#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gef n TYR 2 N 0.00 0.53 0.21 1.12 4.02 -1.26 -4.69 117.16 117.10 1gef n TYR 2 Ca 0.00 -0.34 -0.14 0.00 -0.01 0.00 0.00 57.90 57.40 1gef n TYR 2 Cb 0.00 -0.01 -0.08 0.00 -0.02 0.00 0.00 39.34 39.23 1gef n TYR 2 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1gef h ARG 3 N 3.49 -0.50 -0.40 -0.72 3.08 -2.05 -0.92 114.38 116.35 1gef h ARG 3 Ca 0.00 0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1gef h ARG 3 Cb 0.85 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1gef h ARG 3 CO 0.00 -0.22 0.25 1.57 -1.07 0.00 0.00 179.97 180.49 1gef h LYS 4 N -0.72 0.54 -0.23 0.04 2.10 -2.00 -1.35 116.57 114.94 1gef h LYS 4 Ca -0.05 -0.04 -0.13 0.00 -2.00 0.00 0.00 60.65 58.43 1gef h LYS 4 Cb 0.50 -0.12 -0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1gef h LYS 4 CO 0.09 0.37 -0.36 0.78 -2.00 0.00 0.00 179.45 178.33 1gef h GLY 5 N 0.58 0.72 1.14 0.07 0.00 -1.83 -1.54 103.07 102.20 1gef h GLY 5 Ca 0.15 -0.80 -0.02 0.00 0.00 0.00 0.00 47.33 46.66 1gef h GLY 5 CO -0.03 0.72 0.42 0.00 0.00 0.00 0.00 176.54 177.65 1gef h ALA 6 N 0.64 1.23 -0.29 3.60 0.00 -0.58 -1.53 119.26 122.34 1gef h ALA 6 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1gef h ALA 6 Cb 0.94 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1gef h ALA 6 CO 0.08 0.61 -0.07 0.37 0.00 0.00 0.00 179.25 180.24 1gef h GLN 7 N 1.13 0.55 -0.81 0.00 4.15 -1.22 -2.90 115.11 116.01 1gef h GLN 7 Ca 0.28 -0.21 0.01 0.00 0.77 0.00 0.00 58.65 59.51 1gef h GLN 7 Cb 0.05 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.67 1gef h GLN 7 CO -0.04 0.75 0.53 0.00 -1.93 0.00 0.00 178.83 178.14 1gef h ALA 8 N 0.78 1.03 -0.68 3.38 0.00 -0.92 -2.06 119.26 120.80 1gef h ALA 8 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1gef h ALA 8 Cb 0.55 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1gef h ALA 8 CO 0.03 0.41 0.44 0.93 0.00 0.00 0.00 179.25 181.06 1gef h GLU 9 N 1.07 0.90 -0.71 0.00 5.08 -1.25 -0.21 114.58 119.46 1gef h GLU 9 Ca 0.30 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 1gef h GLU 9 Cb -0.09 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 28.93 1gef h GLU 9 CO -0.08 0.61 0.23 0.00 -1.00 0.00 0.00 179.01 178.77 1gef h ARG 10 N 0.92 1.10 -0.43 2.33 3.08 -1.26 -1.59 114.38 118.54 1gef h ARG 10 Ca 0.25 -0.23 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 1gef h ARG 10 Cb -0.09 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 1gef h ARG 10 CO -0.05 0.94 -0.23 0.93 -1.07 0.00 0.00 179.97 180.49 1gef h GLU 11 N 1.05 0.92 -0.30 0.04 5.08 -0.99 -2.86 114.58 117.53 1gef h GLU 11 Ca 0.23 -0.41 -0.10 0.00 -1.00 0.00 0.00 59.36 58.08 1gef h GLU 11 Cb 0.29 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1gef h GLU 11 CO -0.01 1.07 -0.22 1.25 -1.00 0.00 0.00 179.01 180.11 1gef h LEU 12 N 0.76 0.56 -0.71 1.33 5.85 -0.90 -2.26 115.31 119.94 1gef h LEU 12 Ca 0.09 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1gef h LEU 12 Cb 0.81 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 1gef h LEU 12 CO 0.07 0.78 0.45 0.40 -0.34 0.00 0.00 178.44 179.79 1gef h ILE 13 N 0.50 1.10 -0.39 4.05 2.04 -1.15 -1.28 117.51 122.37 1gef h ILE 13 Ca 0.08 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 1gef h ILE 13 Cb 0.65 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1gef h ILE 13 CO 0.05 0.16 0.17 0.11 0.00 0.00 0.00 178.15 178.63 1gef h LYS 14 N 0.87 0.58 -0.73 2.37 1.79 -1.24 -1.04 116.57 119.16 1gef h LYS 14 Ca 0.28 -0.10 0.04 0.00 -2.18 0.00 0.00 60.65 58.70 1gef h LYS 14 Cb 0.02 -0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 30.52 1gef h LYS 14 CO -0.11 0.53 0.45 -0.07 -1.08 0.00 0.00 179.45 179.17 1gef h LEU 15 N 0.49 0.71 -0.20 2.94 4.07 -0.93 0.42 115.31 122.80 1gef h LEU 15 Ca 0.13 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.07 1gef h LEU 15 Cb 0.16 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.75 1gef h LEU 15 CO -0.01 0.48 -0.01 -0.07 -1.08 0.00 0.00 178.44 177.75 1gef h LEU 16 N 0.85 0.36 -0.85 1.67 3.38 -1.03 -2.87 115.31 116.82 1gef h LEU 16 Ca 0.31 -0.32 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1gef h LEU 16 Cb 0.09 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1gef h LEU 16 CO -0.14 0.59 0.54 -0.33 0.09 0.00 0.00 178.44 179.19 1gef h GLU 17 N 0.12 1.01 -0.05 1.13 5.08 -0.87 0.67 114.58 121.66 1gef h GLU 17 Ca 0.06 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1gef h GLU 17 Cb 0.41 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1gef h GLU 17 CO 0.01 0.67 0.08 -0.22 -1.00 0.00 0.00 179.01 178.55 1gef h LYS 18 N 1.04 0.00 -0.68 2.33 3.64 -0.76 0.79 116.57 122.93 1gef h LYS 18 Ca 0.35 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1gef h LYS 18 Cb 0.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1gef h LYS 18 CO -0.13 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.77 1gef n HIS 19 N -3.62 1.18 -0.37 1.91 8.25 0.17 -4.94 115.22 117.81 1gef n HIS 19 Ca -0.02 -0.52 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 1gef n HIS 19 Cb 0.17 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.16 1gef n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gef n GLY 20 N 1.36 0.78 3.86 -1.41 0.00 0.27 -5.07 105.19 104.97 1gef n GLY 20 Ca 0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 1gef n GLY 20 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gef s PHE 21 N -2.19 3.61 -0.19 1.61 0.08 -0.87 -4.64 117.98 115.39 1gef s PHE 21 Ca 0.00 0.88 -0.12 0.00 0.12 0.00 0.00 56.93 57.81 1gef s PHE 21 Cb 0.00 -2.23 -0.05 0.00 -0.57 0.00 0.00 43.02 40.18 1gef s PHE 21 CO 0.00 0.51 0.20 0.00 -0.10 0.00 0.00 175.22 175.84 1gef s ALA 22 N -1.37 3.64 0.05 5.36 0.00 -0.04 -3.84 121.76 125.56 1gef s ALA 22 Ca 0.33 -0.61 0.07 0.00 0.00 0.00 0.00 51.96 51.74 1gef s ALA 22 Cb -0.15 -2.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 1gef s ALA 22 CO 0.18 0.08 -0.18 0.08 0.00 0.00 0.00 175.76 175.92 1gef s VAL 23 N 0.51 1.47 -0.02 0.00 1.01 -1.26 -1.76 120.40 120.35 1gef s VAL 23 Ca 0.12 -1.19 0.06 0.00 0.00 0.00 0.00 61.98 60.97 1gef s VAL 23 Cb -0.12 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1gef s VAL 23 CO 0.01 0.09 -0.19 0.68 0.00 0.00 0.00 175.10 175.69 1gef s VAL 24 N -0.88 1.53 -0.24 2.92 -7.23 -0.54 -5.00 120.40 110.96 1gef s VAL 24 Ca 0.05 -0.82 -0.12 0.00 -1.81 0.00 0.00 61.98 59.27 1gef s VAL 24 Cb -0.09 -1.28 -0.05 0.00 0.56 0.00 0.00 36.38 35.53 1gef s VAL 24 CO 0.02 0.43 0.25 -0.60 -0.31 0.00 0.00 175.10 174.89 1gef s ARG 25 N -0.41 4.08 0.14 4.82 3.52 -1.26 -2.09 118.95 127.76 1gef s ARG 25 Ca 0.06 -0.12 -0.31 0.00 -0.13 0.00 0.00 55.73 55.23 1gef s ARG 25 Cb -0.08 -3.56 -0.09 0.00 -1.56 0.00 0.00 34.95 29.66 1gef s ARG 25 CO -0.00 -0.02 1.53 0.45 -0.81 0.00 0.00 175.30 176.45 1gef s SER 26 N 1.17 6.65 -0.23 -2.12 0.15 0.06 -4.95 113.70 114.43 1gef s SER 26 Ca 0.11 2.53 -0.29 0.00 0.70 0.00 0.00 55.95 59.00 1gef s SER 26 Cb -0.14 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 61.57 1gef s SER 26 CO 0.07 -0.79 1.28 0.00 1.20 0.00 0.00 173.24 175.00 1gef s ALA 27 N 1.29 3.52 0.00 5.45 0.00 -1.26 -2.77 121.76 127.99 1gef s ALA 27 Ca 0.69 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.94 1gef s ALA 27 Cb -0.41 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1gef s ALA 27 CO 0.31 -1.45 0.00 0.41 0.00 0.00 0.00 175.76 175.02 1gef n GLY 28 N 3.94 2.97 3.81 0.00 0.00 -1.26 -4.34 105.19 110.31 1gef n GLY 28 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1gef n GLY 28 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gef n SER 29 N 0.00 -5.05 -0.14 1.61 7.64 -1.11 -4.89 113.62 111.68 1gef n SER 29 Ca 0.00 -0.70 -0.04 0.00 1.01 0.00 0.00 58.87 59.14 1gef n SER 29 Cb 0.00 -4.03 0.02 0.00 -1.01 0.00 0.00 64.21 59.20 1gef n SER 29 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1gef h LYS 30 N -2.07 -0.04 0.00 1.43 1.57 -1.89 -3.36 116.57 112.21 1gef h LYS 30 Ca -0.57 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 57.91 1gef h LYS 30 Cb 1.37 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.64 1gef h LYS 30 CO 0.65 -0.03 -2.04 1.63 -0.57 0.00 0.00 179.45 179.09 1gef n LYS 31 N -5.36 0.41 -4.22 3.15 4.01 -1.26 -5.08 118.16 109.81 1gef n LYS 31 Ca 0.03 0.16 -0.15 0.00 -0.51 0.00 0.00 58.31 57.85 1gef n LYS 31 Cb 0.27 -1.20 -0.09 0.00 -0.51 0.00 0.00 35.03 33.49 1gef n LYS 31 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 1gef s VAL 32 N -2.35 0.00 -0.19 -0.18 -7.23 -1.26 -4.57 120.40 104.63 1gef s VAL 32 Ca -0.26 -1.95 -0.09 0.00 -1.81 0.00 0.00 61.98 57.87 1gef s VAL 32 Cb 0.09 -2.50 -0.21 0.00 0.56 0.00 0.00 36.38 34.33 1gef s VAL 32 CO 0.35 0.00 0.11 0.47 -0.31 0.00 0.00 175.10 175.71 1gef n ASP 33 N -0.83 2.02 -4.11 4.85 8.00 0.14 -4.35 116.55 122.27 1gef n ASP 33 Ca 0.04 0.19 -0.12 0.00 0.71 0.00 0.00 54.79 55.61 1gef n ASP 33 Cb 0.64 -0.78 -0.11 0.00 -0.02 0.00 0.00 41.12 40.85 1gef n ASP 33 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1gef s LEU 34 N -7.16 2.37 -0.06 0.64 1.43 -0.84 -0.76 118.68 114.29 1gef s LEU 34 Ca -0.29 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.07 1gef s LEU 34 Cb 0.08 -0.13 0.02 0.00 0.03 0.00 0.00 46.19 46.20 1gef s LEU 34 CO 0.66 -0.32 -0.04 -0.69 0.23 0.00 0.00 176.35 176.20 1gef s VAL 35 N -2.35 0.57 0.07 -1.59 1.01 -0.89 -0.40 120.40 116.83 1gef s VAL 35 Ca -0.01 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.95 1gef s VAL 35 Cb -0.03 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 1gef s VAL 35 CO -0.02 0.26 -0.15 0.00 0.00 0.00 0.00 175.10 175.19 1gef s ALA 36 N 1.34 1.26 -0.04 5.51 0.00 -0.10 -1.47 121.76 128.26 1gef s ALA 36 Ca -0.04 -1.01 -0.11 0.00 0.00 0.00 0.00 51.96 50.79 1gef s ALA 36 Cb -0.13 -0.12 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1gef s ALA 36 CO -0.02 0.20 0.26 0.20 0.00 0.00 0.00 175.76 176.39 1gef s GLY 37 N -1.70 -0.13 -0.12 0.00 0.00 -0.72 0.53 107.32 105.17 1gef s GLY 37 Ca -0.01 0.39 0.15 0.00 0.00 0.00 0.00 44.72 45.25 1gef s GLY 37 CO 0.02 0.24 1.15 1.16 0.00 0.00 0.00 173.10 175.67 1gef n ASN 38 N 1.91 1.71 0.00 1.64 6.94 -0.87 -0.86 115.26 125.72 1gef n ASN 38 Ca -0.19 -3.08 0.00 0.00 -0.02 0.00 0.00 54.58 51.29 1gef n ASN 38 Cb 0.57 -0.42 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 1gef n ASN 38 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gef n GLY 39 N -0.97 0.97 1.15 4.83 0.00 -1.26 -4.72 105.19 105.19 1gef n GLY 39 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1gef n GLY 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gef n LYS 40 N -2.04 0.00 -4.27 1.61 5.02 -1.26 -5.12 118.16 112.10 1gef n LYS 40 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 1gef n LYS 40 Cb 0.00 -0.34 -0.10 0.00 -0.02 0.00 0.00 35.03 34.57 1gef n LYS 40 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1gef s LYS 41 N -1.82 1.16 0.02 1.97 1.02 -1.26 -5.16 119.74 115.67 1gef s LYS 41 Ca 0.00 -1.55 0.06 0.00 0.02 0.00 0.00 55.97 54.50 1gef s LYS 41 Cb 0.00 -0.45 -0.02 0.00 -0.52 0.00 0.00 37.83 36.84 1gef s LYS 41 CO 0.00 -0.07 -0.18 0.71 -0.92 0.00 0.00 175.35 174.89 1gef s TYR 42 N -3.51 1.60 -0.02 3.18 2.02 -1.26 -2.06 117.35 117.31 1gef s TYR 42 Ca 0.23 -0.33 0.05 0.00 -0.37 0.00 0.00 57.07 56.65 1gef s TYR 42 Cb 0.05 -0.99 -0.01 0.00 -0.40 0.00 0.00 41.96 40.61 1gef s TYR 42 CO 0.04 0.03 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.36 1gef s LEU 43 N -0.82 2.02 -0.21 -1.29 1.43 0.19 -1.37 118.68 118.62 1gef s LEU 43 Ca 0.06 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.84 1gef s LEU 43 Cb -0.08 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.22 1gef s LEU 43 CO 0.01 0.22 -0.15 0.00 0.23 0.00 0.00 176.35 176.65 1gef s ILE 45 N 1.25 2.45 -0.22 0.00 1.01 0.47 -1.00 121.20 125.17 1gef s ILE 45 Ca 0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.68 1gef s ILE 45 Cb -0.16 -1.94 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1gef s ILE 45 CO -0.09 0.56 0.01 -0.70 0.00 0.00 0.00 174.94 174.73 1gef s GLU 46 N -0.13 3.60 -0.19 2.79 2.56 -0.65 -0.68 118.70 126.00 1gef s GLU 46 Ca -0.04 -0.52 -0.06 0.00 0.00 0.00 0.00 54.97 54.35 1gef s GLU 46 Cb -0.14 -3.13 -0.03 0.00 2.00 0.00 0.00 34.13 32.82 1gef s GLU 46 CO 0.04 -0.07 0.04 0.08 -0.56 0.00 0.00 175.26 174.79 1gef s VAL 47 N 1.22 4.45 0.15 3.70 1.01 -1.26 -1.13 120.40 128.54 1gef s VAL 47 Ca 0.04 -0.15 0.11 0.00 0.00 0.00 0.00 61.98 61.98 1gef s VAL 47 Cb -0.15 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1gef s VAL 47 CO 0.01 0.44 -0.26 -0.54 0.00 0.00 0.00 175.10 174.76 1gef s LYS 48 N 0.66 1.43 -0.00 2.72 -0.14 0.29 -4.99 119.74 119.71 1gef s LYS 48 Ca 0.02 -1.40 0.00 0.00 -1.36 0.00 0.00 55.97 53.23 1gef s LYS 48 Cb -0.13 -1.87 0.00 0.00 -1.68 0.00 0.00 37.83 34.15 1gef s LYS 48 CO 0.02 0.43 -0.00 0.08 -0.76 0.00 0.00 175.35 175.12 1gef s VAL 49 N -1.25 0.04 -0.06 3.17 1.01 -1.26 -1.21 120.40 120.83 1gef s VAL 49 Ca 0.16 -0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.96 1gef s VAL 49 Cb -0.09 -0.05 0.04 0.00 0.00 0.00 0.00 36.38 36.27 1gef s VAL 49 CO 0.07 0.02 0.41 0.28 0.00 0.00 0.00 175.10 175.88 1gef s THR 50 N 0.08 0.03 -0.61 3.92 -1.32 -0.94 -4.97 115.64 111.82 1gef s THR 50 Ca -0.01 -0.26 0.24 0.00 -1.21 0.00 0.00 61.69 60.46 1gef s THR 50 Cb -0.01 -0.68 0.13 0.00 -1.51 0.00 0.00 72.50 70.43 1gef s THR 50 CO -0.00 -0.14 1.44 0.11 -2.21 0.00 0.00 174.62 173.82 1gef h LYS 51 N 4.14 0.00 -7.65 7.08 1.57 -1.90 -0.94 116.57 118.87 1gef h LYS 51 Ca -0.28 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.04 1gef h LYS 51 Cb 1.17 0.00 0.13 0.00 0.08 0.00 0.00 32.23 33.61 1gef h LYS 51 CO 0.35 0.00 0.37 0.15 -0.57 0.00 0.00 179.45 179.75 1gef s LYS 52 N -3.17 1.22 -0.19 3.15 1.02 -1.26 -4.75 119.74 115.76 1gef s LYS 52 Ca 0.07 -0.35 0.16 0.00 0.02 0.00 0.00 55.97 55.87 1gef s LYS 52 Cb 0.12 -1.95 0.79 0.00 -0.52 0.00 0.00 37.83 36.27 1gef s LYS 52 CO 0.69 -2.00 1.71 -0.40 -0.92 0.00 0.00 175.35 174.43 1gef n ASP 53 N -3.48 5.40 -3.50 2.83 5.68 -1.26 -4.70 116.55 117.52 1gef n ASP 53 Ca 0.13 -2.75 -0.15 0.00 -0.50 0.00 0.00 54.79 51.52 1gef n ASP 53 Cb 0.60 -0.65 -0.05 0.00 -1.14 0.00 0.00 41.12 39.89 1gef n ASP 53 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 1gef s HIS 54 N -2.42 -0.57 -0.06 2.11 -3.43 -1.26 -4.31 115.29 105.35 1gef s HIS 54 Ca 0.54 0.79 -0.04 0.00 -0.80 0.00 0.00 55.06 55.55 1gef s HIS 54 Cb 0.39 0.46 0.02 0.00 -1.43 0.00 0.00 32.58 32.02 1gef s HIS 54 CO 0.19 -0.64 0.14 -1.17 -2.00 0.00 0.00 174.74 171.26 1gef s LEU 55 N -1.69 1.15 -0.14 5.38 2.96 0.25 -4.95 118.68 121.65 1gef s LEU 55 Ca -0.06 0.28 -0.19 0.00 -0.22 0.00 0.00 54.13 53.94 1gef s LEU 55 Cb -0.00 0.41 -0.04 0.00 0.50 0.00 0.00 46.19 47.06 1gef s LEU 55 CO 0.02 -0.09 0.54 -0.31 -1.32 0.00 0.00 176.35 175.19 1gef s TYR 56 N 0.57 3.47 -0.21 5.38 2.02 -1.26 0.33 117.35 127.65 1gef s TYR 56 Ca -0.04 0.93 -0.00 0.00 -0.37 0.00 0.00 57.07 57.59 1gef s TYR 56 Cb -0.06 -2.65 0.02 0.00 -0.40 0.00 0.00 41.96 38.87 1gef s TYR 56 CO -0.03 0.05 -0.14 0.08 -1.57 0.00 0.00 175.55 173.94 1gef s VAL 57 N 1.05 2.43 0.70 0.71 1.01 -0.45 -4.98 120.40 120.89 1gef s VAL 57 Ca 0.28 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 1gef s VAL 57 Cb -0.16 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.11 1gef s VAL 57 CO 0.11 0.39 1.09 -0.83 0.00 0.00 0.00 175.10 175.86 1gef s GLY 58 N 1.30 1.63 0.02 4.51 0.00 -1.26 -2.29 107.32 111.24 1gef s GLY 58 Ca 0.03 -0.30 -0.20 0.00 0.00 0.00 0.00 44.72 44.25 1gef s GLY 58 CO -0.09 0.06 1.21 0.07 0.00 0.00 0.00 173.10 174.35 1gef h LYS 59 N -0.66 0.41 -0.38 2.90 2.10 -1.91 -3.06 116.57 115.98 1gef h LYS 59 Ca -0.45 -0.32 0.03 0.00 -2.00 0.00 0.00 60.65 57.91 1gef h LYS 59 Cb 1.25 0.06 -0.03 0.00 -0.90 0.00 0.00 32.23 32.61 1gef h LYS 59 CO 0.63 0.96 0.17 -0.09 -2.00 0.00 0.00 179.45 179.12 1gef h ARG 60 N -0.04 0.35 -0.65 0.07 2.43 -1.95 0.41 114.38 115.00 1gef h ARG 60 Ca -0.02 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.20 1gef h ARG 60 Cb 1.02 -0.08 -0.06 0.00 -0.42 0.00 0.00 29.97 30.43 1gef h ARG 60 CO 0.08 0.23 0.33 0.22 -1.51 0.00 0.00 179.97 179.32 1gef h ASP 61 N 0.36 0.44 0.71 -3.80 3.58 -1.98 -1.00 116.42 114.74 1gef h ASP 61 Ca 0.16 0.05 -0.14 0.00 0.42 0.00 0.00 57.03 57.52 1gef h ASP 61 Cb 0.09 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 1gef h ASP 61 CO -0.13 0.28 -0.65 0.24 -2.88 0.00 0.00 179.24 176.10 1gef h MET 62 N 0.59 0.00 -0.69 0.28 2.86 -1.30 -3.07 114.93 113.59 1gef h MET 62 Ca 0.31 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.91 1gef h MET 62 Cb 0.27 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 1gef h MET 62 CO -0.23 0.65 0.30 0.78 1.06 0.00 0.00 176.91 179.48 1gef h GLY 63 N 2.08 1.07 0.93 8.32 0.00 0.11 -0.11 103.07 115.47 1gef h GLY 63 Ca -0.01 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 1gef h GLY 63 CO 0.08 0.51 0.00 -0.09 0.00 0.00 0.00 176.54 177.05 1gef h ARG 64 N 0.99 0.67 -0.09 4.80 2.43 -1.24 -1.52 114.38 120.43 1gef h ARG 64 Ca 0.24 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1gef h ARG 64 Cb 0.15 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1gef h ARG 64 CO -0.03 0.76 0.05 1.25 -1.51 0.00 0.00 179.97 180.49 1gef h LEU 65 N 0.49 0.11 -0.52 3.80 5.85 -1.39 -1.68 115.31 121.96 1gef h LEU 65 Ca 0.11 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1gef h LEU 65 Cb 0.46 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1gef h LEU 65 CO 0.02 0.17 0.34 0.40 -0.34 0.00 0.00 178.44 179.02 1gef h ILE 66 N 0.04 1.10 -0.65 4.05 2.04 -0.98 -0.54 117.51 122.58 1gef h ILE 66 Ca 0.03 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 1gef h ILE 66 Cb 0.08 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1gef h ILE 66 CO -0.00 0.12 0.19 -0.08 0.00 0.00 0.00 178.15 178.38 1gef h GLU 67 N 0.68 1.01 -0.45 2.37 4.57 -1.18 0.75 114.58 122.34 1gef h GLU 67 Ca 0.20 -0.23 -0.14 0.00 -1.18 0.00 0.00 59.36 58.01 1gef h GLU 67 Cb -0.04 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.39 1gef h GLU 67 CO -0.06 0.90 -0.28 0.35 -1.18 0.00 0.00 179.01 178.73 1gef h PHE 68 N 0.94 1.14 -0.23 0.92 3.04 -1.06 -2.08 116.94 119.62 1gef h PHE 68 Ca 0.21 -0.30 -0.11 0.00 3.98 0.00 0.00 57.97 61.75 1gef h PHE 68 Cb 0.31 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 38.55 1gef h PHE 68 CO 0.02 1.14 -0.31 0.77 -2.02 0.00 0.00 178.31 177.91 1gef h SER 69 N 0.82 0.47 -0.17 0.41 0.02 -0.90 0.66 113.55 114.86 1gef h SER 69 Ca 0.09 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1gef h SER 69 Cb 0.87 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 1gef h SER 69 CO 0.08 0.76 0.06 -0.09 -1.14 0.00 0.00 176.83 176.50 1gef h ARG 70 N 0.40 0.27 -0.11 3.45 2.43 -0.70 0.19 114.38 120.31 1gef h ARG 70 Ca 0.05 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1gef h ARG 70 Cb 0.74 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1gef h ARG 70 CO 0.06 0.38 0.01 0.00 -1.51 0.00 0.00 179.97 178.91 1gef h ARG 71 N 0.11 0.19 -0.41 0.20 3.08 -1.17 -3.25 114.38 113.13 1gef h ARG 71 Ca 0.06 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1gef h ARG 71 Cb 0.22 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1gef h ARG 71 CO -0.00 0.41 0.15 0.35 -1.07 0.00 0.00 179.97 179.81 1gef h PHE 72 N -0.06 0.63 0.00 3.04 3.04 -0.83 -3.48 116.94 119.29 1gef h PHE 72 Ca 0.03 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.93 1gef h PHE 72 Cb 0.32 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.64 1gef h PHE 72 CO 0.02 0.56 0.00 0.41 -2.02 0.00 0.00 178.31 177.29 1gef n GLY 73 N -0.74 0.85 3.30 2.40 0.00 0.57 -5.08 105.19 106.49 1gef n GLY 73 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1gef n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gef s GLY 74 N -1.64 1.54 -0.18 -0.02 0.00 -0.62 -4.72 107.32 101.69 1gef s GLY 74 Ca 0.00 -1.76 -0.27 0.00 0.00 0.00 0.00 44.72 42.69 1gef s GLY 74 CO 0.00 -1.59 0.93 -0.42 0.00 0.00 0.00 173.10 172.02 1gef s ILE 75 N -3.66 4.80 -0.41 0.90 1.01 -0.47 -4.51 121.20 118.85 1gef s ILE 75 Ca 0.32 1.82 -0.29 0.00 0.00 0.00 0.00 60.65 62.50 1gef s ILE 75 Cb 0.07 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.32 1gef s ILE 75 CO 0.10 -0.05 1.51 -2.16 0.00 0.00 0.00 174.94 174.34 1gef s PRO 76 N 2.50 3.48 -0.07 2.79 0.04 -1.26 -1.58 135.00 140.90 1gef s PRO 76 Ca 0.42 1.01 0.04 0.00 0.04 0.00 0.00 61.00 62.51 1gef s PRO 76 Cb -0.16 -4.08 -0.02 0.00 0.04 0.00 0.00 34.50 30.28 1gef s PRO 76 CO 0.11 -1.68 -0.18 0.08 0.04 0.00 0.00 177.00 175.37 1gef s VAL 77 N 5.88 2.67 -0.23 -0.36 1.01 -0.17 -1.03 120.40 128.18 1gef s VAL 77 Ca 0.65 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1gef s VAL 77 Cb -0.15 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1gef s VAL 77 CO 0.32 0.57 0.07 -0.22 0.00 0.00 0.00 175.10 175.84 1gef s LEU 78 N -0.27 3.55 -0.21 3.92 2.96 -0.53 -1.64 118.68 126.44 1gef s LEU 78 Ca 0.01 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 53.78 1gef s LEU 78 Cb -0.13 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.64 1gef s LEU 78 CO 0.03 0.03 -0.09 0.00 -1.32 0.00 0.00 176.35 174.99 1gef s ALA 79 N 1.23 2.64 -0.16 5.97 0.00 -0.28 -2.12 121.76 129.04 1gef s ALA 79 Ca 0.05 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.77 1gef s ALA 79 Cb -0.14 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.43 1gef s ALA 79 CO 0.03 -0.48 -0.16 0.08 0.00 0.00 0.00 175.76 175.24 1gef s VAL 80 N 1.39 2.61 -0.41 0.00 1.01 -0.51 -0.54 120.40 123.95 1gef s VAL 80 Ca 0.05 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 61.10 1gef s VAL 80 Cb -0.14 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.17 1gef s VAL 80 CO -0.06 0.51 0.30 -0.75 0.00 0.00 0.00 175.10 175.10 1gef s LYS 81 N 0.88 2.93 -0.46 2.72 2.20 -0.35 -1.64 119.74 126.03 1gef s LYS 81 Ca -0.04 -1.10 -0.22 0.00 -0.36 0.00 0.00 55.97 54.25 1gef s LYS 81 Cb -0.15 -3.96 0.03 0.00 -1.51 0.00 0.00 37.83 32.24 1gef s LYS 81 CO -0.01 -0.79 0.74 -0.06 -0.36 0.00 0.00 175.35 174.86 1gef s PHE 82 N 1.65 3.01 0.18 4.03 0.40 0.34 -2.23 117.98 125.35 1gef s PHE 82 Ca 0.04 0.04 -0.33 0.00 -0.60 0.00 0.00 56.93 56.08 1gef s PHE 82 Cb -0.20 -3.58 -0.14 0.00 0.51 0.00 0.00 43.02 39.61 1gef s PHE 82 CO 0.09 -0.98 1.51 1.28 0.70 0.00 0.00 175.22 177.82 1gef n LEU 83 N 6.59 3.03 0.00 -0.37 4.77 -0.36 -1.31 117.00 129.35 1gef n LEU 83 Ca 0.00 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.09 1gef n LEU 83 Cb 0.48 -1.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.15 1gef n LEU 83 CO 0.57 -0.39 0.00 0.59 -1.33 0.00 0.00 177.39 176.83 1gef n ASN 84 N 2.95 -2.25 0.04 -1.43 5.03 -1.26 -4.79 115.26 113.55 1gef n ASN 84 Ca 0.15 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.60 1gef n ASN 84 Cb 0.29 -0.63 0.00 0.00 -1.02 0.00 0.00 39.78 38.42 1gef n ASN 84 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 1gef n VAL 85 N -2.61 0.09 -0.85 2.41 3.14 -0.66 -5.18 118.33 114.67 1gef n VAL 85 Ca 0.00 0.03 0.00 0.00 -2.96 0.00 0.00 64.34 61.41 1gef n VAL 85 Cb 0.03 -0.75 0.00 0.00 -1.06 0.00 0.00 33.84 32.06 1gef n VAL 85 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1gef n GLY 86 N 1.91 -0.96 3.88 7.55 0.00 -0.43 -5.01 105.19 112.14 1gef n GLY 86 Ca 0.00 -1.56 -0.34 0.00 0.00 0.00 0.00 46.02 44.11 1gef n GLY 86 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gef s TRP 87 N -1.94 3.57 0.00 1.61 0.52 -1.26 -0.51 118.94 120.93 1gef s TRP 87 Ca 0.00 0.58 0.00 0.00 0.02 0.00 0.00 56.10 56.71 1gef s TRP 87 Cb 0.00 -2.00 -0.00 0.00 -1.15 0.00 0.00 33.47 30.32 1gef s TRP 87 CO 0.00 0.59 -0.01 1.03 0.02 0.00 0.00 176.95 178.57 1gef s ARG 88 N -1.87 0.11 0.14 4.98 1.81 -0.65 -4.70 118.95 118.77 1gef s ARG 88 Ca 0.29 -0.08 0.07 0.00 -1.72 0.00 0.00 55.73 54.30 1gef s ARG 88 Cb -0.13 -0.09 -0.04 0.00 -0.45 0.00 0.00 34.95 34.24 1gef s ARG 88 CO 0.17 0.02 -0.16 -0.06 -0.68 0.00 0.00 175.30 174.60 1gef s PHE 89 N -0.11 1.58 -0.20 -0.53 0.08 0.88 -1.42 117.98 118.26 1gef s PHE 89 Ca -0.00 -0.51 -0.13 0.00 0.12 0.00 0.00 56.93 56.40 1gef s PHE 89 Cb -0.01 -0.81 0.06 0.00 -0.57 0.00 0.00 43.02 41.69 1gef s PHE 89 CO -0.00 0.22 0.50 -1.50 -0.10 0.00 0.00 175.22 174.33 1gef s ILE 90 N -2.04 -0.01 -0.23 0.64 2.07 -0.90 -0.11 121.20 120.62 1gef s ILE 90 Ca 0.11 0.05 -0.29 0.00 -1.41 0.00 0.00 60.65 59.11 1gef s ILE 90 Cb -0.06 -0.72 0.01 0.00 0.13 0.00 0.00 42.46 41.82 1gef s ILE 90 CO 0.04 0.02 1.03 -0.70 -1.91 0.00 0.00 174.94 173.43 1gef s GLU 91 N 1.17 4.26 0.20 3.50 2.12 -1.26 -1.45 118.70 127.24 1gef s GLU 91 Ca -0.07 1.35 -0.29 0.00 0.36 0.00 0.00 54.97 56.31 1gef s GLU 91 Cb -0.06 -3.64 -0.08 0.00 0.26 0.00 0.00 34.13 30.61 1gef s GLU 91 CO -0.11 -0.62 0.93 0.54 -0.54 0.00 0.00 175.26 175.46 1gef s VAL 92 N 3.15 4.22 0.09 3.70 0.11 -0.20 -4.98 120.40 126.49 1gef s VAL 92 Ca 0.44 2.04 -0.02 0.00 -2.93 0.00 0.00 61.98 61.51 1gef s VAL 92 Cb -0.15 -4.31 -0.05 0.00 -1.53 0.00 0.00 36.38 30.35 1gef s VAL 92 CO 0.06 0.45 0.28 -0.94 -3.33 0.00 0.00 175.10 171.62 1gef s SER 93 N -0.86 6.41 0.43 3.54 1.04 -1.26 -4.74 113.70 118.27 1gef s SER 93 Ca 0.42 0.40 0.17 0.00 0.48 0.00 0.00 55.95 57.43 1gef s SER 93 Cb -0.25 -2.01 1.09 0.00 0.10 0.00 0.00 66.02 64.95 1gef s SER 93 CO 0.31 0.13 1.89 -0.65 0.98 0.00 0.00 173.24 175.89 1gef h PRO 94 N 3.01 0.38 -2.09 4.02 0.11 -1.97 -1.06 132.00 134.39 1gef h PRO 94 Ca -0.46 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 65.42 1gef h PRO 94 Cb 1.16 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 1gef h PRO 94 CO 0.74 0.25 -0.13 0.36 -0.21 0.00 0.00 178.00 179.01 1gef n LYS 95 N -4.48 2.03 -3.02 1.05 2.85 -1.26 -4.90 118.16 110.43 1gef n LYS 95 Ca 0.17 -1.04 -0.35 0.00 -1.05 0.00 0.00 58.31 56.05 1gef n LYS 95 Cb 0.63 -2.03 -0.06 0.00 -0.65 0.00 0.00 35.03 32.92 1gef n LYS 95 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 177.40 175.85 1gef s ILE 96 N 1.13 4.52 0.33 0.58 1.10 -0.40 -5.07 121.20 123.38 1gef s ILE 96 Ca 0.65 1.30 -0.09 0.00 -0.51 0.00 0.00 60.65 62.00 1gef s ILE 96 Cb 0.30 -3.76 0.01 0.00 0.15 0.00 0.00 42.46 39.17 1gef s ILE 96 CO -0.00 -0.01 0.56 -0.70 -2.11 0.00 0.00 174.94 172.67 1gef s GLU 97 N -2.50 1.90 0.24 3.50 2.12 -1.26 -4.92 118.70 117.78 1gef s GLU 97 Ca 0.51 -1.54 -0.30 0.00 0.36 0.00 0.00 54.97 54.00 1gef s GLU 97 Cb -0.14 0.50 -0.10 0.00 0.26 0.00 0.00 34.13 34.66 1gef s GLU 97 CO 0.19 -0.82 1.37 -1.59 -0.54 0.00 0.00 175.26 173.87 1gef s LYS 98 N -3.12 4.33 0.20 4.30 -2.85 -1.26 -4.46 119.74 116.87 1gef s LYS 98 Ca 0.24 2.19 -0.15 0.00 -1.00 0.00 0.00 55.97 57.26 1gef s LYS 98 Cb -0.02 -3.14 0.01 0.00 -2.06 0.00 0.00 37.83 32.63 1gef s LYS 98 CO 0.15 -0.32 0.48 -0.59 0.10 0.00 0.00 175.35 175.17 1gef s PHE 99 N -0.15 0.07 -0.14 1.78 -0.71 -0.97 -5.01 117.98 112.86 1gef s PHE 99 Ca 0.57 -0.43 -0.03 0.00 -1.04 0.00 0.00 56.93 56.00 1gef s PHE 99 Cb -0.39 0.28 -0.03 0.00 -1.21 0.00 0.00 43.02 41.67 1gef s PHE 99 CO 0.43 -0.91 -0.02 0.08 -1.34 0.00 0.00 175.22 173.45 1gef s VAL 100 N -3.92 4.03 -0.18 -2.49 1.01 -1.26 -1.34 120.40 116.25 1gef s VAL 100 Ca 0.13 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 1gef s VAL 100 Cb -0.00 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1gef s VAL 100 CO 0.00 0.52 -0.01 0.12 0.00 0.00 0.00 175.10 175.74 1gef s PHE 101 N 0.04 3.05 0.37 5.22 5.36 0.15 -4.91 117.98 127.26 1gef s PHE 101 Ca 0.01 -0.35 0.08 0.00 -0.96 0.00 0.00 56.93 55.71 1gef s PHE 101 Cb -0.13 -2.04 -0.07 0.00 -0.34 0.00 0.00 43.02 40.44 1gef s PHE 101 CO 0.02 -0.13 -0.04 0.95 -1.46 0.00 0.00 175.22 174.56 1gef s THR 102 N 0.72 2.07 -2.00 0.12 -4.23 -1.26 -0.58 115.64 110.48 1gef s THR 102 Ca -0.00 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 1gef s THR 102 Cb -0.14 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 70.89 1gef s THR 102 CO 0.02 -0.11 0.09 -0.81 -0.54 0.00 0.00 174.62 173.27 1gef n PRO 103 N -0.86 0.02 -0.01 3.99 -0.04 -1.26 -1.02 135.00 135.82 1gef n PRO 103 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1gef n PRO 103 Cb 0.65 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 1gef n PRO 103 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1gef n SER 104 N -0.56 0.89 0.06 3.54 3.41 -1.26 -4.87 113.62 114.83 1gef n SER 104 Ca 0.00 -1.47 -0.21 0.00 -0.26 0.00 0.00 58.87 56.93 1gef n SER 104 Cb 0.00 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.83 1gef n SER 104 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1gef h SER 105 N 0.00 0.91 0.00 4.04 0.02 -1.46 -3.47 113.55 113.58 1gef h SER 105 Ca 0.00 -0.77 0.00 0.00 -0.84 0.00 0.00 61.79 60.18 1gef h SER 105 Cb 0.79 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1gef h SER 105 CO 0.00 1.56 0.00 0.61 -1.14 0.00 0.00 176.83 177.86 1gef n GLY 106 N 1.19 1.26 3.26 -3.77 0.00 -1.26 -5.02 105.19 100.84 1gef n GLY 106 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1gef n GLY 106 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gef s VAL 107 N 3.97 0.00 0.79 1.61 -7.23 0.84 -4.86 120.40 115.52 1gef s VAL 107 Ca 0.00 -1.91 -0.11 0.00 -1.81 0.00 0.00 61.98 58.15 1gef s VAL 107 Cb 0.00 -2.46 0.06 0.00 0.56 0.00 0.00 36.38 34.55 1gef s VAL 107 CO 0.00 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 174.94 1gef s SER 108 N -3.14 4.51 0.25 4.85 1.04 -1.26 -0.09 113.70 119.85 1gef s SER 108 Ca 0.36 1.49 -0.06 0.00 0.48 0.00 0.00 55.95 58.23 1gef s SER 108 Cb 0.06 -2.24 0.27 0.00 0.10 0.00 0.00 66.02 64.20 1gef s SER 108 CO 0.12 -1.98 1.87 0.25 0.98 0.00 0.00 173.24 174.47 1gef h LEU 109 N -1.10 1.07 -0.70 2.42 5.85 -1.96 -0.43 115.31 120.46 1gef h LEU 109 Ca -0.46 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.15 1gef h LEU 109 Cb 1.25 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 1gef h LEU 109 CO 0.57 0.86 0.38 -0.33 -0.34 0.00 0.00 178.44 179.58 1gef h GLU 110 N 1.19 0.98 -0.04 1.25 3.07 -1.98 -1.36 114.58 117.70 1gef h GLU 110 Ca 0.30 -0.12 -0.19 0.00 -0.50 0.00 0.00 59.36 58.85 1gef h GLU 110 Cb 0.04 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 27.75 1gef h GLU 110 CO -0.05 0.73 -0.80 -0.24 -1.40 0.00 0.00 179.01 177.26 1gef h VAL 111 N 0.96 1.42 -0.30 3.13 3.04 -1.83 0.43 116.25 123.11 1gef h VAL 111 Ca 0.25 -2.33 0.01 0.00 -1.01 0.00 0.00 66.70 63.62 1gef h VAL 111 Cb 0.04 2.27 -0.02 0.00 -2.01 0.00 0.00 31.29 31.57 1gef h VAL 111 CO -0.04 0.69 0.19 0.25 -1.01 0.00 0.00 177.57 177.65 1gef h LEU 112 N 0.20 0.32 -0.24 3.16 5.85 -0.73 -2.78 115.31 121.07 1gef h LEU 112 Ca -0.04 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1gef h LEU 112 Cb 1.39 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1gef h LEU 112 CO 0.13 0.23 0.00 0.18 -0.34 0.00 0.00 178.44 178.64 1gef n LEU 113 N -4.90 0.58 0.00 2.25 4.77 -0.54 -4.90 117.00 114.26 1gef n LEU 113 Ca -0.01 0.59 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 1gef n LEU 113 Cb 0.04 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 1gef n LEU 113 CO 0.33 -0.30 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 1gef n GLY 114 N 0.75 0.26 0.26 -0.72 0.00 -0.99 -4.92 105.19 99.83 1gef n GLY 114 Ca 0.04 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.17 1gef n GLY 114 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1gef h ILE 115 N 0.00 0.79 0.00 -0.61 1.08 -1.23 -3.48 117.51 114.06 1gef h ILE 115 Ca 0.00 -0.36 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1gef h ILE 115 Cb 0.00 1.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.96 1gef h ILE 115 CO 0.00 0.09 0.00 1.67 -0.69 0.00 0.00 178.15 179.22