#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hcc n PHE 2 N 0.00 0.60 0.25 1.57 -1.74 -1.26 -4.93 117.46 111.95 2hcc n PHE 2 Ca 0.00 -3.15 0.00 0.00 -0.56 0.00 0.00 57.45 53.74 2hcc n PHE 2 Cb 0.00 -0.30 0.00 0.00 1.52 0.00 0.00 39.48 40.70 2hcc n PHE 2 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2hcc n ALA 3 N 0.06 0.00 -0.58 1.98 0.00 -1.26 -5.15 120.51 115.56 2hcc n ALA 3 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2hcc n ALA 3 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.21 2hcc n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hcc n ALA 4 N -3.49 0.00 -3.13 0.00 0.00 -1.26 -3.89 120.51 108.74 2hcc n ALA 4 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2hcc n ALA 4 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2hcc n ALA 4 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hcc n ASP 5 N -3.42 4.41 -4.78 0.00 8.00 -1.26 -5.06 116.55 114.45 2hcc n ASP 5 Ca 0.00 -3.58 -0.38 0.00 0.71 0.00 0.00 54.79 51.54 2hcc n ASP 5 Cb 0.00 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.38 2hcc n ASP 5 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hcc n THR 8 N 2.01 0.41 -3.81 0.00 -2.24 -1.26 -4.86 114.28 104.53 2hcc n THR 8 Ca -0.12 -0.59 -0.13 0.00 -2.27 0.00 0.00 64.05 60.94 2hcc n THR 8 Cb 0.52 -0.17 -0.14 0.00 -2.10 0.00 0.00 70.33 68.44 2hcc n THR 8 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2hcc s SER 9 N -4.87 -0.05 0.61 3.42 1.04 -1.26 -5.16 113.70 107.43 2hcc s SER 9 Ca -0.07 0.15 -0.02 0.00 0.48 0.00 0.00 55.95 56.49 2hcc s SER 9 Cb 0.12 0.11 0.04 0.00 0.10 0.00 0.00 66.02 66.39 2hcc s SER 9 CO 0.88 -0.07 0.87 -0.31 0.98 0.00 0.00 173.24 175.59 2hcc s TYR 10 N 0.44 2.90 1.17 5.02 2.02 -1.26 -4.67 117.35 122.97 2hcc s TYR 10 Ca -0.03 0.18 -0.13 0.00 -0.37 0.00 0.00 57.07 56.72 2hcc s TYR 10 Cb -0.05 -2.92 0.28 0.00 -0.40 0.00 0.00 41.96 38.87 2hcc s TYR 10 CO -0.02 -1.07 0.95 0.44 -1.57 0.00 0.00 175.55 174.27 2hcc n ILE 11 N -2.57 0.00 1.03 2.71 -0.00 -0.17 -4.93 119.36 115.44 2hcc n ILE 11 Ca 0.08 -0.43 0.11 0.00 -0.00 0.00 0.00 62.75 62.51 2hcc n ILE 11 Cb 0.60 -0.97 0.03 0.00 -0.00 0.00 0.00 39.64 39.30 2hcc n ILE 11 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 2hcc n SER 12 N -4.73 1.50 -4.15 7.28 3.41 -1.26 -4.96 113.62 110.71 2hcc n SER 12 Ca 0.03 -1.20 -0.10 0.00 -0.26 0.00 0.00 58.87 57.33 2hcc n SER 12 Cb 0.54 0.56 -0.10 0.00 -0.26 0.00 0.00 64.21 64.96 2hcc n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hcc s GLN 13 N -2.66 1.02 0.49 4.33 -2.07 -1.26 -5.12 119.66 114.39 2hcc s GLN 13 Ca 0.16 -1.48 -0.19 0.00 -1.82 0.00 0.00 55.36 52.03 2hcc s GLN 13 Cb 0.18 0.26 -0.13 0.00 -1.09 0.00 0.00 33.01 32.22 2hcc s GLN 13 CO 0.66 -0.31 0.10 0.45 -1.32 0.00 0.00 175.29 174.87 2hcc n SER 14 N -0.15 -2.74 -4.76 12.60 2.88 -1.26 -4.81 113.62 115.37 2hcc n SER 14 Ca -0.03 0.72 -0.41 0.00 -1.33 0.00 0.00 58.87 57.82 2hcc n SER 14 Cb 0.64 -0.95 -0.03 0.00 -0.75 0.00 0.00 64.21 63.13 2hcc n SER 14 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2hcc s ILE 15 N -1.85 3.15 -1.20 2.46 -1.09 -1.26 -4.90 121.20 116.51 2hcc s ILE 15 Ca 0.60 1.10 -0.21 0.00 -2.23 0.00 0.00 60.65 59.91 2hcc s ILE 15 Cb -0.52 -3.70 -0.01 0.00 -1.58 0.00 0.00 42.46 36.65 2hcc s ILE 15 CO 0.62 0.24 1.82 -2.16 -1.23 0.00 0.00 174.94 174.23 2hcc s PRO 16 N -1.24 3.19 0.53 2.79 0.04 -1.26 -4.76 135.00 134.29 2hcc s PRO 16 Ca 0.49 -1.45 0.19 0.00 0.04 0.00 0.00 61.00 60.27 2hcc s PRO 16 Cb -0.36 -5.36 1.34 0.00 0.04 0.00 0.00 34.50 30.16 2hcc s PRO 16 CO 0.45 -3.11 2.11 0.00 0.04 0.00 0.00 177.00 176.49 2hcc n SER 18 N -4.45 0.00 -1.01 0.00 2.88 -1.26 -2.62 113.62 107.16 2hcc n SER 18 Ca 0.01 -0.81 0.01 0.00 -1.33 0.00 0.00 58.87 56.75 2hcc n SER 18 Cb 0.24 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.70 2hcc n SER 18 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2hcc n LEU 19 N -0.58 0.42 -4.07 2.46 4.32 -0.48 -5.08 117.00 114.00 2hcc n LEU 19 Ca 0.02 -1.54 -0.25 0.00 -0.02 0.00 0.00 56.01 54.22 2hcc n LEU 19 Cb 0.01 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 41.65 2hcc n LEU 19 CO 0.01 0.49 -0.48 -0.04 -1.22 0.00 0.00 177.39 176.15 2hcc s MET 20 N 0.00 1.63 -0.20 3.23 -1.94 -1.08 -4.20 119.30 116.75 2hcc s MET 20 Ca 0.16 -0.49 0.06 0.00 -1.71 0.00 0.00 55.69 53.71 2hcc s MET 20 Cb 0.19 -1.39 -0.21 0.00 2.01 0.00 0.00 34.83 35.42 2hcc s MET 20 CO -0.08 0.14 0.05 1.17 -0.01 0.00 0.00 175.02 176.29 2hcc n LYS 21 N 3.41 0.68 -3.65 2.03 4.81 -0.29 -4.82 118.16 120.32 2hcc n LYS 21 Ca -0.20 0.14 -0.04 0.00 -0.87 0.00 0.00 58.31 57.35 2hcc n LYS 21 Cb 0.53 -1.58 -0.06 0.00 0.02 0.00 0.00 35.03 33.94 2hcc n LYS 21 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2hcc s SER 22 N -6.28 -0.85 0.46 3.14 0.15 -1.08 -4.76 113.70 104.49 2hcc s SER 22 Ca -0.23 1.38 0.02 0.00 0.70 0.00 0.00 55.95 57.83 2hcc s SER 22 Cb 0.08 1.98 0.01 0.00 -1.71 0.00 0.00 66.02 66.38 2hcc s SER 22 CO 0.72 -0.22 0.66 -0.72 1.20 0.00 0.00 173.24 174.87 2hcc s TYR 23 N 2.80 3.06 -0.02 3.44 1.13 -1.26 -1.24 117.35 125.27 2hcc s TYR 23 Ca -0.05 0.03 -0.14 0.00 -1.41 0.00 0.00 57.07 55.51 2hcc s TYR 23 Cb -0.12 -2.39 0.02 0.00 -1.10 0.00 0.00 41.96 38.37 2hcc s TYR 23 CO -0.17 -0.46 0.29 -0.59 -2.51 0.00 0.00 175.55 172.11 2hcc s PHE 24 N -2.53 -0.16 0.13 -3.49 -0.12 -0.55 -4.89 117.98 106.37 2hcc s PHE 24 Ca 0.51 0.24 -0.15 0.00 -0.05 0.00 0.00 56.93 57.48 2hcc s PHE 24 Cb -0.10 0.08 -0.07 0.00 -0.63 0.00 0.00 43.02 42.30 2hcc s PHE 24 CO 0.36 -0.37 0.54 -1.83 -0.05 0.00 0.00 175.22 173.88 2hcc s GLU 25 N -1.28 3.99 0.00 1.99 -1.05 -1.26 -1.62 118.70 119.48 2hcc s GLU 25 Ca -0.13 0.51 0.00 0.00 -0.15 0.00 0.00 54.97 55.19 2hcc s GLU 25 Cb -0.05 -2.98 0.00 0.00 -0.44 0.00 0.00 34.13 30.66 2hcc s GLU 25 CO 0.04 0.51 0.00 0.25 0.95 0.00 0.00 175.26 177.00 2hcc n THR 26 N 0.94 0.00 -3.80 1.83 -2.24 -0.40 -4.94 114.28 105.66 2hcc n THR 26 Ca -0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.35 2hcc n THR 26 Cb 0.52 -1.83 -0.06 0.00 -2.10 0.00 0.00 70.33 66.86 2hcc n THR 26 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2hcc s SER 27 N -1.08 6.47 0.00 3.42 0.01 -1.26 -4.88 113.70 116.37 2hcc s SER 27 Ca 0.00 0.56 0.14 0.00 1.31 0.00 0.00 55.95 57.96 2hcc s SER 27 Cb 0.00 -2.11 0.71 0.00 0.21 0.00 0.00 66.02 64.84 2hcc s SER 27 CO 0.00 0.39 1.34 -0.24 0.41 0.00 0.00 173.24 175.14 2hcc n SER 28 N 1.97 0.00 0.19 2.44 2.88 -1.26 -2.46 113.62 117.39 2hcc n SER 28 Ca -0.19 -0.01 0.07 0.00 -1.33 0.00 0.00 58.87 57.41 2hcc n SER 28 Cb 0.54 -0.23 0.34 0.00 -0.75 0.00 0.00 64.21 64.11 2hcc n SER 28 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2hcc h GLU 29 N 0.00 0.00 -7.12 -1.46 4.22 -1.98 -3.45 114.58 104.80 2hcc h GLU 29 Ca 0.00 0.00 -0.49 0.00 0.08 0.00 0.00 59.36 58.95 2hcc h GLU 29 Cb 0.10 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.41 2hcc h GLU 29 CO 0.00 0.34 0.40 0.00 -2.18 0.00 0.00 179.01 177.57 2hcc n SER 31 N -1.47 0.12 -3.36 0.00 7.64 -1.26 -4.28 113.62 111.01 2hcc n SER 31 Ca 0.10 0.55 -0.10 0.00 1.01 0.00 0.00 58.87 60.43 2hcc n SER 31 Cb 0.52 -0.57 -0.08 0.00 -1.01 0.00 0.00 64.21 63.07 2hcc n SER 31 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2hcc s LYS 32 N -3.10 0.34 0.24 1.43 1.02 -1.26 -5.15 119.74 113.25 2hcc s LYS 32 Ca 0.01 0.49 -0.04 0.00 0.02 0.00 0.00 55.97 56.45 2hcc s LYS 32 Cb 0.03 -0.54 0.06 0.00 -0.52 0.00 0.00 37.83 36.87 2hcc s LYS 32 CO 0.10 -0.66 0.23 -0.35 -0.92 0.00 0.00 175.35 173.75 2hcc n PRO 33 N 5.36 -1.20 0.00 -1.68 -0.04 -1.26 -4.41 135.00 131.76 2hcc n PRO 33 Ca -0.04 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 2hcc n PRO 33 Cb 0.50 -0.32 0.00 0.00 -0.04 0.00 0.00 33.50 33.64 2hcc n PRO 33 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hcc n GLY 34 N 1.46 3.20 3.25 0.55 0.00 -1.26 -4.67 105.19 107.71 2hcc n GLY 34 Ca 0.03 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 2hcc n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hcc s VAL 35 N -2.00 2.56 -0.19 1.61 0.11 -0.63 -1.27 120.40 120.58 2hcc s VAL 35 Ca 0.00 -0.81 -0.10 0.00 -2.93 0.00 0.00 61.98 58.14 2hcc s VAL 35 Cb 0.00 -2.07 -0.05 0.00 -1.53 0.00 0.00 36.38 32.73 2hcc s VAL 35 CO 0.00 0.52 0.12 -0.63 -3.33 0.00 0.00 175.10 171.79 2hcc s ILE 36 N 0.77 5.35 -0.01 7.04 1.01 -0.64 -1.36 121.20 133.36 2hcc s ILE 36 Ca -0.07 0.17 -0.18 0.00 0.00 0.00 0.00 60.65 60.57 2hcc s ILE 36 Cb -0.15 -3.43 -0.06 0.00 0.01 0.00 0.00 42.46 38.83 2hcc s ILE 36 CO 0.00 0.46 0.52 -0.36 0.00 0.00 0.00 174.94 175.56 2hcc s PHE 37 N 0.26 3.69 -0.25 3.97 0.40 -0.81 -1.48 117.98 123.76 2hcc s PHE 37 Ca 0.08 1.10 -0.11 0.00 -0.60 0.00 0.00 56.93 57.40 2hcc s PHE 37 Cb -0.11 -2.49 -0.05 0.00 0.51 0.00 0.00 43.02 40.88 2hcc s PHE 37 CO -0.01 0.45 0.19 -1.17 0.70 0.00 0.00 175.22 175.37 2hcc s LEU 38 N -0.47 4.09 0.19 -0.37 1.98 -0.38 -1.87 118.68 121.85 2hcc s LEU 38 Ca 0.28 0.11 -0.13 0.00 -2.89 0.00 0.00 54.13 51.50 2hcc s LEU 38 Cb -0.17 -2.15 -0.07 0.00 0.66 0.00 0.00 46.19 44.46 2hcc s LEU 38 CO 0.15 0.01 0.57 0.42 -1.89 0.00 0.00 176.35 175.61 2hcc s THR 39 N 1.32 4.86 0.41 3.68 -4.23 -0.73 -1.14 115.64 119.81 2hcc s THR 39 Ca 0.08 0.72 0.18 0.00 -1.18 0.00 0.00 61.69 61.49 2hcc s THR 39 Cb -0.14 -3.69 0.19 0.00 1.34 0.00 0.00 72.50 70.20 2hcc s THR 39 CO 0.07 0.09 1.96 0.50 -0.54 0.00 0.00 174.62 176.70 2hcc h LYS 40 N 3.08 0.00 0.00 3.99 3.64 -1.90 -1.47 116.57 123.91 2hcc h LYS 40 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2hcc h LYS 40 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2hcc h LYS 40 CO 0.67 0.22 0.00 1.17 -2.27 0.00 0.00 179.45 179.24 2hcc n LYS 41 N -4.06 0.32 -0.66 1.90 4.81 -1.26 -4.84 118.16 114.36 2hcc n LYS 41 Ca -0.02 0.10 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2hcc n LYS 41 Cb 0.29 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.84 2hcc n LYS 41 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2hcc n GLY 42 N 0.10 0.78 3.20 3.14 0.00 -0.55 -5.12 105.19 106.74 2hcc n GLY 42 Ca 0.09 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 2hcc n GLY 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2hcc n ARG 43 N -0.61 0.71 -3.76 1.61 0.63 -1.22 -4.96 116.66 109.05 2hcc n ARG 43 Ca 0.00 -2.57 -0.13 0.00 -0.92 0.00 0.00 57.85 54.23 2hcc n ARG 43 Cb 0.22 2.54 -0.10 0.00 0.45 0.00 0.00 32.46 35.58 2hcc n ARG 43 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 2hcc s GLN 44 N -2.68 0.55 0.16 -0.14 -2.07 -1.26 -1.77 119.66 112.45 2hcc s GLN 44 Ca 0.26 0.09 0.09 0.00 -1.82 0.00 0.00 55.36 53.97 2hcc s GLN 44 Cb -0.01 0.25 -0.04 0.00 -1.09 0.00 0.00 33.01 32.12 2hcc s GLN 44 CO 0.19 -0.12 -0.19 0.08 -1.32 0.00 0.00 175.29 173.93 2hcc s VAL 45 N -0.69 1.82 -0.23 3.63 1.01 -0.78 -4.92 120.40 120.24 2hcc s VAL 45 Ca -0.08 -1.89 -0.06 0.00 0.00 0.00 0.00 61.98 59.95 2hcc s VAL 45 Cb -0.04 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 2hcc s VAL 45 CO 0.03 -0.29 0.04 0.00 0.00 0.00 0.00 175.10 174.88 2hcc s ALA 47 N 1.40 1.82 0.90 0.00 0.00 -0.46 -1.00 121.76 124.42 2hcc s ALA 47 Ca 0.05 -1.60 -0.14 0.00 0.00 0.00 0.00 51.96 50.27 2hcc s ALA 47 Cb -0.15 -0.04 0.16 0.00 0.00 0.00 0.00 23.12 23.10 2hcc s ALA 47 CO 0.02 0.01 1.26 0.15 0.00 0.00 0.00 175.76 177.20 2hcc s LYS 48 N -3.68 1.07 0.23 0.00 1.02 -1.26 -1.61 119.74 115.52 2hcc s LYS 48 Ca 0.20 -0.32 0.04 0.00 0.02 0.00 0.00 55.97 55.92 2hcc s LYS 48 Cb 0.00 -1.91 0.24 0.00 -0.52 0.00 0.00 37.83 35.64 2hcc s LYS 48 CO 0.05 -2.12 1.55 -1.00 -0.92 0.00 0.00 175.35 172.91 2hcc h PRO 49 N -1.40 0.24 0.00 -1.68 0.13 -1.93 -3.30 132.00 124.06 2hcc h PRO 49 Ca -0.44 -0.17 -0.05 0.00 -0.87 0.00 0.00 66.00 64.47 2hcc h PRO 49 Cb 1.26 0.03 -0.11 0.00 0.13 0.00 0.00 31.00 32.31 2hcc h PRO 49 CO 0.46 0.78 -0.58 0.43 -0.23 0.00 0.00 178.00 178.85 2hcc n SER 50 N -3.87 1.45 -4.60 1.44 7.64 -1.26 -4.94 113.62 109.48 2hcc n SER 50 Ca -0.02 -3.07 -0.40 0.00 1.01 0.00 0.00 58.87 56.38 2hcc n SER 50 Cb 0.62 -0.42 0.02 0.00 -1.01 0.00 0.00 64.21 63.43 2hcc n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hcc n GLY 51 N -0.60 -0.36 3.55 0.23 0.00 -1.24 -4.81 105.19 101.95 2hcc n GLY 51 Ca 0.13 0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2hcc n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hcc s PRO 52 N -2.20 2.73 0.00 1.61 0.04 -1.26 -2.19 135.00 133.74 2hcc s PRO 52 Ca 0.67 0.35 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2hcc s PRO 52 Cb -0.51 -4.43 0.00 0.00 0.04 0.00 0.00 34.50 29.60 2hcc s PRO 52 CO 0.54 -2.68 0.00 0.41 0.04 0.00 0.00 177.00 175.31 2hcc n GLY 53 N 5.77 1.87 0.36 0.56 0.00 -1.26 -4.53 105.19 107.97 2hcc n GLY 53 Ca 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.18 2hcc n GLY 53 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2hcc h VAL 54 N 0.00 1.25 0.00 1.61 2.07 -1.77 -0.29 116.25 119.12 2hcc h VAL 54 Ca 0.00 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 66.95 2hcc h VAL 54 Cb 0.00 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.66 2hcc h VAL 54 CO 0.00 0.26 -0.28 1.56 0.02 0.00 0.00 177.57 179.12 2hcc h GLN 55 N 1.29 0.00 -0.37 1.57 1.08 -1.93 -2.16 115.11 114.59 2hcc h GLN 55 Ca 0.34 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 57.44 2hcc h GLN 55 Cb -0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 2hcc h GLN 55 CO -0.07 0.28 -0.16 -0.44 -0.95 0.00 0.00 178.83 177.49 2hcc h ASP 56 N 0.00 0.79 -0.47 1.46 5.19 -1.44 0.12 116.42 122.07 2hcc h ASP 56 Ca -0.00 -0.40 -0.04 0.00 -0.62 0.00 0.00 57.03 55.97 2hcc h ASP 56 Cb 0.63 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.91 2hcc h ASP 56 CO 0.04 1.01 0.14 0.00 -3.12 0.00 0.00 179.24 177.30 2hcc h MET 58 N 0.62 0.00 0.23 0.00 2.86 -1.27 -1.57 114.93 115.81 2hcc h MET 58 Ca 0.15 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 2hcc h MET 58 Cb 0.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.95 2hcc h MET 58 CO -0.00 0.12 -0.11 -0.22 1.06 0.00 0.00 176.91 177.76 2hcc h LYS 59 N 0.00 -0.30 0.00 1.72 1.63 0.01 -2.64 116.57 116.99 2hcc h LYS 59 Ca -0.00 0.02 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 2hcc h LYS 59 Cb 0.59 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.28 2hcc h LYS 59 CO 0.02 -0.00 -0.24 -0.22 -3.45 0.00 0.00 179.45 175.55 2hcc h LYS 60 N -0.59 0.00 0.00 1.90 3.11 -1.42 -2.39 116.57 117.18 2hcc h LYS 60 Ca -0.03 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 2hcc h LYS 60 Cb 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.66 2hcc h LYS 60 CO 0.05 0.24 0.00 1.28 -2.81 0.00 0.00 179.45 178.21 2hcc n LEU 61 N -3.48 0.00 -4.13 5.20 4.32 -0.60 -4.49 117.00 113.83 2hcc n LEU 61 Ca -0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 56.01 55.61 2hcc n LEU 61 Cb 0.41 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.11 2hcc n LEU 61 CO 0.33 0.00 -0.01 -0.75 -1.22 0.00 0.00 177.39 175.75 2hcc s LYS 62 N -2.00 2.45 -0.96 3.23 2.20 -0.90 -4.85 119.74 118.91 2hcc s LYS 62 Ca 0.19 -2.24 -0.24 0.00 -0.36 0.00 0.00 55.97 53.32 2hcc s LYS 62 Cb 0.09 -3.75 -0.01 0.00 -1.51 0.00 0.00 37.83 32.64 2hcc s LYS 62 CO 0.14 -1.15 1.77 -1.25 -0.36 0.00 0.00 175.35 174.50 2hcc s PRO 63 N 0.46 2.94 -0.41 4.03 0.04 -1.26 -4.81 135.00 135.99 2hcc s PRO 63 Ca 0.13 -0.65 0.07 0.00 0.04 0.00 0.00 61.00 60.59 2hcc s PRO 63 Cb -0.21 -5.18 0.23 0.00 0.04 0.00 0.00 34.50 29.37 2hcc s PRO 63 CO -0.04 -2.98 0.51 0.66 0.04 0.00 0.00 177.00 175.20 2hcc n TYR 64 N 12.14 -0.88 0.00 0.56 4.01 -1.26 -5.09 117.16 126.64 2hcc n TYR 64 Ca 0.38 -3.27 0.00 0.00 -0.16 0.00 0.00 57.90 54.85 2hcc n TYR 64 Cb 0.48 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 2hcc n TYR 64 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2hcc n SER 65 N 1.83 0.00 -0.89 7.72 2.88 -1.26 -5.27 113.62 118.64 2hcc n SER 65 Ca 0.22 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.87 2hcc n SER 65 Cb 0.53 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.08 2hcc n SER 65 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43