#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7l s TRP 2 N 0.00 0.81 -0.02 0.00 -0.00 0.12 -4.99 118.94 114.86 1l7l s TRP 2 Ca 0.00 -0.16 0.02 0.00 -0.00 0.00 0.00 56.10 55.96 1l7l s TRP 2 Cb 0.00 -0.52 0.01 0.00 -0.00 0.00 0.00 33.47 32.96 1l7l s TRP 2 CO 0.00 -0.01 -0.06 0.21 -0.00 0.00 0.00 176.95 177.09 1l7l s LYS 3 N -0.24 0.71 0.02 5.86 2.20 -1.26 -0.84 119.74 126.19 1l7l s LYS 3 Ca 0.03 -0.19 -0.27 0.00 -0.36 0.00 0.00 55.97 55.18 1l7l s LYS 3 Cb -0.04 -0.70 0.09 0.00 -1.51 0.00 0.00 37.83 35.68 1l7l s LYS 3 CO -0.00 0.05 1.23 0.20 -0.36 0.00 0.00 175.35 176.47 1l7l s GLY 4 N 0.33 -0.12 -0.10 5.54 0.00 -0.70 -5.01 107.32 107.27 1l7l s GLY 4 Ca -0.04 0.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.66 1l7l s GLY 4 CO 0.00 4.23 0.16 1.85 0.00 0.00 0.00 173.10 179.34 1l7l s GLU 5 N -2.11 3.46 -0.28 2.90 2.12 -1.26 -1.14 118.70 122.38 1l7l s GLU 5 Ca 0.26 -0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.46 1l7l s GLU 5 Cb -0.00 -3.18 0.05 0.00 0.26 0.00 0.00 34.13 31.26 1l7l s GLU 5 CO 0.00 0.76 -0.04 0.08 -0.54 0.00 0.00 175.26 175.52 1l7l s VAL 6 N -1.07 2.67 0.14 3.70 1.01 0.31 -4.96 120.40 122.21 1l7l s VAL 6 Ca 0.17 -1.47 -0.30 0.00 0.00 0.00 0.00 61.98 60.38 1l7l s VAL 6 Cb -0.12 -2.54 -0.07 0.00 0.00 0.00 0.00 36.38 33.65 1l7l s VAL 6 CO 0.06 -0.07 1.01 -0.76 0.00 0.00 0.00 175.10 175.35 1l7l s LEU 7 N 1.20 4.50 0.51 3.92 1.02 -1.26 -1.38 118.68 127.19 1l7l s LEU 7 Ca -0.07 1.91 0.17 0.00 0.02 0.00 0.00 54.13 56.17 1l7l s LEU 7 Cb -0.20 -3.60 1.26 0.00 0.02 0.00 0.00 46.19 43.68 1l7l s LEU 7 CO -0.03 -0.11 2.13 0.00 0.02 0.00 0.00 176.35 178.36 1l7l h ALA 8 N 5.33 1.92 -0.25 4.21 0.00 -1.52 -2.29 119.26 126.65 1l7l h ALA 8 Ca -0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1l7l h ALA 8 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1l7l h ALA 8 CO 0.72 0.04 0.00 0.27 0.00 0.00 0.00 179.25 180.27 1l7l n ASN 9 N -4.46 1.69 -4.43 0.00 6.94 -1.26 -4.75 115.26 108.99 1l7l n ASN 9 Ca -0.03 -1.86 -0.44 0.00 -0.02 0.00 0.00 54.58 52.23 1l7l n ASN 9 Cb 0.11 -0.17 -0.02 0.00 -2.36 0.00 0.00 39.78 37.35 1l7l n ASN 9 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1l7l s ASN 10 N -1.26 6.79 0.37 0.53 2.47 -0.86 -4.76 114.94 118.22 1l7l s ASN 10 Ca 0.27 -2.45 0.05 0.00 0.42 0.00 0.00 52.86 51.15 1l7l s ASN 10 Cb 0.14 -2.37 0.73 0.00 -1.45 0.00 0.00 41.25 38.31 1l7l s ASN 10 CO 0.20 -0.88 2.00 -0.08 -3.72 0.00 0.00 177.10 174.62 1l7l h GLU 11 N 8.17 0.72 0.00 0.43 4.81 -1.88 -2.12 114.58 124.71 1l7l h GLU 11 Ca 0.19 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1l7l h GLU 11 Cb 0.98 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 1l7l h GLU 11 CO 1.09 0.48 -0.10 0.00 -0.73 0.00 0.00 179.01 179.75 1l7l h ALA 12 N 1.64 0.96 0.00 2.92 0.00 -1.97 -3.49 119.26 119.31 1l7l h ALA 12 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1l7l h ALA 12 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1l7l h ALA 12 CO -0.07 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.73 1l7l n GLY 13 N 0.69 0.59 3.48 0.00 0.00 -0.80 -4.93 105.19 104.22 1l7l n GLY 13 Ca 0.02 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1l7l n GLY 13 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1l7l s GLN 14 N -2.53 3.08 0.28 1.61 2.00 0.78 -4.92 119.66 119.96 1l7l s GLN 14 Ca 0.00 -0.89 -0.29 0.00 -2.00 0.00 0.00 55.36 52.18 1l7l s GLN 14 Cb 0.00 -3.95 -0.10 0.00 0.80 0.00 0.00 33.01 29.76 1l7l s GLN 14 CO 0.00 -0.73 1.24 0.54 -0.50 0.00 0.00 175.29 175.84 1l7l s VAL 15 N 1.81 3.08 0.49 1.34 0.11 -1.26 -0.98 120.40 124.98 1l7l s VAL 15 Ca 0.07 1.03 0.07 0.00 -2.93 0.00 0.00 61.98 60.22 1l7l s VAL 15 Cb -0.18 -3.66 0.01 0.00 -1.53 0.00 0.00 36.38 31.02 1l7l s VAL 15 CO 0.11 0.22 0.40 0.42 -3.33 0.00 0.00 175.10 172.93 1l7l s THR 16 N -0.84 2.07 -2.24 5.04 -4.23 -0.64 -4.93 115.64 109.87 1l7l s THR 16 Ca 0.49 -1.43 0.30 0.00 -1.18 0.00 0.00 61.69 59.88 1l7l s THR 16 Cb -0.36 -2.50 0.73 0.00 1.34 0.00 0.00 72.50 71.71 1l7l s THR 16 CO 0.46 0.00 1.99 -1.54 -0.54 0.00 0.00 174.62 174.98 1l7l n SER 17 N -1.68 0.73 -4.66 3.99 3.41 -1.26 -4.68 113.62 109.46 1l7l n SER 17 Ca 0.01 -1.25 -0.41 0.00 -0.26 0.00 0.00 58.87 56.97 1l7l n SER 17 Cb 0.63 -0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.53 1l7l n SER 17 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1l7l s ILE 18 N -2.00 4.97 -0.35 -1.33 -1.09 -1.26 -5.02 121.20 115.12 1l7l s ILE 18 Ca 0.43 1.35 -0.10 0.00 -2.23 0.00 0.00 60.65 60.09 1l7l s ILE 18 Cb 0.21 -4.02 0.01 0.00 -1.58 0.00 0.00 42.46 37.09 1l7l s ILE 18 CO 0.35 0.08 0.19 -0.63 -1.23 0.00 0.00 174.94 173.70 1l7l s ILE 19 N 2.00 4.60 -0.16 2.92 -1.09 -1.26 -1.13 121.20 127.08 1l7l s ILE 19 Ca 0.32 -0.67 -0.29 0.00 -2.23 0.00 0.00 60.65 57.78 1l7l s ILE 19 Cb -0.16 -3.48 -0.01 0.00 -1.58 0.00 0.00 42.46 37.23 1l7l s ILE 19 CO 0.11 -0.11 1.21 -0.47 -1.23 0.00 0.00 174.94 174.45 1l7l s TYR 20 N 1.58 2.99 0.16 3.97 6.14 0.06 -4.89 117.35 127.36 1l7l s TYR 20 Ca 0.03 1.12 0.08 0.00 0.64 0.00 0.00 57.07 58.94 1l7l s TYR 20 Cb -0.18 -3.45 -0.04 0.00 0.42 0.00 0.00 41.96 38.71 1l7l s TYR 20 CO 0.07 -1.41 -0.06 -0.80 0.64 0.00 0.00 175.55 173.98 1l7l s ASN 21 N 1.76 4.49 0.07 4.32 0.01 -1.26 -0.65 114.94 123.69 1l7l s ASN 21 Ca 0.53 -0.47 -0.37 0.00 -0.71 0.00 0.00 52.86 51.84 1l7l s ASN 21 Cb -0.21 -0.86 -0.17 0.00 0.41 0.00 0.00 41.25 40.42 1l7l s ASN 21 CO 0.14 0.11 1.34 -2.65 -1.51 0.00 0.00 177.10 174.54 1l7l n PRO 22 N 0.10 1.11 0.00 -0.60 -0.02 -1.26 -1.24 135.00 133.09 1l7l n PRO 22 Ca -0.11 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1l7l n PRO 22 Cb 0.55 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1l7l n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l7l n GLY 23 N 2.54 1.73 3.77 -1.23 0.00 -1.26 -5.04 105.19 105.70 1l7l n GLY 23 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1l7l n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1l7l s ASP 24 N -2.29 6.09 -0.15 1.61 1.01 -0.38 -4.93 116.67 117.63 1l7l s ASP 24 Ca 0.00 2.70 -0.02 0.00 0.71 0.00 0.00 52.55 55.94 1l7l s ASP 24 Cb 0.00 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.27 1l7l s ASP 24 CO 0.00 -1.01 -0.08 -0.69 0.21 0.00 0.00 175.17 173.61 1l7l s VAL 25 N -1.27 3.53 0.14 -1.27 1.01 -1.26 -4.50 120.40 116.78 1l7l s VAL 25 Ca 0.60 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 62.15 1l7l s VAL 25 Cb -0.39 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1l7l s VAL 25 CO 0.50 0.50 -0.14 0.27 0.00 0.00 0.00 175.10 176.23 1l7l s ILE 26 N 0.38 1.43 -0.04 2.22 -4.36 -0.33 -0.09 121.20 120.41 1l7l s ILE 26 Ca -0.07 -1.85 0.05 0.00 -0.26 0.00 0.00 60.65 58.52 1l7l s ILE 26 Cb -0.15 -1.68 -0.01 0.00 1.25 0.00 0.00 42.46 41.87 1l7l s ILE 26 CO 0.04 -0.47 -0.19 -0.89 0.24 0.00 0.00 174.94 173.67 1l7l s THR 27 N -2.38 1.58 -0.04 8.37 2.01 -0.29 -0.44 115.64 124.45 1l7l s THR 27 Ca 0.13 -0.81 0.05 0.00 0.31 0.00 0.00 61.69 61.36 1l7l s THR 27 Cb -0.04 -1.34 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 1l7l s THR 27 CO 0.04 0.45 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.59 1l7l s ILE 28 N -0.11 1.60 -0.07 1.82 1.01 -0.16 -1.24 121.20 124.05 1l7l s ILE 28 Ca -0.01 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.84 1l7l s ILE 28 Cb -0.11 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 41.01 1l7l s ILE 28 CO 0.02 0.45 -0.14 -0.69 0.00 0.00 0.00 174.94 174.58 1l7l s VAL 29 N -0.14 1.28 -0.02 2.92 1.01 -0.71 -1.34 120.40 123.41 1l7l s VAL 29 Ca -0.01 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.48 1l7l s VAL 29 Cb -0.11 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 1l7l s VAL 29 CO 0.02 0.39 -0.22 0.00 0.00 0.00 0.00 175.10 175.29 1l7l s ALA 30 N 0.67 1.81 0.05 5.51 0.00 -0.31 -1.32 121.76 128.17 1l7l s ALA 30 Ca -0.14 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 50.86 1l7l s ALA 30 Cb -0.16 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 1l7l s ALA 30 CO 0.04 0.44 0.00 0.00 0.00 0.00 0.00 175.76 176.24 1l7l s ALA 31 N -0.47 0.33 0.00 0.00 0.00 -0.21 -4.77 121.76 116.64 1l7l s ALA 31 Ca 0.07 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1l7l s ALA 31 Cb -0.09 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1l7l s ALA 31 CO -0.00 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1l7l n GLY 32 N 0.33 0.35 2.86 0.00 0.00 -1.26 -0.41 105.19 107.06 1l7l n GLY 32 Ca -0.16 -2.24 -0.19 0.00 0.00 0.00 0.00 46.02 43.43 1l7l n GLY 32 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1l7l s TRP 33 N -0.34 0.56 0.15 1.61 0.52 -1.19 -4.18 118.94 116.07 1l7l s TRP 33 Ca 0.00 -0.12 -0.11 0.00 0.02 0.00 0.00 56.10 55.90 1l7l s TRP 33 Cb 0.00 -0.54 0.00 0.00 -1.15 0.00 0.00 33.47 31.78 1l7l s TRP 33 CO 0.00 -0.16 0.30 0.00 0.02 0.00 0.00 176.95 177.12 1l7l s ALA 34 N 0.91 -0.25 0.03 0.98 0.00 -0.34 -2.54 121.76 120.54 1l7l s ALA 34 Ca -0.11 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.19 1l7l s ALA 34 Cb -0.14 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 1l7l s ALA 34 CO -0.00 -0.63 -0.05 0.45 0.00 0.00 0.00 175.76 175.52 1l7l s SER 35 N -2.92 0.49 0.00 0.00 0.15 0.06 -0.30 113.70 111.18 1l7l s SER 35 Ca 0.12 -0.45 0.19 0.00 0.70 0.00 0.00 55.95 56.52 1l7l s SER 35 Cb 0.03 0.05 0.52 0.00 -1.71 0.00 0.00 66.02 64.91 1l7l s SER 35 CO -0.04 -0.21 1.43 0.00 1.20 0.00 0.00 173.24 175.62 1l7l n TYR 36 N 1.77 0.58 0.00 3.44 4.11 -1.26 -1.53 117.16 124.28 1l7l n TYR 36 Ca -0.22 -0.29 0.00 0.00 -0.00 0.00 0.00 57.90 57.39 1l7l n TYR 36 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.90 1l7l n TYR 36 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1l7l n GLY 37 N 1.36 1.14 3.56 -7.48 0.00 -1.25 -4.54 105.19 97.98 1l7l n GLY 37 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1l7l n GLY 37 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1l7l s PRO 38 N 0.00 -0.13 0.28 1.61 0.02 -1.26 -4.94 135.00 130.58 1l7l s PRO 38 Ca 0.00 1.18 0.08 0.00 0.02 0.00 0.00 61.00 62.28 1l7l s PRO 38 Cb 0.00 -1.62 0.38 0.00 0.02 0.00 0.00 34.50 33.28 1l7l s PRO 38 CO 0.00 -3.30 1.63 1.79 -0.33 0.00 0.00 177.00 176.80 1l7l h THR 39 N -2.33 1.38 -4.10 0.99 1.35 -2.01 -3.44 112.91 104.74 1l7l h THR 39 Ca -0.54 -1.87 -0.55 0.00 -0.55 0.00 0.00 66.41 62.91 1l7l h THR 39 Cb 1.30 1.96 0.18 0.00 -1.73 0.00 0.00 68.15 69.86 1l7l h THR 39 CO 0.46 0.54 0.35 1.67 -0.25 0.00 0.00 175.52 178.29 1l7l n GLN 40 N -3.90 0.51 -4.40 4.72 7.27 -1.26 -5.05 117.38 115.27 1l7l n GLN 40 Ca -0.02 0.24 -0.23 0.00 0.07 0.00 0.00 57.00 57.07 1l7l n GLN 40 Cb 0.57 -2.44 -0.11 0.00 2.41 0.00 0.00 30.24 30.68 1l7l n GLN 40 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1l7l s LYS 41 N -3.78 1.47 0.13 3.69 1.02 -1.26 -4.62 119.74 116.39 1l7l s LYS 41 Ca 0.76 -1.59 0.06 0.00 0.02 0.00 0.00 55.97 55.22 1l7l s LYS 41 Cb -0.33 -1.53 -0.04 0.00 -0.52 0.00 0.00 37.83 35.41 1l7l s LYS 41 CO 0.48 0.30 -0.13 -1.58 -0.92 0.00 0.00 175.35 173.49 1l7l s TRP 42 N -2.33 1.40 0.35 3.18 0.51 0.59 -4.86 118.94 117.78 1l7l s TRP 42 Ca 0.23 -0.59 -0.06 0.00 -2.12 0.00 0.00 56.10 53.56 1l7l s TRP 42 Cb -0.05 -0.72 0.08 0.00 -0.81 0.00 0.00 33.47 31.98 1l7l s TRP 42 CO 0.10 0.15 0.41 0.41 -0.51 0.00 0.00 176.95 177.52 1l7l n GLY 43 N 0.31 -1.69 0.00 0.98 0.00 -1.26 -1.20 105.19 102.32 1l7l n GLY 43 Ca -0.14 -1.61 0.06 0.00 0.00 0.00 0.00 46.02 44.34 1l7l n GLY 43 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1l7l n PRO 44 N -2.16 0.21 0.00 1.61 -0.04 -1.26 -0.79 135.00 132.57 1l7l n PRO 44 Ca 0.05 0.14 0.13 0.00 -0.04 0.00 0.00 63.50 63.79 1l7l n PRO 44 Cb 0.19 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.58 1l7l n PRO 44 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1l7l n GLN 45 N -1.25 0.52 0.00 0.54 6.02 -1.26 -1.17 117.38 120.78 1l7l n GLN 45 Ca 0.06 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 1l7l n GLN 45 Cb 0.09 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.86 1l7l n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1l7l n GLY 46 N 1.38 -1.19 3.29 1.08 0.00 0.03 -4.26 105.19 105.52 1l7l n GLY 46 Ca 0.11 -1.25 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 1l7l n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l7l s ASP 47 N -4.00 5.67 0.09 1.61 2.15 0.19 -4.62 116.67 117.77 1l7l s ASP 47 Ca 0.00 -1.44 0.16 0.00 0.43 0.00 0.00 52.55 51.71 1l7l s ASP 47 Cb 0.00 -2.00 0.69 0.00 -0.30 0.00 0.00 42.92 41.31 1l7l s ASP 47 CO 0.00 -0.52 1.50 -2.11 -0.17 0.00 0.00 175.17 173.87 1l7l n ARG 48 N 4.94 0.07 0.00 4.34 1.85 -1.26 -2.55 116.66 124.04 1l7l n ARG 48 Ca -0.10 0.35 0.11 0.00 -1.00 0.00 0.00 57.85 57.20 1l7l n ARG 48 Cb 0.43 -1.63 0.04 0.00 -1.05 0.00 0.00 32.46 30.25 1l7l n ARG 48 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1l7l n GLU 49 N -1.76 0.48 -3.25 2.89 -0.58 -1.26 -4.95 120.64 112.21 1l7l n GLU 49 Ca 0.02 -0.37 -0.38 0.00 -0.42 0.00 0.00 57.16 56.01 1l7l n GLU 49 Cb 0.16 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.49 1l7l n GLU 49 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1l7l s HIS 50 N -2.78 3.54 0.47 -0.32 2.46 -1.06 -5.04 115.29 112.57 1l7l s HIS 50 Ca 0.14 0.99 -0.23 0.00 0.47 0.00 0.00 55.06 56.42 1l7l s HIS 50 Cb 0.17 -2.61 -0.07 0.00 -0.13 0.00 0.00 32.58 29.95 1l7l s HIS 50 CO 0.71 0.17 1.28 -1.25 -2.47 0.00 0.00 174.74 173.18 1l7l s PRO 51 N 0.58 3.61 -0.32 2.88 0.04 -1.26 -4.70 135.00 135.83 1l7l s PRO 51 Ca 0.29 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 63.10 1l7l s PRO 51 Cb -0.16 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1l7l s PRO 51 CO 0.12 -0.76 1.28 0.34 0.04 0.00 0.00 177.00 178.03 1l7l s ASP 52 N -1.01 6.67 -0.27 6.66 -1.08 -1.26 -4.91 116.67 121.47 1l7l s ASP 52 Ca 0.64 1.14 0.09 0.00 -0.52 0.00 0.00 52.55 53.90 1l7l s ASP 52 Cb -0.36 -2.54 0.46 0.00 -1.46 0.00 0.00 42.92 39.02 1l7l s ASP 52 CO 0.44 -1.10 1.33 0.00 0.52 0.00 0.00 175.17 176.37 1l7l n GLN 53 N 7.35 2.00 0.00 4.34 6.02 -1.26 -4.85 117.38 130.98 1l7l n GLN 53 Ca 0.15 -3.39 0.00 0.00 -0.01 0.00 0.00 57.00 53.74 1l7l n GLN 53 Cb 0.47 -1.81 0.00 0.00 1.02 0.00 0.00 30.24 29.92 1l7l n GLN 53 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1l7l n GLY 54 N -1.06 1.29 3.74 1.08 0.00 -1.26 -4.95 105.19 104.03 1l7l n GLY 54 Ca 0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.95 1l7l n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7l s LEU 55 N 0.00 3.56 0.59 0.99 1.43 -1.26 -4.11 118.68 119.88 1l7l s LEU 55 Ca 0.00 2.44 0.36 0.00 -1.03 0.00 0.00 54.13 55.90 1l7l s LEU 55 Cb 0.00 -4.60 1.82 0.00 0.03 0.00 0.00 46.19 43.44 1l7l s LEU 55 CO 0.00 -1.85 2.17 0.16 0.23 0.00 0.00 176.35 177.06 1l7l h ILE 56 N 0.53 0.16 -3.34 -0.59 3.07 -1.80 -3.38 117.51 112.16 1l7l h ILE 56 Ca -0.50 -0.31 -0.53 0.00 1.55 0.00 0.00 64.86 65.07 1l7l h ILE 56 Cb 1.31 1.26 -0.39 0.00 -0.27 0.00 0.00 36.82 38.72 1l7l h ILE 56 CO 0.53 0.03 -0.77 0.00 -1.05 0.00 0.00 178.15 176.89 1l7l n HIS 58 N 4.97 0.00 -0.45 0.00 8.25 -1.26 -3.26 115.22 123.47 1l7l n HIS 58 Ca -0.10 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.47 1l7l n HIS 58 Cb 0.47 -0.05 0.34 0.00 1.12 0.00 0.00 29.99 31.86 1l7l n HIS 58 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1l7l n ASP 59 N -0.68 4.22 -3.99 0.41 8.00 -1.26 -4.93 116.55 118.32 1l7l n ASP 59 Ca 0.20 -2.13 -0.09 0.00 0.71 0.00 0.00 54.79 53.48 1l7l n ASP 59 Cb 0.22 -0.52 -0.08 0.00 -0.02 0.00 0.00 41.12 40.72 1l7l n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1l7l s ALA 60 N -1.25 0.19 0.67 2.24 0.00 -1.20 -4.85 121.76 117.56 1l7l s ALA 60 Ca 0.50 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 51.38 1l7l s ALA 60 Cb 0.28 0.63 -0.01 0.00 0.00 0.00 0.00 23.12 24.02 1l7l s ALA 60 CO 0.31 -0.52 1.05 -0.06 0.00 0.00 0.00 175.76 176.54 1l7l s PHE 61 N -3.94 3.28 0.19 0.00 0.08 -1.26 -4.90 117.98 111.43 1l7l s PHE 61 Ca 0.13 1.36 -0.32 0.00 0.12 0.00 0.00 56.93 58.21 1l7l s PHE 61 Cb 0.06 -2.84 -0.12 0.00 -0.57 0.00 0.00 43.02 39.54 1l7l s PHE 61 CO -0.05 -1.07 1.70 0.00 -0.10 0.00 0.00 175.22 175.70 1l7l n GLY 63 N 3.87 0.74 3.86 0.00 0.00 0.09 -0.64 105.19 113.12 1l7l n GLY 63 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1l7l n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7l s ALA 64 N -2.60 3.16 0.00 4.61 0.00 -0.71 -3.50 121.76 122.72 1l7l s ALA 64 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 51.64 1l7l s ALA 64 Cb 0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 1l7l s ALA 64 CO 0.00 -0.34 0.91 -1.17 0.00 0.00 0.00 175.76 175.17 1l7l s LEU 65 N -4.42 4.38 0.38 0.00 2.96 -0.32 -0.42 118.68 121.24 1l7l s LEU 65 Ca 0.55 1.57 0.04 0.00 -0.22 0.00 0.00 54.13 56.07 1l7l s LEU 65 Cb -0.10 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 43.09 1l7l s LEU 65 CO 0.39 -0.20 0.12 0.68 -1.32 0.00 0.00 176.35 176.02 1l7l s VAL 66 N 0.81 0.69 0.11 1.68 -7.23 -0.21 -0.90 120.40 115.35 1l7l s VAL 66 Ca 0.48 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.58 1l7l s VAL 66 Cb -0.21 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.26 1l7l s VAL 66 CO 0.26 0.00 0.19 0.00 -0.31 0.00 0.00 175.10 175.24 1l7l s MET 67 N -3.77 0.94 0.05 4.82 0.23 -0.29 -0.98 119.30 120.29 1l7l s MET 67 Ca 0.28 -1.11 0.08 0.00 -1.03 0.00 0.00 55.69 53.91 1l7l s MET 67 Cb 0.04 0.33 -0.03 0.00 -1.53 0.00 0.00 34.83 33.65 1l7l s MET 67 CO 0.15 -0.30 -0.22 0.15 -2.03 0.00 0.00 175.02 172.76 1l7l s LYS 68 N -3.92 1.50 -0.25 3.16 1.02 -0.10 -0.73 119.74 120.42 1l7l s LYS 68 Ca 0.11 -1.00 -0.01 0.00 0.02 0.00 0.00 55.97 55.09 1l7l s LYS 68 Cb 0.05 -1.64 0.03 0.00 -0.52 0.00 0.00 37.83 35.74 1l7l s LYS 68 CO -0.06 0.42 -0.06 0.42 -0.92 0.00 0.00 175.35 175.15 1l7l s ILE 69 N -0.81 2.86 0.00 2.17 1.01 -1.26 -1.20 121.20 123.97 1l7l s ILE 69 Ca 0.09 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.67 1l7l s ILE 69 Cb -0.09 -2.47 0.00 0.00 0.01 0.00 0.00 42.46 39.91 1l7l s ILE 69 CO 0.02 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.74 1l7l n GLY 70 N 4.66 3.39 1.91 6.18 0.00 -0.06 -1.63 105.19 119.63 1l7l n GLY 70 Ca -0.16 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.57 1l7l n GLY 70 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l7l n ASN 71 N 3.91 3.72 -4.73 1.61 2.85 -1.26 -4.87 115.26 116.49 1l7l n ASN 71 Ca 0.00 -3.18 -0.29 0.00 -0.11 0.00 0.00 54.58 50.99 1l7l n ASN 71 Cb 0.00 -0.75 0.14 0.00 1.24 0.00 0.00 39.78 40.41 1l7l n ASN 71 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1l7l s SER 72 N -0.76 3.39 1.04 1.20 1.04 -0.64 -5.05 113.70 113.92 1l7l s SER 72 Ca 0.44 1.32 -0.13 0.00 0.48 0.00 0.00 55.95 58.05 1l7l s SER 72 Cb 0.37 -1.99 0.21 0.00 0.10 0.00 0.00 66.02 64.70 1l7l s SER 72 CO 0.09 -2.67 1.09 -0.83 0.98 0.00 0.00 173.24 171.91 1l7l s GLY 73 N -3.57 1.56 0.45 7.32 0.00 -1.26 -4.68 107.32 107.14 1l7l s GLY 73 Ca 0.64 -0.47 -0.23 0.00 0.00 0.00 0.00 44.72 44.65 1l7l s GLY 73 CO 0.56 0.20 1.18 -0.51 0.00 0.00 0.00 173.10 174.53 1l7l s THR 74 N -2.97 3.04 -0.08 0.90 -4.23 -1.26 -4.59 115.64 106.46 1l7l s THR 74 Ca 0.66 0.81 0.02 0.00 -1.18 0.00 0.00 61.69 62.00 1l7l s THR 74 Cb -0.17 -3.42 0.02 0.00 1.34 0.00 0.00 72.50 70.26 1l7l s THR 74 CO 0.58 0.01 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.93 1l7l s ILE 75 N -1.49 1.06 0.36 2.99 1.01 0.09 -4.95 121.20 120.26 1l7l s ILE 75 Ca 0.62 -0.41 -0.28 0.00 0.00 0.00 0.00 60.65 60.58 1l7l s ILE 75 Cb -0.30 -1.00 -0.11 0.00 0.01 0.00 0.00 42.46 41.05 1l7l s ILE 75 CO 0.37 0.35 1.50 -2.65 0.00 0.00 0.00 174.94 174.50 1l7l n PRO 76 N 4.10 2.64 -0.06 2.79 -0.02 -1.26 -1.14 135.00 142.05 1l7l n PRO 76 Ca -0.21 0.93 -0.10 0.00 -2.02 0.00 0.00 63.50 62.10 1l7l n PRO 76 Cb 0.51 -2.66 -0.05 0.00 -0.02 0.00 0.00 33.50 31.28 1l7l n PRO 76 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1l7l n VAL 77 N 0.80 0.68 -1.42 -1.45 0.31 -0.43 -4.84 118.33 111.98 1l7l n VAL 77 Ca 0.03 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1l7l n VAL 77 Cb 0.38 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 1l7l n VAL 77 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1l7l n ASN 78 N -3.16 0.00 0.12 4.52 3.02 -0.08 -1.18 115.26 118.50 1l7l n ASN 78 Ca -0.22 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.44 1l7l n ASN 78 Cb 0.70 0.00 0.48 0.00 -0.61 0.00 0.00 39.78 40.35 1l7l n ASN 78 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1l7l n THR 79 N 0.00 0.85 0.00 3.41 -2.24 -1.26 -4.55 114.28 110.49 1l7l n THR 79 Ca 0.00 0.24 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 1l7l n THR 79 Cb 0.00 -1.16 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 1l7l n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l7l n GLY 80 N -0.04 1.31 2.95 3.38 0.00 -0.33 -1.16 105.19 111.30 1l7l n GLY 80 Ca 0.02 -1.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.09 1l7l n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7l s LEU 81 N 0.00 1.61 -0.30 0.99 1.43 -0.45 -4.92 118.68 117.04 1l7l s LEU 81 Ca 0.00 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 52.89 1l7l s LEU 81 Cb 0.00 -0.50 0.02 0.00 0.03 0.00 0.00 46.19 45.74 1l7l s LEU 81 CO 0.00 0.01 0.05 0.12 0.23 0.00 0.00 176.35 176.76 1l7l s PHE 82 N 0.49 3.17 -1.20 0.29 5.36 -1.26 -0.98 117.98 123.84 1l7l s PHE 82 Ca -0.07 -1.28 -0.19 0.00 -0.96 0.00 0.00 56.93 54.43 1l7l s PHE 82 Cb -0.11 -2.20 0.00 0.00 -0.34 0.00 0.00 43.02 40.37 1l7l s PHE 82 CO 0.01 -0.66 0.71 0.54 -1.46 0.00 0.00 175.22 174.35 1l7l n ARG 83 N 4.79 -1.47 -3.99 10.12 1.74 -1.05 -4.92 116.66 121.88 1l7l n ARG 83 Ca -0.14 0.39 -0.36 0.00 -0.77 0.00 0.00 57.85 56.96 1l7l n ARG 83 Cb 0.47 -3.96 -0.07 0.00 -1.02 0.00 0.00 32.46 27.88 1l7l n ARG 83 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1l7l s TRP 84 N -3.57 3.50 -0.06 -1.55 -0.00 0.41 -4.79 118.94 112.88 1l7l s TRP 84 Ca 0.39 0.45 0.04 0.00 -0.00 0.00 0.00 56.10 56.98 1l7l s TRP 84 Cb -0.15 -1.90 -0.02 0.00 -0.00 0.00 0.00 33.47 31.40 1l7l s TRP 84 CO 0.88 0.68 -0.19 0.08 -0.00 0.00 0.00 176.95 178.40 1l7l s VAL 85 N -1.01 2.64 0.68 5.86 1.01 -1.26 -1.19 120.40 127.13 1l7l s VAL 85 Ca 0.15 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 1l7l s VAL 85 Cb -0.12 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 1l7l s VAL 85 CO 0.04 0.57 1.06 0.00 0.00 0.00 0.00 175.10 176.77 1l7l s ALA 86 N -0.35 2.70 0.96 5.51 0.00 -1.26 -5.03 121.76 124.28 1l7l s ALA 86 Ca 0.03 0.13 -0.11 0.00 0.00 0.00 0.00 51.96 52.01 1l7l s ALA 86 Cb -0.12 -3.18 0.16 0.00 0.00 0.00 0.00 23.12 19.98 1l7l s ALA 86 CO 0.02 -1.14 1.09 -2.30 0.00 0.00 0.00 175.76 173.43 1l7l n PRO 87 N -2.94 -0.72 -1.70 0.00 -0.02 -1.26 -4.91 135.00 123.45 1l7l n PRO 87 Ca 0.08 -0.15 -0.40 0.00 -2.02 0.00 0.00 63.50 61.00 1l7l n PRO 87 Cb 0.53 -2.32 0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1l7l n PRO 87 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1l7l n ASN 88 N -4.20 2.36 0.00 2.55 3.02 -1.26 -2.47 115.26 115.26 1l7l n ASN 88 Ca 0.11 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 1l7l n ASN 88 Cb 0.52 -1.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.20 1l7l n ASN 88 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1l7l n ASN 89 N -0.06 -3.36 -4.64 6.41 5.03 -1.26 -4.99 115.26 112.39 1l7l n ASN 89 Ca 0.08 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.15 1l7l n ASN 89 Cb 0.41 -1.78 -0.09 0.00 -1.02 0.00 0.00 39.78 37.29 1l7l n ASN 89 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1l7l s VAL 90 N -1.76 5.28 0.04 2.41 1.01 -1.03 -5.05 120.40 121.30 1l7l s VAL 90 Ca 0.00 0.35 -0.27 0.00 0.00 0.00 0.00 61.98 62.06 1l7l s VAL 90 Cb 0.00 -3.59 0.09 0.00 0.00 0.00 0.00 36.38 32.88 1l7l s VAL 90 CO 0.00 0.27 0.75 0.00 0.00 0.00 0.00 175.10 176.12 1l7l s GLN 91 N 1.46 1.02 0.00 2.72 -2.07 -1.26 -4.68 119.66 116.85 1l7l s GLN 91 Ca 0.11 -0.25 0.00 0.00 -1.82 0.00 0.00 55.36 53.40 1l7l s GLN 91 Cb -0.15 0.47 0.00 0.00 -1.09 0.00 0.00 33.01 32.24 1l7l s GLN 91 CO 0.08 -0.42 0.00 0.41 -1.32 0.00 0.00 175.29 174.04 1l7l n GLY 92 N -0.06 0.66 3.78 2.60 0.00 0.18 -3.41 105.19 108.93 1l7l n GLY 92 Ca -0.14 -2.19 -0.41 0.00 0.00 0.00 0.00 46.02 43.28 1l7l n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7l s ALA 93 N -1.39 3.52 -0.21 4.61 0.00 -1.26 -0.76 121.76 126.27 1l7l s ALA 93 Ca 0.00 1.49 -0.20 0.00 0.00 0.00 0.00 51.96 53.25 1l7l s ALA 93 Cb 0.00 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 1l7l s ALA 93 CO 0.00 -0.96 0.57 0.42 0.00 0.00 0.00 175.76 175.79 1l7l s ILE 94 N -1.14 5.06 -0.14 0.00 1.01 -0.28 -0.88 121.20 124.82 1l7l s ILE 94 Ca 0.52 1.06 -0.01 0.00 0.00 0.00 0.00 60.65 62.23 1l7l s ILE 94 Cb -0.44 -3.89 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 1l7l s ILE 94 CO 0.60 0.13 -0.11 -0.89 0.00 0.00 0.00 174.94 174.67 1l7l s THR 95 N 1.88 3.23 -0.09 2.92 2.01 -0.34 -1.62 115.64 123.63 1l7l s THR 95 Ca 0.26 -0.59 -0.10 0.00 0.31 0.00 0.00 61.69 61.57 1l7l s THR 95 Cb -0.16 -2.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1l7l s THR 95 CO 0.10 0.51 0.23 -0.76 -0.69 0.00 0.00 174.62 174.01 1l7l s LEU 96 N 0.43 4.39 -0.03 4.42 1.43 -0.16 -0.92 118.68 128.25 1l7l s LEU 96 Ca -0.08 0.60 -0.03 0.00 -1.03 0.00 0.00 54.13 53.59 1l7l s LEU 96 Cb -0.15 -2.24 0.01 0.00 0.03 0.00 0.00 46.19 43.83 1l7l s LEU 96 CO 0.04 0.35 0.09 -0.63 0.23 0.00 0.00 176.35 176.43 1l7l s ILE 97 N -0.86 -0.00 0.18 -0.59 1.01 -0.15 -0.15 121.20 120.63 1l7l s ILE 97 Ca 0.17 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 1l7l s ILE 97 Cb -0.13 -0.13 -0.08 0.00 0.01 0.00 0.00 42.46 42.12 1l7l s ILE 97 CO 0.06 0.00 1.21 -0.47 0.00 0.00 0.00 174.94 175.75 1l7l s TYR 98 N 0.10 3.41 -0.56 3.97 5.04 -1.26 -1.04 117.35 127.01 1l7l s TYR 98 Ca -0.00 1.39 -0.28 0.00 -2.44 0.00 0.00 57.07 55.74 1l7l s TYR 98 Cb -0.01 -3.45 0.03 0.00 0.35 0.00 0.00 41.96 38.88 1l7l s TYR 98 CO -0.00 -1.28 1.16 1.21 -1.34 0.00 0.00 175.55 175.30 1l7l s ASN 99 N 0.22 6.46 0.34 4.32 2.47 0.44 -4.91 114.94 124.29 1l7l s ASN 99 Ca 0.54 0.12 0.00 0.00 0.42 0.00 0.00 52.86 53.94 1l7l s ASN 99 Cb -0.33 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 36.93 1l7l s ASN 99 CO 0.36 -1.42 0.42 -0.62 -3.72 0.00 0.00 177.10 172.12 1l7l s ASP 100 N 2.86 1.13 0.04 -4.21 -1.08 -1.26 -0.73 116.67 113.42 1l7l s ASP 100 Ca 0.42 -1.57 -0.28 0.00 -0.52 0.00 0.00 52.55 50.61 1l7l s ASP 100 Cb -0.08 0.63 -0.04 0.00 -1.46 0.00 0.00 42.92 41.97 1l7l s ASP 100 CO 0.26 -1.23 0.90 -0.69 0.52 0.00 0.00 175.17 174.92 1l7l s VAL 101 N -3.16 4.75 0.20 1.11 1.01 -1.26 -2.17 120.40 120.88 1l7l s VAL 101 Ca 0.33 1.90 -0.32 0.00 0.00 0.00 0.00 61.98 63.90 1l7l s VAL 101 Cb 0.00 -4.25 -0.15 0.00 0.00 0.00 0.00 36.38 31.99 1l7l s VAL 101 CO 0.22 0.26 1.24 -2.65 0.00 0.00 0.00 175.10 174.17 1l7l n PRO 102 N 3.32 1.46 -0.75 2.72 -0.02 -1.26 -1.52 135.00 138.95 1l7l n PRO 102 Ca 0.02 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1l7l n PRO 102 Cb 0.50 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1l7l n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l7l n GLY 103 N 2.04 0.87 0.07 -1.23 0.00 -1.26 -4.89 105.19 100.79 1l7l n GLY 103 Ca 0.14 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.23 1l7l n GLY 103 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l7l n THR 104 N -2.02 1.63 0.53 2.61 -2.24 -0.57 -4.71 114.28 109.51 1l7l n THR 104 Ca 0.00 -1.88 0.13 0.00 -2.27 0.00 0.00 64.05 60.03 1l7l n THR 104 Cb 0.00 -0.02 0.40 0.00 -2.10 0.00 0.00 70.33 68.61 1l7l n THR 104 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1l7l h TYR 105 N 0.06 0.00 0.00 4.78 -1.99 -1.91 -3.36 116.97 114.56 1l7l h TYR 105 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1l7l h TYR 105 Cb 0.86 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.59 1l7l h TYR 105 CO 0.01 0.00 -0.07 0.78 -0.00 0.00 0.00 178.16 178.89 1l7l h GLY 106 N 4.02 0.00 -2.14 3.88 0.00 -1.86 -1.83 103.07 105.15 1l7l h GLY 106 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1l7l h GLY 106 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.70 1l7l n ASN 107 N -4.38 3.17 -4.86 0.19 6.94 -1.26 -4.95 115.26 110.10 1l7l n ASN 107 Ca -0.03 -2.14 -0.31 0.00 -0.02 0.00 0.00 54.58 52.08 1l7l n ASN 107 Cb 0.15 -0.41 -0.02 0.00 -2.36 0.00 0.00 39.78 37.14 1l7l n ASN 107 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1l7l s ASN 108 N -0.91 6.46 0.14 0.53 -0.87 -0.69 -3.77 114.94 115.85 1l7l s ASN 108 Ca 0.36 1.39 -0.10 0.00 -1.57 0.00 0.00 52.86 52.95 1l7l s ASN 108 Cb 0.21 -2.44 -0.00 0.00 -0.02 0.00 0.00 41.25 38.99 1l7l s ASN 108 CO 0.21 -0.63 0.27 -0.94 -2.57 0.00 0.00 177.10 173.45 1l7l s SER 109 N -3.49 0.04 0.19 -1.22 1.04 -0.58 -4.55 113.70 105.13 1l7l s SER 109 Ca 0.55 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.21 1l7l s SER 109 Cb -0.10 0.42 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1l7l s SER 109 CO 0.39 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 174.36 1l7l n GLY 110 N -0.18 -1.86 3.57 7.32 0.00 -1.26 -0.76 105.19 112.02 1l7l n GLY 110 Ca -0.10 -1.34 -0.06 0.00 0.00 0.00 0.00 46.02 44.52 1l7l n GLY 110 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1l7l s SER 111 N -4.00 -0.28 -0.03 1.61 1.04 -1.05 -1.52 113.70 109.47 1l7l s SER 111 Ca 0.00 -0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.37 1l7l s SER 111 Cb 0.00 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.45 1l7l s SER 111 CO 0.00 -0.61 -0.12 -0.36 0.98 0.00 0.00 173.24 173.13 1l7l s PHE 112 N -3.03 2.76 -0.18 5.02 0.08 -0.48 -3.16 117.98 119.00 1l7l s PHE 112 Ca 0.08 -0.12 -0.15 0.00 0.12 0.00 0.00 56.93 56.85 1l7l s PHE 112 Cb -0.01 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.79 1l7l s PHE 112 CO -0.06 0.26 0.36 0.45 -0.10 0.00 0.00 175.22 176.13 1l7l s SER 113 N -1.02 6.45 -0.04 1.36 0.15 0.45 -0.53 113.70 120.53 1l7l s SER 113 Ca 0.13 0.53 0.02 0.00 0.70 0.00 0.00 55.95 57.34 1l7l s SER 113 Cb -0.11 -2.22 0.01 0.00 -1.71 0.00 0.00 66.02 62.00 1l7l s SER 113 CO 0.03 0.00 -0.08 -0.69 1.20 0.00 0.00 173.24 173.70 1l7l s VAL 114 N 0.91 0.76 -0.11 4.45 1.01 -0.29 -1.05 120.40 126.08 1l7l s VAL 114 Ca 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.84 1l7l s VAL 114 Cb -0.14 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 1l7l s VAL 114 CO 0.07 0.26 -0.04 0.20 0.00 0.00 0.00 175.10 175.59 1l7l s ASN 115 N 0.52 4.85 -0.06 3.32 0.01 -0.44 -1.72 114.94 121.43 1l7l s ASN 115 Ca -0.08 -0.04 0.03 0.00 -0.71 0.00 0.00 52.86 52.06 1l7l s ASN 115 Cb -0.12 -1.53 0.01 0.00 0.41 0.00 0.00 41.25 40.02 1l7l s ASN 115 CO 0.01 0.27 -0.13 -0.63 -1.51 0.00 0.00 177.10 175.11 1l7l s ILE 116 N -0.27 1.20 0.09 0.60 1.01 -0.02 -1.73 121.20 122.08 1l7l s ILE 116 Ca 0.05 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.18 1l7l s ILE 116 Cb -0.13 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 1l7l s ILE 116 CO 0.02 0.36 -0.08 -0.83 0.00 0.00 0.00 174.94 174.42 1l7l s GLY 117 N 0.47 0.78 0.04 6.18 0.00 -0.38 -0.70 107.32 113.70 1l7l s GLY 117 Ca -0.11 -1.22 -0.18 0.00 0.00 0.00 0.00 44.72 43.20 1l7l s GLY 117 CO 0.03 -1.31 0.52 0.54 0.00 0.00 0.00 173.10 172.89 1l7l s LYS 118 N -3.16 4.14 0.43 2.90 1.02 -1.26 -1.13 119.74 122.67 1l7l s LYS 118 Ca 0.07 0.64 0.08 0.00 0.02 0.00 0.00 55.97 56.78 1l7l s LYS 118 Cb 0.00 -3.25 0.01 0.00 -0.52 0.00 0.00 37.83 34.07 1l7l s LYS 118 CO -0.02 0.62 0.54 -0.51 -0.92 0.00 0.00 175.35 175.06 1l7l s ASP 119 N -0.98 5.50 0.45 2.83 1.01 0.87 -4.92 116.67 121.44 1l7l s ASP 119 Ca 0.28 -0.51 -0.23 0.00 0.71 0.00 0.00 52.55 52.79 1l7l s ASP 119 Cb -0.18 -0.59 -0.09 0.00 1.01 0.00 0.00 42.92 43.06 1l7l s ASP 119 CO 0.17 -0.77 1.06 0.00 0.21 0.00 0.00 175.17 175.85 1l7l n GLN 120 N -1.81 1.41 0.00 8.23 6.02 -1.26 -4.52 117.38 125.45 1l7l n GLN 120 Ca 0.07 0.51 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1l7l n GLN 120 Cb 0.60 -2.15 0.00 0.00 1.02 0.00 0.00 30.24 29.71 1l7l n GLN 120 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92