#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gef s TYR 2 N 0.00 2.44 0.15 1.12 6.04 -1.26 -4.84 117.35 121.00 1gef s TYR 2 Ca 0.00 -0.73 -0.16 0.00 0.04 0.00 0.00 57.07 56.22 1gef s TYR 2 Cb 0.00 -4.52 0.02 0.00 -1.04 0.00 0.00 41.96 36.41 1gef s TYR 2 CO 0.00 -1.75 1.81 0.00 -1.54 0.00 0.00 175.55 174.08 1gef h ARG 3 N 9.15 0.52 -0.59 4.97 2.47 -2.06 -1.83 114.38 127.00 1gef h ARG 3 Ca 0.28 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.96 1gef h ARG 3 Cb 0.95 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 29.12 1gef h ARG 3 CO 1.38 0.34 0.32 0.87 0.56 0.00 0.00 179.97 183.44 1gef h LYS 4 N 0.53 0.82 -0.21 0.04 6.56 -2.00 -1.60 116.57 120.71 1gef h LYS 4 Ca 0.15 -0.08 -0.03 0.00 -1.06 0.00 0.00 60.65 59.63 1gef h LYS 4 Cb -0.05 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.44 1gef h LYS 4 CO -0.04 0.61 0.03 0.78 -2.06 0.00 0.00 179.45 178.77 1gef h GLY 5 N 0.89 0.38 1.06 3.86 0.00 -1.87 -2.32 103.07 105.07 1gef h GLY 5 Ca 0.21 -0.25 0.03 0.00 0.00 0.00 0.00 47.33 47.32 1gef h GLY 5 CO -0.03 0.23 0.57 0.00 0.00 0.00 0.00 176.54 177.31 1gef h ALA 6 N 0.84 1.44 -0.52 3.60 0.00 -0.85 -0.87 119.26 122.89 1gef h ALA 6 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1gef h ALA 6 Cb 0.32 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1gef h ALA 6 CO 0.00 0.49 0.09 0.37 0.00 0.00 0.00 179.25 180.21 1gef h GLN 7 N 1.11 0.86 -0.42 0.00 4.15 -1.16 -1.56 115.11 118.09 1gef h GLN 7 Ca 0.34 -0.23 -0.07 0.00 0.77 0.00 0.00 58.65 59.46 1gef h GLN 7 Cb -0.02 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 1gef h GLN 7 CO -0.09 0.84 -0.01 0.00 -1.93 0.00 0.00 178.83 177.63 1gef h ALA 8 N 0.98 0.57 -0.55 3.38 0.00 -0.96 -2.78 119.26 119.90 1gef h ALA 8 Ca 0.16 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.84 1gef h ALA 8 Cb 0.39 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1gef h ALA 8 CO 0.01 0.36 0.30 1.49 0.00 0.00 0.00 179.25 181.41 1gef h GLU 9 N 0.58 0.56 -0.77 0.00 4.81 -0.98 -0.77 114.58 118.01 1gef h GLU 9 Ca 0.12 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1gef h GLU 9 Cb 0.50 -0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.70 1gef h GLU 9 CO 0.02 0.37 0.47 0.00 -0.73 0.00 0.00 179.01 179.15 1gef h ARG 10 N 0.58 0.86 -0.21 1.92 3.08 -1.19 -0.78 114.38 118.63 1gef h ARG 10 Ca 0.24 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 1gef h ARG 10 Cb 0.11 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1gef h ARG 10 CO -0.14 0.57 0.09 1.49 -1.07 0.00 0.00 179.97 180.90 1gef h GLU 11 N 0.89 0.32 -0.50 0.04 4.81 -1.09 -2.81 114.58 116.24 1gef h GLU 11 Ca 0.33 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.51 1gef h GLU 11 Cb 0.11 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1gef h GLU 11 CO -0.15 0.37 0.32 1.25 -0.73 0.00 0.00 179.01 180.07 1gef h LEU 12 N 0.20 0.55 -0.47 1.64 5.85 -0.68 -2.43 115.31 119.97 1gef h LEU 12 Ca 0.07 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1gef h LEU 12 Cb 0.17 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1gef h LEU 12 CO -0.01 0.39 0.16 0.40 -0.34 0.00 0.00 178.44 179.05 1gef h ILE 13 N 0.65 0.84 -0.66 4.05 2.04 -1.07 -0.56 117.51 122.80 1gef h ILE 13 Ca 0.19 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 1gef h ILE 13 Cb -0.05 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1gef h ILE 13 CO -0.05 0.06 0.36 0.11 0.00 0.00 0.00 178.15 178.63 1gef h LYS 14 N 0.34 0.90 -0.40 2.37 1.57 -1.24 0.11 116.57 120.22 1gef h LYS 14 Ca 0.22 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1gef h LYS 14 Cb 0.23 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 1gef h LYS 14 CO -0.23 0.66 0.16 -0.07 -0.57 0.00 0.00 179.45 179.41 1gef h LEU 15 N 0.91 0.55 -0.39 2.94 3.38 -0.79 0.12 115.31 122.04 1gef h LEU 15 Ca 0.23 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1gef h LEU 15 Cb 0.02 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1gef h LEU 15 CO -0.04 0.57 0.09 -0.07 0.09 0.00 0.00 178.44 179.08 1gef h LEU 16 N 0.51 0.60 -1.09 1.67 3.38 -0.52 -2.61 115.31 117.24 1gef h LEU 16 Ca 0.13 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1gef h LEU 16 Cb 0.19 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1gef h LEU 16 CO -0.01 0.68 0.10 -0.33 0.09 0.00 0.00 178.44 178.97 1gef h GLU 17 N 0.49 0.74 -0.68 1.13 5.08 -0.61 -1.57 114.58 119.17 1gef h GLU 17 Ca 0.12 -0.15 0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1gef h GLU 17 Cb 0.32 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.42 1gef h GLU 17 CO 0.00 0.69 0.45 -0.22 -1.00 0.00 0.00 179.01 178.93 1gef h LYS 18 N 0.72 0.66 -0.79 2.33 3.64 -0.40 0.65 116.57 123.37 1gef h LYS 18 Ca 0.16 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1gef h LYS 18 Cb 0.30 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1gef h LYS 18 CO 0.00 0.44 0.00 0.72 -2.27 0.00 0.00 179.45 178.34 1gef n HIS 19 N -4.48 0.82 -0.82 1.91 8.25 -0.67 -4.88 115.22 115.35 1gef n HIS 19 Ca 0.10 -0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1gef n HIS 19 Cb 0.25 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 0.31 0.72 3.80 -1.41 0.00 0.22 -5.05 105.19 103.77 1gef n GLY 20 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.64 3.75 -0.24 1.61 0.08 -0.73 -4.65 117.98 115.15 1gef s PHE 21 Ca 0.00 1.50 -0.11 0.00 0.12 0.00 0.00 56.93 58.44 1gef s PHE 21 Cb 0.00 -2.69 -0.05 0.00 -0.57 0.00 0.00 43.02 39.71 1gef s PHE 21 CO 0.00 0.40 0.17 0.00 -0.10 0.00 0.00 175.22 175.69 1gef s ALA 22 N -1.39 3.60 0.02 5.36 0.00 0.32 -3.92 121.76 125.75 1gef s ALA 22 Ca 0.41 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.53 1gef s ALA 22 Cb -0.19 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.54 1gef s ALA 22 CO 0.23 -0.24 -0.16 0.08 0.00 0.00 0.00 175.76 175.67 1gef s VAL 23 N 1.15 2.90 -0.05 0.00 1.01 -1.26 -1.76 120.40 122.39 1gef s VAL 23 Ca 0.08 -1.08 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1gef s VAL 23 Cb -0.14 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.04 1gef s VAL 23 CO 0.05 0.38 -0.13 -0.69 0.00 0.00 0.00 175.10 174.72 1gef s VAL 24 N -0.90 1.14 -0.14 2.92 1.01 -0.41 -5.01 120.40 119.01 1gef s VAL 24 Ca 0.14 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.47 1gef s VAL 24 Cb -0.11 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.21 1gef s VAL 24 CO 0.05 0.35 0.29 -0.13 0.00 0.00 0.00 175.10 175.66 1gef s ARG 25 N 0.37 4.18 -0.08 2.72 0.52 -1.26 -1.75 118.95 123.64 1gef s ARG 25 Ca -0.09 0.11 -0.30 0.00 -0.52 0.00 0.00 55.73 54.94 1gef s ARG 25 Cb -0.13 -3.39 -0.02 0.00 0.52 0.00 0.00 34.95 31.93 1gef s ARG 25 CO 0.03 0.31 1.08 0.45 0.02 0.00 0.00 175.30 177.19 1gef s SER 26 N 0.24 7.17 0.18 0.23 0.15 -0.47 -4.97 113.70 116.23 1gef s SER 26 Ca 0.17 1.65 -0.33 0.00 0.70 0.00 0.00 55.95 58.15 1gef s SER 26 Cb -0.13 -2.56 -0.13 0.00 -1.71 0.00 0.00 66.02 61.49 1gef s SER 26 CO 0.05 -0.49 1.67 0.00 1.20 0.00 0.00 173.24 175.66 1gef n ALA 27 N 5.01 2.09 -1.17 5.45 0.00 -1.26 -0.83 120.51 129.80 1gef n ALA 27 Ca 0.09 0.41 -0.06 0.00 0.00 0.00 0.00 53.44 53.89 1gef n ALA 27 Cb 0.48 -2.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 1gef n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gef n GLY 28 N 3.74 0.61 2.34 0.00 0.00 -1.26 -2.42 105.19 108.21 1gef n GLY 28 Ca 0.17 -0.04 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.94 -4.55 0.00 1.61 7.64 -0.01 -4.89 113.62 112.47 1gef n SER 29 Ca -0.06 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.05 1gef n SER 29 Cb 0.50 -3.95 0.00 0.00 -1.01 0.00 0.00 64.21 59.75 1gef n SER 29 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1gef n LYS 30 N -2.54 0.00 -0.11 1.43 3.00 -1.01 -3.22 118.16 115.70 1gef n LYS 30 Ca -0.18 0.03 -0.15 0.00 -0.00 0.00 0.00 58.31 58.01 1gef n LYS 30 Cb 0.60 -0.06 -0.14 0.00 0.00 0.00 0.00 35.03 35.43 1gef n LYS 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1gef n LYS 31 N -0.55 0.67 -4.03 1.64 4.76 -1.26 -5.04 118.16 114.34 1gef n LYS 31 Ca 0.00 0.09 -0.10 0.00 -2.87 0.00 0.00 58.31 55.43 1gef n LYS 31 Cb 0.00 -1.53 -0.07 0.00 -1.84 0.00 0.00 35.03 31.60 1gef n LYS 31 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1gef s VAL 32 N -2.51 0.01 -0.13 -0.18 0.11 -1.20 -4.60 120.40 111.90 1gef s VAL 32 Ca -0.24 -1.52 -0.28 0.00 -2.93 0.00 0.00 61.98 57.01 1gef s VAL 32 Cb 0.08 -2.20 -0.26 0.00 -1.53 0.00 0.00 36.38 32.46 1gef s VAL 32 CO 0.70 -0.05 0.76 0.44 -3.33 0.00 0.00 175.10 173.63 1gef h ASP 33 N 2.38 0.06 -5.10 3.54 3.32 -1.60 -3.40 116.42 115.62 1gef h ASP 33 Ca -0.29 -0.97 -0.14 0.00 0.02 0.00 0.00 57.03 55.65 1gef h ASP 33 Cb 1.25 -0.02 -0.18 0.00 0.22 0.00 0.00 39.33 40.60 1gef h ASP 33 CO 0.41 1.08 -0.65 -0.76 -1.72 0.00 0.00 179.24 177.60 1gef s LEU 34 N -8.16 2.21 -0.06 1.55 1.43 -0.57 -1.36 118.68 113.72 1gef s LEU 34 Ca -0.19 -0.68 0.02 0.00 -1.03 0.00 0.00 54.13 52.26 1gef s LEU 34 Cb -0.02 0.27 0.01 0.00 0.03 0.00 0.00 46.19 46.48 1gef s LEU 34 CO 0.70 -0.46 -0.11 -0.69 0.23 0.00 0.00 176.35 176.03 1gef s VAL 35 N -2.61 1.03 -0.01 -1.59 1.01 -0.72 -0.33 120.40 117.18 1gef s VAL 35 Ca -0.05 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1gef s VAL 35 Cb -0.01 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.42 1gef s VAL 35 CO -0.05 0.33 -0.08 0.00 0.00 0.00 0.00 175.10 175.30 1gef s ALA 36 N 0.58 0.67 0.02 5.51 0.00 -0.35 -1.28 121.76 126.91 1gef s ALA 36 Ca -0.12 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 51.53 1gef s ALA 36 Cb -0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1gef s ALA 36 CO 0.03 0.15 -0.04 0.20 0.00 0.00 0.00 175.76 176.10 1gef s GLY 37 N -0.11 0.29 0.00 0.00 0.00 -0.72 -0.64 107.32 106.13 1gef s GLY 37 Ca 0.02 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.27 1gef s GLY 37 CO -0.00 -0.50 0.66 1.16 0.00 0.00 0.00 173.10 174.41 1gef n ASN 38 N 2.07 0.99 0.00 1.64 6.94 -1.06 -0.53 115.26 125.31 1gef n ASN 38 Ca -0.19 -1.43 0.00 0.00 -0.02 0.00 0.00 54.58 52.94 1gef n ASN 38 Cb 0.56 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 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 -0.21 1.18 1.21 4.83 0.00 -1.26 -4.80 105.19 106.13 1gef n GLY 39 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 0.00 -4.37 1.61 5.02 -1.26 -5.07 118.16 112.08 1gef n LYS 40 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 1gef n LYS 40 Cb 0.00 -0.39 -0.10 0.00 -0.02 0.00 0.00 35.03 34.52 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 -1.99 2.36 -0.09 1.97 1.02 -1.26 -5.12 119.74 116.64 1gef s LYS 41 Ca 0.00 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.13 1gef s LYS 41 Cb 0.00 -2.41 0.02 0.00 -0.52 0.00 0.00 37.83 34.92 1gef s LYS 41 CO 0.00 0.56 -0.07 0.71 -0.92 0.00 0.00 175.35 175.63 1gef s TYR 42 N -1.09 1.24 -0.00 3.18 2.02 -1.26 -2.56 117.35 118.88 1gef s TYR 42 Ca 0.19 -0.52 0.08 0.00 -0.37 0.00 0.00 57.07 56.44 1gef s TYR 42 Cb -0.11 -1.04 -0.02 0.00 -0.40 0.00 0.00 41.96 40.38 1gef s TYR 42 CO 0.10 -0.38 -0.24 -0.51 -1.57 0.00 0.00 175.55 172.95 1gef s LEU 43 N 1.38 2.19 -0.24 -1.29 1.43 0.18 0.29 118.68 122.61 1gef s LEU 43 Ca -0.02 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1gef s LEU 43 Cb -0.14 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.76 1gef s LEU 43 CO -0.04 0.31 -0.09 0.00 0.23 0.00 0.00 176.35 176.75 1gef s ILE 45 N 1.26 2.57 -0.18 0.00 1.01 0.55 -1.11 121.20 125.29 1gef s ILE 45 Ca -0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 59.70 1gef s ILE 45 Cb -0.17 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 1gef s ILE 45 CO -0.06 0.57 -0.03 -1.61 0.00 0.00 0.00 174.94 173.82 1gef s GLU 46 N -0.39 3.59 -0.15 2.79 0.41 -0.68 -1.52 118.70 122.75 1gef s GLU 46 Ca 0.04 -0.55 -0.05 0.00 -0.41 0.00 0.00 54.97 54.00 1gef s GLU 46 Cb -0.12 -2.98 -0.04 0.00 -1.78 0.00 0.00 34.13 29.21 1gef s GLU 46 CO 0.02 0.08 0.03 0.08 -0.49 0.00 0.00 175.26 174.97 1gef s VAL 47 N 0.80 4.50 0.08 2.63 1.01 -1.26 -1.10 120.40 127.06 1gef s VAL 47 Ca -0.01 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1gef s VAL 47 Cb -0.14 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1gef s VAL 47 CO 0.02 0.51 -0.12 -0.54 0.00 0.00 0.00 175.10 174.97 1gef s LYS 48 N -0.03 0.79 -0.06 2.72 -0.14 0.23 -4.99 119.74 118.26 1gef s LYS 48 Ca 0.04 -0.99 -0.04 0.00 -1.36 0.00 0.00 55.97 53.63 1gef s LYS 48 Cb -0.12 -0.67 0.03 0.00 -1.68 0.00 0.00 37.83 35.38 1gef s LYS 48 CO 0.02 0.14 0.14 0.54 -0.76 0.00 0.00 175.35 175.43 1gef s VAL 49 N -1.61 -0.03 0.06 3.17 0.11 -1.26 -1.32 120.40 119.51 1gef s VAL 49 Ca -0.01 0.10 -0.13 0.00 -2.93 0.00 0.00 61.98 59.01 1gef s VAL 49 Cb -0.08 -0.23 0.02 0.00 -1.53 0.00 0.00 36.38 34.56 1gef s VAL 49 CO 0.02 0.04 0.30 0.28 -3.33 0.00 0.00 175.10 172.41 1gef s THR 50 N 0.69 0.09 -1.26 5.04 -1.32 -0.23 -4.94 115.64 113.71 1gef s THR 50 Ca -0.05 -0.73 0.22 0.00 -1.21 0.00 0.00 61.69 59.92 1gef s THR 50 Cb -0.07 -1.01 -0.15 0.00 -1.51 0.00 0.00 72.50 69.76 1gef s THR 50 CO -0.03 -0.40 0.99 2.29 -2.21 0.00 0.00 174.62 175.26 1gef n LYS 51 N 0.42 0.30 -2.26 7.08 2.85 -1.26 -4.22 118.16 121.06 1gef n LYS 51 Ca -0.18 -0.24 -0.28 0.00 -1.05 0.00 0.00 58.31 56.56 1gef n LYS 51 Cb 0.60 -1.49 0.02 0.00 -0.65 0.00 0.00 35.03 33.51 1gef n LYS 51 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1gef s LYS 52 N -2.87 3.23 -0.03 -1.58 1.02 -1.26 -4.98 119.74 113.27 1gef s LYS 52 Ca 0.11 0.29 0.09 0.00 0.02 0.00 0.00 55.97 56.49 1gef s LYS 52 Cb 0.17 -2.22 0.32 0.00 -0.52 0.00 0.00 37.83 35.58 1gef s LYS 52 CO 0.78 -0.59 1.19 -0.40 -0.92 0.00 0.00 175.35 175.41 1gef n ASP 53 N -2.60 2.22 -3.51 2.83 5.68 -1.26 -4.87 116.55 115.03 1gef n ASP 53 Ca 0.04 -2.13 -0.11 0.00 -0.50 0.00 0.00 54.79 52.09 1gef n ASP 53 Cb 0.56 -0.34 -0.03 0.00 -1.14 0.00 0.00 41.12 40.17 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 -1.63 -0.40 -0.13 2.11 -3.43 -1.25 -4.39 115.29 106.17 1gef s HIS 54 Ca 0.23 0.15 -0.07 0.00 -0.80 0.00 0.00 55.06 54.57 1gef s HIS 54 Cb 0.14 0.46 0.05 0.00 -1.43 0.00 0.00 32.58 31.81 1gef s HIS 54 CO 0.13 -0.82 0.31 -1.17 -2.00 0.00 0.00 174.74 171.19 1gef s LEU 55 N -2.78 0.13 -0.04 5.38 2.96 -0.54 -4.89 118.68 118.90 1gef s LEU 55 Ca 0.02 0.67 -0.19 0.00 -0.22 0.00 0.00 54.13 54.42 1gef s LEU 55 Cb -0.00 0.95 -0.05 0.00 0.50 0.00 0.00 46.19 47.59 1gef s LEU 55 CO -0.12 -0.19 0.52 -0.31 -1.32 0.00 0.00 176.35 174.94 1gef s TYR 56 N 1.49 3.64 -0.26 5.38 1.51 -1.26 -1.62 117.35 126.23 1gef s TYR 56 Ca -0.08 1.06 -0.00 0.00 -1.01 0.00 0.00 57.07 57.04 1gef s TYR 56 Cb -0.10 -2.53 0.08 0.00 -0.11 0.00 0.00 41.96 39.30 1gef s TYR 56 CO -0.10 0.35 0.03 0.08 -1.11 0.00 0.00 175.55 174.79 1gef s VAL 57 N -0.10 1.13 0.27 0.71 1.01 -0.83 -5.03 120.40 117.57 1gef s VAL 57 Ca 0.28 -1.21 -0.29 0.00 0.00 0.00 0.00 61.98 60.75 1gef s VAL 57 Cb -0.17 -1.64 -0.14 0.00 0.00 0.00 0.00 36.38 34.43 1gef s VAL 57 CO 0.14 -0.36 1.14 0.61 0.00 0.00 0.00 175.10 176.63 1gef n GLY 58 N 4.79 0.07 0.32 4.51 0.00 -1.26 -3.69 105.19 109.93 1gef n GLY 58 Ca -0.07 0.39 0.20 0.00 0.00 0.00 0.00 46.02 46.54 1gef n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gef h LYS 59 N 2.67 0.00 -0.19 1.61 6.56 -1.98 -0.67 116.57 124.57 1gef h LYS 59 Ca -0.42 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.13 1gef h LYS 59 Cb 1.32 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.98 1gef h LYS 59 CO 0.65 0.01 -0.02 0.00 -2.06 0.00 0.00 179.45 178.03 1gef h ARG 60 N 0.00 0.35 -0.43 3.15 3.08 -1.99 0.23 114.38 118.78 1gef h ARG 60 Ca -0.00 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1gef h ARG 60 Cb 0.11 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1gef h ARG 60 CO 0.00 0.58 0.13 -0.44 -1.07 0.00 0.00 179.97 179.17 1gef h ASP 61 N 0.09 0.57 -0.19 7.04 5.19 -1.51 -1.62 116.42 126.00 1gef h ASP 61 Ca 0.05 -0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.30 1gef h ASP 61 Cb 0.43 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.78 1gef h ASP 61 CO 0.01 0.55 -0.18 0.24 -3.12 0.00 0.00 179.24 176.74 1gef h MET 62 N 0.61 0.61 -0.40 3.56 2.86 -0.77 -2.68 114.93 118.73 1gef h MET 62 Ca 0.14 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 1gef h MET 62 Cb 0.19 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 1gef h MET 62 CO -0.01 0.76 -0.08 0.78 1.06 0.00 0.00 176.91 179.43 1gef h GLY 63 N 0.98 0.82 0.85 8.32 0.00 0.39 -1.79 103.07 112.64 1gef h GLY 63 Ca 0.09 -0.66 0.02 0.00 0.00 0.00 0.00 47.33 46.78 1gef h GLY 63 CO 0.04 0.60 0.15 -0.09 0.00 0.00 0.00 176.54 177.25 1gef h ARG 64 N 0.57 0.31 -0.09 4.80 2.43 -1.28 -0.21 114.38 120.91 1gef h ARG 64 Ca 0.10 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1gef h ARG 64 Cb 0.59 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1gef h ARG 64 CO 0.04 0.20 0.04 1.25 -1.51 0.00 0.00 179.97 179.99 1gef h LEU 65 N 0.32 0.13 -0.57 3.80 5.85 -1.42 -1.44 115.31 121.97 1gef h LEU 65 Ca 0.13 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1gef h LEU 65 Cb 0.05 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1gef h LEU 65 CO -0.09 0.25 0.25 0.40 -0.34 0.00 0.00 178.44 178.91 1gef h ILE 66 N -0.01 1.22 0.18 4.05 2.04 -1.22 -0.87 117.51 122.91 1gef h ILE 66 Ca 0.03 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1gef h ILE 66 Cb 0.17 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1gef h ILE 66 CO -0.00 0.25 -0.09 -0.08 0.00 0.00 0.00 178.15 178.23 1gef h GLU 67 N 0.77 -0.24 -0.59 2.37 4.57 -0.97 -1.21 114.58 119.28 1gef h GLU 67 Ca 0.19 0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.36 1gef h GLU 67 Cb 0.16 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 1gef h GLU 67 CO -0.02 -0.12 0.26 0.35 -1.18 0.00 0.00 179.01 178.30 1gef h PHE 68 N -0.29 0.87 -0.92 0.92 3.04 -1.18 -2.21 116.94 117.17 1gef h PHE 68 Ca -0.03 -0.05 -0.01 0.00 3.98 0.00 0.00 57.97 61.86 1gef h PHE 68 Cb 0.22 -0.27 -0.04 0.00 2.56 0.00 0.00 35.95 38.42 1gef h PHE 68 CO -0.05 0.68 0.52 0.77 -2.02 0.00 0.00 178.31 178.21 1gef h SER 69 N 0.81 1.13 -0.42 0.41 0.02 -1.06 0.74 113.55 115.18 1gef h SER 69 Ca 0.20 -0.09 -0.10 0.00 -0.84 0.00 0.00 61.79 60.96 1gef h SER 69 Cb 0.15 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1gef h SER 69 CO -0.02 0.90 -0.13 -0.09 -1.14 0.00 0.00 176.83 176.35 1gef h ARG 70 N 1.28 0.84 -0.33 3.45 2.43 -1.02 0.70 114.38 121.73 1gef h ARG 70 Ca 0.33 -0.33 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1gef h ARG 70 Cb 0.00 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1gef h ARG 70 CO -0.05 0.96 -0.34 -0.09 -1.51 0.00 0.00 179.97 178.94 1gef h ARG 71 N 0.66 0.81 -0.27 0.20 2.43 -1.05 -3.26 114.38 113.90 1gef h ARG 71 Ca 0.10 -0.43 -0.18 0.00 -0.81 0.00 0.00 59.98 58.66 1gef h ARG 71 Cb 0.67 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1gef h ARG 71 CO 0.05 1.07 -0.56 0.35 -1.51 0.00 0.00 179.97 179.37 1gef h PHE 72 N 0.59 1.04 0.00 2.20 3.04 -0.84 -3.48 116.94 119.49 1gef h PHE 72 Ca 0.05 -0.37 0.00 0.00 3.98 0.00 0.00 57.97 61.63 1gef h PHE 72 Cb 0.93 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 39.24 1gef h PHE 72 CO 0.07 1.19 0.00 0.41 -2.02 0.00 0.00 178.31 177.96 1gef n GLY 73 N 0.36 1.06 3.32 2.40 0.00 0.10 -5.08 105.19 107.35 1gef n GLY 73 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 1.37 -0.16 -0.02 0.00 -0.40 -4.80 107.32 101.32 1gef s GLY 74 Ca 0.00 -1.65 -0.29 0.00 0.00 0.00 0.00 44.72 42.77 1gef s GLY 74 CO 0.00 -1.68 1.12 -0.42 0.00 0.00 0.00 173.10 172.12 1gef s ILE 75 N -3.23 4.52 -0.26 0.90 1.01 0.14 -4.45 121.20 119.84 1gef s ILE 75 Ca 0.23 1.83 -0.29 0.00 0.00 0.00 0.00 60.65 62.41 1gef s ILE 75 Cb 0.03 -4.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.31 1gef s ILE 75 CO 0.06 -0.10 1.51 -2.16 0.00 0.00 0.00 174.94 174.25 1gef s PRO 76 N 2.86 3.80 -0.07 2.79 0.04 -1.26 -1.62 135.00 141.53 1gef s PRO 76 Ca 0.50 1.48 0.04 0.00 0.04 0.00 0.00 61.00 63.06 1gef s PRO 76 Cb -0.19 -3.99 0.00 0.00 0.04 0.00 0.00 34.50 30.36 1gef s PRO 76 CO 0.14 -1.28 -0.20 0.08 0.04 0.00 0.00 177.00 175.77 1gef s VAL 77 N 5.02 1.75 -0.31 -0.36 1.01 -0.27 -1.83 120.40 125.41 1gef s VAL 77 Ca 0.66 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 1gef s VAL 77 Cb -0.22 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1gef s VAL 77 CO 0.28 0.49 0.14 -0.22 0.00 0.00 0.00 175.10 175.79 1gef s LEU 78 N 0.27 4.07 -0.29 3.92 2.96 -0.24 -1.69 118.68 127.68 1gef s LEU 78 Ca -0.13 -0.54 -0.07 0.00 -0.22 0.00 0.00 54.13 53.17 1gef s LEU 78 Cb -0.16 -1.99 0.01 0.00 0.50 0.00 0.00 46.19 44.55 1gef s LEU 78 CO 0.06 -0.19 0.08 0.00 -1.32 0.00 0.00 176.35 174.97 1gef s ALA 79 N 1.60 3.06 -0.08 5.97 0.00 -0.26 -0.60 121.76 131.46 1gef s ALA 79 Ca 0.04 -1.43 0.04 0.00 0.00 0.00 0.00 51.96 50.61 1gef s ALA 79 Cb -0.17 -2.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.80 1gef s ALA 79 CO 0.06 -0.90 -0.22 0.08 0.00 0.00 0.00 175.76 174.78 1gef s VAL 80 N 1.50 2.32 -0.29 0.00 1.01 -0.60 -0.60 120.40 123.73 1gef s VAL 80 Ca 0.03 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 60.97 1gef s VAL 80 Cb -0.17 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1gef s VAL 80 CO 0.02 0.56 0.10 -0.75 0.00 0.00 0.00 175.10 175.03 1gef s LYS 81 N -0.04 3.23 -0.17 2.72 2.20 -0.44 -2.19 119.74 125.05 1gef s LYS 81 Ca -0.06 -0.77 0.17 0.00 -0.36 0.00 0.00 55.97 54.94 1gef s LYS 81 Cb -0.15 -3.42 -0.25 0.00 -1.51 0.00 0.00 37.83 32.51 1gef s LYS 81 CO 0.05 -0.40 0.17 1.19 -0.36 0.00 0.00 175.35 175.99 1gef n PHE 82 N 4.91 0.17 -4.06 4.03 3.01 -1.26 -1.07 117.46 123.18 1gef n PHE 82 Ca -0.15 0.06 -0.28 0.00 1.01 0.00 0.00 57.45 58.09 1gef n PHE 82 Cb 0.49 -1.03 -0.06 0.00 -0.01 0.00 0.00 39.48 38.87 1gef n PHE 82 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1gef s TRP 87 N -2.51 3.18 -0.15 1.38 0.52 -1.26 -4.95 118.94 115.15 1gef s TRP 87 Ca -0.09 0.03 0.02 0.00 0.02 0.00 0.00 56.10 56.08 1gef s TRP 87 Cb 0.06 -1.57 0.01 0.00 -1.15 0.00 0.00 33.47 30.83 1gef s TRP 87 CO 0.83 0.52 -0.21 1.03 0.02 0.00 0.00 176.95 179.14 1gef s ARG 88 N -2.79 2.97 -0.19 4.98 1.81 -0.93 -4.73 118.95 120.08 1gef s ARG 88 Ca 0.30 -0.83 -0.04 0.00 -1.72 0.00 0.00 55.73 53.44 1gef s ARG 88 Cb -0.11 -2.46 -0.02 0.00 -0.45 0.00 0.00 34.95 31.91 1gef s ARG 88 CO 0.23 -0.09 -0.04 -0.06 -0.68 0.00 0.00 175.30 174.66 1gef s PHE 89 N 0.99 2.98 -0.29 -0.53 0.08 -0.52 -1.56 117.98 119.13 1gef s PHE 89 Ca -0.03 -0.59 -0.02 0.00 0.12 0.00 0.00 56.93 56.41 1gef s PHE 89 Cb -0.15 -2.03 0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1gef s PHE 89 CO -0.06 -0.28 -0.00 0.42 -0.10 0.00 0.00 175.22 175.20 1gef s ILE 90 N 0.91 3.07 -0.65 0.64 1.09 0.23 -0.84 121.20 125.64 1gef s ILE 90 Ca -0.00 -1.25 -0.27 0.00 -1.10 0.00 0.00 60.65 58.02 1gef s ILE 90 Cb -0.15 -2.71 0.02 0.00 -1.06 0.00 0.00 42.46 38.57 1gef s ILE 90 CO 0.01 -0.03 1.38 -1.61 -0.10 0.00 0.00 174.94 174.59 1gef s GLU 91 N 1.29 3.19 0.43 2.79 2.02 -1.26 -1.08 118.70 126.08 1gef s GLU 91 Ca -0.03 0.12 -0.22 0.00 0.02 0.00 0.00 54.97 54.86 1gef s GLU 91 Cb -0.19 -4.17 -0.10 0.00 0.10 0.00 0.00 34.13 29.77 1gef s GLU 91 CO -0.01 -2.10 0.98 0.14 0.02 0.00 0.00 175.26 174.28 1gef s VAL 92 N 6.14 4.17 0.11 2.63 -7.23 -0.76 -5.02 120.40 120.44 1gef s VAL 92 Ca 0.45 1.42 0.03 0.00 -1.81 0.00 0.00 61.98 62.07 1gef s VAL 92 Cb -0.09 -3.61 -0.04 0.00 0.56 0.00 0.00 36.38 33.20 1gef s VAL 92 CO 0.20 -0.23 -0.09 -0.94 -0.31 0.00 0.00 175.10 173.73 1gef s SER 93 N -2.03 1.45 0.50 4.85 1.04 -1.26 -4.69 113.70 113.57 1gef s SER 93 Ca 0.62 -0.95 0.34 0.00 0.48 0.00 0.00 55.95 56.44 1gef s SER 93 Cb -0.13 0.03 1.70 0.00 0.10 0.00 0.00 66.02 67.73 1gef s SER 93 CO 0.17 -0.36 2.03 1.55 0.98 0.00 0.00 173.24 177.61 1gef h PRO 94 N 3.09 0.00 -2.78 4.02 0.13 -1.97 -3.52 132.00 130.96 1gef h PRO 94 Ca -0.36 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.16 1gef h PRO 94 Cb 1.18 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.90 1gef h PRO 94 CO 0.61 0.00 -0.65 1.63 -0.23 0.00 0.00 178.00 179.35 1gef n LYS 95 N -2.77 1.69 0.00 0.86 5.02 -1.26 -5.19 118.16 116.51 1gef n LYS 95 Ca -0.01 -4.29 0.00 0.00 -2.02 0.00 0.00 58.31 51.98 1gef n LYS 95 Cb 0.13 -2.16 0.00 0.00 -0.02 0.00 0.00 35.03 32.99 1gef n LYS 95 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 1gef n PHE 99 N 1.86 0.00 -4.06 2.13 1.16 -1.24 -5.22 117.46 112.08 1gef n PHE 99 Ca 0.23 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.50 1gef n PHE 99 Cb 0.39 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.19 1gef n PHE 99 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 1gef s VAL 100 N -1.48 4.62 0.07 1.97 -7.23 -1.26 -1.96 120.40 115.14 1gef s VAL 100 Ca 0.00 -0.64 0.06 0.00 -1.81 0.00 0.00 61.98 59.59 1gef s VAL 100 Cb 0.00 -3.19 -0.03 0.00 0.56 0.00 0.00 36.38 33.72 1gef s VAL 100 CO 0.00 0.20 -0.16 -0.36 -0.31 0.00 0.00 175.10 174.47 1gef s PHE 101 N -1.33 1.34 0.33 2.82 0.40 -0.64 -4.88 117.98 116.01 1gef s PHE 101 Ca 0.28 -0.43 0.03 0.00 -0.60 0.00 0.00 56.93 56.20 1gef s PHE 101 Cb -0.12 -0.75 -0.05 0.00 0.51 0.00 0.00 43.02 42.60 1gef s PHE 101 CO 0.20 0.08 0.09 0.95 0.70 0.00 0.00 175.22 177.24 1gef s THR 102 N -1.17 0.88 0.00 0.64 -4.23 -1.26 -1.46 115.64 109.03 1gef s THR 102 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 1gef s THR 102 Cb -0.10 -2.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.05 1gef s THR 102 CO 0.02 0.00 1.14 -0.81 -0.54 0.00 0.00 174.62 174.43 1gef n PRO 103 N -0.68 0.54 0.00 3.99 -0.04 -1.26 0.19 135.00 137.73 1gef n PRO 103 Ca -0.02 -0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1gef n PRO 103 Cb 0.66 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 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 2.21 0.00 0.00 3.54 3.41 -1.26 -4.96 113.62 116.56 1gef n SER 104 Ca 0.07 -0.18 0.12 0.00 -0.26 0.00 0.00 58.87 58.61 1gef n SER 104 Cb 0.26 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 64.78 1gef n SER 104 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1gef n SER 105 N 0.00 0.00 0.00 4.04 2.88 0.13 -4.86 113.62 115.81 1gef n SER 105 Ca 0.00 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 1gef n SER 105 Cb 0.08 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 1gef n SER 105 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1gef n GLY 106 N 0.76 5.44 3.43 0.46 0.00 -1.26 -4.90 105.19 109.12 1gef n GLY 106 Ca 0.10 -1.33 -0.21 0.00 0.00 0.00 0.00 46.02 44.57 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 0.77 1.89 1.21 1.61 -7.23 -0.02 -4.86 120.40 113.77 1gef s VAL 107 Ca 0.00 -2.21 -0.18 0.00 -1.81 0.00 0.00 61.98 57.77 1gef s VAL 107 Cb 0.00 -2.33 0.29 0.00 0.56 0.00 0.00 36.38 34.90 1gef s VAL 107 CO 0.00 -0.39 1.08 -0.94 -0.31 0.00 0.00 175.10 174.53 1gef s SER 108 N -3.44 0.86 -0.01 4.85 1.04 -1.26 -1.43 113.70 114.31 1gef s SER 108 Ca 0.28 0.77 -0.22 0.00 0.48 0.00 0.00 55.95 57.26 1gef s SER 108 Cb 0.01 -1.12 -0.20 0.00 0.10 0.00 0.00 66.02 64.81 1gef s SER 108 CO 0.11 -4.18 1.16 0.25 0.98 0.00 0.00 173.24 171.57 1gef h LEU 109 N -2.61 0.30 -0.60 2.42 5.85 -1.96 -1.85 115.31 116.85 1gef h LEU 109 Ca -0.47 -0.65 0.11 0.00 0.84 0.00 0.00 57.88 57.71 1gef h LEU 109 Cb 1.31 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 42.17 1gef h LEU 109 CO 0.37 0.91 0.15 -0.33 -0.34 0.00 0.00 178.44 179.21 1gef h GLU 110 N -0.28 0.28 -0.57 1.25 3.07 -1.96 0.55 114.58 116.91 1gef h GLU 110 Ca -0.02 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.77 1gef h GLU 110 Cb 0.90 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.72 1gef h GLU 110 CO 0.05 0.19 0.13 0.28 -1.40 0.00 0.00 179.01 178.26 1gef h VAL 111 N 0.29 1.24 -0.30 3.13 2.07 -1.92 0.66 116.25 121.41 1gef h VAL 111 Ca 0.31 -0.86 -0.10 0.00 0.82 0.00 0.00 66.70 66.88 1gef h VAL 111 Cb 0.45 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1gef h VAL 111 CO -0.38 0.32 -0.23 0.25 0.02 0.00 0.00 177.57 177.55 1gef h LEU 112 N 0.86 0.58 -0.20 2.57 5.85 0.15 -2.96 115.31 122.16 1gef h LEU 112 Ca 0.18 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1gef h LEU 112 Cb 0.32 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1gef h LEU 112 CO 0.00 0.80 -0.57 0.18 -0.34 0.00 0.00 178.44 178.51 1gef n LEU 113 N -4.13 0.88 0.00 2.25 4.77 0.16 -4.94 117.00 115.99 1gef n LEU 113 Ca -0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1gef n LEU 113 Cb 0.40 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1gef n LEU 113 CO 0.43 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1gef n GLY 114 N 1.46 0.13 0.35 -0.72 0.00 0.23 -4.85 105.19 101.78 1gef n GLY 114 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 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 0.32 0.00 -0.61 5.03 -1.83 -3.49 117.51 116.93 1gef h ILE 115 Ca 0.00 -0.19 0.00 0.00 -0.12 0.00 0.00 64.86 64.55 1gef h ILE 115 Cb 0.54 0.38 0.00 0.00 -3.03 0.00 0.00 36.82 34.72 1gef h ILE 115 CO 0.00 0.02 0.00 0.00 -0.68 0.00 0.00 178.15 177.49