17 2hde s MET 110 CO 0.00 -0.37 2.13 0.45 -0.01 0.00 0.00 175.02 177.22 2hde n SER 111 N -0.19 3.90 0.00 3.03 2.88 -1.07 -3.59 113.62 118.59 2hde n SER 111 Ca -0.04 -2.84 0.00 0.00 -1.33 0.00 0.00 58.87 54.66 2hde n SER 111 Cb 0.64 -1.63 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2hde n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2hde n GLY 112 N 4.35 1.15 3.33 0.46 0.00 -1.26 -4.34 105.19 108.88 2hde n GLY 112 Ca 0.51 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.20 2hde n GLY 112 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2hde s ARG 113 N -0.69 3.34 -0.81 1.61 3.52 -1.24 -5.07 118.95 119.62 2hde s ARG 113 Ca 0.00 -0.69 -0.23 0.00 -0.13 0.00 0.00 55.73 54.68 2hde s ARG 113 Cb 0.00 -2.69 0.07 0.00 -1.56 0.00 0.00 34.95 30.77 2hde s ARG 113 CO 0.00 0.10 1.16 0.21 -0.81 0.00 0.00 175.30 175.96 2hde s LYS 114 N 0.65 3.33 0.00 5.12 2.20 -1.26 -3.86 119.74 125.91 2hde s LYS 114 Ca -0.07 -0.97 0.00 0.00 -0.36 0.00 0.00 55.97 54.58 2hde s LYS 114 Cb -0.15 -4.59 0.00 0.00 -1.51 0.00 0.00 37.83 31.58 2hde s LYS 114 CO 0.02 -1.96 0.00 0.41 -0.36 0.00 0.00 175.35 173.47 2hde n GLY 115 N 5.68 -0.67 0.10 5.54 0.00 -1.26 -4.97 105.19 109.61 2hde n GLY 115 Ca 0.11 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 2hde n GLY 115 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2hde h THR 116 N -0.04 1.07 0.00 2.61 2.02 -1.95 -3.34 112.91 113.28 2hde h THR 116 Ca 0.00 -2.81 -0.08 0.00 0.77 0.00 0.00 66.41 64.29 2hde h THR 116 Cb 0.00 2.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 2hde h THR 116 CO 0.00 0.73 -0.49 0.44 0.37 0.00 0.00 175.52 176.57 2hde h ASP 117 N 0.03 0.00 -0.70 4.18 3.32 -1.95 -3.35 116.42 117.96 2hde h ASP 117 Ca -0.24 0.00 0.15 0.00 0.02 0.00 0.00 57.03 56.96 2hde h ASP 117 Cb 1.98 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 41.40 2hde h ASP 117 CO 0.12 0.37 -0.05 -0.78 -1.72 0.00 0.00 179.24 177.18 2hde h ASP 118 N 0.00 -0.42 0.55 6.45 3.58 -1.83 0.80 116.42 125.55 2hde h ASP 118 Ca -0.02 0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.62 2hde h ASP 118 Cb 1.30 0.35 0.00 0.00 1.72 0.00 0.00 39.33 42.70 2hde h ASP 118 CO 0.05 -0.18 0.00 -0.24 -2.88 0.00 0.00 179.24 175.99 2hde n SER 119 N -5.37 0.00 -4.80 2.28 2.88 -1.25 -1.90 113.62 105.46 2hde n SER 119 Ca 0.11 0.45 -0.33 0.00 -1.33 0.00 0.00 58.87 57.77 2hde n SER 119 Cb 0.41 -0.48 -0.02 0.00 -0.75 0.00 0.00 64.21 63.37 2hde n SER 119 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 2hde s MET 120 N -2.95 3.65 0.06 -1.46 0.00 0.28 -4.80 119.30 114.08 2hde s MET 120 Ca 0.09 1.28 0.01 0.00 0.00 0.00 0.00 55.69 57.08 2hde s MET 120 Cb 0.11 -2.08 -0.04 0.00 0.00 0.00 0.00 34.83 32.82 2hde s MET 120 CO 0.30 -0.54 0.13 0.95 0.00 0.00 0.00 175.02 175.86 2hde s THR 121 N -2.18 4.89 0.17 10.11 -4.23 -1.26 0.36 115.64 123.50 2hde s THR 121 Ca 0.66 -0.57 -0.15 0.00 -1.18 0.00 0.00 61.69 60.45 2hde s THR 121 Cb -0.16 -3.35 0.05 0.00 1.34 0.00 0.00 72.50 70.38 2hde s THR 121 CO 0.26 0.17 1.83 -0.07 -0.54 0.00 0.00 174.62 176.26 2hde h LEU 122 N 3.34 0.54 -0.93 4.79 3.38 -0.52 -2.81 115.31 123.09 2hde h LEU 122 Ca -0.46 -0.01 0.27 0.00 0.09 0.00 0.00 57.88 57.76 2hde h LEU 122 Cb 1.17 -0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.64 2hde h LEU 122 CO 0.69 0.39 0.35 0.06 0.09 0.00 0.00 178.44 180.02 2hde h GLN 123 N 0.64 0.24 0.00 1.13 3.07 -1.33 1.02 115.11 119.88 2hde h GLN 123 Ca 0.18 -0.01 -0.00 0.00 0.09 0.00 0.00 58.65 58.90 2hde h GLN 123 Cb -0.06 -0.05 -0.00 0.00 0.08 0.00 0.00 27.48 27.45 2hde h GLN 123 CO -0.05 0.16 -0.01 0.66 0.09 0.00 0.00 178.83 179.68 2hde h SER 124 N 0.24 0.00 -0.38 0.06 4.64 -1.81 -1.74 113.55 114.55 2hde h SER 124 Ca 0.62 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.94 2hde h SER 124 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 2hde h SER 124 CO -0.65 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.32 2hde n GLN 125 N -3.12 2.33 -2.06 4.77 1.13 0.35 -4.88 117.38 115.89 2hde n GLN 125 Ca -0.01 -1.57 -0.15 0.00 -1.94 0.00 0.00 57.00 53.34 2hde n GLN 125 Cb 0.24 -1.51 -0.02 0.00 0.11 0.00 0.00 30.24 29.06 2hde n GLN 125 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2hde n LYS 126 N 0.60 -1.14 -2.92 -1.09 5.02 -0.65 -4.97 118.16 113.00 2hde n LYS 126 Ca 0.14 0.80 -0.42 0.00 -2.02 0.00 0.00 58.31 56.81 2hde n LYS 126 Cb 0.48 -5.07 -0.05 0.00 -0.02 0.00 0.00 35.03 30.37 2hde n LYS 126 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2hde s PHE 127 N -2.69 3.27 0.44 2.13 5.36 -1.12 -5.03 117.98 120.33 2hde s PHE 127 Ca 0.00 1.01 0.03 0.00 -0.96 0.00 0.00 56.93 57.01 2hde s PHE 127 Cb 0.00 -3.10 -0.02 0.00 -0.34 0.00 0.00 43.02 39.57 2hde s PHE 127 CO 0.00 -0.45 0.12 1.14 -1.46 0.00 0.00 175.22 174.56 2hde s GLN 128 N 2.87 2.02 0.15 10.12 -2.07 -1.26 -4.38 119.66 127.10 2hde s GLN 128 Ca 0.33 -2.25 -0.31 0.00 -1.82 0.00 0.00 55.36 51.31 2hde s GLN 128 Cb -0.15 -0.74 -0.10 0.00 -1.09 0.00 0.00 33.01 30.93 2hde s GLN 128 CO 0.09 -0.50 1.55 0.42 -1.32 0.00 0.00 175.29 175.53 2hde s ILE 129 N -3.13 2.78 0.00 3.63 1.01 -1.26 -1.90 121.20 122.32 2hde s ILE 129 Ca 0.19 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.37 2hde s ILE 129 Cb 0.02 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.14 2hde s ILE 129 CO 0.12 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.71 2hde n GLY 130 N 3.73 2.58 3.71 6.18 0.00 -1.26 -5.03 105.19 115.10 2hde n GLY 130 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2hde n GLY 130 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hde n ASP 131 N 0.00 2.08 -4.39 1.61 2.03 -0.80 -4.91 116.55 112.18 2hde n ASP 131 Ca 0.00 0.88 -0.43 0.00 0.52 0.00 0.00 54.79 55.76 2hde n ASP 131 Cb 0.00 -1.54 -0.09 0.00 -0.72 0.00 0.00 41.12 38.78 2hde n ASP 131 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2hde s TYR 132 N -1.37 3.26 -0.20 -0.67 2.02 -1.26 -4.33 117.35 114.80 2hde s TYR 132 Ca 0.78 -0.94 -0.09 0.00 -0.37 0.00 0.00 57.07 56.45 2hde s TYR 132 Cb -0.40 -2.96 -0.05 0.00 -0.40 0.00 0.00 41.96 38.15 2hde s TYR 132 CO 0.44 -0.75 0.11 -0.51 -1.57 0.00 0.00 175.55 173.28 2hde s LEU 133 N 1.61 4.04 -0.38 -1.29 1.43 -1.12 -2.49 118.68 120.48 2hde s LEU 133 Ca 0.04 0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.25 2hde s LEU 133 Cb -0.23 -2.04 0.09 0.00 0.03 0.00 0.00 46.19 44.04 2hde s LEU 133 CO 0.07 0.16 0.16 -0.62 0.23 0.00 0.00 176.35 176.34 2hde s ASP 134 N 0.49 5.23 -0.29 2.29 -1.08 0.11 -1.00 116.67 122.42 2hde s ASP 134 Ca 0.06 -1.72 -0.22 0.00 -0.52 0.00 0.00 52.55 50.15 2hde s ASP 134 Cb -0.12 -1.83 -0.01 0.00 -1.46 0.00 0.00 42.92 39.51 2hde s ASP 134 CO -0.00 -0.46 0.70 -0.63 0.52 0.00 0.00 175.17 175.30 2hde s ILE 135 N 1.22 4.88 -0.57 4.11 1.09 0.14 -1.99 121.20 130.09 2hde s ILE 135 Ca 0.04 1.08 -0.20 0.00 -1.10 0.00 0.00 60.65 60.46 2hde s ILE 135 Cb -0.22 -4.05 0.08 0.00 -1.06 0.00 0.00 42.46 37.21 2hde s ILE 135 CO -0.02 -0.15 0.75 0.00 -0.10 0.00 0.00 174.94 175.42 2hde s ALA 136 N 2.74 3.33 -0.14 9.38 0.00 0.88 -2.64 121.76 135.31 2hde s ALA 136 Ca 0.29 -1.91 -0.25 0.00 0.00 0.00 0.00 51.96 50.09 2hde s ALA 136 Cb -0.15 -3.55 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 2hde s ALA 136 CO 0.11 -2.32 0.81 0.42 0.00 0.00 0.00 175.76 174.78 2hde s ILE 137 N 3.03 4.92 -0.27 0.00 1.01 -0.05 -0.69 121.20 129.14 2hde s ILE 137 Ca 0.16 1.60 -0.00 0.00 0.00 0.00 0.00 60.65 62.41 2hde s ILE 137 Cb -0.20 -4.12 0.05 0.00 0.01 0.00 0.00 42.46 38.19 2hde s ILE 137 CO 0.10 0.09 -0.05 -0.89 0.00 0.00 0.00 174.94 174.19 2hde s THR 138 N 1.77 2.73 0.43 2.92 2.01 0.15 -0.53 115.64 125.12 2hde s THR 138 Ca 0.39 -1.35 -0.23 0.00 0.31 0.00 0.00 61.69 60.81 2hde s THR 138 Cb -0.17 -2.52 -0.08 0.00 0.01 0.00 0.00 72.50 69.73 2hde s THR 138 CO 0.15 0.00 1.10 -2.16 -0.69 0.00 0.00 174.62 173.02 2hde s PRO 139 N 1.23 3.95 -1.27 4.92 0.04 -1.26 -1.37 135.00 141.24 2hde s PRO 139 Ca -0.05 1.61 -0.19 0.00 0.04 0.00 0.00 61.00 62.41 2hde s PRO 139 Cb -0.19 -2.44 0.04 0.00 0.04 0.00 0.00 34.50 31.95 2hde s PRO 139 CO -0.03 -0.35 1.78 -1.25 0.04 0.00 0.00 177.00 177.19 2hde s PRO 140 N -2.66 3.66 -0.11 0.56 0.04 -1.26 -4.28 135.00 130.95 2hde s PRO 140 Ca 0.61 -1.80 0.06 0.00 0.04 0.00 0.00 61.00 59.91 2hde s PRO 140 Cb -0.24 -5.47 0.16 0.00 0.04 0.00 0.00 34.50 28.99 2hde s PRO 140 CO 0.30 -2.63 1.18 0.27 0.04 0.00 0.00 177.00 176.16 2hde n ASN 141 N 9.70 -1.00 0.00 6.66 0.23 -1.26 -4.93 115.26 124.66 2hde n ASN 141 Ca 0.48 -2.07 0.00 0.00 -0.53 0.00 0.00 54.58 52.46 2hde n ASN 141 Cb 0.46 0.38 0.00 0.00 -2.08 0.00 0.00 39.78 38.54 2hde n ASN 141 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2hde n ARG 142 N -0.48 0.00 -0.56 -3.83 0.63 -1.26 -5.15 116.66 106.01 2hde n ARG 142 Ca -0.23 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.59 2hde n ARG 142 Cb 0.78 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.78 2hde n ARG 142 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hde n ALA 143 N -0.45 -1.01 -2.53 5.13 0.00 -1.26 -4.95 120.51 115.43 2hde n ALA 143 Ca 0.00 -0.65 -0.43 0.00 0.00 0.00 0.00 53.44 52.36 2hde n ALA 143 Cb 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.39 2hde n ALA 143 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2hde s PRO 144 N -4.04 3.75 -0.46 0.00 0.04 -1.26 -5.00 135.00 128.04 2hde s PRO 144 Ca 0.28 0.78 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 2hde s PRO 144 Cb -0.02 -3.91 0.03 0.00 0.04 0.00 0.00 34.50 30.64 2hde s PRO 144 CO 0.21 -1.34 1.16 -1.25 0.04 0.00 0.00 177.00 175.82 2hde s PRO 145 N 4.44 3.74 -0.40 0.56 0.04 -1.26 -4.99 135.00 137.13 2hde s PRO 145 Ca 0.51 0.65 -0.29 0.00 0.04 0.00 0.00 61.00 61.92 2hde s PRO 145 Cb -0.10 -3.91 0.01 0.00 0.04 0.00 0.00 34.50 30.54 2hde s PRO 145 CO 0.29 -1.36 1.46 -1.25 0.04 0.00 0.00 177.00 176.18 2hde s PRO 146 N 4.44 3.56 -0.28 0.56 0.04 -1.26 -4.88 135.00 137.18 2hde s PRO 146 Ca 0.49 1.01 0.10 0.00 0.04 0.00 0.00 61.00 62.64 2hde s PRO 146 Cb -0.08 -4.04 0.47 0.00 0.04 0.00 0.00 34.50 30.88 2hde s PRO 146 CO 0.30 -1.59 1.17 0.43 0.04 0.00 0.00 177.00 177.36 2hde n SER 147 N 8.97 4.29 0.00 6.66 7.64 -1.26 -5.08 113.62 134.83 2hde n SER 147 Ca 0.17 -3.42 0.00 0.00 1.01 0.00 0.00 58.87 56.63 2hde n SER 147 Cb 0.48 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 2hde n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hde n GLY 148 N -0.69 -0.74 0.89 0.23 0.00 -1.26 -5.37 105.19 98.26 2hde n GLY 148 Ca 0.37 -1.47 0.11 0.00 0.00 0.00 0.00 46.02 45.03 2hde n GLY 148 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19