#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1p s SER 2 N 0.00 0.10 -0.19 1.61 1.04 -1.26 -5.15 113.70 109.85 1l1p s SER 2 Ca 0.00 -0.78 0.01 0.00 0.48 0.00 0.00 55.95 55.65 1l1p s SER 2 Cb 0.00 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.54 1l1p s SER 2 CO 0.00 -0.80 -0.10 -1.00 0.98 0.00 0.00 173.24 172.32 1l1p s HIS 3 N -3.92 2.33 -0.23 5.02 0.09 -1.26 -5.09 115.29 112.23 1l1p s HIS 3 Ca 0.11 -1.52 -0.03 0.00 -0.00 0.00 0.00 55.06 53.62 1l1p s HIS 3 Cb 0.04 -1.61 0.13 0.00 -0.00 0.00 0.00 32.58 31.14 1l1p s HIS 3 CO -0.05 -0.73 0.39 -1.64 -0.00 0.00 0.00 174.74 172.71 1l1p s MET 4 N 1.42 0.35 -0.06 1.40 1.00 -1.26 -5.06 119.30 117.09 1l1p s MET 4 Ca -0.01 0.65 -0.01 0.00 0.00 0.00 0.00 55.69 56.33 1l1p s MET 4 Cb -0.16 -0.29 -0.00 0.00 0.00 0.00 0.00 34.83 34.38 1l1p s MET 4 CO -0.08 -0.56 0.03 0.37 0.00 0.00 0.00 175.02 174.78 1l1p h GLN 5 N 8.18 -0.02 -6.80 2.03 -0.00 -2.08 -3.46 115.11 112.96 1l1p h GLN 5 Ca -0.19 0.00 -0.48 0.00 -0.00 0.00 0.00 58.65 57.98 1l1p h GLN 5 Cb 1.15 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 28.61 1l1p h GLN 5 CO 0.24 -0.01 0.19 0.00 0.00 0.00 0.00 178.83 179.25 1l1p s ALA 6 N -2.77 3.26 -0.09 3.38 0.00 -1.26 -5.07 121.76 119.20 1l1p s ALA 6 Ca -0.00 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.20 1l1p s ALA 6 Cb 0.00 -2.92 -0.01 0.00 0.00 0.00 0.00 23.12 20.19 1l1p s ALA 6 CO 0.01 0.26 -0.20 -0.08 0.00 0.00 0.00 175.76 175.75 1l1p s THR 7 N -1.90 2.48 0.04 0.00 -1.32 -1.26 -5.12 115.64 108.56 1l1p s THR 7 Ca 0.54 -0.89 0.00 0.00 -1.21 0.00 0.00 61.69 60.12 1l1p s THR 7 Cb -0.12 -1.97 -0.03 0.00 -1.51 0.00 0.00 72.50 68.87 1l1p s THR 7 CO 0.18 0.56 -0.04 0.26 -2.21 0.00 0.00 174.62 173.36 1l1p s TRP 8 N 0.03 0.50 -0.07 9.09 0.52 -1.26 -4.88 118.94 122.87 1l1p s TRP 8 Ca -0.07 -0.78 0.17 0.00 0.02 0.00 0.00 56.10 55.44 1l1p s TRP 8 Cb -0.15 -0.34 0.32 0.00 -1.15 0.00 0.00 33.47 32.16 1l1p s TRP 8 CO 0.05 -0.24 1.15 0.36 0.02 0.00 0.00 176.95 178.29 1l1p n LYS 9 N 0.80 0.40 -2.06 4.98 0.00 -1.26 -5.02 118.16 116.00 1l1p n LYS 9 Ca -0.18 -1.90 -0.41 0.00 -0.00 0.00 0.00 58.31 55.82 1l1p n LYS 9 Cb 0.58 -0.08 -0.02 0.00 -0.00 0.00 0.00 35.03 35.51 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1l1p s GLU 10 N -0.60 4.31 0.00 -1.58 -1.05 -1.22 -4.73 118.70 113.83 1l1p s GLU 10 Ca 0.21 2.27 0.00 0.00 -0.15 0.00 0.00 54.97 57.31 1l1p s GLU 10 Cb 0.28 -3.07 0.00 0.00 -0.44 0.00 0.00 34.13 30.90 1l1p s GLU 10 CO -0.10 -0.28 0.00 1.63 0.95 0.00 0.00 175.26 177.46 1l1p n LYS 11 N 1.10 0.98 -0.54 -4.83 5.02 -1.13 -4.70 118.16 114.06 1l1p n LYS 11 Ca 0.02 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.36 1l1p n LYS 11 Cb 0.41 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.51 1l1p n LYS 11 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1l1p n ASP 12 N -0.02 1.23 0.00 4.39 -0.08 -1.26 -4.45 116.55 116.36 1l1p n ASP 12 Ca 0.00 -2.68 0.00 0.00 -1.51 0.00 0.00 54.79 50.60 1l1p n ASP 12 Cb 0.00 -0.35 0.00 0.00 2.34 0.00 0.00 41.12 43.11 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1l1p n GLY 13 N -0.58 4.48 0.26 0.27 0.00 -1.26 -5.05 105.19 103.31 1l1p n GLY 13 Ca 0.09 -1.93 -0.02 0.00 0.00 0.00 0.00 46.02 44.17 1l1p n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l1p n ALA 14 N -3.00 -0.27 -1.43 4.61 0.00 -1.26 -4.31 120.51 114.84 1l1p n ALA 14 Ca 0.00 -0.12 -0.33 0.00 0.00 0.00 0.00 53.44 52.99 1l1p n ALA 14 Cb 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1l1p n ALA 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1l1p s VAL 15 N -1.14 2.96 0.11 0.00 0.11 0.16 -4.45 120.40 118.14 1l1p s VAL 15 Ca 0.05 0.44 0.02 0.00 -2.93 0.00 0.00 61.98 59.57 1l1p s VAL 15 Cb -0.01 -2.96 -0.04 0.00 -1.53 0.00 0.00 36.38 31.85 1l1p s VAL 15 CO 0.04 -0.28 -0.07 -1.61 -3.33 0.00 0.00 175.10 169.85 1l1p s GLU 16 N -4.09 0.87 0.00 1.54 8.01 -1.26 -4.98 118.70 118.78 1l1p s GLU 16 Ca 0.69 -1.34 0.00 0.00 0.01 0.00 0.00 54.97 54.33 1l1p s GLU 16 Cb -0.23 -0.29 0.00 0.00 -4.31 0.00 0.00 34.13 29.30 1l1p s GLU 16 CO 0.43 0.00 0.02 0.00 0.01 0.00 0.00 175.26 175.73 1l1p n ALA 17 N -0.02 0.00 -3.36 5.21 0.00 -1.26 -1.62 120.51 119.46 1l1p n ALA 17 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.03 1l1p n ALA 17 Cb 0.61 0.01 -0.07 0.00 0.00 0.00 0.00 19.45 20.00 1l1p n ALA 17 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1l1p n GLU 18 N -1.35 2.79 -0.92 0.00 1.02 -1.21 -4.34 120.64 116.63 1l1p n GLU 18 Ca 0.00 -4.67 0.00 0.00 -0.02 0.00 0.00 57.16 52.47 1l1p n GLU 18 Cb 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 31.44 29.13 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1l1p n ASP 19 N 0.86 0.08 -3.58 1.62 5.75 -0.64 -4.42 116.55 116.22 1l1p n ASP 19 Ca 0.30 -0.89 -0.20 0.00 -0.01 0.00 0.00 54.79 53.99 1l1p n ASP 19 Cb 0.40 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.34 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1l1p s ARG 20 N -1.44 0.10 0.50 0.11 3.00 -0.91 0.12 118.95 120.43 1l1p s ARG 20 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 55.73 55.95 1l1p s ARG 20 Cb 0.00 -1.13 0.01 0.00 0.00 0.00 0.00 34.95 33.83 1l1p s ARG 20 CO 0.00 -0.56 0.73 0.14 0.00 0.00 0.00 175.30 175.61 1l1p s VAL 21 N 2.26 3.40 -0.27 3.52 -7.23 0.35 -3.49 120.40 118.93 1l1p s VAL 21 Ca 0.04 -0.54 -0.02 0.00 -1.81 0.00 0.00 61.98 59.65 1l1p s VAL 21 Cb -0.15 -3.27 0.03 0.00 0.56 0.00 0.00 36.38 33.56 1l1p s VAL 21 CO -0.09 -0.19 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.59 1l1p s THR 22 N -2.67 3.01 0.07 5.32 2.01 0.24 -0.11 115.64 123.49 1l1p s THR 22 Ca 0.53 -1.15 0.05 0.00 0.31 0.00 0.00 61.69 61.43 1l1p s THR 22 Cb -0.10 -2.61 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1l1p s THR 22 CO 0.38 0.06 -0.14 0.27 -0.69 0.00 0.00 174.62 174.51 1l1p s ILE 23 N 1.31 1.13 -0.11 1.82 -4.36 0.22 -0.32 121.20 120.88 1l1p s ILE 23 Ca -0.02 -1.25 0.03 0.00 -0.26 0.00 0.00 60.65 59.14 1l1p s ILE 23 Cb -0.18 -1.07 -0.00 0.00 1.25 0.00 0.00 42.46 42.46 1l1p s ILE 23 CO -0.03 -0.18 -0.21 1.51 0.24 0.00 0.00 174.94 176.28 1l1p s ASP 24 N -1.63 3.35 0.18 4.36 -4.77 -0.79 0.53 116.67 117.91 1l1p s ASP 24 Ca -0.01 -0.50 -0.05 0.00 -3.30 0.00 0.00 52.55 48.69 1l1p s ASP 24 Cb -0.10 -1.47 -0.03 0.00 -1.09 0.00 0.00 42.92 40.23 1l1p s ASP 24 CO 0.02 0.15 0.20 0.72 0.70 0.00 0.00 175.17 176.96 1l1p s PHE 25 N 0.42 0.79 -0.18 2.11 -0.12 0.32 0.34 117.98 121.65 1l1p s PHE 25 Ca -0.15 -1.10 -0.05 0.00 -0.05 0.00 0.00 56.93 55.58 1l1p s PHE 25 Cb -0.17 -0.31 0.09 0.00 -0.63 0.00 0.00 43.02 42.00 1l1p s PHE 25 CO 0.07 -0.69 0.31 0.99 -0.05 0.00 0.00 175.22 175.85 1l1p s THR 26 N -4.07 -0.49 0.21 -4.49 2.01 -0.76 0.14 115.64 108.20 1l1p s THR 26 Ca 0.28 0.14 -0.23 0.00 0.31 0.00 0.00 61.69 62.19 1l1p s THR 26 Cb 0.05 -0.59 0.05 0.00 0.01 0.00 0.00 72.50 72.02 1l1p s THR 26 CO 0.06 0.02 0.89 -0.83 -0.69 0.00 0.00 174.62 174.07 1l1p s GLY 27 N 2.47 -0.12 0.36 4.40 0.00 0.60 -2.59 107.32 112.45 1l1p s GLY 27 Ca 0.03 -0.10 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1l1p s GLY 27 CO -0.11 0.18 0.26 -1.14 0.00 0.00 0.00 173.10 172.29 1l1p n SER 28 N -0.61 2.20 0.00 1.64 3.41 -0.69 -4.04 113.62 115.52 1l1p n SER 28 Ca -0.05 -2.27 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 1l1p n SER 28 Cb 0.60 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1l1p n SER 28 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1l1p n VAL 29 N -1.33 0.00 -1.10 -3.33 3.14 -1.16 -0.05 118.33 114.50 1l1p n VAL 29 Ca -0.02 0.01 -0.26 0.00 -2.96 0.00 0.00 64.34 61.10 1l1p n VAL 29 Cb 0.42 -0.67 0.07 0.00 -1.06 0.00 0.00 33.84 32.59 1l1p n VAL 29 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1l1p n ASP 30 N -1.48 6.87 0.00 6.55 2.03 -1.26 -4.59 116.55 124.67 1l1p n ASP 30 Ca 0.00 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 51.86 1l1p n ASP 30 Cb 0.00 -0.99 0.00 0.00 -0.72 0.00 0.00 41.12 39.41 1l1p n ASP 30 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l1p n GLY 31 N -0.40 2.01 3.00 0.27 0.00 -1.26 -5.02 105.19 103.79 1l1p n GLY 31 Ca 0.48 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.24 1l1p n GLY 31 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1l1p s GLU 32 N -0.83 1.84 -0.08 1.61 2.02 -1.26 -4.96 118.70 117.05 1l1p s GLU 32 Ca 0.00 -0.42 -0.30 0.00 0.02 0.00 0.00 54.97 54.27 1l1p s GLU 32 Cb 0.00 -1.64 -0.05 0.00 0.10 0.00 0.00 34.13 32.54 1l1p s GLU 32 CO 0.00 -0.09 1.64 -1.83 0.02 0.00 0.00 175.26 175.00 1l1p s GLU 33 N 1.08 4.13 0.00 1.61 -1.05 -1.26 -2.97 118.70 120.25 1l1p s GLU 33 Ca -0.06 2.11 0.00 0.00 -0.15 0.00 0.00 54.97 56.87 1l1p s GLU 33 Cb -0.15 -3.99 0.00 0.00 -0.44 0.00 0.00 34.13 29.56 1l1p s GLU 33 CO -0.02 -0.90 0.00 1.97 0.95 0.00 0.00 175.26 177.26 1l1p n PHE 34 N 7.29 0.00 0.09 4.83 -1.74 -1.26 -4.77 117.46 121.90 1l1p n PHE 34 Ca 0.17 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.95 1l1p n PHE 34 Cb 0.43 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.35 1l1p n PHE 34 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 1l1p h GLU 35 N 0.00 -0.26 -0.30 3.97 5.08 -1.96 -3.12 114.58 117.98 1l1p h GLU 35 Ca 0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1l1p h GLU 35 Cb 0.00 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1l1p h GLU 35 CO 0.00 0.13 0.00 0.41 -1.00 0.00 0.00 179.01 178.55 1l1p n GLY 36 N 0.23 -0.21 0.05 -3.84 0.00 -1.26 -4.07 105.19 96.09 1l1p n GLY 36 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.97 1l1p n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l1p n GLY 37 N 0.33 -0.53 3.08 -0.02 0.00 -1.18 -4.40 105.19 102.46 1l1p n GLY 37 Ca 0.00 0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 1l1p n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l1p s LYS 38 N -3.04 0.22 0.00 1.61 3.01 -1.26 -0.29 119.74 120.00 1l1p s LYS 38 Ca -0.01 0.56 0.00 0.00 -1.01 0.00 0.00 55.97 55.52 1l1p s LYS 38 Cb 0.02 -0.11 -0.00 0.00 -1.01 0.00 0.00 37.83 36.72 1l1p s LYS 38 CO 0.05 -0.17 -0.01 0.00 0.51 0.00 0.00 175.35 175.73 1l1p s ALA 39 N 1.31 0.07 0.04 5.17 0.00 0.37 -4.96 121.76 123.76 1l1p s ALA 39 Ca -0.09 -0.16 -0.03 0.00 0.00 0.00 0.00 51.96 51.68 1l1p s ALA 39 Cb -0.10 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.03 1l1p s ALA 39 CO -0.09 -0.03 -0.07 -1.13 0.00 0.00 0.00 175.76 174.45 1l1p n SER 40 N 2.73 1.21 -3.92 0.00 3.41 -1.26 0.12 113.62 115.90 1l1p n SER 40 Ca -0.15 0.17 -0.40 0.00 -0.26 0.00 0.00 58.87 58.23 1l1p n SER 40 Cb 0.59 -0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 64.13 1l1p n SER 40 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1l1p n ASP 41 N -3.65 5.96 -4.44 4.04 5.68 -1.26 -2.63 116.55 120.25 1l1p n ASP 41 Ca -0.03 -3.41 -0.44 0.00 -0.50 0.00 0.00 54.79 50.41 1l1p n ASP 41 Cb 0.13 -1.17 -0.06 0.00 -1.14 0.00 0.00 41.12 38.88 1l1p n ASP 41 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1l1p s PHE 42 N -2.70 3.00 -0.75 2.11 5.36 0.19 -4.88 117.98 120.31 1l1p s PHE 42 Ca 0.32 -0.54 -0.27 0.00 -0.96 0.00 0.00 56.93 55.49 1l1p s PHE 42 Cb 0.06 -3.68 0.03 0.00 -0.34 0.00 0.00 43.02 39.09 1l1p s PHE 42 CO 0.08 -1.12 1.34 0.54 -1.46 0.00 0.00 175.22 174.60 1l1p s VAL 43 N 2.82 3.71 0.05 3.12 0.11 -1.26 -0.61 120.40 128.35 1l1p s VAL 43 Ca 0.16 0.31 -0.19 0.00 -2.93 0.00 0.00 61.98 59.34 1l1p s VAL 43 Cb -0.19 -4.86 -0.06 0.00 -1.53 0.00 0.00 36.38 29.74 1l1p s VAL 43 CO 0.12 -1.79 0.55 -0.22 -3.33 0.00 0.00 175.10 170.42 1l1p s LEU 44 N 5.94 4.51 -0.43 2.54 0.20 0.84 -4.87 118.68 127.41 1l1p s LEU 44 Ca 0.38 1.20 -0.12 0.00 0.69 0.00 0.00 54.13 56.29 1l1p s LEU 44 Cb -0.08 -2.85 0.07 0.00 -0.43 0.00 0.00 46.19 42.90 1l1p s LEU 44 CO 0.14 0.26 0.30 0.00 -0.29 0.00 0.00 176.35 176.75 1l1p s ALA 45 N -0.98 3.38 -1.05 5.97 0.00 -1.26 0.13 121.76 127.95 1l1p s ALA 45 Ca 0.28 -2.07 -0.23 0.00 0.00 0.00 0.00 51.96 49.94 1l1p s ALA 45 Cb -0.19 -2.78 -0.05 0.00 0.00 0.00 0.00 23.12 20.09 1l1p s ALA 45 CO 0.18 -1.64 1.90 -1.64 0.00 0.00 0.00 175.76 174.56 1l1p s MET 46 N 1.52 2.67 0.00 0.00 -1.94 0.31 -3.47 119.30 118.39 1l1p s MET 46 Ca 0.03 -0.80 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 1l1p s MET 46 Cb -0.23 -5.18 0.00 0.00 2.01 0.00 0.00 34.83 31.43 1l1p s MET 46 CO 0.04 -3.50 0.00 0.41 -0.01 0.00 0.00 175.02 171.96 1l1p n GLY 47 N 6.34 0.84 1.23 -0.03 0.00 -1.26 -2.42 105.19 109.89 1l1p n GLY 47 Ca 0.42 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1l1p n GLY 47 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1l1p n GLN 48 N 0.00 0.00 -0.10 1.61 0.00 -1.23 -4.69 117.38 112.98 1l1p n GLN 48 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.00 56.86 1l1p n GLN 48 Cb 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 30.24 30.08 1l1p n GLN 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1l1p n GLY 49 N 3.07 -0.50 0.00 1.69 0.00 -1.26 -5.00 105.19 103.19 1l1p n GLY 49 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1l1p n GLY 49 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1l1p n ARG 50 N -4.37 0.00 -1.49 1.61 1.85 -1.26 -5.12 116.66 107.89 1l1p n ARG 50 Ca -0.24 0.00 -0.54 0.00 -1.00 0.00 0.00 57.85 56.07 1l1p n ARG 50 Cb 0.60 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.93 1l1p n ARG 50 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1l1p n MET 51 N 0.00 0.93 -1.17 2.89 1.56 -1.26 -4.91 117.12 115.16 1l1p n MET 51 Ca 0.00 0.29 -0.30 0.00 -0.27 0.00 0.00 57.70 57.42 1l1p n MET 51 Cb 0.00 -2.21 0.14 0.00 2.15 0.00 0.00 33.22 33.30 1l1p n MET 51 CO 0.00 0.00 0.00 0.96 -0.73 0.00 0.00 175.97 176.20 1l1p s ILE 52 N 6.05 2.72 -0.41 1.12 -4.36 -1.26 -4.70 121.20 120.36 1l1p s ILE 52 Ca 1.08 0.23 0.17 0.00 -0.26 0.00 0.00 60.65 61.87 1l1p s ILE 52 Cb -1.02 -2.68 0.17 0.00 1.25 0.00 0.00 42.46 40.18 1l1p s ILE 52 CO 0.56 -0.30 1.52 -0.81 0.24 0.00 0.00 174.94 176.15 1l1p n PRO 53 N -3.88 0.11 0.01 0.37 -0.04 -1.26 -1.35 135.00 128.97 1l1p n PRO 53 Ca 0.07 0.58 -0.02 0.00 -0.04 0.00 0.00 63.50 64.10 1l1p n PRO 53 Cb 0.55 -1.85 -0.01 0.00 -0.04 0.00 0.00 33.50 32.15 1l1p n PRO 53 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1l1p h GLY 54 N 0.23 -0.11 0.68 0.55 0.00 -1.90 -3.05 103.07 99.46 1l1p h GLY 54 Ca 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1l1p h GLY 54 CO 0.00 -0.04 -0.02 0.74 0.00 0.00 0.00 176.54 177.22 1l1p h PHE 55 N -0.71 -0.05 -0.22 5.60 0.04 -1.70 -2.50 116.94 117.40 1l1p h PHE 55 Ca -0.01 -0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.82 1l1p h PHE 55 Cb 0.08 0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 1l1p h PHE 55 CO 0.01 0.27 0.44 1.49 -0.60 0.00 0.00 178.31 179.92 1l1p h GLU 56 N -0.37 0.00 0.00 1.51 4.81 -1.41 0.24 114.58 119.35 1l1p h GLU 56 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1l1p h GLU 56 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1l1p h GLU 56 CO 0.01 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.82 1l1p n ASP 57 N -3.26 0.00 -0.03 1.04 2.03 -0.95 -3.46 116.55 111.93 1l1p n ASP 57 Ca 0.03 0.36 -0.13 0.00 0.52 0.00 0.00 54.79 55.56 1l1p n ASP 57 Cb 0.56 -0.14 -0.10 0.00 -0.72 0.00 0.00 41.12 40.72 1l1p n ASP 57 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1l1p h GLY 58 N 0.00 0.12 -2.60 0.27 0.00 -1.47 -3.17 103.07 96.21 1l1p h GLY 58 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1l1p h GLY 58 CO 0.00 0.13 0.00 1.39 0.00 0.00 0.00 176.54 178.06 1l1p n ILE 59 N -4.72 1.47 -0.08 2.60 -0.00 0.83 -4.18 119.36 115.28 1l1p n ILE 59 Ca -0.08 -0.27 -0.06 0.00 -0.00 0.00 0.00 62.75 62.34 1l1p n ILE 59 Cb 0.33 -1.25 -0.00 0.00 -0.00 0.00 0.00 39.64 38.71 1l1p n ILE 59 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.55 176.62 1l1p h LYS 60 N 0.72 -0.09 0.00 0.38 2.10 -1.58 -3.43 116.57 114.68 1l1p h LYS 60 Ca 0.00 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1l1p h LYS 60 Cb 0.94 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 1l1p h LYS 60 CO 0.00 -0.06 0.00 0.41 -2.00 0.00 0.00 179.45 177.80 1l1p n GLY 61 N -1.32 0.82 0.00 0.07 0.00 -1.26 -4.82 105.19 98.68 1l1p n GLY 61 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1l1p n GLY 61 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1l1p n HIS 62 N 0.00 0.00 -3.88 1.61 1.44 -1.26 0.37 115.22 113.50 1l1p n HIS 62 Ca 0.00 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.43 1l1p n HIS 62 Cb 0.00 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 29.99 1l1p n HIS 62 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1l1p s LYS 63 N -1.08 2.30 -0.59 -1.40 -0.14 -1.26 -4.98 119.74 112.60 1l1p s LYS 63 Ca 0.00 -3.16 -0.26 0.00 -1.36 0.00 0.00 55.97 51.19 1l1p s LYS 63 Cb 0.00 -3.31 -0.09 0.00 -1.68 0.00 0.00 37.83 32.75 1l1p s LYS 63 CO 0.00 -1.26 2.42 0.00 -0.76 0.00 0.00 175.35 175.75 1l1p n ALA 64 N 2.22 0.65 0.00 5.17 0.00 -1.26 -1.55 120.51 125.74 1l1p n ALA 64 Ca 0.18 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.56 1l1p n ALA 64 Cb 0.35 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.59 1l1p n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l1p n GLY 65 N 6.24 1.14 3.98 0.00 0.00 0.15 -4.81 105.19 111.90 1l1p n GLY 65 Ca 0.41 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.23 1l1p n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1l1p s GLU 66 N -0.13 3.05 -0.25 1.61 2.12 0.16 -4.84 118.70 120.42 1l1p s GLU 66 Ca 0.00 -0.89 -0.03 0.00 0.36 0.00 0.00 54.97 54.41 1l1p s GLU 66 Cb 0.00 -2.73 0.08 0.00 0.26 0.00 0.00 34.13 31.74 1l1p s GLU 66 CO 0.00 -0.09 0.08 -1.83 -0.54 0.00 0.00 175.26 172.88 1l1p s GLU 67 N -4.32 0.49 0.20 4.30 -1.05 -1.26 0.11 118.70 117.17 1l1p s GLU 67 Ca 0.47 -0.60 0.00 0.00 -0.15 0.00 0.00 54.97 54.69 1l1p s GLU 67 Cb -0.10 -1.81 -0.05 0.00 -0.44 0.00 0.00 34.13 31.74 1l1p s GLU 67 CO 0.33 -0.84 0.07 -0.59 0.95 0.00 0.00 175.26 175.18 1l1p s PHE 68 N 1.88 1.24 -0.18 4.83 -0.12 0.37 -4.96 117.98 121.04 1l1p s PHE 68 Ca 0.05 -1.19 0.01 0.00 -0.05 0.00 0.00 56.93 55.75 1l1p s PHE 68 Cb -0.17 -0.69 0.03 0.00 -0.63 0.00 0.00 43.02 41.57 1l1p s PHE 68 CO -0.20 -0.40 -0.12 0.99 -0.05 0.00 0.00 175.22 175.44 1l1p s THR 69 N -3.87 1.60 0.22 -4.49 2.01 -1.26 0.88 115.64 110.72 1l1p s THR 69 Ca 0.32 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.52 1l1p s THR 69 Cb 0.07 -1.60 -0.05 0.00 0.01 0.00 0.00 72.50 70.93 1l1p s THR 69 CO 0.08 0.29 -0.03 0.27 -0.69 0.00 0.00 174.62 174.55 1l1p s ILE 70 N 1.44 1.14 0.14 1.82 -0.00 -0.91 -4.96 121.20 119.88 1l1p s ILE 70 Ca 0.02 -2.05 -0.04 0.00 -0.00 0.00 0.00 60.65 58.57 1l1p s ILE 70 Cb -0.15 -2.26 -0.05 0.00 -0.00 0.00 0.00 42.46 40.00 1l1p s ILE 70 CO -0.09 -0.41 0.37 -0.62 -0.00 0.00 0.00 174.94 174.19 1l1p s ASP 71 N -3.29 6.47 -0.10 4.36 -1.08 -1.26 -2.39 116.67 119.37 1l1p s ASP 71 Ca 0.26 0.55 -0.07 0.00 -0.52 0.00 0.00 52.55 52.77 1l1p s ASP 71 Cb 0.05 -2.07 0.04 0.00 -1.46 0.00 0.00 42.92 39.47 1l1p s ASP 71 CO 0.07 0.05 0.24 -0.69 0.52 0.00 0.00 175.17 175.37 1l1p s VAL 72 N -1.68 -0.02 -0.15 1.11 1.01 -0.82 -3.74 120.40 116.11 1l1p s VAL 72 Ca 0.40 0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.40 1l1p s VAL 72 Cb -0.12 -0.36 0.06 0.00 0.00 0.00 0.00 36.38 35.96 1l1p s VAL 72 CO 0.25 0.03 0.32 -0.89 0.00 0.00 0.00 175.10 174.82 1l1p s THR 73 N 0.77 -0.27 -0.05 3.92 2.01 -1.26 -0.09 115.64 120.67 1l1p s THR 73 Ca -0.05 0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.87 1l1p s THR 73 Cb -0.07 -0.51 -0.03 0.00 0.01 0.00 0.00 72.50 71.90 1l1p s THR 73 CO -0.05 0.08 0.78 -0.36 -0.69 0.00 0.00 174.62 174.38 1l1p s PHE 74 N 1.92 3.60 1.26 4.92 0.40 -1.18 -4.90 117.98 124.00 1l1p s PHE 74 Ca -0.05 1.38 -0.20 0.00 -0.60 0.00 0.00 56.93 57.47 1l1p s PHE 74 Cb -0.11 -2.90 0.31 0.00 0.51 0.00 0.00 43.02 40.83 1l1p s PHE 74 CO -0.10 0.05 1.06 -1.25 0.70 0.00 0.00 175.22 175.68 1l1p s PRO 75 N 0.88 -1.64 0.00 0.24 0.04 -1.26 -4.02 135.00 129.24 1l1p s PRO 75 Ca 0.42 0.03 0.23 0.00 0.04 0.00 0.00 61.00 61.72 1l1p s PRO 75 Cb -0.19 -1.54 1.07 0.00 0.04 0.00 0.00 34.50 33.89 1l1p s PRO 75 CO 0.21 -4.01 1.73 -0.85 0.04 0.00 0.00 177.00 174.12 1l1p n GLU 76 N -4.99 0.19 0.01 4.56 0.00 -1.26 -2.96 120.64 116.20 1l1p n GLU 76 Ca 0.12 0.09 -0.17 0.00 0.00 0.00 0.00 57.16 57.21 1l1p n GLU 76 Cb 0.59 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.39 1l1p n GLU 76 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1l1p h GLU 77 N 0.00 0.19 0.00 3.44 4.39 -2.03 -3.40 114.58 117.16 1l1p h GLU 77 Ca 0.00 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.38 1l1p h GLU 77 Cb 0.28 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1l1p h GLU 77 CO 0.00 0.99 0.00 0.98 -1.16 0.00 0.00 179.01 179.82 1l1p n TYR 78 N -3.35 0.00 -3.22 4.33 4.19 -1.15 -4.94 117.16 113.02 1l1p n TYR 78 Ca -0.24 0.00 -0.27 0.00 3.31 0.00 0.00 57.90 60.70 1l1p n TYR 78 Cb 1.05 -0.47 0.02 0.00 0.49 0.00 0.00 39.34 40.43 1l1p n TYR 78 CO 0.00 0.00 0.00 0.72 0.91 0.00 0.00 176.86 178.49 1l1p n HIS 79 N -1.91 -1.91 -3.20 2.98 8.25 -1.22 -4.92 115.22 113.28 1l1p n HIS 79 Ca 0.00 0.80 -0.34 0.00 -0.26 0.00 0.00 57.72 57.92 1l1p n HIS 79 Cb 0.00 -1.70 -0.06 0.00 1.12 0.00 0.00 29.99 29.35 1l1p n HIS 79 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1l1p s ALA 80 N -1.82 3.43 0.57 -1.41 0.00 -1.26 -4.68 121.76 116.59 1l1p s ALA 80 Ca 0.18 0.01 0.32 0.00 0.00 0.00 0.00 51.96 52.47 1l1p s ALA 80 Cb -0.02 -2.70 1.44 0.00 0.00 0.00 0.00 23.12 21.85 1l1p s ALA 80 CO 0.70 0.38 1.79 1.05 0.00 0.00 0.00 175.76 179.68 1l1p h GLU 81 N 2.94 0.00 0.04 0.00 9.09 -1.97 1.26 114.58 125.94 1l1p h GLU 81 Ca -0.48 0.00 -0.37 0.00 0.05 0.00 0.00 59.36 58.56 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.23 1l1p h GLU 81 CO 0.66 0.00 -2.22 0.27 0.05 0.00 0.00 179.01 177.77 1l1p n ASN 82 N -3.90 1.67 -0.37 3.06 6.94 -1.26 -4.70 115.26 116.70 1l1p n ASN 82 Ca 0.18 0.06 0.02 0.00 -0.02 0.00 0.00 54.58 54.82 1l1p n ASN 82 Cb 1.05 -0.36 0.03 0.00 -2.36 0.00 0.00 39.78 38.13 1l1p n ASN 82 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1l1p n LEU 83 N -3.25 0.55 -3.22 -4.53 -0.00 -0.94 -5.02 117.00 100.58 1l1p n LEU 83 Ca -0.36 -1.42 -0.43 0.00 -0.00 0.00 0.00 56.01 53.80 1l1p n LEU 83 Cb 1.04 -0.09 -0.06 0.00 -0.00 0.00 0.00 43.42 44.30 1l1p n LEU 83 CO 0.36 0.34 0.49 2.29 -0.00 0.00 0.00 177.39 180.88 1l1p n LYS 84 N -0.32 0.00 -3.95 1.47 2.85 0.43 -1.21 118.16 117.42 1l1p n LYS 84 Ca 0.03 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.01 1l1p n LYS 84 Cb 0.67 -1.06 -0.01 0.00 -0.65 0.00 0.00 35.03 33.97 1l1p n LYS 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1l1p n GLY 85 N 1.45 -0.39 3.34 2.58 0.00 -1.26 -4.77 105.19 106.14 1l1p n GLY 85 Ca 0.16 0.22 -0.47 0.00 0.00 0.00 0.00 46.02 45.93 1l1p n GLY 85 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1l1p s LYS 86 N -6.60 3.70 -0.66 1.61 2.36 -0.35 -4.82 119.74 114.98 1l1p s LYS 86 Ca 0.12 -2.55 -0.27 0.00 -2.55 0.00 0.00 55.97 50.72 1l1p s LYS 86 Cb -0.05 -4.48 0.02 0.00 -1.05 0.00 0.00 37.83 32.27 1l1p s LYS 86 CO 0.90 -1.31 1.37 0.00 1.55 0.00 0.00 175.35 177.86 1l1p s ALA 87 N 0.08 2.73 0.00 3.13 0.00 -1.26 -3.12 121.76 123.32 1l1p s ALA 87 Ca 0.21 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1l1p s ALA 87 Cb -0.10 -4.20 0.00 0.00 0.00 0.00 0.00 23.12 18.83 1l1p s ALA 87 CO -0.09 -3.19 0.00 0.00 0.00 0.00 0.00 175.76 172.49 1l1p n ALA 88 N 9.69 0.00 -2.80 0.00 0.00 0.87 -4.45 120.51 123.82 1l1p n ALA 88 Ca 0.08 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.35 1l1p n ALA 88 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.80 1l1p n ALA 88 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1l1p s LYS 89 N -1.84 0.56 0.14 0.00 1.02 0.93 -1.95 119.74 118.60 1l1p s LYS 89 Ca 0.00 -0.22 -0.00 0.00 0.02 0.00 0.00 55.97 55.76 1l1p s LYS 89 Cb 0.00 -0.54 -0.04 0.00 -0.52 0.00 0.00 37.83 36.73 1l1p s LYS 89 CO 0.00 0.12 0.05 -0.06 -0.92 0.00 0.00 175.35 174.54 1l1p s PHE 90 N -0.07 0.95 -0.29 3.18 0.08 -1.01 -1.71 117.98 119.12 1l1p s PHE 90 Ca 0.01 -1.20 0.01 0.00 0.12 0.00 0.00 56.93 55.88 1l1p s PHE 90 Cb -0.04 -0.53 0.09 0.00 -0.57 0.00 0.00 43.02 41.97 1l1p s PHE 90 CO -0.00 -0.46 0.03 0.00 -0.10 0.00 0.00 175.22 174.68 1l1p s ALA 91 N -3.98 2.17 0.29 5.36 0.00 -1.07 -2.14 121.76 122.40 1l1p s ALA 91 Ca 0.25 -1.87 0.06 0.00 0.00 0.00 0.00 51.96 50.40 1l1p s ALA 91 Cb 0.07 -1.68 -0.02 0.00 0.00 0.00 0.00 23.12 21.49 1l1p s ALA 91 CO 0.03 -1.51 0.43 0.42 0.00 0.00 0.00 175.76 175.13 1l1p s ILE 92 N 1.29 4.64 -0.25 0.00 1.01 0.25 -1.82 121.20 126.32 1l1p s ILE 92 Ca 0.05 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 59.71 1l1p s ILE 92 Cb -0.18 -3.63 0.08 0.00 0.01 0.00 0.00 42.46 38.74 1l1p s ILE 92 CO -0.12 -0.25 0.08 0.20 0.00 0.00 0.00 174.94 174.84 1l1p s ASN 93 N -4.08 3.36 0.73 3.58 0.01 0.15 0.14 114.94 118.82 1l1p s ASN 93 Ca 0.40 -1.17 -0.15 0.00 -0.71 0.00 0.00 52.86 51.24 1l1p s ASN 93 Cb -0.09 -0.59 0.04 0.00 0.41 0.00 0.00 41.25 41.02 1l1p s ASN 93 CO 0.30 -0.37 1.18 -0.22 -1.51 0.00 0.00 177.10 176.48 1l1p s LEU 94 N 1.86 3.30 0.00 0.60 2.96 0.30 -1.88 118.68 125.82 1l1p s LEU 94 Ca 0.05 2.27 0.00 0.00 -0.22 0.00 0.00 54.13 56.23 1l1p s LEU 94 Cb -0.17 -4.58 0.00 0.00 0.50 0.00 0.00 46.19 41.94 1l1p s LEU 94 CO -0.20 -2.19 0.00 0.29 -1.32 0.00 0.00 176.35 172.93 1l1p n LYS 95 N -2.77 0.00 -2.22 1.98 5.02 0.56 0.37 118.16 121.11 1l1p n LYS 95 Ca 0.13 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.01 1l1p n LYS 95 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.49 1l1p n LYS 95 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1l1p s LYS 96 N 2.21 3.08 -0.38 1.97 1.02 -1.20 -3.18 119.74 123.26 1l1p s LYS 96 Ca 0.00 0.62 -0.07 0.00 0.02 0.00 0.00 55.97 56.54 1l1p s LYS 96 Cb 0.00 -4.23 0.07 0.00 -0.52 0.00 0.00 37.83 33.15 1l1p s LYS 96 CO 0.00 -2.20 0.18 0.54 -0.92 0.00 0.00 175.35 172.95 1l1p s VAL 97 N 7.17 3.85 0.22 3.17 0.11 -1.26 0.79 120.40 134.46 1l1p s VAL 97 Ca 0.61 -1.39 0.03 0.00 -2.93 0.00 0.00 61.98 58.30 1l1p s VAL 97 Cb -0.13 -3.32 -0.05 0.00 -1.53 0.00 0.00 36.38 31.35 1l1p s VAL 97 CO 0.24 -0.38 0.01 -1.61 -3.33 0.00 0.00 175.10 170.03 1l1p s GLU 98 N 1.37 1.29 -0.80 1.54 2.02 -1.23 -4.30 118.70 118.60 1l1p s GLU 98 Ca 0.01 -1.65 -0.19 0.00 0.02 0.00 0.00 54.97 53.17 1l1p s GLU 98 Cb -0.21 -0.49 0.13 0.00 0.10 0.00 0.00 34.13 33.66 1l1p s GLU 98 CO 0.01 -0.13 0.95 -2.00 0.02 0.00 0.00 175.26 174.11 1l1p s GLU 99 N -3.90 3.40 1.07 1.61 2.12 -1.26 -2.14 118.70 119.60 1l1p s GLU 99 Ca 0.29 -1.65 -0.17 0.00 0.36 0.00 0.00 54.97 53.80 1l1p s GLU 99 Cb 0.06 -4.59 0.23 0.00 0.26 0.00 0.00 34.13 30.09 1l1p s GLU 99 CO 0.08 -1.65 1.19 -0.98 -0.54 0.00 0.00 175.26 173.36 1l1p s ARG 100 N 2.46 -0.20 -0.30 4.30 1.04 -1.26 -2.83 118.95 122.17 1l1p s ARG 100 Ca 0.24 -0.12 -0.02 0.00 -1.04 0.00 0.00 55.73 54.79 1l1p s ARG 100 Cb -0.12 -1.72 0.19 0.00 -2.04 0.00 0.00 34.95 31.26 1l1p s ARG 100 CO -0.03 -3.02 0.76 -1.21 -0.04 0.00 0.00 175.30 171.75 1l1p s GLU 101 N -5.54 0.42 -0.18 3.89 2.02 -1.26 -4.71 118.70 113.34 1l1p s GLU 101 Ca 0.71 0.55 -0.29 0.00 0.02 0.00 0.00 54.97 55.96 1l1p s GLU 101 Cb -0.09 0.28 -0.02 0.00 0.10 0.00 0.00 34.13 34.41 1l1p s GLU 101 CO 0.55 -0.65 1.32 -0.51 0.02 0.00 0.00 175.26 175.98 1l1p s LEU 102 N 2.88 4.14 -0.59 1.80 1.43 -1.26 -4.65 118.68 122.43 1l1p s LEU 102 Ca 0.15 1.67 -0.32 0.00 -1.03 0.00 0.00 54.13 54.59 1l1p s LEU 102 Cb -0.10 -3.54 -0.14 0.00 0.03 0.00 0.00 46.19 42.45 1l1p s LEU 102 CO -0.22 -0.85 2.39 -2.65 0.23 0.00 0.00 176.35 175.26 1l1p n PRO 103 N 6.81 0.67 0.02 1.29 -0.02 -1.26 -4.79 135.00 137.72 1l1p n PRO 103 Ca 0.15 0.11 -0.08 0.00 -2.02 0.00 0.00 63.50 61.66 1l1p n PRO 103 Cb 0.45 -2.36 -0.13 0.00 -0.02 0.00 0.00 33.50 31.44 1l1p n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1l1p h GLU 104 N 13.84 0.00 -4.88 -0.52 4.81 -2.05 -3.43 114.58 122.35 1l1p h GLU 104 Ca -0.19 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.38 1l1p h GLU 104 Cb 1.31 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.44 1l1p h GLU 104 CO 1.17 0.74 -0.63 -1.17 -0.73 0.00 0.00 179.01 178.39 1l1p s LEU 105 N -6.39 3.61 0.00 1.64 0.20 -1.26 -5.35 118.68 111.12 1l1p s LEU 105 Ca -0.02 -0.48 0.24 0.00 0.69 0.00 0.00 54.13 54.55 1l1p s LEU 105 Cb 0.09 -1.89 1.40 0.00 -0.43 0.00 0.00 46.19 45.37 1l1p s LEU 105 CO 0.82 -0.12 1.77 0.41 -0.29 0.00 0.00 176.35 178.95