#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hck h GLU 2 N 0.00 0.04 -0.09 2.12 4.11 -2.05 -1.62 114.58 117.09 1hck h GLU 2 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1hck h GLU 2 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1hck h GLU 2 CO 0.00 0.03 0.00 0.09 0.07 0.00 0.00 179.01 179.20 1hck n ASN 3 N -4.37 2.02 -4.08 3.06 4.13 -1.26 -4.90 115.26 109.86 1hck n ASN 3 Ca 0.11 -1.70 -0.25 0.00 1.68 0.00 0.00 54.58 54.43 1hck n ASN 3 Cb 0.65 -0.05 -0.16 0.00 -1.54 0.00 0.00 39.78 38.68 1hck n ASN 3 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1hck s PHE 4 N -1.90 1.51 -0.44 3.10 0.08 -0.61 -1.16 117.98 118.55 1hck s PHE 4 Ca 0.35 -0.46 -0.15 0.00 0.12 0.00 0.00 56.93 56.79 1hck s PHE 4 Cb 0.20 -1.05 0.05 0.00 -0.57 0.00 0.00 43.02 41.65 1hck s PHE 4 CO 0.31 -0.19 0.34 1.14 -0.10 0.00 0.00 175.22 176.72 1hck s GLN 5 N 0.24 2.95 0.04 0.44 -2.07 -0.31 -4.27 119.66 116.67 1hck s GLN 5 Ca -0.07 -1.20 -0.30 0.00 -1.82 0.00 0.00 55.36 51.97 1hck s GLN 5 Cb -0.12 -4.02 -0.07 0.00 -1.09 0.00 0.00 33.01 27.71 1hck s GLN 5 CO 0.02 -0.88 1.48 0.15 -1.32 0.00 0.00 175.29 174.74 1hck s LYS 6 N 1.64 4.26 -0.20 9.60 1.02 -1.26 -0.47 119.74 134.33 1hck s LYS 6 Ca 0.04 2.10 -0.14 0.00 0.02 0.00 0.00 55.97 57.99 1hck s LYS 6 Cb -0.22 -3.53 -0.20 0.00 -0.52 0.00 0.00 37.83 33.36 1hck s LYS 6 CO 0.08 -0.61 0.13 0.28 -0.92 0.00 0.00 175.35 174.31 1hck n VAL 7 N 4.58 1.61 -3.77 3.17 0.31 0.24 -4.94 118.33 119.52 1hck n VAL 7 Ca 0.14 -0.33 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 1hck n VAL 7 Cb 0.42 -1.86 -0.02 0.00 -0.91 0.00 0.00 33.84 31.47 1hck n VAL 7 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1hck s GLU 8 N -2.46 1.62 -0.44 5.55 2.02 -1.11 -4.97 118.70 118.91 1hck s GLU 8 Ca -0.29 -0.90 -0.14 0.00 0.02 0.00 0.00 54.97 53.66 1hck s GLU 8 Cb 0.08 0.58 0.06 0.00 0.10 0.00 0.00 34.13 34.95 1hck s GLU 8 CO 0.63 -0.73 0.34 0.21 0.02 0.00 0.00 175.26 175.73 1hck s LYS 9 N -3.89 2.91 0.26 1.61 2.20 -1.26 -0.18 119.74 121.38 1hck s LYS 9 Ca 0.10 -1.28 0.01 0.00 -0.36 0.00 0.00 55.97 54.45 1hck s LYS 9 Cb -0.04 -4.02 0.33 0.00 -1.51 0.00 0.00 37.83 32.60 1hck s LYS 9 CO 0.02 -0.93 1.67 0.82 -0.36 0.00 0.00 175.35 176.56 1hck h ILE 10 N 5.79 1.29 0.00 5.43 2.04 -1.27 -3.48 117.51 127.30 1hck h ILE 10 Ca -0.27 -1.43 0.00 0.00 1.00 0.00 0.00 64.86 64.16 1hck h ILE 10 Cb 1.11 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1hck h ILE 10 CO 0.81 0.45 0.00 0.61 0.00 0.00 0.00 178.15 180.02 1hck n GLY 11 N -0.20 -1.01 2.85 5.37 0.00 -1.07 -5.00 105.19 106.13 1hck n GLY 11 Ca -0.01 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 1hck n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hck s GLU 12 N -1.01 0.00 0.00 1.61 2.02 -1.26 -1.23 118.70 118.83 1hck s GLU 12 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 54.97 55.07 1hck s GLU 12 Cb 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 34.13 34.16 1hck s GLU 12 CO 0.00 -0.05 0.00 0.41 0.02 0.00 0.00 175.26 175.64 1hck n GLY 13 N 3.41 6.16 0.18 -1.39 0.00 -0.01 -4.99 105.19 108.55 1hck n GLY 13 Ca -0.17 -1.87 -0.06 0.00 0.00 0.00 0.00 46.02 43.92 1hck n GLY 13 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1hck h THR 14 N 0.28 1.36 -0.03 2.61 1.35 -1.92 -2.40 112.91 114.15 1hck h THR 14 Ca 0.00 -1.90 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 1hck h THR 14 Cb 0.00 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1hck h THR 14 CO 0.00 0.57 0.00 -1.22 -0.25 0.00 0.00 175.52 174.62 1hck n TYR 15 N -3.91 0.02 0.00 4.73 4.01 -1.26 -2.01 117.16 118.74 1hck n TYR 15 Ca -0.03 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1hck n TYR 15 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1hck n TYR 15 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hck n GLY 16 N 1.25 0.92 3.82 2.72 0.00 -1.22 -0.61 105.19 112.07 1hck n GLY 16 Ca 0.17 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.79 1hck n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hck s VAL 17 N -1.19 4.71 -0.15 1.61 1.01 -1.17 -0.83 120.40 124.39 1hck s VAL 17 Ca 0.00 1.16 -0.03 0.00 0.00 0.00 0.00 61.98 63.11 1hck s VAL 17 Cb 0.00 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1hck s VAL 17 CO 0.00 0.40 -0.05 -0.69 0.00 0.00 0.00 175.10 174.75 1hck s VAL 18 N -1.30 3.73 0.06 2.92 1.01 -0.37 -1.63 120.40 124.83 1hck s VAL 18 Ca 0.35 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 61.99 1hck s VAL 18 Cb -0.18 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 1hck s VAL 18 CO 0.20 0.49 -0.21 -0.31 0.00 0.00 0.00 175.10 175.27 1hck s TYR 19 N 0.42 1.85 0.07 5.22 2.02 -0.50 -0.76 117.35 125.68 1hck s TYR 19 Ca -0.05 -0.39 -0.24 0.00 -0.37 0.00 0.00 57.07 56.02 1hck s TYR 19 Cb -0.15 -1.08 -0.06 0.00 -0.40 0.00 0.00 41.96 40.28 1hck s TYR 19 CO 0.03 0.13 0.73 0.21 -1.57 0.00 0.00 175.55 175.09 1hck s LYS 20 N -1.39 4.47 0.03 -0.62 2.20 0.74 -1.31 119.74 123.86 1hck s LYS 20 Ca 0.08 1.03 -0.09 0.00 -0.36 0.00 0.00 55.97 56.62 1hck s LYS 20 Cb -0.09 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.90 1hck s LYS 20 CO 0.03 0.39 0.18 0.00 -0.36 0.00 0.00 175.35 175.59 1hck s ALA 21 N -0.41 -0.36 -0.13 3.13 0.00 -0.85 -0.59 121.76 122.54 1hck s ALA 21 Ca 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 1hck s ALA 21 Cb -0.21 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1hck s ALA 21 CO 0.23 -0.31 -0.10 0.50 0.00 0.00 0.00 175.76 176.08 1hck s ARG 22 N -2.19 3.43 -0.02 0.00 3.52 0.38 -1.12 118.95 122.95 1hck s ARG 22 Ca -0.08 -0.63 -0.30 0.00 -0.13 0.00 0.00 55.73 54.59 1hck s ARG 22 Cb -0.03 -2.71 -0.04 0.00 -1.56 0.00 0.00 34.95 30.61 1hck s ARG 22 CO -0.02 0.25 1.22 1.21 -0.81 0.00 0.00 175.30 177.15 1hck s ASN 23 N 0.28 7.04 0.34 -2.12 3.84 -0.17 -1.17 114.94 122.99 1hck s ASN 23 Ca -0.07 1.89 0.18 0.00 0.21 0.00 0.00 52.86 55.07 1hck s ASN 23 Cb -0.15 -2.56 0.23 0.00 -0.55 0.00 0.00 41.25 38.22 1hck s ASN 23 CO 0.05 -0.56 1.53 0.11 -2.79 0.00 0.00 177.10 175.43 1hck h LYS 24 N 7.32 0.00 -0.00 0.43 1.57 -1.47 1.42 116.57 125.83 1hck h LYS 24 Ca -0.37 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.41 1hck h LYS 24 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1hck h LYS 24 CO 0.86 0.33 -0.22 1.47 -0.57 0.00 0.00 179.45 181.32 1hck n LEU 25 N -3.20 0.59 0.00 2.94 -0.00 -1.26 -4.35 117.00 111.71 1hck n LEU 25 Ca 0.02 -0.02 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1hck n LEU 25 Cb 0.65 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.85 1hck n LEU 25 CO 0.38 0.12 -0.02 0.35 -0.00 0.00 0.00 177.39 178.21 1hck n THR 26 N -1.04 0.00 -0.00 1.47 -2.24 -1.18 -5.03 114.28 106.26 1hck n THR 26 Ca 0.11 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1hck n THR 26 Cb 0.32 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1hck n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hck n GLY 27 N 0.17 1.83 3.77 3.38 0.00 0.48 -4.97 105.19 109.86 1hck n GLY 27 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1hck n GLY 27 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1hck s GLU 28 N -0.00 4.04 -0.09 1.61 -1.05 -1.25 -4.67 118.70 117.29 1hck s GLU 28 Ca 0.00 1.74 -0.16 0.00 -0.15 0.00 0.00 54.97 56.40 1hck s GLU 28 Cb 0.00 -2.60 -0.05 0.00 -0.44 0.00 0.00 34.13 31.04 1hck s GLU 28 CO 0.00 -0.31 0.40 0.14 0.95 0.00 0.00 175.26 176.45 1hck s VAL 29 N -1.49 5.17 0.37 1.83 -7.23 -1.26 -1.00 120.40 116.79 1hck s VAL 29 Ca 0.58 0.81 0.04 0.00 -1.81 0.00 0.00 61.98 61.60 1hck s VAL 29 Cb -0.28 -3.73 -0.03 0.00 0.56 0.00 0.00 36.38 32.89 1hck s VAL 29 CO 0.35 0.42 0.13 0.68 -0.31 0.00 0.00 175.10 176.38 1hck s VAL 30 N 0.06 0.58 -0.19 1.32 -7.23 -0.27 -4.29 120.40 110.37 1hck s VAL 30 Ca 0.23 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.36 1hck s VAL 30 Cb -0.15 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 1hck s VAL 30 CO 0.09 0.00 -0.03 0.00 -0.31 0.00 0.00 175.10 174.86 1hck s ALA 31 N -3.33 2.94 -0.18 1.32 0.00 0.53 -2.00 121.76 121.03 1hck s ALA 31 Ca 0.29 -0.99 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 1hck s ALA 31 Cb 0.04 -1.67 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1hck s ALA 31 CO 0.16 -0.11 -0.09 -1.17 0.00 0.00 0.00 175.76 174.55 1hck s LEU 32 N 0.94 2.77 -0.32 0.00 2.96 -0.43 0.15 118.68 124.74 1hck s LEU 32 Ca 0.00 -0.39 -0.05 0.00 -0.22 0.00 0.00 54.13 53.48 1hck s LEU 32 Cb -0.14 -1.67 0.04 0.00 0.50 0.00 0.00 46.19 44.91 1hck s LEU 32 CO 0.01 0.05 0.07 -0.75 -1.32 0.00 0.00 176.35 174.41 1hck s LYS 33 N 1.05 2.56 -0.14 1.98 2.20 0.19 -1.41 119.74 126.17 1hck s LYS 33 Ca 0.00 -1.20 -0.29 0.00 -0.36 0.00 0.00 55.97 54.11 1hck s LYS 33 Cb -0.15 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.80 1hck s LYS 33 CO -0.01 -0.65 1.14 0.15 -0.36 0.00 0.00 175.35 175.62 1hck s LYS 34 N 1.35 4.31 0.09 4.03 1.02 -0.64 -0.86 119.74 129.04 1hck s LYS 34 Ca -0.03 1.53 -0.27 0.00 0.02 0.00 0.00 55.97 57.23 1hck s LYS 34 Cb -0.20 -3.64 -0.06 0.00 -0.52 0.00 0.00 37.83 33.42 1hck s LYS 34 CO 0.01 -0.55 0.84 0.42 -0.92 0.00 0.00 175.35 175.16 1hck s ILE 35 N 2.81 4.57 0.00 2.17 -1.09 -0.63 -3.02 121.20 126.01 1hck s ILE 35 Ca 0.51 1.81 0.00 0.00 -2.23 0.00 0.00 60.65 60.74 1hck s ILE 35 Cb -0.20 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.48 1hck s ILE 35 CO 0.15 0.38 0.00 -1.14 -1.23 0.00 0.00 174.94 173.10 1hck n ARG 36 N 2.57 1.58 -2.99 2.79 0.63 0.21 -4.77 116.66 116.68 1hck n ARG 36 Ca -0.01 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.86 1hck n ARG 36 Cb 0.49 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.39 1hck n ARG 36 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1hck s THR 41 N 0.00 -0.82 -0.03 5.15 2.01 -1.26 -5.02 115.64 115.67 1hck s THR 41 Ca 0.00 -0.89 0.05 0.00 0.31 0.00 0.00 61.69 61.16 1hck s THR 41 Cb 0.00 -0.17 0.08 0.00 0.01 0.00 0.00 72.50 72.42 1hck s THR 41 CO 0.00 -0.17 0.93 -1.84 -0.69 0.00 0.00 174.62 172.86 1hck n GLU 42 N 3.43 0.85 0.00 4.92 0.00 -1.26 -4.97 120.64 123.61 1hck n GLU 42 Ca 0.17 -1.40 0.00 0.00 0.00 0.00 0.00 57.16 55.93 1hck n GLU 42 Cb 0.55 -0.85 0.00 0.00 0.00 0.00 0.00 31.44 31.13 1hck n GLU 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1hck n GLY 43 N -0.47 1.26 1.44 -1.84 0.00 -1.26 -4.96 105.19 99.36 1hck n GLY 43 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1hck n GLY 43 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1hck n VAL 44 N -1.43 -7.94 -1.69 1.61 0.31 -1.26 -4.85 118.33 103.07 1hck n VAL 44 Ca 0.00 1.72 -0.54 0.00 -0.01 0.00 0.00 64.34 65.51 1hck n VAL 44 Cb 0.00 -4.11 -0.06 0.00 -0.91 0.00 0.00 33.84 28.76 1hck n VAL 44 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1hck n PRO 45 N 0.96 1.58 -0.05 5.55 -0.02 -1.26 -4.86 135.00 136.90 1hck n PRO 45 Ca 0.00 0.58 0.17 0.00 -2.02 0.00 0.00 63.50 62.23 1hck n PRO 45 Cb 0.00 -2.34 0.61 0.00 -0.02 0.00 0.00 33.50 31.75 1hck n PRO 45 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1hck h SER 46 N 8.22 0.17 -0.04 2.55 4.64 -1.99 0.31 113.55 127.40 1hck h SER 46 Ca -0.47 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1hck h SER 46 Cb 1.30 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1hck h SER 46 CO 0.96 0.09 0.01 0.71 -0.87 0.00 0.00 176.83 177.73 1hck h THR 47 N 0.18 1.19 -0.17 2.95 1.35 -1.98 -2.31 112.91 114.11 1hck h THR 47 Ca 0.28 -0.56 0.03 0.00 -0.55 0.00 0.00 66.41 65.61 1hck h THR 47 Cb 0.85 1.49 -0.03 0.00 -1.73 0.00 0.00 68.15 68.72 1hck h THR 47 CO -0.05 0.15 -0.03 0.00 -0.25 0.00 0.00 175.52 175.35 1hck h ALA 48 N 0.79 0.13 0.00 6.62 0.00 -1.22 -1.43 119.26 124.15 1hck h ALA 48 Ca 0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1hck h ALA 48 Cb 0.24 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1hck h ALA 48 CO 0.00 -0.47 -0.09 -0.84 0.00 0.00 0.00 179.25 177.85 1hck h ILE 49 N 0.02 0.58 0.00 0.00 -0.00 -1.26 -1.47 117.51 115.38 1hck h ILE 49 Ca 0.08 -0.38 -0.18 0.00 -0.00 0.00 0.00 64.86 64.38 1hck h ILE 49 Cb 0.12 1.24 -0.03 0.00 -0.00 0.00 0.00 36.82 38.16 1hck h ILE 49 CO -0.17 0.09 -0.92 0.03 -0.00 0.00 0.00 178.15 177.18 1hck h ARG 50 N 0.00 0.00 -0.07 0.16 3.08 -0.71 -2.99 114.38 113.85 1hck h ARG 50 Ca -0.00 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.82 1hck h ARG 50 Cb 0.24 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.30 1hck h ARG 50 CO 0.01 0.74 -0.88 0.93 -1.07 0.00 0.00 179.97 179.71 1hck h GLU 51 N 0.00 0.66 -0.33 0.04 4.39 -0.39 -2.98 114.58 115.96 1hck h GLU 51 Ca -0.04 -0.61 -0.05 0.00 0.34 0.00 0.00 59.36 59.00 1hck h GLU 51 Cb 1.65 0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 30.43 1hck h GLU 51 CO 0.10 1.22 0.00 0.82 -1.16 0.00 0.00 179.01 179.99 1hck h ILE 52 N 0.41 1.26 0.00 3.13 1.08 -1.45 -2.69 117.51 119.25 1hck h ILE 52 Ca -0.08 -0.95 0.00 0.00 -0.39 0.00 0.00 64.86 63.44 1hck h ILE 52 Cb 1.51 1.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.48 1hck h ILE 52 CO 0.17 0.31 0.00 0.28 -0.69 0.00 0.00 178.15 178.22 1hck h SER 53 N 0.39 0.00 -0.20 1.72 0.02 -1.55 0.10 113.55 114.03 1hck h SER 53 Ca 0.09 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.85 1hck h SER 53 Cb 0.44 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.99 1hck h SER 53 CO 0.02 0.00 -0.62 -0.07 -1.14 0.00 0.00 176.83 175.01 1hck h LEU 54 N 0.00 0.89 -1.75 5.07 3.38 -1.32 -3.17 115.31 118.40 1hck h LEU 54 Ca 0.00 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1hck h LEU 54 Cb 0.21 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1hck h LEU 54 CO 0.00 1.32 0.15 -0.07 0.09 0.00 0.00 178.44 179.93 1hck h LEU 55 N 0.50 0.27 -2.07 1.67 3.38 -0.86 -2.70 115.31 115.50 1hck h LEU 55 Ca -0.02 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.03 1hck h LEU 55 Cb 1.25 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1hck h LEU 55 CO 0.13 0.21 0.35 0.11 0.09 0.00 0.00 178.44 179.33 1hck h LYS 56 N 0.32 0.00 -0.01 1.13 1.57 -1.49 0.21 116.57 118.29 1hck h LYS 56 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1hck h LYS 56 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1hck h LYS 56 CO -0.02 0.00 -0.48 0.39 -0.57 0.00 0.00 179.45 178.78 1hck n GLU 57 N -3.71 0.63 -3.00 3.15 4.71 -1.02 -4.70 120.64 116.70 1hck n GLU 57 Ca 0.05 -0.44 -0.44 0.00 -0.01 0.00 0.00 57.16 56.31 1hck n GLU 57 Cb 0.51 -1.49 -0.01 0.00 -1.01 0.00 0.00 31.44 29.43 1hck n GLU 57 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1hck s LEU 58 N -2.68 5.29 -0.16 -4.62 2.96 0.73 -5.00 118.68 115.20 1hck s LEU 58 Ca 0.18 -2.60 -0.05 0.00 -0.22 0.00 0.00 54.13 51.44 1hck s LEU 58 Cb 0.18 -2.37 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 1hck s LEU 58 CO 0.62 -0.84 0.00 0.20 -1.32 0.00 0.00 176.35 175.02 1hck s ASN 59 N 3.02 5.14 -0.09 3.68 0.01 -1.26 -4.94 114.94 120.51 1hck s ASN 59 Ca 0.35 -0.02 -0.19 0.00 -0.71 0.00 0.00 52.86 52.30 1hck s ASN 59 Cb -0.05 -1.81 0.04 0.00 0.41 0.00 0.00 41.25 39.84 1hck s ASN 59 CO -0.05 0.20 0.45 -2.28 -1.51 0.00 0.00 177.10 173.90 1hck s HIS 60 N 0.21 -0.41 0.35 2.20 2.46 -1.26 -5.05 115.29 113.80 1hck s HIS 60 Ca 0.00 0.83 0.34 0.00 0.47 0.00 0.00 55.06 56.70 1hck s HIS 60 Cb -0.13 0.19 1.83 0.00 -0.13 0.00 0.00 32.58 34.34 1hck s HIS 60 CO 0.02 -0.38 2.02 -1.00 -2.47 0.00 0.00 174.74 172.93 1hck h PRO 61 N 4.30 0.00 -0.30 2.88 0.13 -1.99 -1.63 132.00 135.40 1hck h PRO 61 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1hck h PRO 61 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1hck h PRO 61 CO 0.32 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.18 1hck n ASN 62 N -2.73 3.84 -4.12 1.44 4.13 -1.26 -4.88 115.26 111.68 1hck n ASN 62 Ca -0.02 -2.83 -0.31 0.00 1.68 0.00 0.00 54.58 53.10 1hck n ASN 62 Cb 0.11 -0.50 -0.17 0.00 -1.54 0.00 0.00 39.78 37.69 1hck n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1hck s ILE 63 N -2.50 1.82 -0.04 2.41 -1.09 -0.61 -1.09 121.20 120.10 1hck s ILE 63 Ca 0.40 -0.83 -0.30 0.00 -2.23 0.00 0.00 60.65 57.69 1hck s ILE 63 Cb 0.31 -1.63 -0.07 0.00 -1.58 0.00 0.00 42.46 39.49 1hck s ILE 63 CO 0.11 0.50 1.96 -0.69 -1.23 0.00 0.00 174.94 175.59 1hck s VAL 64 N 0.92 3.12 0.06 2.92 1.01 -0.62 -4.59 120.40 123.23 1hck s VAL 64 Ca -0.06 0.15 -0.31 0.00 0.00 0.00 0.00 61.98 61.76 1hck s VAL 64 Cb -0.15 -3.11 -0.07 0.00 0.00 0.00 0.00 36.38 33.05 1hck s VAL 64 CO -0.02 -0.03 1.48 -0.75 0.00 0.00 0.00 175.10 175.78 1hck s LYS 65 N 4.80 4.26 -0.58 2.72 2.20 -1.26 -4.88 119.74 127.00 1hck s LYS 65 Ca 0.88 2.13 -0.25 0.00 -0.36 0.00 0.00 55.97 58.37 1hck s LYS 65 Cb -0.39 -3.46 0.04 0.00 -1.51 0.00 0.00 37.83 32.52 1hck s LYS 65 CO 0.38 -0.58 1.01 -1.17 -0.36 0.00 0.00 175.35 174.63 1hck s LEU 66 N 2.00 3.95 -0.05 5.43 2.96 -1.26 -1.50 118.68 130.22 1hck s LEU 66 Ca 0.67 -0.35 -0.10 0.00 -0.22 0.00 0.00 54.13 54.14 1hck s LEU 66 Cb -0.36 -2.82 -0.05 0.00 0.50 0.00 0.00 46.19 43.45 1hck s LEU 66 CO 0.29 -1.34 0.44 -0.07 -1.32 0.00 0.00 176.35 174.35 1hck h LEU 67 N 11.34 -0.29 -8.36 -0.68 3.38 -0.97 -3.44 115.31 116.28 1hck h LEU 67 Ca -0.26 0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.48 1hck h LEU 67 Cb 1.07 0.08 -0.17 0.00 0.09 0.00 0.00 40.66 41.73 1hck h LEU 67 CO 1.13 0.10 -0.71 -1.81 0.09 0.00 0.00 178.44 177.24 1hck s ASP 68 N -4.77 1.06 -0.09 -0.43 1.01 -0.89 -4.99 116.67 107.57 1hck s ASP 68 Ca -0.05 -0.88 0.02 0.00 0.71 0.00 0.00 52.55 52.36 1hck s ASP 68 Cb 0.01 0.08 0.01 0.00 1.01 0.00 0.00 42.92 44.03 1hck s ASP 68 CO 0.15 -0.39 -0.15 0.54 0.21 0.00 0.00 175.17 175.53 1hck s VAL 69 N -2.98 1.40 -0.29 -1.27 0.11 -1.26 -0.31 120.40 115.80 1hck s VAL 69 Ca 0.06 -0.61 0.01 0.00 -2.93 0.00 0.00 61.98 58.50 1hck s VAL 69 Cb 0.01 -1.27 0.09 0.00 -1.53 0.00 0.00 36.38 33.67 1hck s VAL 69 CO -0.03 0.42 0.03 -0.63 -3.33 0.00 0.00 175.10 171.56 1hck s ILE 70 N 0.78 1.45 -0.74 7.04 1.01 0.61 -4.97 121.20 126.39 1hck s ILE 70 Ca -0.11 -1.56 -0.11 0.00 0.00 0.00 0.00 60.65 58.87 1hck s ILE 70 Cb -0.16 -1.96 0.19 0.00 0.01 0.00 0.00 42.46 40.55 1hck s ILE 70 CO 0.02 -0.45 0.64 -2.28 0.00 0.00 0.00 174.94 172.87 1hck s HIS 71 N 1.36 3.62 0.10 3.97 2.46 -1.20 -0.81 115.29 124.79 1hck s HIS 71 Ca 0.05 -2.17 0.10 0.00 0.47 0.00 0.00 55.06 53.50 1hck s HIS 71 Cb -0.18 -3.62 -0.04 0.00 -0.13 0.00 0.00 32.58 28.61 1hck s HIS 71 CO -0.14 -0.95 -0.25 0.95 -2.47 0.00 0.00 174.74 171.89 1hck s THR 72 N 0.21 2.06 -1.77 0.89 -4.23 -0.29 -4.59 115.64 107.92 1hck s THR 72 Ca 0.16 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1hck s THR 72 Cb -0.15 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.87 1hck s THR 72 CO -0.06 0.11 0.00 -0.62 -0.54 0.00 0.00 174.62 173.51 1hck n GLU 73 N 1.18 -1.56 -2.92 3.99 4.71 -1.26 0.84 120.64 125.62 1hck n GLU 73 Ca -0.18 0.99 -0.17 0.00 -0.01 0.00 0.00 57.16 57.79 1hck n GLU 73 Cb 0.53 -5.43 0.03 0.00 -1.01 0.00 0.00 31.44 25.56 1hck n GLU 73 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1hck n ASN 74 N -1.34 -5.06 -4.32 1.62 3.02 -1.26 -5.02 115.26 102.90 1hck n ASN 74 Ca -0.19 -0.25 -0.27 0.00 -0.03 0.00 0.00 54.58 53.84 1hck n ASN 74 Cb 0.61 -3.87 -0.13 0.00 -0.61 0.00 0.00 39.78 35.78 1hck n ASN 74 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1hck s LYS 75 N -5.52 1.37 -0.19 3.52 -0.14 0.25 -4.40 119.74 114.63 1hck s LYS 75 Ca 0.27 -1.16 -0.03 0.00 -1.36 0.00 0.00 55.97 53.69 1hck s LYS 75 Cb -0.12 -1.66 -0.01 0.00 -1.68 0.00 0.00 37.83 34.36 1hck s LYS 75 CO 0.33 0.40 -0.06 -0.51 -0.76 0.00 0.00 175.35 174.76 1hck s LEU 76 N -1.69 2.93 -0.05 3.17 1.43 -1.25 -1.14 118.68 122.08 1hck s LEU 76 Ca 0.10 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 1hck s LEU 76 Cb -0.10 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.41 1hck s LEU 76 CO 0.04 0.06 -0.10 -0.31 0.23 0.00 0.00 176.35 176.27 1hck s TYR 77 N 0.99 1.24 -0.15 0.29 2.02 0.01 -1.61 117.35 120.15 1hck s TYR 77 Ca -0.00 -0.42 -0.02 0.00 -0.37 0.00 0.00 57.07 56.26 1hck s TYR 77 Cb -0.15 -0.93 -0.02 0.00 -0.40 0.00 0.00 41.96 40.47 1hck s TYR 77 CO 0.00 -0.22 -0.08 -0.51 -1.57 0.00 0.00 175.55 173.17 1hck s LEU 78 N 0.60 2.99 -0.27 -1.29 1.43 -0.04 -0.28 118.68 121.82 1hck s LEU 78 Ca -0.12 -0.24 -0.08 0.00 -1.03 0.00 0.00 54.13 52.66 1hck s LEU 78 Cb -0.14 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 1hck s LEU 78 CO 0.02 0.15 0.11 -0.69 0.23 0.00 0.00 176.35 176.17 1hck s VAL 79 N 0.47 4.45 0.28 -1.59 1.01 0.57 0.54 120.40 126.13 1hck s VAL 79 Ca -0.06 -0.26 0.11 0.00 0.00 0.00 0.00 61.98 61.77 1hck s VAL 79 Cb -0.15 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 1hck s VAL 79 CO 0.04 0.23 -0.13 -0.36 0.00 0.00 0.00 175.10 174.88 1hck s PHE 80 N 1.62 2.43 0.58 5.22 0.08 0.12 -0.27 117.98 127.76 1hck s PHE 80 Ca 0.06 -0.31 -0.19 0.00 0.12 0.00 0.00 56.93 56.61 1hck s PHE 80 Cb -0.16 -1.09 -0.04 0.00 -0.57 0.00 0.00 43.02 41.16 1hck s PHE 80 CO 0.05 0.68 1.21 -1.83 -0.10 0.00 0.00 175.22 175.22 1hck s GLU 81 N -3.57 3.05 -0.18 0.44 -1.05 -0.56 -0.35 118.70 116.47 1hck s GLU 81 Ca 0.31 1.83 -0.10 0.00 -0.15 0.00 0.00 54.97 56.85 1hck s GLU 81 Cb -0.05 -1.97 -0.05 0.00 -0.44 0.00 0.00 34.13 31.62 1hck s GLU 81 CO 0.17 -1.15 0.16 0.12 0.95 0.00 0.00 175.26 175.51 1hck s PHE 82 N -1.59 3.44 -0.03 4.83 2.19 -1.26 -4.42 117.98 121.14 1hck s PHE 82 Ca 0.76 0.39 0.07 0.00 0.33 0.00 0.00 56.93 58.48 1hck s PHE 82 Cb -0.30 -2.16 -0.02 0.00 -1.31 0.00 0.00 43.02 39.22 1hck s PHE 82 CO 0.33 0.33 -0.23 -0.51 1.83 0.00 0.00 175.22 176.97 1hck s LEU 83 N 0.22 2.22 0.33 6.12 1.02 -1.26 -5.00 118.68 122.34 1hck s LEU 83 Ca 0.10 -0.41 0.07 0.00 0.02 0.00 0.00 54.13 53.92 1hck s LEU 83 Cb -0.11 -1.40 0.60 0.00 0.02 0.00 0.00 46.19 45.30 1hck s LEU 83 CO -0.00 0.32 1.80 0.45 0.02 0.00 0.00 176.35 178.94 1hck h HIS 84 N 5.50 0.29 -3.86 0.29 3.86 -1.99 -3.46 115.15 115.78 1hck h HIS 84 Ca -0.43 -0.06 -0.16 0.00 -1.16 0.00 0.00 60.37 58.57 1hck h HIS 84 Cb 1.13 -0.07 -0.20 0.00 1.06 0.00 0.00 27.41 29.32 1hck h HIS 84 CO 0.42 0.51 -0.63 -1.14 0.86 0.00 0.00 177.93 177.95 1hck s GLN 85 N -4.45 0.38 0.25 2.45 0.74 -1.22 -5.06 119.66 112.77 1hck s GLN 85 Ca -0.05 -0.59 0.06 0.00 0.05 0.00 0.00 55.36 54.83 1hck s GLN 85 Cb 0.14 0.14 -0.03 0.00 1.10 0.00 0.00 33.01 34.37 1hck s GLN 85 CO 0.76 -0.08 0.31 0.16 -0.55 0.00 0.00 175.29 175.90 1hck s ASP 86 N -1.54 6.01 0.47 6.67 1.47 -1.26 -0.98 116.67 127.51 1hck s ASP 86 Ca -0.14 -0.07 0.20 0.00 1.18 0.00 0.00 52.55 53.71 1hck s ASP 86 Cb -0.08 -1.64 1.18 0.00 -0.34 0.00 0.00 42.92 42.04 1hck s ASP 86 CO -0.01 -0.10 2.02 0.25 0.68 0.00 0.00 175.17 178.01 1hck h LEU 87 N 1.25 0.00 0.21 2.11 5.85 -0.76 -2.09 115.31 121.88 1hck h LEU 87 Ca -0.50 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 1hck h LEU 87 Cb 1.24 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1hck h LEU 87 CO 0.60 0.17 -0.10 0.50 -0.34 0.00 0.00 178.44 179.27 1hck h LYS 88 N 0.00 -0.27 -0.34 1.25 1.63 -1.81 0.33 116.57 117.35 1hck h LYS 88 Ca -0.00 0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.86 1hck h LYS 88 Cb 0.34 0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 31.99 1hck h LYS 88 CO 0.02 -0.11 0.08 -0.22 -3.45 0.00 0.00 179.45 175.77 1hck h LYS 89 N -0.38 0.20 -0.76 1.90 3.64 -1.84 -1.53 116.57 117.81 1hck h LYS 89 Ca -0.03 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.40 1hck h LYS 89 Cb 0.29 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.01 1hck h LYS 89 CO 0.05 0.13 0.46 0.35 -2.27 0.00 0.00 179.45 178.17 1hck h PHE 90 N 0.21 0.85 -0.56 1.91 3.57 -1.08 -1.33 116.94 120.51 1hck h PHE 90 Ca 0.16 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 1hck h PHE 90 Cb 0.16 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 1hck h PHE 90 CO -0.17 0.43 -0.02 0.52 -2.23 0.00 0.00 178.31 176.84 1hck h MET 91 N 0.85 1.00 0.00 1.11 2.86 -0.39 -1.22 114.93 119.13 1hck h MET 91 Ca 0.33 -0.33 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1hck h MET 91 Cb 0.16 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 1hck h MET 91 CO -0.17 1.01 -0.16 -0.44 1.06 0.00 0.00 176.91 178.21 1hck h ASP 92 N 0.88 0.00 0.75 1.22 3.32 -0.82 -1.64 116.42 120.13 1hck h ASP 92 Ca 0.16 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.96 1hck h ASP 92 Cb 0.57 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1hck h ASP 92 CO 0.03 0.16 -1.11 0.00 -1.72 0.00 0.00 179.24 176.60 1hck h ALA 93 N 1.84 0.24 -0.55 3.45 0.00 -0.60 -3.32 119.26 120.33 1hck h ALA 93 Ca -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.04 1hck h ALA 93 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1hck h ALA 93 CO 0.02 1.06 0.00 0.43 0.00 0.00 0.00 179.25 180.76 1hck n SER 94 N -3.49 5.39 -0.00 0.00 7.64 -0.52 -4.70 113.62 117.93 1hck n SER 94 Ca -0.05 -2.87 0.09 0.00 1.01 0.00 0.00 58.87 57.05 1hck n SER 94 Cb 0.96 -0.65 0.49 0.00 -1.01 0.00 0.00 64.21 64.00 1hck n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hck h ALA 95 N 3.76 1.91 0.03 -0.43 0.00 -1.42 0.80 119.26 123.90 1hck h ALA 95 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 1hck h ALA 95 Cb 1.84 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 1hck h ALA 95 CO 0.42 0.02 -1.53 -0.07 0.00 0.00 0.00 179.25 178.09 1hck h LEU 96 N 0.40 0.09 0.00 0.00 3.38 -1.89 -3.37 115.31 113.92 1hck h LEU 96 Ca 0.19 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1hck h LEU 96 Cb 0.25 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1hck h LEU 96 CO -0.05 1.13 -1.92 1.07 0.09 0.00 0.00 178.44 178.77 1hck n THR 97 N -3.21 0.19 -0.28 0.22 5.66 -1.13 -5.11 114.28 110.61 1hck n THR 97 Ca -0.14 -0.54 0.00 0.00 -3.05 0.00 0.00 64.05 60.33 1hck n THR 97 Cb 1.02 -0.08 -0.00 0.00 -1.55 0.00 0.00 70.33 69.72 1hck n THR 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1hck n GLY 98 N 1.29 -3.01 3.69 1.09 0.00 0.28 -4.83 105.19 103.70 1hck n GLY 98 Ca -0.06 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 1hck n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hck s ILE 99 N -4.23 4.30 0.50 -0.61 1.01 -1.26 -4.93 121.20 115.97 1hck s ILE 99 Ca 0.00 1.63 -0.24 0.00 0.00 0.00 0.00 60.65 62.04 1hck s ILE 99 Cb 0.00 -4.04 -0.07 0.00 0.01 0.00 0.00 42.46 38.36 1hck s ILE 99 CO 0.00 0.03 1.41 -2.16 0.00 0.00 0.00 174.94 174.22 1hck s PRO 100 N 1.91 3.43 0.31 2.79 0.04 -1.26 -4.75 135.00 137.46 1hck s PRO 100 Ca 0.56 2.36 0.05 0.00 0.04 0.00 0.00 61.00 64.00 1hck s PRO 100 Cb -0.25 -2.48 0.68 0.00 0.04 0.00 0.00 34.50 32.49 1hck s PRO 100 CO 0.23 -1.00 1.82 1.25 0.04 0.00 0.00 177.00 179.34 1hck h LEU 101 N 1.92 0.82 -1.60 -3.56 5.85 -1.99 0.23 115.31 116.99 1hck h LEU 101 Ca -0.51 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 1hck h LEU 101 Cb 1.28 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1hck h LEU 101 CO 0.59 0.38 -0.03 -0.65 -0.34 0.00 0.00 178.44 178.40 1hck h PRO 102 N 0.85 0.22 -0.09 5.25 0.11 -1.99 0.75 132.00 137.10 1hck h PRO 102 Ca 0.52 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.40 1hck h PRO 102 Cb 0.69 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.78 1hck h PRO 102 CO -0.29 0.27 -0.70 1.25 -0.21 0.00 0.00 178.00 178.31 1hck h LEU 103 N 0.21 0.78 -0.62 2.35 6.46 -1.36 -2.45 115.31 120.69 1hck h LEU 103 Ca 0.05 -0.67 0.02 0.00 -0.12 0.00 0.00 57.88 57.16 1hck h LEU 103 Cb 0.20 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 39.86 1hck h LEU 103 CO 0.01 1.33 0.40 0.40 -0.62 0.00 0.00 178.44 179.95 1hck h ILE 104 N 0.29 1.12 -0.34 4.05 2.04 -0.64 -1.06 117.51 122.96 1hck h ILE 104 Ca -0.06 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.43 1hck h ILE 104 Cb 1.35 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 1hck h ILE 104 CO 0.14 0.15 -0.19 0.50 0.00 0.00 0.00 178.15 178.75 1hck h LYS 105 N 0.80 0.64 -0.16 2.37 3.64 -0.90 -1.05 116.57 121.91 1hck h LYS 105 Ca 0.24 -0.23 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 1hck h LYS 105 Cb -0.05 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1hck h LYS 105 CO -0.07 0.79 -0.10 1.03 -2.27 0.00 0.00 179.45 178.83 1hck h SER 106 N 0.57 0.36 -0.27 4.20 0.87 -1.10 -1.98 113.55 116.21 1hck h SER 106 Ca 0.09 -0.43 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 1hck h SER 106 Cb 0.64 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 1hck h SER 106 CO 0.05 0.72 0.11 1.88 -0.53 0.00 0.00 176.83 179.06 1hck h TYR 107 N 0.01 0.40 -0.76 2.24 0.05 -1.07 -1.14 116.97 116.71 1hck h TYR 107 Ca 0.03 -0.03 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 1hck h TYR 107 Cb 0.59 -0.12 -0.03 0.00 1.01 0.00 0.00 36.73 38.18 1hck h TYR 107 CO 0.07 0.40 0.36 1.25 -1.05 0.00 0.00 178.16 179.19 1hck h LEU 108 N 0.29 1.01 -0.60 3.88 5.85 -1.25 -0.71 115.31 123.78 1hck h LEU 108 Ca 0.09 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1hck h LEU 108 Cb 0.16 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1hck h LEU 108 CO -0.01 0.87 0.38 0.15 -0.34 0.00 0.00 178.44 179.49 1hck h PHE 109 N 1.08 0.77 -0.29 1.25 3.57 -1.13 -0.92 116.94 121.27 1hck h PHE 109 Ca 0.26 0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.61 1hck h PHE 109 Cb 0.14 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1hck h PHE 109 CO 0.01 0.50 -0.45 1.96 -2.23 0.00 0.00 178.31 178.10 1hck h GLN 110 N 0.82 0.76 -0.79 1.11 4.20 -0.84 -2.41 115.11 117.95 1hck h GLN 110 Ca 0.22 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.45 1hck h GLN 110 Cb -0.06 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 1hck h GLN 110 CO -0.04 1.05 0.31 -0.07 -0.67 0.00 0.00 178.83 179.41 1hck h LEU 111 N 0.61 1.10 -0.96 1.46 3.38 -0.81 -1.19 115.31 118.90 1hck h LEU 111 Ca 0.04 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 1hck h LEU 111 Cb 1.02 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1hck h LEU 111 CO 0.10 0.98 -0.10 -0.07 0.09 0.00 0.00 178.44 179.43 1hck h LEU 112 N 1.16 0.62 -0.40 1.67 3.38 -1.14 0.12 115.31 120.73 1hck h LEU 112 Ca 0.26 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1hck h LEU 112 Cb 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1hck h LEU 112 CO -0.02 0.76 0.10 1.56 0.09 0.00 0.00 178.44 180.93 1hck h GLN 113 N 0.59 0.63 -0.54 1.13 4.20 -0.89 0.12 115.11 120.34 1hck h GLN 113 Ca 0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1hck h GLN 113 Cb 0.53 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1hck h GLN 113 CO 0.03 0.65 0.24 0.78 -0.67 0.00 0.00 178.83 179.87 1hck h GLY 114 N 0.50 0.85 0.91 3.46 0.00 -0.78 -2.44 103.07 105.57 1hck h GLY 114 Ca 0.13 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1hck h GLY 114 CO 0.00 0.42 0.07 1.41 0.00 0.00 0.00 176.54 178.44 1hck h LEU 115 N 0.73 0.55 -1.46 3.11 3.38 -0.83 -2.13 115.31 118.66 1hck h LEU 115 Ca 0.18 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.96 1hck h LEU 115 Cb 0.16 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1hck h LEU 115 CO -0.02 0.66 0.43 0.00 0.09 0.00 0.00 178.44 179.59 1hck h ALA 116 N 0.91 1.75 -0.06 1.53 0.00 -0.83 0.24 119.26 122.81 1hck h ALA 116 Ca 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1hck h ALA 116 Cb 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1hck h ALA 116 CO 0.00 0.15 -0.05 0.35 0.00 0.00 0.00 179.25 179.70 1hck h PHE 117 N 0.67 0.16 -0.52 0.00 3.57 -1.16 -2.28 116.94 117.38 1hck h PHE 117 Ca 0.28 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 1hck h PHE 117 Cb 0.24 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1hck h PHE 117 CO -0.00 0.58 0.05 0.00 -2.23 0.00 0.00 178.31 176.71 1hck h HIS 119 N 0.75 0.47 0.00 0.00 3.86 -0.54 -0.06 115.15 119.64 1hck h HIS 119 Ca 0.15 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1hck h HIS 119 Cb 0.44 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.76 1hck h HIS 119 CO 0.03 0.32 0.00 0.66 0.86 0.00 0.00 177.93 179.81 1hck h SER 120 N 0.50 0.00 -0.57 2.45 4.64 -1.31 -2.26 113.55 116.99 1hck h SER 120 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1hck h SER 120 Cb -0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1hck h SER 120 CO -0.02 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.35 1hck n HIS 121 N -2.33 1.42 -2.34 4.77 8.25 -0.20 -4.93 115.22 119.85 1hck n HIS 121 Ca 0.04 -0.65 -0.18 0.00 -0.26 0.00 0.00 57.72 56.67 1hck n HIS 121 Cb 0.35 -0.27 -0.01 0.00 1.12 0.00 0.00 29.99 31.18 1hck n HIS 121 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1hck n ARG 122 N 0.82 -1.82 -3.90 -0.41 5.12 -0.85 -4.97 116.66 110.65 1hck n ARG 122 Ca 0.24 0.89 -0.36 0.00 -1.93 0.00 0.00 57.85 56.70 1hck n ARG 122 Cb 0.89 -5.51 -0.13 0.00 -1.16 0.00 0.00 32.46 26.55 1hck n ARG 122 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1hck s VAL 123 N -2.87 4.02 0.12 1.55 1.01 -0.24 -5.00 120.40 119.00 1hck s VAL 123 Ca 0.00 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1hck s VAL 123 Cb 0.00 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1hck s VAL 123 CO 0.00 0.39 0.09 -0.76 0.00 0.00 0.00 175.10 174.81 1hck s LEU 124 N 1.35 3.72 -0.17 3.92 1.02 -1.26 -3.35 118.68 123.91 1hck s LEU 124 Ca 0.05 -0.11 -0.16 0.00 0.02 0.00 0.00 54.13 53.93 1hck s LEU 124 Cb -0.15 -2.38 -0.12 0.00 0.02 0.00 0.00 46.19 43.56 1hck s LEU 124 CO 0.02 0.13 0.07 -0.74 0.02 0.00 0.00 176.35 175.84 1hck h HIS 125 N 2.92 0.00 0.00 0.29 2.76 -1.95 -3.24 115.15 115.93 1hck h HIS 125 Ca -0.47 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.70 1hck h HIS 125 Cb 1.18 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1hck h HIS 125 CO 0.60 0.79 0.00 2.89 -1.30 0.00 0.00 177.93 180.91 1hck n ARG 126 N -4.53 0.00 -2.73 5.26 1.85 -1.26 -4.37 116.66 110.88 1hck n ARG 126 Ca -0.19 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.60 1hck n ARG 126 Cb 0.47 -3.34 0.04 0.00 -1.05 0.00 0.00 32.46 28.58 1hck n ARG 126 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1hck n ASP 127 N 0.00 1.51 -4.74 2.89 2.03 -1.26 -5.03 116.55 111.95 1hck n ASP 127 Ca 0.00 -2.43 -0.41 0.00 0.52 0.00 0.00 54.79 52.46 1hck n ASP 127 Cb 0.00 -0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 39.86 1hck n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1hck s LEU 128 N -3.40 4.42 0.07 -2.67 1.43 -1.26 -4.92 118.68 112.35 1hck s LEU 128 Ca 0.27 2.34 -0.26 0.00 -1.03 0.00 0.00 54.13 55.45 1hck s LEU 128 Cb 0.40 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 43.10 1hck s LEU 128 CO 0.01 -0.49 0.72 -1.59 0.23 0.00 0.00 176.35 175.22 1hck s LYS 129 N -0.04 1.08 0.54 1.70 -2.85 -1.26 -4.74 119.74 114.18 1hck s LYS 129 Ca 0.56 -0.33 0.27 0.00 -1.00 0.00 0.00 55.97 55.47 1hck s LYS 129 Cb -0.35 0.50 1.44 0.00 -2.06 0.00 0.00 37.83 37.36 1hck s LYS 129 CO 0.37 -0.46 1.98 -1.35 0.10 0.00 0.00 175.35 175.99 1hck h PRO 130 N 2.11 0.00 0.00 1.78 0.11 -1.95 -1.50 132.00 132.56 1hck h PRO 130 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1hck h PRO 130 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1hck h PRO 130 CO 0.35 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 180.10 1hck h GLN 131 N 0.00 0.00 -0.44 1.05 4.20 -1.96 -2.90 115.11 115.07 1hck h GLN 131 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1hck h GLN 131 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 1hck h GLN 131 CO -0.00 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.25 1hck n ASN 132 N -2.66 3.32 -4.17 1.46 3.02 -0.56 -4.86 115.26 110.80 1hck n ASN 132 Ca 0.02 -1.97 -0.34 0.00 -0.03 0.00 0.00 54.58 52.26 1hck n ASN 132 Cb 0.31 -0.28 -0.14 0.00 -0.61 0.00 0.00 39.78 39.05 1hck n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1hck s LEU 133 N -1.38 3.27 0.01 3.41 1.43 -1.11 0.21 118.68 124.52 1hck s LEU 133 Ca 0.40 -1.01 0.01 0.00 -1.03 0.00 0.00 54.13 52.50 1hck s LEU 133 Cb 0.22 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 1hck s LEU 133 CO 0.31 -0.15 0.04 -0.76 0.23 0.00 0.00 176.35 176.02 1hck s LEU 134 N 1.27 3.71 0.11 1.79 1.43 0.41 -0.62 118.68 126.79 1hck s LEU 134 Ca -0.02 0.06 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 1hck s LEU 134 Cb -0.17 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 1hck s LEU 134 CO -0.05 0.26 -0.14 0.27 0.23 0.00 0.00 176.35 176.93 1hck s ILE 135 N -1.17 1.28 0.53 -0.59 -4.36 -0.15 0.18 121.20 116.92 1hck s ILE 135 Ca 0.22 -1.62 0.00 0.00 -0.26 0.00 0.00 60.65 58.99 1hck s ILE 135 Cb -0.12 -1.43 0.00 0.00 1.25 0.00 0.00 42.46 42.16 1hck s ILE 135 CO 0.13 -0.37 0.02 -0.46 0.24 0.00 0.00 174.94 174.50 1hck n ASN 136 N 0.71 3.42 0.00 4.36 0.23 -1.00 -3.41 115.26 119.56 1hck n ASN 136 Ca -0.17 -3.27 0.09 0.00 -0.53 0.00 0.00 54.58 50.70 1hck n ASN 136 Cb 0.56 0.34 0.39 0.00 -2.08 0.00 0.00 39.78 39.00 1hck n ASN 136 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1hck n THR 137 N -1.33 0.74 1.05 5.53 -2.24 -1.26 -3.08 114.28 113.68 1hck n THR 137 Ca -0.21 0.18 0.12 0.00 -2.27 0.00 0.00 64.05 61.88 1hck n THR 137 Cb 0.66 -0.88 0.29 0.00 -2.10 0.00 0.00 70.33 68.30 1hck n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1hck n GLU 138 N -1.48 0.16 -0.26 -0.78 4.71 -1.26 -4.51 120.64 117.22 1hck n GLU 138 Ca 0.05 -0.09 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 1hck n GLU 138 Cb 0.20 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.14 1hck n GLU 138 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1hck n GLY 139 N 1.47 1.07 3.80 0.62 0.00 -1.18 -4.66 105.19 106.32 1hck n GLY 139 Ca 0.07 -0.22 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 1hck n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hck s ALA 140 N -2.00 3.65 -0.00 4.61 0.00 -1.26 -4.87 121.76 121.89 1hck s ALA 140 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1hck s ALA 140 Cb 0.00 -1.53 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 1hck s ALA 140 CO 0.00 0.76 -0.07 -1.50 0.00 0.00 0.00 175.76 174.94 1hck s ILE 141 N -1.38 0.57 0.05 0.00 2.07 -1.26 -2.39 121.20 118.86 1hck s ILE 141 Ca 0.29 -0.32 0.04 0.00 -1.41 0.00 0.00 60.65 59.25 1hck s ILE 141 Cb -0.12 -0.48 -0.02 0.00 0.13 0.00 0.00 42.46 41.96 1hck s ILE 141 CO 0.22 0.15 -0.11 -0.54 -1.91 0.00 0.00 174.94 172.75 1hck s LYS 142 N -0.19 0.68 -0.25 3.50 1.02 0.13 -4.65 119.74 119.99 1hck s LYS 142 Ca 0.03 -0.78 -0.23 0.00 0.02 0.00 0.00 55.97 55.00 1hck s LYS 142 Cb -0.03 -0.59 -0.01 0.00 -0.52 0.00 0.00 37.83 36.68 1hck s LYS 142 CO -0.00 0.13 0.77 -0.51 -0.92 0.00 0.00 175.35 174.82 1hck s LEU 143 N -1.46 4.08 0.19 3.17 1.43 -0.25 -0.45 118.68 125.39 1hck s LEU 143 Ca -0.05 0.95 0.04 0.00 -1.03 0.00 0.00 54.13 54.04 1hck s LEU 143 Cb -0.09 -3.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.00 1hck s LEU 143 CO 0.01 -0.48 0.27 0.00 0.23 0.00 0.00 176.35 176.38 1hck s ALA 144 N 2.74 3.85 -1.78 4.21 0.00 0.13 -1.59 121.76 129.32 1hck s ALA 144 Ca 0.32 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1hck s ALA 144 Cb -0.15 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.32 1hck s ALA 144 CO 0.08 0.43 0.00 -0.25 0.00 0.00 0.00 175.76 176.01 1hck n ASP 145 N -0.79 -5.63 -4.66 0.00 8.00 -1.26 -4.84 116.55 107.36 1hck n ASP 145 Ca -0.08 0.09 -0.42 0.00 0.71 0.00 0.00 54.79 55.09 1hck n ASP 145 Cb 0.55 -4.75 -0.03 0.00 -0.02 0.00 0.00 41.12 36.88 1hck n ASP 145 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1hck s PHE 146 N -2.94 1.80 0.00 1.24 2.19 -1.26 -2.96 117.98 116.05 1hck s PHE 146 Ca 0.00 0.02 0.00 0.00 0.33 0.00 0.00 56.93 57.28 1hck s PHE 146 Cb 0.00 -4.01 0.00 0.00 -1.31 0.00 0.00 43.02 37.70 1hck s PHE 146 CO 0.00 -4.33 0.00 0.41 1.83 0.00 0.00 175.22 173.13 1hck n GLY 147 N 4.24 1.30 0.15 13.12 0.00 -1.23 -4.92 105.19 117.85 1hck n GLY 147 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 1hck n GLY 147 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1hck h LEU 148 N 0.00 0.07 -0.79 0.99 4.07 -1.83 -2.73 115.31 115.08 1hck h LEU 148 Ca 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1hck h LEU 148 Cb 0.00 -0.02 -0.04 0.00 1.08 0.00 0.00 40.66 41.68 1hck h LEU 148 CO 0.00 0.63 0.51 0.00 -1.08 0.00 0.00 178.44 178.50 1hck h ALA 149 N 1.37 1.01 0.72 1.53 0.00 -1.80 0.30 119.26 122.39 1hck h ALA 149 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1hck h ALA 149 Cb 1.03 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1hck h ALA 149 CO 0.08 0.44 -0.45 -0.09 0.00 0.00 0.00 179.25 179.23 1hck h ARG 150 N 1.08 -1.05 -0.58 0.00 2.43 -1.83 0.64 114.38 115.07 1hck h ARG 150 Ca 0.29 0.07 0.12 0.00 -0.81 0.00 0.00 59.98 59.65 1hck h ARG 150 Cb -0.10 0.24 -0.10 0.00 -0.42 0.00 0.00 29.97 29.59 1hck h ARG 150 CO -0.06 -0.70 0.01 0.00 -1.51 0.00 0.00 179.97 177.71 1hck h ALA 151 N -1.25 0.57 -0.00 2.80 0.00 -1.13 -3.20 119.26 117.06 1hck h ALA 151 Ca -0.10 0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1hck h ALA 151 Cb 0.88 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1hck h ALA 151 CO 0.09 -0.38 -0.71 1.19 0.00 0.00 0.00 179.25 179.44 1hck n PHE 152 N -5.26 0.00 -2.34 0.00 3.72 0.10 -4.57 117.46 109.12 1hck n PHE 152 Ca 0.08 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.47 1hck n PHE 152 Cb 0.33 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.87 1hck n PHE 152 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hck n GLY 153 N 1.36 -3.42 2.20 1.37 0.00 0.22 -4.89 105.19 102.03 1hck n GLY 153 Ca 0.03 0.33 -0.38 0.00 0.00 0.00 0.00 46.02 46.00 1hck n GLY 153 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1hck n VAL 154 N 0.35 0.00 -3.44 1.61 3.14 -1.24 -5.00 118.33 113.74 1hck n VAL 154 Ca 0.01 0.00 -0.20 0.00 -2.96 0.00 0.00 64.34 61.19 1hck n VAL 154 Cb 0.05 -0.08 -0.00 0.00 -1.06 0.00 0.00 33.84 32.74 1hck n VAL 154 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1hck s PRO 155 N 0.51 3.18 -0.09 1.45 0.04 -1.26 -5.07 135.00 133.77 1hck s PRO 155 Ca 0.58 -0.81 -0.27 0.00 0.04 0.00 0.00 61.00 60.55 1hck s PRO 155 Cb -0.82 -2.76 -0.24 0.00 0.04 0.00 0.00 34.50 30.71 1hck s PRO 155 CO 0.39 0.06 0.96 -0.24 0.04 0.00 0.00 177.00 178.21 1hck h VAL 156 N 0.82 1.63 -3.40 -0.36 3.04 -1.96 -3.45 116.25 112.57 1hck h VAL 156 Ca -0.47 -1.96 -0.68 0.00 -1.01 0.00 0.00 66.70 62.58 1hck h VAL 156 Cb 1.25 2.93 -0.16 0.00 -2.01 0.00 0.00 31.29 33.30 1hck h VAL 156 CO 0.56 0.52 -0.64 -0.13 -1.01 0.00 0.00 177.57 176.86 1hck s ARG 157 N -2.95 2.96 1.03 4.17 1.81 -1.26 -1.27 118.95 123.44 1hck s ARG 157 Ca -0.17 -0.44 -0.12 0.00 -1.72 0.00 0.00 55.73 53.27 1hck s ARG 157 Cb -0.01 -2.75 0.21 0.00 -0.45 0.00 0.00 34.95 31.95 1hck s ARG 157 CO 0.70 0.67 1.07 0.95 -0.68 0.00 0.00 175.30 178.02 1hck s THR 158 N -0.81 2.20 0.51 0.02 -4.23 0.17 -4.76 115.64 108.74 1hck s THR 158 Ca 0.12 0.06 0.35 0.00 -1.18 0.00 0.00 61.69 61.04 1hck s THR 158 Cb -0.11 -2.27 0.54 0.00 1.34 0.00 0.00 72.50 71.99 1hck s THR 158 CO 0.02 -0.08 1.77 0.10 -0.54 0.00 0.00 174.62 175.88 1hck h TYR 159 N -2.13 0.15 -2.09 3.99 -0.00 -0.87 0.20 116.97 116.22 1hck h TYR 159 Ca -0.54 0.01 -0.73 0.00 -0.00 0.00 0.00 58.73 57.46 1hck h TYR 159 Cb 1.31 -0.04 -0.31 0.00 -0.00 0.00 0.00 36.73 37.68 1hck h TYR 159 CO 0.35 -0.00 0.54 0.25 -0.00 0.00 0.00 178.16 179.30 1hck n THR 160 N -4.27 4.39 -1.32 -0.90 -2.24 -1.26 -4.91 114.28 103.78 1hck n THR 160 Ca 0.28 -5.29 0.00 0.00 -2.27 0.00 0.00 64.05 56.77 1hck n THR 160 Cb 1.27 -1.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 1hck n THR 160 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hck n HIS 161 N -0.29 -1.15 -2.97 4.78 1.44 0.71 -4.88 115.22 112.86 1hck n HIS 161 Ca 0.45 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.76 1hck n HIS 161 Cb 0.32 -0.86 -0.04 0.00 0.12 0.00 0.00 29.99 29.53 1hck n HIS 161 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1hck s GLU 162 N -2.59 4.39 0.22 -1.40 8.01 -1.25 -4.71 118.70 121.37 1hck s GLU 162 Ca 0.00 0.96 -0.32 0.00 0.01 0.00 0.00 54.97 55.62 1hck s GLU 162 Cb 0.00 -3.50 -0.12 0.00 -4.31 0.00 0.00 34.13 26.20 1hck s GLU 162 CO 0.00 -0.10 1.70 0.28 0.01 0.00 0.00 175.26 177.15 1hck n VAL 163 N 4.18 0.18 -2.73 2.63 0.31 -1.26 0.41 118.33 122.05 1hck n VAL 163 Ca 0.01 -0.04 -0.39 0.00 -0.01 0.00 0.00 64.34 63.91 1hck n VAL 163 Cb 0.50 -1.96 -0.06 0.00 -0.91 0.00 0.00 33.84 31.41 1hck n VAL 163 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1hck s VAL 164 N 0.95 4.05 0.11 2.52 0.11 -0.40 -4.84 120.40 122.90 1hck s VAL 164 Ca 0.73 1.89 -0.30 0.00 -2.93 0.00 0.00 61.98 61.37 1hck s VAL 164 Cb -0.51 -4.14 -0.06 0.00 -1.53 0.00 0.00 36.38 30.14 1hck s VAL 164 CO 0.35 0.32 1.10 0.28 -3.33 0.00 0.00 175.10 173.83 1hck s THR 165 N -1.37 4.12 -1.38 5.04 -1.32 -1.26 -4.96 115.64 114.51 1hck s THR 165 Ca 0.46 1.67 0.20 0.00 -1.21 0.00 0.00 61.69 62.81 1hck s THR 165 Cb -0.23 -4.07 -0.12 0.00 -1.51 0.00 0.00 72.50 66.57 1hck s THR 165 CO 0.29 0.21 0.93 0.18 -2.21 0.00 0.00 174.62 174.02 1hck n LEU 166 N 3.13 1.39 -0.18 9.08 7.99 -1.26 -4.68 117.00 132.47 1hck n LEU 166 Ca 0.05 -0.62 0.30 0.00 -0.01 0.00 0.00 56.01 55.73 1hck n LEU 166 Cb 0.47 0.00 0.70 0.00 -0.11 0.00 0.00 43.42 44.48 1hck n LEU 166 CO 0.54 0.29 1.27 -0.50 -1.51 0.00 0.00 177.39 177.48 1hck h TRP 167 N 1.05 0.00 -0.20 -1.77 6.55 -1.82 -0.00 115.95 119.75 1hck h TRP 167 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1hck h TRP 167 Cb 0.58 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.88 1hck h TRP 167 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1hck n TYR 168 N -3.89 0.25 -2.26 0.49 4.01 -1.26 -4.58 117.16 109.93 1hck n TYR 168 Ca 0.20 -0.19 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 1hck n TYR 168 Cb 1.10 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 40.09 1hck n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1hck s ARG 169 N -1.21 4.35 0.48 -0.72 3.52 -0.02 -4.00 118.95 121.36 1hck s ARG 169 Ca 0.24 1.97 -0.22 0.00 -0.13 0.00 0.00 55.73 57.59 1hck s ARG 169 Cb 0.15 -3.31 -0.07 0.00 -1.56 0.00 0.00 34.95 30.17 1hck s ARG 169 CO 0.21 -0.39 1.20 0.00 -0.81 0.00 0.00 175.30 175.50 1hck s ALA 170 N 1.20 2.91 0.50 6.12 0.00 -1.26 -4.92 121.76 126.31 1hck s ALA 170 Ca 0.63 0.99 0.17 0.00 0.00 0.00 0.00 51.96 53.75 1hck s ALA 170 Cb -0.34 -3.41 1.24 0.00 0.00 0.00 0.00 23.12 20.60 1hck s ALA 170 CO 0.30 -0.80 2.09 -1.00 0.00 0.00 0.00 175.76 176.34 1hck h PRO 171 N 1.85 0.09 -0.09 0.00 0.13 -1.95 -2.22 132.00 129.82 1hck h PRO 171 Ca -0.50 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.55 1hck h PRO 171 Cb 1.26 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1hck h PRO 171 CO 0.59 0.06 -0.28 1.05 -0.23 0.00 0.00 178.00 179.20 1hck h GLU 172 N 0.10 0.16 -0.14 0.86 9.09 -1.92 0.13 114.58 122.85 1hck h GLU 172 Ca 0.11 -0.05 -0.13 0.00 0.05 0.00 0.00 59.36 59.33 1hck h GLU 172 Cb 0.30 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.39 1hck h GLU 172 CO -0.01 0.43 -0.43 0.82 0.05 0.00 0.00 179.01 179.87 1hck h ILE 173 N 0.15 1.35 -0.06 -1.06 2.04 -1.65 0.53 117.51 118.81 1hck h ILE 173 Ca 0.02 -1.72 -0.04 0.00 1.00 0.00 0.00 64.86 64.12 1hck h ILE 173 Cb 0.57 2.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 1hck h ILE 173 CO 0.04 0.52 -0.17 -0.07 0.00 0.00 0.00 178.15 178.47 1hck h LEU 174 N 0.17 0.08 -0.37 1.44 3.38 -1.19 -1.66 115.31 117.16 1hck h LEU 174 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1hck h LEU 174 Cb 1.05 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1hck h LEU 174 CO 0.09 0.26 0.00 0.18 0.09 0.00 0.00 178.44 179.06 1hck n LEU 175 N -4.30 0.55 0.00 1.67 4.77 0.39 -4.87 117.00 115.21 1hck n LEU 175 Ca -0.02 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1hck n LEU 175 Cb 0.26 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1hck n LEU 175 CO 0.37 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1hck n GLY 176 N 0.77 0.68 3.67 -0.72 0.00 -0.62 -0.91 105.19 108.06 1hck n GLY 176 Ca 0.09 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1hck n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hck h LYS 178 N 8.69 0.48 -3.06 0.00 6.56 -1.93 -3.41 116.57 123.89 1hck h LYS 178 Ca -0.38 -0.71 -0.74 0.00 -1.06 0.00 0.00 60.65 57.75 1hck h LYS 178 Cb 1.17 0.25 -0.32 0.00 -0.57 0.00 0.00 32.23 32.76 1hck h LYS 178 CO 0.94 1.32 0.25 0.66 -2.06 0.00 0.00 179.45 180.56 1hck n TYR 179 N -3.69 3.70 -3.26 -1.35 4.01 -1.26 -5.05 117.16 110.26 1hck n TYR 179 Ca -0.12 -3.57 -0.32 0.00 -0.16 0.00 0.00 57.90 53.73 1hck n TYR 179 Cb 1.01 -1.21 -0.06 0.00 -0.31 0.00 0.00 39.34 38.77 1hck n TYR 179 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 1hck s TYR 180 N -2.01 3.41 0.00 -0.72 -0.85 -1.26 -5.09 117.35 110.83 1hck s TYR 180 Ca 0.31 1.08 0.00 0.00 -0.52 0.00 0.00 57.07 57.94 1hck s TYR 180 Cb -0.00 -2.42 0.00 0.00 0.38 0.00 0.00 41.96 39.92 1hck s TYR 180 CO -0.02 0.19 0.00 -1.13 -1.52 0.00 0.00 175.55 173.07 1hck n SER 181 N -0.19 0.02 0.33 -0.18 3.41 -1.26 -4.98 113.62 110.77 1hck n SER 181 Ca 0.02 -0.62 0.21 0.00 -0.26 0.00 0.00 58.87 58.21 1hck n SER 181 Cb 0.53 0.00 1.13 0.00 -0.26 0.00 0.00 64.21 65.61 1hck n SER 181 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1hck h THR 182 N 0.00 0.16 0.00 6.66 1.35 -1.98 -2.24 112.91 116.87 1hck h THR 182 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.85 1hck h THR 182 Cb 0.00 1.00 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 1hck h THR 182 CO 0.00 0.00 -0.05 0.00 -0.25 0.00 0.00 175.52 175.22 1hck h ALA 183 N 2.00 1.64 -0.51 6.62 0.00 -1.93 -1.83 119.26 125.24 1hck h ALA 183 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1hck h ALA 183 Cb 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1hck h ALA 183 CO -0.00 0.06 0.29 -0.39 0.00 0.00 0.00 179.25 179.21 1hck h VAL 184 N 0.00 1.15 -0.18 0.00 -1.51 -1.79 -1.45 116.25 112.48 1hck h VAL 184 Ca -0.00 -0.37 -0.15 0.00 -1.23 0.00 0.00 66.70 64.95 1hck h VAL 184 Cb 0.10 0.45 -0.01 0.00 -2.13 0.00 0.00 31.29 29.71 1hck h VAL 184 CO 0.01 0.17 -0.51 0.44 -1.23 0.00 0.00 177.57 176.44 1hck h ASP 185 N 0.70 0.56 -0.31 4.19 3.32 -1.54 -2.49 116.42 120.85 1hck h ASP 185 Ca 0.18 -0.29 -0.10 0.00 0.02 0.00 0.00 57.03 56.85 1hck h ASP 185 Cb 0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1hck h ASP 185 CO -0.03 0.97 -0.13 0.40 -1.72 0.00 0.00 179.24 178.73 1hck h ILE 186 N 0.40 1.26 -0.01 0.35 5.03 -1.40 -1.38 117.51 121.76 1hck h ILE 186 Ca 0.01 -1.19 -0.00 0.00 -0.12 0.00 0.00 64.86 63.56 1hck h ILE 186 Cb 1.04 1.09 -0.00 0.00 -3.03 0.00 0.00 36.82 35.91 1hck h ILE 186 CO 0.09 0.40 0.00 -0.25 -0.68 0.00 0.00 178.15 177.72 1hck h TRP 187 N 0.68 0.02 -0.35 1.37 2.91 -1.16 -0.41 115.95 119.01 1hck h TRP 187 Ca 0.11 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.18 1hck h TRP 187 Cb 0.61 -0.01 -0.05 0.00 -0.51 0.00 0.00 29.16 29.21 1hck h TRP 187 CO 0.03 0.20 0.07 0.77 -1.03 0.00 0.00 178.44 178.48 1hck h SER 188 N -0.16 0.02 -0.63 2.65 0.02 -1.28 -0.89 113.55 113.27 1hck h SER 188 Ca 0.00 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 1hck h SER 188 Cb 0.19 0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 1hck h SER 188 CO -0.00 0.05 0.37 0.25 -1.14 0.00 0.00 176.83 176.36 1hck h LEU 189 N 0.19 0.78 -0.57 5.07 5.85 -1.11 -1.59 115.31 123.93 1hck h LEU 189 Ca 0.17 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1hck h LEU 189 Cb 0.18 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1hck h LEU 189 CO -0.22 0.62 0.34 1.23 -0.34 0.00 0.00 178.44 180.07 1hck h GLY 190 N 0.94 0.83 1.06 3.75 0.00 0.26 -0.53 103.07 109.38 1hck h GLY 190 Ca 0.23 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 1hck h GLY 190 CO -0.04 0.34 0.30 0.00 0.00 0.00 0.00 176.54 177.14 1hck h ILE 192 N 1.15 1.27 -0.07 0.00 2.04 -0.99 -2.11 117.51 118.80 1hck h ILE 192 Ca 0.26 -1.50 0.02 0.00 1.00 0.00 0.00 64.86 64.65 1hck h ILE 192 Cb 0.24 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1hck h ILE 192 CO -0.02 0.51 -0.08 0.15 0.00 0.00 0.00 178.15 178.71 1hck h PHE 193 N 0.78 -0.20 -0.84 1.37 3.57 -0.90 -0.36 116.94 120.36 1hck h PHE 193 Ca 0.08 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1hck h PHE 193 Cb 0.91 0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 1hck h PHE 193 CO 0.06 -0.13 0.48 0.00 -2.23 0.00 0.00 178.31 176.49 1hck h ALA 194 N 0.94 1.25 -0.67 2.41 0.00 -1.32 -2.64 119.26 119.24 1hck h ALA 194 Ca 0.06 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1hck h ALA 194 Cb 0.19 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1hck h ALA 194 CO -0.14 0.62 0.09 1.49 0.00 0.00 0.00 179.25 181.31 1hck h GLU 195 N 1.17 1.11 -0.82 0.00 4.81 -0.85 -1.92 114.58 118.09 1hck h GLU 195 Ca 0.30 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1hck h GLU 195 Cb 0.00 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 1hck h GLU 195 CO -0.05 1.03 0.44 0.52 -0.73 0.00 0.00 179.01 180.21 1hck h MET 196 N 1.04 1.16 -0.05 1.92 2.86 -0.80 0.28 114.93 121.33 1hck h MET 196 Ca 0.20 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.67 1hck h MET 196 Cb 0.46 -0.22 -0.00 0.00 0.06 0.00 0.00 31.60 31.90 1hck h MET 196 CO 0.02 0.86 -0.06 0.28 1.06 0.00 0.00 176.91 179.07 1hck h VAL 197 N 1.15 1.39 0.00 -2.22 2.07 -1.27 -3.34 116.25 114.02 1hck h VAL 197 Ca 0.29 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.56 1hck h VAL 197 Cb 0.05 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1hck h VAL 197 CO -0.04 0.34 -0.99 0.35 0.02 0.00 0.00 177.57 177.24 1hck n THR 198 N -4.73 0.55 -2.64 2.57 -2.24 -0.74 -4.81 114.28 102.23 1hck n THR 198 Ca -0.08 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 61.10 1hck n THR 198 Cb 0.30 -0.27 0.02 0.00 -2.10 0.00 0.00 70.33 68.28 1hck n THR 198 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hck n ARG 199 N -2.56 -2.42 -3.69 -0.78 1.74 0.99 -5.02 116.66 104.92 1hck n ARG 199 Ca 0.00 0.43 -0.11 0.00 -0.77 0.00 0.00 57.85 57.40 1hck n ARG 199 Cb 0.53 -4.29 -0.09 0.00 -1.02 0.00 0.00 32.46 27.59 1hck n ARG 199 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1hck s ARG 200 N -5.11 0.56 0.31 5.56 3.52 -1.19 -5.05 118.95 117.55 1hck s ARG 200 Ca 0.15 0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 56.29 1hck s ARG 200 Cb -0.07 0.18 -0.11 0.00 -1.56 0.00 0.00 34.95 33.38 1hck s ARG 200 CO 0.19 -0.11 1.59 0.00 -0.81 0.00 0.00 175.30 176.16 1hck n ALA 201 N 3.49 2.59 0.21 6.12 0.00 -1.26 -4.15 120.51 127.51 1hck n ALA 201 Ca -0.17 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.49 1hck n ALA 201 Cb 0.56 -2.47 -0.08 0.00 0.00 0.00 0.00 19.45 17.47 1hck n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1hck h LEU 202 N 4.60 -0.44 -6.73 0.00 6.46 -1.91 -3.39 115.31 113.90 1hck h LEU 202 Ca -0.47 -0.09 -0.61 0.00 -0.12 0.00 0.00 57.88 56.59 1hck h LEU 202 Cb 1.22 0.11 -0.40 0.00 -0.73 0.00 0.00 40.66 40.87 1hck h LEU 202 CO 0.78 -0.17 -0.74 0.49 -0.62 0.00 0.00 178.44 178.17 1hck n PHE 203 N -5.24 1.60 -1.62 1.25 3.72 -1.26 -5.02 117.46 110.89 1hck n PHE 203 Ca -0.10 -3.91 -0.41 0.00 -0.05 0.00 0.00 57.45 52.97 1hck n PHE 203 Cb 0.27 -0.28 -0.01 0.00 -0.94 0.00 0.00 39.48 38.52 1hck n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1hck n PRO 204 N 2.20 2.86 -2.39 -1.08 -0.04 -1.26 -4.40 135.00 130.88 1hck n PRO 204 Ca 0.24 -2.48 -0.36 0.00 -0.04 0.00 0.00 63.50 60.87 1hck n PRO 204 Cb 0.41 -3.19 -0.02 0.00 -0.04 0.00 0.00 33.50 30.66 1hck n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1hck s GLY 205 N 3.20 2.66 -0.05 0.55 0.00 -1.26 -4.97 107.32 107.44 1hck s GLY 205 Ca 0.51 0.77 0.09 0.00 0.00 0.00 0.00 44.72 46.09 1hck s GLY 205 CO -0.07 1.16 1.18 2.09 0.00 0.00 0.00 173.10 177.46 1hck n ASP 206 N -0.77 2.70 -3.62 1.64 5.68 -1.26 -4.64 116.55 116.27 1hck n ASP 206 Ca 0.09 -2.33 -0.07 0.00 -0.50 0.00 0.00 54.79 51.98 1hck n ASP 206 Cb 0.50 -0.24 -0.02 0.00 -1.14 0.00 0.00 41.12 40.23 1hck n ASP 206 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1hck s SER 207 N -1.43 -0.31 0.28 -1.12 1.04 -1.26 -4.98 113.70 105.91 1hck s SER 207 Ca 0.20 -0.22 -0.03 0.00 0.48 0.00 0.00 55.95 56.38 1hck s SER 207 Cb 0.14 0.49 0.38 0.00 0.10 0.00 0.00 66.02 67.14 1hck s SER 207 CO 0.07 -0.86 1.88 -0.33 0.98 0.00 0.00 173.24 174.99 1hck h GLU 208 N 2.00 1.00 0.02 4.02 5.08 -1.99 0.18 114.58 124.89 1hck h GLU 208 Ca -0.24 -0.13 -0.26 0.00 -1.00 0.00 0.00 59.36 57.72 1hck h GLU 208 Cb 1.25 -0.19 0.02 0.00 0.50 0.00 0.00 28.75 30.33 1hck h GLU 208 CO 0.29 0.77 -1.05 0.97 -1.00 0.00 0.00 179.01 178.99 1hck h ILE 209 N 0.99 1.32 -0.55 3.13 6.09 -1.97 -2.29 117.51 124.24 1hck h ILE 209 Ca 0.24 -2.36 -0.08 0.00 -1.37 0.00 0.00 64.86 61.30 1hck h ILE 209 Cb 0.10 2.45 -0.02 0.00 0.47 0.00 0.00 36.82 39.81 1hck h ILE 209 CO -0.03 0.72 0.02 -0.78 -3.07 0.00 0.00 178.15 175.00 1hck h ASP 210 N 0.32 0.91 0.09 2.19 3.58 -1.87 -0.63 116.42 121.02 1hck h ASP 210 Ca -0.12 -0.23 -0.00 0.00 0.42 0.00 0.00 57.03 57.09 1hck h ASP 210 Cb 1.70 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 42.50 1hck h ASP 210 CO 0.20 0.96 -0.06 -0.61 -2.88 0.00 0.00 179.24 176.84 1hck h GLN 211 N 0.87 -0.15 -0.51 0.28 5.75 -0.58 -1.16 115.11 119.60 1hck h GLN 211 Ca 0.16 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.68 1hck h GLN 211 Cb 0.49 0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 1hck h GLN 211 CO 0.02 -0.10 0.33 1.25 -2.65 0.00 0.00 178.83 177.68 1hck h LEU 212 N -0.16 0.56 -1.15 -2.39 5.85 -1.20 -2.22 115.31 114.60 1hck h LEU 212 Ca -0.01 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1hck h LEU 212 Cb 0.13 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1hck h LEU 212 CO 0.00 0.40 -0.28 -0.26 -0.34 0.00 0.00 178.44 177.96 1hck h PHE 213 N 0.66 0.27 -0.43 1.25 -1.00 -0.95 -0.59 116.94 116.15 1hck h PHE 213 Ca 0.19 -0.05 -0.13 0.00 2.81 0.00 0.00 57.97 60.78 1hck h PHE 213 Cb -0.05 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.43 1hck h PHE 213 CO -0.05 0.51 -0.27 0.00 -1.61 0.00 0.00 178.31 176.89 1hck h ARG 214 N 0.21 0.91 -0.19 1.51 3.08 -0.86 0.13 114.38 119.18 1hck h ARG 214 Ca 0.03 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.66 1hck h ARG 214 Cb 0.61 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 1hck h ARG 214 CO 0.04 1.06 0.07 0.82 -1.07 0.00 0.00 179.97 180.90 1hck h ILE 215 N 0.77 1.17 -0.47 2.04 2.04 -1.11 -3.06 117.51 118.90 1hck h ILE 215 Ca 0.09 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 1hck h ILE 215 Cb 0.83 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1hck h ILE 215 CO 0.07 0.16 0.25 -0.26 0.00 0.00 0.00 178.15 178.37 1hck h PHE 216 N 0.15 0.66 0.00 1.37 0.04 -0.78 0.09 116.94 118.46 1hck h PHE 216 Ca 0.06 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 1hck h PHE 216 Cb 0.19 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.13 1hck h PHE 216 CO -0.01 0.50 -0.03 0.00 -0.60 0.00 0.00 178.31 178.17 1hck h ARG 217 N 0.62 0.00 0.00 1.51 3.08 -0.75 0.18 114.38 119.02 1hck h ARG 217 Ca 0.16 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.06 1hck h ARG 217 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1hck h ARG 217 CO -0.02 0.03 -1.17 2.41 -1.07 0.00 0.00 179.97 180.15 1hck n THR 218 N -3.79 1.49 1.32 2.04 -1.04 -0.97 -4.54 114.28 108.79 1hck n THR 218 Ca -0.03 0.03 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 1hck n THR 218 Cb 0.12 -2.19 0.45 0.00 -1.82 0.00 0.00 70.33 66.89 1hck n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1hck n LEU 219 N -4.47 1.00 0.00 -4.42 4.32 -0.02 -0.06 117.00 113.35 1hck n LEU 219 Ca -0.24 -0.25 0.00 0.00 -0.02 0.00 0.00 56.01 55.49 1hck n LEU 219 Cb 0.54 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.23 1hck n LEU 219 CO 0.14 0.18 0.00 0.61 -1.22 0.00 0.00 177.39 177.10 1hck n GLY 220 N 1.30 -0.64 3.68 -0.72 0.00 0.62 -4.41 105.19 105.02 1hck n GLY 220 Ca 0.14 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 1hck n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hck s THR 221 N -2.80 3.42 0.63 2.61 2.01 -0.61 -4.60 115.64 116.31 1hck s THR 221 Ca 0.00 0.78 -0.16 0.00 0.31 0.00 0.00 61.69 62.62 1hck s THR 221 Cb 0.00 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 1hck s THR 221 CO 0.00 -0.01 1.13 -2.16 -0.69 0.00 0.00 174.62 172.88 1hck s PRO 222 N 2.79 2.90 0.17 4.92 0.04 -1.26 -4.85 135.00 139.71 1hck s PRO 222 Ca 0.69 1.49 0.03 0.00 0.04 0.00 0.00 61.00 63.26 1hck s PRO 222 Cb -0.35 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.22 1hck s PRO 222 CO 0.29 -1.19 0.13 -0.40 0.04 0.00 0.00 177.00 175.87 1hck n ASP 223 N -2.12 -0.10 0.29 6.66 5.68 -1.26 -5.01 116.55 120.70 1hck n ASP 223 Ca 0.11 -2.07 0.18 0.00 -0.50 0.00 0.00 54.79 52.51 1hck n ASP 223 Cb 0.51 0.76 0.84 0.00 -1.14 0.00 0.00 41.12 42.10 1hck n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1hck h GLU 224 N 0.00 0.00 -0.04 0.11 4.39 -1.97 -0.20 114.58 116.86 1hck h GLU 224 Ca -0.12 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.55 1hck h GLU 224 Cb 0.59 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1hck h GLU 224 CO 0.18 0.02 -0.07 0.28 -1.16 0.00 0.00 179.01 178.26 1hck h VAL 225 N 0.00 1.41 0.00 3.13 2.07 -2.00 -3.17 116.25 117.70 1hck h VAL 225 Ca -0.00 -1.33 -0.26 0.00 0.82 0.00 0.00 66.70 65.93 1hck h VAL 225 Cb 0.36 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.29 1hck h VAL 225 CO 0.00 0.36 -1.42 -0.37 0.02 0.00 0.00 177.57 176.16 1hck h VAL 226 N -0.37 1.18 -2.70 2.57 -1.51 -1.96 -3.42 116.25 110.04 1hck h VAL 226 Ca 0.00 -2.98 -0.59 0.00 -1.23 0.00 0.00 66.70 61.90 1hck h VAL 226 Cb 0.62 2.58 -0.39 0.00 -2.13 0.00 0.00 31.29 31.97 1hck h VAL 226 CO 0.02 0.67 -0.82 0.86 -1.23 0.00 0.00 177.57 177.07 1hck s TRP 227 N -2.65 1.30 0.14 5.19 -0.11 -0.09 -4.40 118.94 118.32 1hck s TRP 227 Ca -0.02 -2.06 -0.31 0.00 1.22 0.00 0.00 56.10 54.92 1hck s TRP 227 Cb 0.09 -1.30 -0.10 0.00 -1.50 0.00 0.00 33.47 30.66 1hck s TRP 227 CO 0.82 -0.80 1.65 -2.14 -4.62 0.00 0.00 176.95 171.86 1hck s PRO 228 N 0.58 4.19 0.00 5.86 0.02 -1.20 -2.12 135.00 142.33 1hck s PRO 228 Ca 0.21 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.64 1hck s PRO 228 Cb -0.18 -3.34 0.00 0.00 0.02 0.00 0.00 34.50 31.00 1hck s PRO 228 CO -0.03 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 1hck n GLY 229 N 3.92 0.78 0.33 0.52 0.00 -1.26 -4.95 105.19 104.53 1hck n GLY 229 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.14 1hck n GLY 229 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1hck h VAL 230 N 0.00 1.21 0.00 1.61 3.04 -1.75 -2.54 116.25 117.82 1hck h VAL 230 Ca 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 1hck h VAL 230 Cb 0.00 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.23 1hck h VAL 230 CO 0.00 0.21 0.00 0.35 -1.01 0.00 0.00 177.57 177.12 1hck n THR 231 N -4.49 0.69 0.71 3.17 -2.24 -1.26 -1.34 114.28 109.52 1hck n THR 231 Ca 0.09 0.17 0.09 0.00 -2.27 0.00 0.00 64.05 62.14 1hck n THR 231 Cb 0.02 -0.94 0.09 0.00 -2.10 0.00 0.00 70.33 67.40 1hck n THR 231 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1hck n SER 232 N -1.33 2.62 -4.78 3.42 7.64 -0.96 -4.92 113.62 115.32 1hck n SER 232 Ca 0.06 -1.79 -0.41 0.00 1.01 0.00 0.00 58.87 57.74 1hck n SER 232 Cb 0.12 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1hck n SER 232 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1hck s MET 233 N -1.52 3.99 0.24 1.43 -1.94 -0.45 -4.91 119.30 116.15 1hck s MET 233 Ca 0.23 2.54 -0.11 0.00 -1.71 0.00 0.00 55.69 56.64 1hck s MET 233 Cb 0.16 -2.88 0.35 0.00 2.01 0.00 0.00 34.83 34.46 1hck s MET 233 CO 0.24 -0.61 1.60 -1.35 -0.01 0.00 0.00 175.02 174.88 1hck h PRO 234 N 2.82 0.01 -0.56 2.03 0.11 -1.84 -1.62 132.00 132.94 1hck h PRO 234 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1hck h PRO 234 Cb 1.25 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1hck h PRO 234 CO 0.63 0.01 0.00 -0.25 -0.21 0.00 0.00 178.00 178.18 1hck n ASP 235 N -5.50 3.32 -4.76 -2.05 8.00 -0.09 -4.95 116.55 110.52 1hck n ASP 235 Ca 0.12 -1.98 -0.40 0.00 0.71 0.00 0.00 54.79 53.23 1hck n ASP 235 Cb 0.41 -0.37 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 1hck n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1hck s TYR 236 N -1.26 3.43 -0.04 1.24 5.04 -0.61 -4.96 117.35 120.19 1hck s TYR 236 Ca 0.41 1.60 0.04 0.00 -2.44 0.00 0.00 57.07 56.68 1hck s TYR 236 Cb 0.22 -3.40 -0.00 0.00 0.35 0.00 0.00 41.96 39.12 1hck s TYR 236 CO 0.29 -0.96 -0.17 0.15 -1.34 0.00 0.00 175.55 173.53 1hck s LYS 237 N -1.40 1.70 0.61 4.97 -0.14 -1.26 -4.93 119.74 119.29 1hck s LYS 237 Ca 0.47 -0.59 0.38 0.00 -1.36 0.00 0.00 55.97 54.86 1hck s LYS 237 Cb -0.34 -1.50 1.97 0.00 -1.68 0.00 0.00 37.83 36.29 1hck s LYS 237 CO 0.44 0.24 2.23 -1.35 -0.76 0.00 0.00 175.35 176.15 1hck h PRO 238 N 6.22 0.00 -0.02 -1.68 0.11 -1.96 -2.21 132.00 132.47 1hck h PRO 238 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1hck h PRO 238 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1hck h PRO 238 CO 0.48 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 177.16 1hck n SER 239 N -3.26 0.14 -4.75 -2.05 3.41 -1.26 -4.90 113.62 100.95 1hck n SER 239 Ca -0.02 -1.70 -0.41 0.00 -0.26 0.00 0.00 58.87 56.48 1hck n SER 239 Cb 0.15 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 1hck n SER 239 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1hck s PHE 240 N -1.97 3.02 0.61 7.33 0.08 -0.83 -4.96 117.98 121.25 1hck s PHE 240 Ca 0.16 1.17 -0.18 0.00 0.12 0.00 0.00 56.93 58.20 1hck s PHE 240 Cb 0.08 -3.77 -0.03 0.00 -0.57 0.00 0.00 43.02 38.73 1hck s PHE 240 CO 0.13 -2.38 1.20 -2.14 -0.10 0.00 0.00 175.22 171.92 1hck s PRO 241 N -0.88 2.89 -0.37 0.24 0.02 -1.26 -4.97 135.00 130.67 1hck s PRO 241 Ca 0.56 1.79 -0.14 0.00 0.02 0.00 0.00 61.00 63.23 1hck s PRO 241 Cb -0.41 -1.92 -0.00 0.00 0.02 0.00 0.00 34.50 32.18 1hck s PRO 241 CO 0.47 -1.26 0.27 0.21 -0.33 0.00 0.00 177.00 176.36 1hck s LYS 242 N -3.43 3.30 0.14 5.54 2.36 -1.26 -4.80 119.74 121.60 1hck s LYS 242 Ca 0.76 -0.77 0.08 0.00 -2.55 0.00 0.00 55.97 53.49 1hck s LYS 242 Cb -0.30 -3.87 -0.04 0.00 -1.05 0.00 0.00 37.83 32.57 1hck s LYS 242 CO 0.35 -0.56 -0.09 -1.58 1.55 0.00 0.00 175.35 175.01 1hck s TRP 243 N 1.72 2.70 0.40 4.03 0.51 -1.26 -4.95 118.94 122.09 1hck s TRP 243 Ca 0.06 -0.19 -0.01 0.00 -2.12 0.00 0.00 56.10 53.84 1hck s TRP 243 Cb -0.18 -1.36 -0.03 0.00 -0.81 0.00 0.00 33.47 31.09 1hck s TRP 243 CO 0.10 0.47 0.64 0.00 -0.51 0.00 0.00 176.95 177.65 1hck s ALA 244 N -1.48 3.60 0.20 0.98 0.00 -1.26 -1.57 121.76 122.24 1hck s ALA 244 Ca 0.23 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 51.11 1hck s ALA 244 Cb -0.10 -2.27 -0.08 0.00 0.00 0.00 0.00 23.12 20.67 1hck s ALA 244 CO 0.15 -0.16 1.05 0.50 0.00 0.00 0.00 175.76 177.30 1hck s ARG 245 N -4.47 4.68 0.36 0.00 3.52 -1.26 -3.77 118.95 118.00 1hck s ARG 245 Ca 0.43 1.65 -0.04 0.00 -0.13 0.00 0.00 55.73 57.64 1hck s ARG 245 Cb -0.10 -3.27 -0.05 0.00 -1.56 0.00 0.00 34.95 29.97 1hck s ARG 245 CO 0.39 0.22 0.63 -0.65 -0.81 0.00 0.00 175.30 175.08 1hck s GLN 246 N -0.73 3.60 0.16 5.12 -1.52 0.92 -4.91 119.66 122.29 1hck s GLN 246 Ca 0.46 0.02 -0.30 0.00 -1.95 0.00 0.00 55.36 53.59 1hck s GLN 246 Cb -0.28 -2.56 -0.08 0.00 -0.22 0.00 0.00 33.01 29.87 1hck s GLN 246 CO 0.35 0.08 1.20 0.34 -0.25 0.00 0.00 175.29 177.00 1hck s ASP 247 N -3.57 7.09 0.46 5.90 -1.08 -1.26 -4.88 116.67 119.33 1hck s ASP 247 Ca 0.45 2.18 0.17 0.00 -0.52 0.00 0.00 52.55 54.83 1hck s ASP 247 Cb -0.10 -2.60 1.10 0.00 -1.46 0.00 0.00 42.92 39.85 1hck s ASP 247 CO 0.35 -0.39 2.01 -0.26 0.52 0.00 0.00 175.17 177.40 1hck h PHE 248 N 5.58 0.00 0.00 -5.34 -1.00 -1.96 -0.97 116.94 113.25 1hck h PHE 248 Ca -0.44 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.32 1hck h PHE 248 Cb 1.21 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.77 1hck h PHE 248 CO 0.63 0.17 -0.12 0.66 -1.61 0.00 0.00 178.31 178.05 1hck h SER 249 N 0.00 0.00 0.97 2.17 4.64 -1.92 -0.91 113.55 118.50 1hck h SER 249 Ca -0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1hck h SER 249 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 1hck h SER 249 CO 0.02 0.12 -1.10 0.50 -0.87 0.00 0.00 176.83 175.51 1hck h LYS 250 N 0.00 0.00 0.14 4.77 3.64 -1.58 -3.33 116.57 120.21 1hck h LYS 250 Ca -0.00 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.13 1hck h LYS 250 Cb 0.28 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1hck h LYS 250 CO 0.02 0.30 -1.16 0.28 -2.27 0.00 0.00 179.45 176.61 1hck h VAL 251 N 0.00 1.27 -1.90 2.00 2.07 -0.85 -3.42 116.25 115.42 1hck h VAL 251 Ca -0.10 -2.50 -0.56 0.00 0.82 0.00 0.00 66.70 64.37 1hck h VAL 251 Cb 1.45 2.97 -0.42 0.00 -1.52 0.00 0.00 31.29 33.77 1hck h VAL 251 CO 0.04 0.72 -0.77 1.33 0.02 0.00 0.00 177.57 178.92 1hck n VAL 252 N -3.98 2.34 -2.66 2.57 0.24 -0.42 -5.00 118.33 111.41 1hck n VAL 252 Ca -0.19 -5.07 -0.33 0.00 -2.04 0.00 0.00 64.34 56.70 1hck n VAL 252 Cb 0.89 -1.08 -0.05 0.00 -1.47 0.00 0.00 33.84 32.13 1hck n VAL 252 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1hck s PRO 253 N -3.36 4.03 -0.78 7.34 0.04 -1.25 -1.57 135.00 139.44 1hck s PRO 253 Ca 0.46 1.18 0.01 0.00 0.04 0.00 0.00 61.00 62.69 1hck s PRO 253 Cb 0.34 -2.14 0.35 0.00 0.04 0.00 0.00 34.50 33.09 1hck s PRO 253 CO -0.14 -0.21 1.58 -0.35 0.04 0.00 0.00 177.00 177.92 1hck n PRO 254 N -0.90 3.88 -2.44 0.56 -0.04 -1.26 -4.60 135.00 130.20 1hck n PRO 254 Ca 0.08 -4.36 -0.41 0.00 -0.04 0.00 0.00 63.50 58.76 1hck n PRO 254 Cb 0.54 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.63 1hck n PRO 254 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1hck s LEU 255 N -3.95 4.43 1.07 1.53 2.96 -0.61 -5.03 118.68 119.07 1hck s LEU 255 Ca 0.46 2.10 -0.15 0.00 -0.22 0.00 0.00 54.13 56.32 1hck s LEU 255 Cb 0.32 -3.59 0.22 0.00 0.50 0.00 0.00 46.19 43.63 1hck s LEU 255 CO -0.22 -0.36 1.12 1.51 -1.32 0.00 0.00 176.35 177.08 1hck s ASP 256 N 0.41 2.08 0.24 3.68 1.47 -1.26 -4.67 116.67 118.61 1hck s ASP 256 Ca 0.54 0.85 -0.05 0.00 1.18 0.00 0.00 52.55 55.07 1hck s ASP 256 Cb -0.30 -1.30 0.41 0.00 -0.34 0.00 0.00 42.92 41.39 1hck s ASP 256 CO 0.33 -3.43 1.74 -0.08 0.68 0.00 0.00 175.17 174.41 1hck h GLU 257 N -2.10 0.45 -0.13 2.11 4.57 -1.98 -0.62 114.58 116.87 1hck h GLU 257 Ca -0.50 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 1hck h GLU 257 Cb 1.31 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 1hck h GLU 257 CO 0.48 0.30 0.08 -0.44 -1.18 0.00 0.00 179.01 178.24 1hck h ASP 258 N 0.46 0.13 -0.28 1.04 3.32 -1.97 0.63 116.42 119.75 1hck h ASP 258 Ca 0.39 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 1hck h ASP 258 Cb 0.55 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 1hck h ASP 258 CO -0.37 0.10 0.13 1.23 -1.72 0.00 0.00 179.24 178.61 1hck h GLY 259 N 0.16 0.44 1.02 2.75 0.00 -1.74 -1.30 103.07 104.41 1hck h GLY 259 Ca 0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 1hck h GLY 259 CO -0.02 0.21 0.35 3.21 0.00 0.00 0.00 176.54 180.30 1hck h ARG 260 N 0.32 1.09 -0.36 4.80 3.08 -1.02 0.10 114.38 122.38 1hck h ARG 260 Ca 0.10 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1hck h ARG 260 Cb 0.14 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1hck h ARG 260 CO -0.01 0.86 0.23 1.03 -1.07 0.00 0.00 179.97 181.00 1hck h SER 261 N 1.06 0.43 -0.04 7.04 0.87 -0.76 -1.19 113.55 120.97 1hck h SER 261 Ca 0.26 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.77 1hck h SER 261 Cb 0.13 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 61.98 1hck h SER 261 CO -0.03 0.35 0.02 0.25 -0.53 0.00 0.00 176.83 176.88 1hck h LEU 262 N 0.48 0.05 -1.03 2.23 5.85 -0.76 -2.84 115.31 119.29 1hck h LEU 262 Ca 0.13 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1hck h LEU 262 Cb -0.01 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 40.95 1hck h LEU 262 CO -0.03 0.17 0.65 0.25 -0.34 0.00 0.00 178.44 179.14 1hck h LEU 263 N -0.07 1.09 -1.46 2.25 5.85 -0.70 -2.14 115.31 120.13 1hck h LEU 263 Ca 0.01 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1hck h LEU 263 Cb 0.13 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1hck h LEU 263 CO -0.00 0.75 -0.27 0.77 -0.34 0.00 0.00 178.44 179.35 1hck h SER 264 N 1.26 0.00 0.78 1.25 4.64 -1.11 -1.00 113.55 119.38 1hck h SER 264 Ca 0.39 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.55 1hck h SER 264 Cb -0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1hck h SER 264 CO -0.12 0.27 -0.76 1.56 -0.87 0.00 0.00 176.83 176.91 1hck h GLN 265 N 0.00 0.00 0.00 4.77 4.20 -1.17 -2.98 115.11 119.94 1hck h GLN 265 Ca -0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.53 1hck h GLN 265 Cb 0.55 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 1hck h GLN 265 CO 0.03 0.76 -0.81 0.52 -0.67 0.00 0.00 178.83 178.66 1hck h MET 266 N 0.00 0.04 -0.72 1.46 2.86 -0.86 -2.33 114.93 115.38 1hck h MET 266 Ca -0.01 -0.04 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 1hck h MET 266 Cb 1.36 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.94 1hck h MET 266 CO 0.10 0.83 0.18 1.28 1.06 0.00 0.00 176.91 180.36 1hck n LEU 267 N -3.60 5.83 -4.74 1.22 4.77 -0.44 -4.05 117.00 116.00 1hck n LEU 267 Ca -0.01 -3.01 -0.41 0.00 -0.03 0.00 0.00 56.01 52.54 1hck n LEU 267 Cb 0.78 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1hck n LEU 267 CO 0.45 0.73 1.05 -1.00 -1.33 0.00 0.00 177.39 177.29 1hck s HIS 268 N -2.81 3.15 0.12 -1.77 3.76 -1.14 -4.93 115.29 111.67 1hck s HIS 268 Ca 0.53 1.10 -0.20 0.00 -0.15 0.00 0.00 55.06 56.34 1hck s HIS 268 Cb 0.41 -3.71 -0.07 0.00 1.11 0.00 0.00 32.58 30.33 1hck s HIS 268 CO 0.14 -2.28 1.74 1.88 -0.85 0.00 0.00 174.74 175.36 1hck h TYR 269 N 5.37 0.04 -3.15 1.40 0.05 -1.92 -3.40 116.97 115.35 1hck h TYR 269 Ca -0.45 0.01 -0.57 0.00 0.05 0.00 0.00 58.73 57.77 1hck h TYR 269 Cb 1.21 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.91 1hck h TYR 269 CO 0.62 0.01 1.11 0.34 -1.05 0.00 0.00 178.16 179.19 1hck s ASP 270 N -5.25 6.25 0.43 3.88 -1.08 -1.26 -4.86 116.67 114.78 1hck s ASP 270 Ca -0.13 0.93 0.21 0.00 -0.52 0.00 0.00 52.55 53.04 1hck s ASP 270 Cb 0.09 -2.54 1.17 0.00 -1.46 0.00 0.00 42.92 40.18 1hck s ASP 270 CO 0.68 -1.48 1.81 -0.65 0.52 0.00 0.00 175.17 176.05 1hck h PRO 271 N 11.12 0.32 0.00 4.34 0.11 -1.96 0.31 132.00 146.23 1hck h PRO 271 Ca -0.29 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 1hck h PRO 271 Cb 1.12 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1hck h PRO 271 CO 1.07 0.21 -0.06 -0.91 -0.21 0.00 0.00 178.00 178.11 1hck h ASN 272 N 0.33 0.00 0.88 -2.05 -0.26 -1.94 -3.02 115.58 109.52 1hck h ASN 272 Ca 0.54 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 56.11 1hck h ASN 272 Cb 1.48 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.72 1hck h ASN 272 CO -0.21 0.06 -1.20 0.11 -1.06 0.00 0.00 177.43 175.13 1hck h LYS 273 N 0.00 0.00 -6.59 0.81 1.57 -0.78 -3.47 116.57 108.11 1hck h LYS 273 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1hck h LYS 273 Cb 0.75 0.00 0.07 0.00 0.08 0.00 0.00 32.23 33.13 1hck h LYS 273 CO 0.01 0.42 0.79 -2.13 -0.57 0.00 0.00 179.45 177.97 1hck n ARG 274 N -3.02 2.28 -1.76 3.15 0.63 -0.90 -4.93 116.66 112.11 1hck n ARG 274 Ca -0.07 0.82 -0.41 0.00 -0.92 0.00 0.00 57.85 57.26 1hck n ARG 274 Cb 0.85 -2.57 -0.00 0.00 0.45 0.00 0.00 32.46 31.19 1hck n ARG 274 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 1hck n ILE 275 N 2.91 1.91 -1.90 5.15 3.06 -0.88 -5.00 119.36 124.61 1hck n ILE 275 Ca 0.14 -0.48 -0.30 0.00 -2.50 0.00 0.00 62.75 59.61 1hck n ILE 275 Cb 0.31 -1.89 0.04 0.00 0.54 0.00 0.00 39.64 38.64 1hck n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1hck s SER 276 N -0.11 5.57 0.27 9.51 1.04 -1.26 -4.89 113.70 123.82 1hck s SER 276 Ca 0.55 1.16 -0.01 0.00 0.48 0.00 0.00 55.95 58.12 1hck s SER 276 Cb -0.50 -2.00 0.36 0.00 0.10 0.00 0.00 66.02 63.99 1hck s SER 276 CO 0.62 -1.26 1.78 0.00 0.98 0.00 0.00 173.24 175.36 1hck h ALA 277 N -0.59 1.15 -0.24 5.32 0.00 -1.94 -2.10 119.26 120.85 1hck h ALA 277 Ca -0.45 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 1hck h ALA 277 Cb 1.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1hck h ALA 277 CO 0.63 0.56 -0.37 -0.22 0.00 0.00 0.00 179.25 179.85 1hck h LYS 278 N 0.75 0.54 -0.02 0.00 3.64 -1.93 -2.62 116.57 116.93 1hck h LYS 278 Ca 0.15 -0.26 -0.14 0.00 -1.27 0.00 0.00 60.65 59.13 1hck h LYS 278 Cb 0.40 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1hck h LYS 278 CO 0.01 0.83 -0.63 0.00 -2.27 0.00 0.00 179.45 177.40 1hck h ALA 279 N 1.14 0.92 0.00 5.00 0.00 -1.90 -2.99 119.26 121.44 1hck h ALA 279 Ca 0.04 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 1hck h ALA 279 Cb 0.86 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1hck h ALA 279 CO 0.07 0.77 -0.28 0.00 0.00 0.00 0.00 179.25 179.81 1hck h ALA 280 N 1.32 1.16 0.00 0.00 0.00 -1.11 -2.58 119.26 118.04 1hck h ALA 280 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1hck h ALA 280 Cb 1.12 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1hck h ALA 280 CO 0.09 0.35 0.00 -0.07 0.00 0.00 0.00 179.25 179.62 1hck h LEU 281 N 0.00 0.00 -1.41 0.00 3.38 -1.32 -2.50 115.31 113.46 1hck h LEU 281 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1hck h LEU 281 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1hck h LEU 281 CO 0.04 0.00 -0.20 0.00 0.09 0.00 0.00 178.44 178.37 1hck n ALA 282 N -2.06 2.93 -1.78 1.53 0.00 -0.98 -4.91 120.51 115.25 1hck n ALA 282 Ca -0.00 -0.64 -0.41 0.00 0.00 0.00 0.00 53.44 52.39 1hck n ALA 282 Cb 0.25 -0.85 -0.00 0.00 0.00 0.00 0.00 19.45 18.85 1hck n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1hck s HIS 283 N -2.22 2.65 -0.22 0.00 5.04 -0.94 -4.87 115.29 114.73 1hck s HIS 283 Ca 0.25 1.19 0.16 0.00 -1.54 0.00 0.00 55.06 55.13 1hck s HIS 283 Cb 0.19 -3.98 0.90 0.00 0.04 0.00 0.00 32.58 29.73 1hck s HIS 283 CO 0.42 -2.85 1.47 -0.35 -2.34 0.00 0.00 174.74 171.08 1hck n PRO 284 N 0.54 0.11 0.25 2.88 -0.04 -1.26 -1.50 135.00 135.98 1hck n PRO 284 Ca 0.01 0.59 0.07 0.00 -0.04 0.00 0.00 63.50 64.14 1hck n PRO 284 Cb 0.40 -1.95 0.60 0.00 -0.04 0.00 0.00 33.50 32.51 1hck n PRO 284 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1hck h PHE 285 N 0.00 0.00 -0.14 0.54 3.57 -1.89 -2.31 116.94 116.70 1hck h PHE 285 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1hck h PHE 285 Cb 0.19 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1hck h PHE 285 CO 0.00 0.07 0.00 1.19 -2.23 0.00 0.00 178.31 177.34 1hck n PHE 286 N -4.41 0.17 -0.37 0.41 3.72 -0.56 -4.43 117.46 111.99 1hck n PHE 286 Ca -0.03 -0.09 0.30 0.00 -0.05 0.00 0.00 57.45 57.59 1hck n PHE 286 Cb 0.15 0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.29 1hck n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 1hck h GLN 287 N 2.85 0.22 0.00 -1.08 5.75 -1.55 -1.93 115.11 119.38 1hck h GLN 287 Ca 0.00 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1hck h GLN 287 Cb 0.62 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.10 1hck h GLN 287 CO 0.00 0.14 -0.27 -0.40 -2.65 0.00 0.00 178.83 175.65 1hck n ASP 288 N -4.57 1.92 -4.74 -0.69 5.75 -1.26 -5.07 116.55 107.88 1hck n ASP 288 Ca 0.30 -3.33 -0.37 0.00 -0.01 0.00 0.00 54.79 51.38 1hck n ASP 288 Cb 1.14 -0.45 0.05 0.00 -1.03 0.00 0.00 41.12 40.83 1hck n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1hck s VAL 289 N -2.77 2.19 0.25 2.12 0.11 -0.73 -5.03 120.40 116.54 1hck s VAL 289 Ca 0.33 0.12 0.05 0.00 -2.93 0.00 0.00 61.98 59.55 1hck s VAL 289 Cb 0.31 -3.05 -0.02 0.00 -1.53 0.00 0.00 36.38 32.09 1hck s VAL 289 CO -0.02 -0.02 0.23 0.35 -3.33 0.00 0.00 175.10 172.31 1hck n THR 290 N -1.64 0.00 -3.81 5.04 -2.24 -1.26 -5.08 114.28 105.28 1hck n THR 290 Ca 0.14 -1.73 -0.29 0.00 -2.27 0.00 0.00 64.05 59.90 1hck n THR 290 Cb 0.48 0.88 -0.13 0.00 -2.10 0.00 0.00 70.33 69.47 1hck n THR 290 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1hck s LYS 291 N -2.94 1.80 0.71 -0.78 2.20 -1.26 -4.41 119.74 115.05 1hck s LYS 291 Ca 0.28 -2.59 -0.11 0.00 -0.36 0.00 0.00 55.97 53.19 1hck s LYS 291 Cb 0.01 -2.86 0.01 0.00 -1.51 0.00 0.00 37.83 33.48 1hck s LYS 291 CO 0.20 -1.20 1.08 -2.14 -0.36 0.00 0.00 175.35 172.93 1hck s PRO 292 N -0.39 2.86 -0.15 4.03 0.02 -1.26 -5.03 135.00 135.08 1hck s PRO 292 Ca 0.21 0.62 -0.07 0.00 0.02 0.00 0.00 61.00 61.78 1hck s PRO 292 Cb -0.17 -2.01 -0.04 0.00 0.02 0.00 0.00 34.50 32.30 1hck s PRO 292 CO -0.06 -1.07 0.09 0.14 -0.33 0.00 0.00 177.00 175.77 1hck s VAL 293 N -3.24 5.08 1.28 3.83 -7.23 -1.26 -4.40 120.40 114.46 1hck s VAL 293 Ca 0.58 0.06 -0.21 0.00 -1.81 0.00 0.00 61.98 60.60 1hck s VAL 293 Cb -0.12 -3.25 0.32 0.00 0.56 0.00 0.00 36.38 33.89 1hck s VAL 293 CO 0.53 0.53 1.07 -2.16 -0.31 0.00 0.00 175.10 174.76 1hck s PRO 294 N -0.30 -1.84 -0.86 4.82 0.04 -1.26 -4.96 135.00 130.63 1hck s PRO 294 Ca 0.10 -0.09 0.01 0.00 0.04 0.00 0.00 61.00 61.06 1hck s PRO 294 Cb -0.12 -1.53 0.28 0.00 0.04 0.00 0.00 34.50 33.18 1hck s PRO 294 CO 0.01 -4.12 1.13 -2.39 0.04 0.00 0.00 177.00 171.67 1hck n HIS 295 N -5.04 2.96 -3.20 0.56 1.44 -1.26 -5.01 115.22 105.66 1hck n HIS 295 Ca 0.14 -3.36 -0.38 0.00 -2.01 0.00 0.00 57.72 52.11 1hck n HIS 295 Cb 0.60 -0.90 -0.06 0.00 0.12 0.00 0.00 29.99 29.75 1hck n HIS 295 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1hck s LEU 296 N -2.69 4.47 -0.35 2.39 1.02 -1.26 -5.06 118.68 117.20 1hck s LEU 296 Ca 0.36 1.33 0.00 0.00 0.02 0.00 0.00 54.13 55.84 1hck s LEU 296 Cb 0.10 -3.17 0.12 0.00 0.02 0.00 0.00 46.19 43.26 1hck s LEU 296 CO 0.04 0.19 0.16 -0.60 0.02 0.00 0.00 176.35 176.16 1hck s ARG 297 N -1.44 0.83 0.00 1.70 6.06 -1.26 -5.14 118.95 119.71 1hck s ARG 297 Ca 0.34 -1.36 0.28 0.00 -2.50 0.00 0.00 55.73 52.49 1hck s ARG 297 Cb -0.19 -1.95 1.02 0.00 0.06 0.00 0.00 34.95 33.89 1hck s ARG 297 CO 0.21 -1.07 1.73 1.28 -2.50 0.00 0.00 175.30 174.94