#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1p n SER 2 N 0.00 1.83 -4.69 1.61 7.64 -1.26 -4.94 113.62 113.81 1l1p n SER 2 Ca 0.00 0.03 -0.33 0.00 1.01 0.00 0.00 58.87 59.57 1l1p n SER 2 Cb 0.00 -0.45 -0.09 0.00 -1.01 0.00 0.00 64.21 62.66 1l1p n SER 2 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1l1p s HIS 3 N -2.54 3.12 -0.50 1.43 5.65 -1.26 -5.08 115.29 116.11 1l1p s HIS 3 Ca -0.27 0.12 -0.14 0.00 0.25 0.00 0.00 55.06 55.02 1l1p s HIS 3 Cb 0.08 -1.71 0.11 0.00 -1.18 0.00 0.00 32.58 29.87 1l1p s HIS 3 CO 0.69 0.47 0.42 0.00 -0.65 0.00 0.00 174.74 175.67 1l1p s MET 4 N -1.36 2.87 -0.17 2.88 0.00 -1.26 -5.05 119.30 117.21 1l1p s MET 4 Ca 0.18 -1.58 -0.29 0.00 0.00 0.00 0.00 55.69 53.99 1l1p s MET 4 Cb -0.11 -4.14 -0.00 0.00 0.00 0.00 0.00 34.83 30.57 1l1p s MET 4 CO 0.08 -1.18 1.09 -0.65 0.00 0.00 0.00 175.02 174.36 1l1p s GLN 5 N 1.56 4.30 0.53 3.16 -0.21 -1.26 -5.03 119.66 122.71 1l1p s GLN 5 Ca 0.04 1.46 -0.14 0.00 0.02 0.00 0.00 55.36 56.73 1l1p s GLN 5 Cb -0.27 -3.64 -0.07 0.00 1.00 0.00 0.00 33.01 30.04 1l1p s GLN 5 CO 0.03 -0.56 0.97 0.00 -2.12 0.00 0.00 175.29 173.62 1l1p s ALA 6 N 2.91 3.11 -0.01 6.09 0.00 -1.26 -5.08 121.76 127.51 1l1p s ALA 6 Ca 0.48 0.07 0.03 0.00 0.00 0.00 0.00 51.96 52.54 1l1p s ALA 6 Cb -0.18 -3.06 -0.00 0.00 0.00 0.00 0.00 23.12 19.88 1l1p s ALA 6 CO 0.12 -0.33 -0.10 -0.08 0.00 0.00 0.00 175.76 175.37 1l1p s THR 7 N -2.74 0.83 0.04 0.00 -1.32 -1.26 -5.15 115.64 106.04 1l1p s THR 7 Ca 0.57 -0.43 0.01 0.00 -1.21 0.00 0.00 61.69 60.63 1l1p s THR 7 Cb -0.10 -0.71 -0.03 0.00 -1.51 0.00 0.00 72.50 70.15 1l1p s THR 7 CO 0.37 0.24 -0.05 0.26 -2.21 0.00 0.00 174.62 173.24 1l1p s TRP 8 N -0.10 0.48 -0.02 9.09 0.52 -1.26 -4.83 118.94 122.81 1l1p s TRP 8 Ca 0.02 -0.64 0.17 0.00 0.02 0.00 0.00 56.10 55.66 1l1p s TRP 8 Cb -0.06 -0.31 0.28 0.00 -1.15 0.00 0.00 33.47 32.24 1l1p s TRP 8 CO -0.00 -0.18 1.12 0.36 0.02 0.00 0.00 176.95 178.26 1l1p n LYS 9 N 1.18 0.11 -2.14 4.98 2.85 -1.26 -5.04 118.16 118.84 1l1p n LYS 9 Ca -0.21 -1.70 -0.40 0.00 -1.05 0.00 0.00 58.31 54.96 1l1p n LYS 9 Cb 0.56 0.12 -0.01 0.00 -0.65 0.00 0.00 35.03 35.05 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 1l1p s GLU 10 N -0.16 4.12 0.00 -1.58 4.04 -1.22 -4.79 118.70 119.11 1l1p s GLU 10 Ca 0.21 2.09 0.00 0.00 0.04 0.00 0.00 54.97 57.32 1l1p s GLU 10 Cb 0.25 -2.84 0.00 0.00 0.02 0.00 0.00 34.13 31.56 1l1p s GLU 10 CO -0.10 -0.35 0.00 0.36 -1.84 0.00 0.00 175.26 173.33 1l1p n LYS 11 N 0.34 0.88 -0.41 -4.83 2.85 -1.21 -4.76 118.16 111.03 1l1p n LYS 11 Ca 0.03 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.35 1l1p n LYS 11 Cb 0.44 0.00 0.12 0.00 -0.65 0.00 0.00 35.03 34.94 1l1p n LYS 11 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1l1p n ASP 12 N -0.18 1.67 0.00 -5.58 -0.08 -1.26 -4.44 116.55 106.69 1l1p n ASP 12 Ca 0.00 -3.03 0.00 0.00 -1.51 0.00 0.00 54.79 50.25 1l1p n ASP 12 Cb 0.00 -0.41 0.00 0.00 2.34 0.00 0.00 41.12 43.05 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 -0.95 3.56 0.00 0.27 0.00 -1.26 -5.03 105.19 101.78 1l1p n GLY 13 Ca 0.13 -1.98 0.00 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 0.00 -1.61 4.61 0.00 -1.26 -4.23 120.51 115.02 1l1p n ALA 14 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1l1p n ALA 14 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 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 -0.94 2.89 0.11 0.00 0.11 0.19 -4.36 120.40 118.39 1l1p s VAL 15 Ca 0.00 0.48 0.02 0.00 -2.93 0.00 0.00 61.98 59.56 1l1p s VAL 15 Cb 0.00 -3.09 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 1l1p s VAL 15 CO 0.00 -0.18 -0.07 -1.61 -3.33 0.00 0.00 175.10 169.91 1l1p s GLU 16 N -3.66 0.88 0.00 1.54 2.02 -1.26 -4.99 118.70 113.22 1l1p s GLU 16 Ca 0.72 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 54.36 1l1p s GLU 16 Cb -0.26 -0.27 0.00 0.00 0.10 0.00 0.00 34.13 33.70 1l1p s GLU 16 CO 0.36 -0.01 0.04 0.00 0.02 0.00 0.00 175.26 175.68 1l1p n ALA 17 N -0.07 0.00 -3.30 5.21 0.00 -1.26 -1.41 120.51 119.68 1l1p n ALA 17 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.04 1l1p n ALA 17 Cb 0.61 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.57 2.85 -1.13 0.00 1.02 -1.21 -4.34 120.64 116.26 1l1p n GLU 18 Ca 0.00 -4.70 -0.01 0.00 -0.02 0.00 0.00 57.16 52.43 1l1p n GLU 18 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.14 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 0.70 0.17 -3.63 1.62 5.75 -0.50 -4.31 116.55 116.35 1l1p n ASP 19 Ca 0.30 -1.07 -0.23 0.00 -0.01 0.00 0.00 54.79 53.77 1l1p n ASP 19 Cb 0.40 -0.02 -0.17 0.00 -1.03 0.00 0.00 41.12 40.30 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1l1p s ARG 20 N -2.12 0.01 0.43 0.11 6.06 -0.59 0.16 118.95 123.02 1l1p s ARG 20 Ca 0.03 0.12 0.01 0.00 -2.50 0.00 0.00 55.73 53.39 1l1p s ARG 20 Cb -0.00 -1.26 -0.00 0.00 0.06 0.00 0.00 34.95 33.74 1l1p s ARG 20 CO 0.02 -0.53 0.64 0.14 -2.50 0.00 0.00 175.30 173.07 1l1p s VAL 21 N 2.16 3.97 -0.26 7.11 -7.23 0.22 -3.08 120.40 123.29 1l1p s VAL 21 Ca 0.03 -0.59 -0.01 0.00 -1.81 0.00 0.00 61.98 59.61 1l1p s VAL 21 Cb -0.14 -3.45 0.04 0.00 0.56 0.00 0.00 36.38 33.38 1l1p s VAL 21 CO -0.07 -0.29 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.48 1l1p s THR 22 N -2.50 2.75 0.09 5.32 2.01 0.24 -0.22 115.64 123.34 1l1p s THR 22 Ca 0.48 -1.18 0.05 0.00 0.31 0.00 0.00 61.69 61.36 1l1p s THR 22 Cb -0.10 -2.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 1l1p s THR 22 CO 0.37 0.12 -0.14 0.27 -0.69 0.00 0.00 174.62 174.55 1l1p s ILE 23 N 1.28 1.19 -0.14 1.82 -4.36 0.59 -0.24 121.20 121.35 1l1p s ILE 23 Ca -0.02 -1.49 0.02 0.00 -0.26 0.00 0.00 60.65 58.90 1l1p s ILE 23 Cb -0.18 -1.28 0.01 0.00 1.25 0.00 0.00 42.46 42.27 1l1p s ILE 23 CO -0.04 -0.32 -0.21 1.51 0.24 0.00 0.00 174.94 176.12 1l1p s ASP 24 N -2.06 3.01 0.19 4.36 -4.77 -0.80 0.12 116.67 116.71 1l1p s ASP 24 Ca 0.03 -0.58 -0.03 0.00 -3.30 0.00 0.00 52.55 48.67 1l1p s ASP 24 Cb -0.08 -1.39 -0.03 0.00 -1.09 0.00 0.00 42.92 40.33 1l1p s ASP 24 CO 0.02 0.07 0.17 0.72 0.70 0.00 0.00 175.17 176.85 1l1p s PHE 25 N 0.86 0.95 -0.20 2.11 -0.12 0.30 0.20 117.98 122.08 1l1p s PHE 25 Ca -0.07 -1.23 -0.05 0.00 -0.05 0.00 0.00 56.93 55.53 1l1p s PHE 25 Cb -0.15 -0.42 0.10 0.00 -0.63 0.00 0.00 43.02 41.92 1l1p s PHE 25 CO -0.02 -0.67 0.37 0.99 -0.05 0.00 0.00 175.22 175.84 1l1p s THR 26 N -4.11 -0.57 0.23 -4.49 2.01 -0.53 0.16 115.64 108.35 1l1p s THR 26 Ca 0.33 0.12 -0.22 0.00 0.31 0.00 0.00 61.69 62.22 1l1p s THR 26 Cb 0.06 -0.66 0.04 0.00 0.01 0.00 0.00 72.50 71.95 1l1p s THR 26 CO 0.09 0.02 0.69 -0.83 -0.69 0.00 0.00 174.62 173.90 1l1p s GLY 27 N 2.54 -0.27 0.45 4.40 0.00 0.12 -2.62 107.32 111.94 1l1p s GLY 27 Ca 0.03 -0.02 0.07 0.00 0.00 0.00 0.00 44.72 44.80 1l1p s GLY 27 CO -0.13 -0.00 0.32 -0.56 0.00 0.00 0.00 173.10 172.73 1l1p s SER 28 N -2.86 4.72 0.00 1.64 0.01 -0.75 -4.01 113.70 112.46 1l1p s SER 28 Ca 0.08 -0.99 0.00 0.00 1.31 0.00 0.00 55.95 56.34 1l1p s SER 28 Cb -0.04 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.91 1l1p s SER 28 CO 0.00 -0.73 0.00 0.55 0.41 0.00 0.00 173.24 173.47 1l1p n VAL 29 N -1.50 0.00 -0.90 3.43 3.14 -1.24 0.38 118.33 121.64 1l1p n VAL 29 Ca 0.01 0.17 -0.22 0.00 -2.96 0.00 0.00 64.34 61.34 1l1p n VAL 29 Cb 0.63 -1.11 0.11 0.00 -1.06 0.00 0.00 33.84 32.41 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 -2.20 5.01 0.00 6.55 2.03 -1.26 -4.62 116.55 122.06 1l1p n ASP 30 Ca 0.00 -3.35 0.00 0.00 0.52 0.00 0.00 54.79 51.96 1l1p n ASP 30 Cb 0.00 -0.86 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 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 -0.63 0.56 2.76 0.27 0.00 -1.26 -5.02 105.19 101.87 1l1p n GLY 31 Ca 0.48 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.81 0.64 -0.04 1.61 2.02 -1.26 -4.97 118.70 115.88 1l1p s GLU 32 Ca 0.00 -0.04 -0.33 0.00 0.02 0.00 0.00 54.97 54.62 1l1p s GLU 32 Cb 0.00 -1.30 -0.11 0.00 0.10 0.00 0.00 34.13 32.82 1l1p s GLU 32 CO 0.00 -0.40 1.92 -0.85 0.02 0.00 0.00 175.26 175.95 1l1p n GLU 33 N 5.12 2.44 0.00 1.61 0.00 -1.26 -3.66 120.64 124.89 1l1p n GLU 33 Ca -0.08 0.90 0.00 0.00 0.00 0.00 0.00 57.16 57.98 1l1p n GLU 33 Cb 0.49 -2.78 0.00 0.00 0.00 0.00 0.00 31.44 29.15 1l1p n GLU 33 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.13 179.10 1l1p n PHE 34 N 6.98 0.00 0.12 -1.84 -1.74 -1.26 -4.75 117.46 114.97 1l1p n PHE 34 Ca 0.22 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.99 1l1p n PHE 34 Cb 0.34 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.27 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 -0.36 -0.07 3.97 5.08 -1.96 -3.15 114.58 118.09 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 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1l1p h GLU 35 CO 0.00 -0.01 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 1l1p n GLY 36 N 0.19 -0.80 0.00 -3.84 0.00 -1.26 -4.06 105.19 95.42 1l1p n GLY 36 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 0.48 -0.40 3.22 -0.02 0.00 -1.19 -4.29 105.19 102.99 1l1p n GLY 37 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 1l1p n GLY 37 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l1p s LYS 38 N -2.80 0.30 0.02 1.61 -2.85 -1.26 0.12 119.74 114.88 1l1p s LYS 38 Ca 0.00 0.96 0.03 0.00 -1.00 0.00 0.00 55.97 55.96 1l1p s LYS 38 Cb 0.00 0.23 -0.02 0.00 -2.06 0.00 0.00 37.83 35.98 1l1p s LYS 38 CO 0.00 -0.25 -0.10 0.00 0.10 0.00 0.00 175.35 175.11 1l1p s ALA 39 N 2.43 0.77 -0.00 0.59 0.00 0.43 -4.97 121.76 121.00 1l1p s ALA 39 Ca -0.02 -0.60 -0.06 0.00 0.00 0.00 0.00 51.96 51.28 1l1p s ALA 39 Cb -0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1l1p s ALA 39 CO -0.12 0.12 -0.12 0.43 0.00 0.00 0.00 175.76 176.07 1l1p n SER 40 N 2.18 1.34 -3.96 0.00 7.64 -1.26 0.11 113.62 119.67 1l1p n SER 40 Ca -0.17 0.20 -0.41 0.00 1.01 0.00 0.00 58.87 59.50 1l1p n SER 40 Cb 0.56 -0.46 -0.01 0.00 -1.01 0.00 0.00 64.21 63.29 1l1p n SER 40 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1l1p n ASP 41 N -3.79 5.95 -4.49 6.43 9.92 -1.26 -2.52 116.55 126.79 1l1p n ASP 41 Ca -0.06 -3.38 -0.43 0.00 -0.53 0.00 0.00 54.79 50.39 1l1p n ASP 41 Cb 0.22 -1.19 -0.06 0.00 -0.64 0.00 0.00 41.12 39.44 1l1p n ASP 41 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1l1p s PHE 42 N -2.60 2.99 -0.75 1.24 5.36 0.32 -4.87 117.98 119.67 1l1p s PHE 42 Ca 0.32 -0.23 -0.25 0.00 -0.96 0.00 0.00 56.93 55.81 1l1p s PHE 42 Cb 0.05 -3.61 0.05 0.00 -0.34 0.00 0.00 43.02 39.17 1l1p s PHE 42 CO 0.07 -1.05 1.17 0.08 -1.46 0.00 0.00 175.22 174.03 1l1p s VAL 43 N 3.03 4.01 -0.03 3.12 1.01 -1.26 -0.30 120.40 129.98 1l1p s VAL 43 Ca 0.22 -0.09 -0.20 0.00 0.00 0.00 0.00 61.98 61.90 1l1p s VAL 43 Cb -0.16 -4.84 -0.05 0.00 0.00 0.00 0.00 36.38 31.33 1l1p s VAL 43 CO 0.16 -1.70 0.56 -0.22 0.00 0.00 0.00 175.10 173.90 1l1p s LEU 44 N 4.89 4.39 -0.48 3.92 0.20 0.70 -4.89 118.68 127.40 1l1p s LEU 44 Ca 0.31 1.08 -0.16 0.00 0.69 0.00 0.00 54.13 56.05 1l1p s LEU 44 Cb -0.10 -2.86 0.08 0.00 -0.43 0.00 0.00 46.19 42.88 1l1p s LEU 44 CO 0.09 0.09 0.41 0.00 -0.29 0.00 0.00 176.35 176.65 1l1p s ALA 45 N -0.04 3.57 -1.01 5.97 0.00 -1.26 0.69 121.76 129.68 1l1p s ALA 45 Ca 0.30 -2.15 -0.24 0.00 0.00 0.00 0.00 51.96 49.87 1l1p s ALA 45 Cb -0.17 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1l1p s ALA 45 CO 0.16 -1.77 1.86 -1.64 0.00 0.00 0.00 175.76 174.37 1l1p s MET 46 N 1.66 2.77 0.00 0.00 -1.94 0.43 -3.23 119.30 118.98 1l1p s MET 46 Ca 0.04 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.31 1l1p s MET 46 Cb -0.25 -5.17 0.00 0.00 2.01 0.00 0.00 34.83 31.42 1l1p s MET 46 CO 0.06 -3.30 0.00 0.41 -0.01 0.00 0.00 175.02 172.19 1l1p n GLY 47 N 6.53 0.69 1.34 -0.03 0.00 -1.26 -2.29 105.19 110.17 1l1p n GLY 47 Ca 0.41 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.92 1.61 0.00 -1.20 -4.76 117.38 110.11 1l1p n GLN 48 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.00 56.57 1l1p n GLN 48 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 30.24 30.25 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 2.41 5.39 3.79 1.69 0.00 -1.26 -4.83 105.19 112.38 1l1p n GLY 49 Ca 0.00 -2.65 -0.28 0.00 0.00 0.00 0.00 46.02 43.09 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 1.01 -1.15 -1.53 1.61 1.85 -1.26 -4.66 116.66 112.53 1l1p n ARG 50 Ca 0.30 0.52 -0.56 0.00 -1.00 0.00 0.00 57.85 57.12 1l1p n ARG 50 Cb 0.32 -2.06 -0.08 0.00 -1.05 0.00 0.00 32.46 29.59 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 -3.01 0.87 -1.23 2.89 0.00 -1.26 -4.91 117.12 110.47 1l1p n MET 51 Ca -0.26 0.28 -0.31 0.00 -0.00 0.00 0.00 57.70 57.41 1l1p n MET 51 Cb 0.61 -2.10 0.10 0.00 0.00 0.00 0.00 33.22 31.83 1l1p n MET 51 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 175.97 176.93 1l1p s ILE 52 N 5.36 3.20 0.56 1.12 -4.36 -1.26 -4.73 121.20 121.08 1l1p s ILE 52 Ca 1.07 0.40 0.39 0.00 -0.26 0.00 0.00 60.65 62.25 1l1p s ILE 52 Cb -1.09 -2.85 0.39 0.00 1.25 0.00 0.00 42.46 40.16 1l1p s ILE 52 CO 0.60 -0.50 2.19 1.55 0.24 0.00 0.00 174.94 179.02 1l1p h PRO 53 N -1.13 0.00 0.50 0.37 0.13 -1.93 -0.71 132.00 129.23 1l1p h PRO 53 Ca -0.44 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1l1p h PRO 53 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1l1p h PRO 53 CO 0.51 0.00 -0.24 0.78 -0.23 0.00 0.00 178.00 178.82 1l1p h GLY 54 N 0.00 -0.70 0.82 1.56 0.00 -1.91 -2.63 103.07 100.21 1l1p h GLY 54 Ca 0.00 0.26 -0.12 0.00 0.00 0.00 0.00 47.33 47.47 1l1p h GLY 54 CO 0.00 -0.25 -0.41 0.74 0.00 0.00 0.00 176.54 176.62 1l1p h PHE 55 N -0.99 0.62 -0.17 5.60 0.04 -1.70 -3.02 116.94 117.33 1l1p h PHE 55 Ca -0.07 -0.26 0.05 0.00 2.80 0.00 0.00 57.97 60.49 1l1p h PHE 55 Cb 0.51 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 1l1p h PHE 55 CO 0.03 1.01 0.34 1.49 -0.60 0.00 0.00 178.31 180.58 1l1p h GLU 56 N 0.05 0.00 0.00 1.51 4.81 -1.27 0.11 114.58 119.79 1l1p h GLU 56 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1l1p h GLU 56 Cb 1.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1l1p h GLU 56 CO 0.09 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.90 1l1p n ASP 57 N -3.30 0.00 0.28 1.04 -0.08 -0.99 -3.70 116.55 109.80 1l1p n ASP 57 Ca 0.02 0.21 -0.16 0.00 -1.51 0.00 0.00 54.79 53.35 1l1p n ASP 57 Cb 0.44 -0.22 -0.08 0.00 2.34 0.00 0.00 41.12 43.60 1l1p n ASP 57 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1l1p h GLY 58 N 0.00 -0.73 -3.08 0.27 0.00 -1.51 -2.85 103.07 95.17 1l1p h GLY 58 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.60 1l1p h GLY 58 CO 0.00 -0.26 0.00 1.39 0.00 0.00 0.00 176.54 177.67 1l1p n ILE 59 N -5.33 1.71 -0.08 2.60 -0.00 0.37 -4.27 119.36 114.36 1l1p n ILE 59 Ca -0.12 -0.42 -0.09 0.00 -0.00 0.00 0.00 62.75 62.13 1l1p n ILE 59 Cb 0.31 -1.42 -0.02 0.00 -0.00 0.00 0.00 39.64 38.51 1l1p n ILE 59 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 176.55 176.66 1l1p h LYS 60 N 1.33 -0.29 0.00 0.38 1.79 -1.52 -3.43 116.57 114.83 1l1p h LYS 60 Ca 0.00 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1l1p h LYS 60 Cb 0.88 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.59 1l1p h LYS 60 CO 0.00 -0.19 0.00 0.41 -1.08 0.00 0.00 179.45 178.59 1l1p n GLY 61 N -1.41 0.79 0.00 3.86 0.00 -1.26 -4.81 105.19 102.36 1l1p n GLY 61 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.86 1.61 1.44 -1.26 0.54 115.22 113.69 1l1p n HIS 62 Ca 0.00 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.40 1l1p n HIS 62 Cb 0.00 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.00 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 -1.55 2.46 -0.58 -1.40 -0.14 -1.26 -4.96 119.74 112.31 1l1p s LYS 63 Ca 0.00 -3.05 -0.26 0.00 -1.36 0.00 0.00 55.97 51.30 1l1p s LYS 63 Cb 0.00 -3.51 -0.09 0.00 -1.68 0.00 0.00 37.83 32.55 1l1p s LYS 63 CO 0.00 -1.22 2.42 0.00 -0.76 0.00 0.00 175.35 175.79 1l1p n ALA 64 N 2.50 0.65 0.00 5.17 0.00 -1.26 -1.58 120.51 125.99 1l1p n ALA 64 Ca 0.15 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1l1p n ALA 64 Cb 0.35 -3.24 0.00 0.00 0.00 0.00 0.00 19.45 16.56 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 1.51 3.99 0.00 0.00 0.17 -4.82 105.19 112.29 1l1p n GLY 65 Ca 0.40 0.00 -0.19 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 -0.45 3.07 -0.23 1.61 2.12 -0.05 -4.85 118.70 119.92 1l1p s GLU 66 Ca 0.00 -0.94 -0.01 0.00 0.36 0.00 0.00 54.97 54.37 1l1p s GLU 66 Cb 0.00 -2.77 0.07 0.00 0.26 0.00 0.00 34.13 31.69 1l1p s GLU 66 CO 0.00 -0.04 0.03 -1.83 -0.54 0.00 0.00 175.26 172.87 1l1p s GLU 67 N -4.27 0.94 0.16 4.30 -1.05 -1.26 0.11 118.70 117.63 1l1p s GLU 67 Ca 0.47 -0.74 -0.01 0.00 -0.15 0.00 0.00 54.97 54.54 1l1p s GLU 67 Cb -0.10 -2.23 -0.04 0.00 -0.44 0.00 0.00 34.13 31.32 1l1p s GLU 67 CO 0.33 -0.71 0.08 -0.59 0.95 0.00 0.00 175.26 175.31 1l1p s PHE 68 N 1.67 0.97 -0.10 4.83 -0.12 0.37 -4.96 117.98 120.63 1l1p s PHE 68 Ca 0.00 -1.28 0.02 0.00 -0.05 0.00 0.00 56.93 55.62 1l1p s PHE 68 Cb -0.18 -0.51 0.01 0.00 -0.63 0.00 0.00 43.02 41.72 1l1p s PHE 68 CO -0.11 -0.55 -0.14 0.99 -0.05 0.00 0.00 175.22 175.35 1l1p s THR 69 N -4.08 1.42 0.24 -4.49 2.01 -1.26 0.15 115.64 109.63 1l1p s THR 69 Ca 0.29 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.72 1l1p s THR 69 Cb 0.07 -1.31 -0.05 0.00 0.01 0.00 0.00 72.50 71.22 1l1p s THR 69 CO 0.05 0.43 0.03 0.27 -0.69 0.00 0.00 174.62 174.71 1l1p s ILE 70 N 0.98 0.84 0.19 1.82 -0.00 -0.17 -4.93 121.20 119.92 1l1p s ILE 70 Ca -0.07 -2.01 -0.05 0.00 -0.00 0.00 0.00 60.65 58.52 1l1p s ILE 70 Cb -0.15 -2.44 -0.06 0.00 -0.00 0.00 0.00 42.46 39.82 1l1p s ILE 70 CO -0.01 -0.22 0.43 1.51 -0.00 0.00 0.00 174.94 176.65 1l1p s ASP 71 N -3.30 6.49 -0.09 4.36 -4.77 -1.26 -1.67 116.67 116.43 1l1p s ASP 71 Ca 0.31 0.64 -0.05 0.00 -3.30 0.00 0.00 52.55 50.15 1l1p s ASP 71 Cb 0.07 -2.11 0.04 0.00 -1.09 0.00 0.00 42.92 39.82 1l1p s ASP 71 CO 0.10 -0.02 0.22 0.68 0.70 0.00 0.00 175.17 176.85 1l1p s VAL 72 N -1.78 -0.03 -0.20 2.11 -7.23 -0.42 -3.86 120.40 108.98 1l1p s VAL 72 Ca 0.42 0.12 -0.08 0.00 -1.81 0.00 0.00 61.98 60.64 1l1p s VAL 72 Cb -0.12 -0.34 0.09 0.00 0.56 0.00 0.00 36.38 36.57 1l1p s VAL 72 CO 0.25 0.05 0.44 -0.89 -0.31 0.00 0.00 175.10 174.65 1l1p s THR 73 N 1.00 -0.52 -0.03 5.32 2.01 -1.26 0.13 115.64 122.30 1l1p s THR 73 Ca -0.07 0.13 -0.25 0.00 0.31 0.00 0.00 61.69 61.81 1l1p s THR 73 Cb -0.09 -0.69 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 1l1p s THR 73 CO -0.06 0.06 0.78 -0.36 -0.69 0.00 0.00 174.62 174.34 1l1p s PHE 74 N 2.34 3.63 1.33 4.92 0.40 -1.19 -4.90 117.98 124.51 1l1p s PHE 74 Ca -0.04 1.40 -0.21 0.00 -0.60 0.00 0.00 56.93 57.48 1l1p s PHE 74 Cb -0.11 -2.88 0.33 0.00 0.51 0.00 0.00 43.02 40.87 1l1p s PHE 74 CO -0.13 0.10 1.00 -1.25 0.70 0.00 0.00 175.22 175.63 1l1p s PRO 75 N 0.69 -2.19 0.00 0.24 0.04 -1.26 -4.09 135.00 128.43 1l1p s PRO 75 Ca 0.41 0.12 0.25 0.00 0.04 0.00 0.00 61.00 61.82 1l1p s PRO 75 Cb -0.19 -1.47 1.22 0.00 0.04 0.00 0.00 34.50 34.10 1l1p s PRO 75 CO 0.21 -4.39 1.82 -1.91 0.04 0.00 0.00 177.00 172.78 1l1p n GLU 76 N -5.28 0.29 -0.03 4.56 2.13 -1.26 -3.10 120.64 117.95 1l1p n GLU 76 Ca 0.12 0.06 -0.12 0.00 0.66 0.00 0.00 57.16 57.88 1l1p n GLU 76 Cb 0.59 -1.50 -0.14 0.00 0.27 0.00 0.00 31.44 30.66 1l1p n GLU 76 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1l1p n GLU 77 N -1.32 0.67 0.03 5.31 0.28 -1.26 -4.53 120.64 119.81 1l1p n GLU 77 Ca 0.11 0.23 -0.01 0.00 -0.16 0.00 0.00 57.16 57.33 1l1p n GLU 77 Cb 0.21 -1.72 -0.01 0.00 1.43 0.00 0.00 31.44 31.36 1l1p n GLU 77 CO 0.00 0.00 0.00 -0.92 -0.16 0.00 0.00 177.13 176.05 1l1p h TYR 78 N 0.02 -0.07 -5.92 -1.84 5.03 -1.89 -3.47 116.97 108.82 1l1p h TYR 78 Ca -0.38 -0.00 -0.34 0.00 2.58 0.00 0.00 58.73 60.59 1l1p h TYR 78 Cb 2.05 0.02 0.01 0.00 1.55 0.00 0.00 36.73 40.36 1l1p h TYR 78 CO 0.02 -0.04 -0.88 0.72 -1.32 0.00 0.00 178.16 176.65 1l1p n HIS 79 N -2.23 -1.76 -3.11 -3.82 8.25 -1.24 -4.91 115.22 106.39 1l1p n HIS 79 Ca -0.01 0.73 -0.31 0.00 -0.26 0.00 0.00 57.72 57.87 1l1p n HIS 79 Cb 0.03 -1.71 -0.05 0.00 1.12 0.00 0.00 29.99 29.38 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 -1.96 3.39 0.54 -1.41 0.00 -1.26 -4.68 121.76 116.38 1l1p s ALA 80 Ca 0.14 -0.12 0.32 0.00 0.00 0.00 0.00 51.96 52.29 1l1p s ALA 80 Cb -0.01 -2.66 1.48 0.00 0.00 0.00 0.00 23.12 21.93 1l1p s ALA 80 CO 0.67 0.25 1.88 1.49 0.00 0.00 0.00 175.76 180.06 1l1p h GLU 81 N 1.97 0.00 0.04 0.00 4.81 -1.98 0.99 114.58 120.42 1l1p h GLU 81 Ca -0.47 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.39 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.51 1l1p h GLU 81 CO 0.66 0.00 -2.20 0.27 -0.73 0.00 0.00 179.01 177.01 1l1p n ASN 82 N -4.23 1.60 -0.29 1.04 6.94 -1.26 -4.71 115.26 114.35 1l1p n ASN 82 Ca 0.18 0.08 0.02 0.00 -0.02 0.00 0.00 54.58 54.84 1l1p n ASN 82 Cb 0.96 -0.32 0.03 0.00 -2.36 0.00 0.00 39.78 38.09 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 -3.24 0.58 -2.45 -4.53 -0.00 -1.06 -5.03 117.00 101.28 1l1p n LEU 83 Ca -0.35 -1.28 -0.34 0.00 -0.00 0.00 0.00 56.01 54.04 1l1p n LEU 83 Cb 1.04 -0.08 -0.05 0.00 -0.00 0.00 0.00 43.42 44.33 1l1p n LEU 83 CO 0.37 0.31 0.48 2.29 -0.00 0.00 0.00 177.39 180.83 1l1p n LYS 84 N -0.31 0.00 -3.83 1.47 2.85 0.34 -1.15 118.16 117.53 1l1p n LYS 84 Ca 0.03 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 57.01 1l1p n LYS 84 Cb 0.62 -0.79 0.01 0.00 -0.65 0.00 0.00 35.03 34.22 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 1.55 -0.54 3.34 2.58 0.00 -1.26 -4.77 105.19 106.10 1l1p n GLY 85 Ca 0.14 0.27 -0.47 0.00 0.00 0.00 0.00 46.02 45.96 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 -6.31 3.65 -0.63 1.61 2.36 -0.30 -4.82 119.74 115.29 1l1p s LYS 86 Ca 0.20 -2.46 -0.27 0.00 -2.55 0.00 0.00 55.97 50.88 1l1p s LYS 86 Cb -0.07 -4.48 0.02 0.00 -1.05 0.00 0.00 37.83 32.24 1l1p s LYS 86 CO 0.87 -1.33 1.36 0.00 1.55 0.00 0.00 175.35 177.80 1l1p s ALA 87 N 0.28 2.77 0.12 3.13 0.00 -1.26 -3.16 121.76 123.64 1l1p s ALA 87 Ca 0.20 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.23 1l1p s ALA 87 Cb -0.10 -4.16 -0.01 0.00 0.00 0.00 0.00 23.12 18.85 1l1p s ALA 87 CO -0.09 -3.09 0.09 0.00 0.00 0.00 0.00 175.76 172.67 1l1p n ALA 88 N 9.54 0.24 -2.52 0.00 0.00 0.35 -4.52 120.51 123.59 1l1p n ALA 88 Ca 0.09 -0.68 -0.24 0.00 0.00 0.00 0.00 53.44 52.61 1l1p n ALA 88 Cb 0.49 0.53 -0.15 0.00 0.00 0.00 0.00 19.45 20.32 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 -2.48 1.36 0.06 0.00 1.02 0.16 -1.30 119.74 118.56 1l1p s LYS 89 Ca 0.12 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 55.53 1l1p s LYS 89 Cb 0.01 -1.31 -0.03 0.00 -0.52 0.00 0.00 37.83 35.97 1l1p s LYS 89 CO 0.09 0.36 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.75 1l1p s PHE 90 N -0.38 0.69 -0.30 3.18 0.08 -0.67 -1.82 117.98 118.77 1l1p s PHE 90 Ca 0.06 -0.71 0.02 0.00 0.12 0.00 0.00 56.93 56.42 1l1p s PHE 90 Cb -0.07 -0.42 0.09 0.00 -0.57 0.00 0.00 43.02 42.05 1l1p s PHE 90 CO -0.01 -0.15 0.03 0.00 -0.10 0.00 0.00 175.22 174.99 1l1p s ALA 91 N -2.46 2.28 0.33 5.36 0.00 -1.08 -1.00 121.76 125.20 1l1p s ALA 91 Ca -0.01 -1.96 0.07 0.00 0.00 0.00 0.00 51.96 50.06 1l1p s ALA 91 Cb -0.03 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1l1p s ALA 91 CO -0.03 -1.52 0.40 0.42 0.00 0.00 0.00 175.76 175.03 1l1p s ILE 92 N 1.23 3.97 -0.25 0.00 1.01 0.40 -1.45 121.20 126.12 1l1p s ILE 92 Ca 0.05 -1.13 -0.03 0.00 0.00 0.00 0.00 60.65 59.54 1l1p s ILE 92 Cb -0.19 -3.36 0.08 0.00 0.01 0.00 0.00 42.46 39.01 1l1p s ILE 92 CO -0.12 -0.18 0.08 0.20 0.00 0.00 0.00 174.94 174.93 1l1p s ASN 93 N -4.09 3.29 0.73 3.58 -0.87 0.13 0.14 114.94 117.84 1l1p s ASN 93 Ca 0.43 -1.13 -0.15 0.00 -1.57 0.00 0.00 52.86 50.44 1l1p s ASN 93 Cb -0.08 -0.55 0.04 0.00 -0.02 0.00 0.00 41.25 40.63 1l1p s ASN 93 CO 0.29 -0.38 1.19 -0.22 -2.57 0.00 0.00 177.10 175.42 1l1p s LEU 94 N 1.90 3.31 0.00 0.60 2.96 0.31 -1.91 118.68 125.84 1l1p s LEU 94 Ca 0.05 2.30 0.00 0.00 -0.22 0.00 0.00 54.13 56.26 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 -2.21 0.00 0.29 -1.32 0.00 0.00 176.35 172.91 1l1p n LYS 95 N -2.74 0.00 -2.15 1.98 4.76 0.67 -0.66 118.16 120.03 1l1p n LYS 95 Ca 0.13 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.17 1l1p n LYS 95 Cb 0.50 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.67 1l1p n LYS 95 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1l1p s LYS 96 N 2.44 3.00 -0.34 1.97 1.02 -1.19 -3.44 119.74 123.20 1l1p s LYS 96 Ca 0.00 0.73 -0.06 0.00 0.02 0.00 0.00 55.97 56.65 1l1p s LYS 96 Cb 0.00 -4.26 0.04 0.00 -0.52 0.00 0.00 37.83 33.09 1l1p s LYS 96 CO 0.00 -2.28 0.10 0.54 -0.92 0.00 0.00 175.35 172.79 1l1p s VAL 97 N 7.60 3.76 0.20 3.17 0.11 -1.26 0.79 120.40 134.76 1l1p s VAL 97 Ca 0.65 -1.13 0.01 0.00 -2.93 0.00 0.00 61.98 58.57 1l1p s VAL 97 Cb -0.14 -3.13 -0.05 0.00 -1.53 0.00 0.00 36.38 31.53 1l1p s VAL 97 CO 0.25 -0.17 0.04 -1.61 -3.33 0.00 0.00 175.10 170.28 1l1p s GLU 98 N 1.40 1.19 -0.74 1.54 8.01 -1.18 -4.31 118.70 124.61 1l1p s GLU 98 Ca -0.02 -1.60 -0.19 0.00 0.01 0.00 0.00 54.97 53.17 1l1p s GLU 98 Cb -0.19 -0.18 0.12 0.00 -4.31 0.00 0.00 34.13 29.56 1l1p s GLU 98 CO 0.03 -0.21 0.90 -2.00 0.01 0.00 0.00 175.26 173.99 1l1p s GLU 99 N -3.98 3.31 0.94 1.61 -6.30 -1.26 -1.54 118.70 111.48 1l1p s GLU 99 Ca 0.29 -1.50 -0.12 0.00 -2.50 0.00 0.00 54.97 51.14 1l1p s GLU 99 Cb 0.07 -4.49 0.15 0.00 0.00 0.00 0.00 34.13 29.86 1l1p s GLU 99 CO 0.07 -1.65 1.12 -0.98 0.02 0.00 0.00 175.26 173.84 1l1p s ARG 100 N 2.68 0.92 -0.30 4.30 1.70 -1.26 -3.29 118.95 123.69 1l1p s ARG 100 Ca 0.21 0.40 -0.19 0.00 -0.47 0.00 0.00 55.73 55.69 1l1p s ARG 100 Cb -0.15 -1.80 0.18 0.00 -0.57 0.00 0.00 34.95 32.61 1l1p s ARG 100 CO 0.00 -2.37 1.26 -1.21 -1.08 0.00 0.00 175.30 171.90 1l1p s GLU 101 N -5.15 0.02 -0.07 3.89 0.41 -1.26 -4.66 118.70 111.87 1l1p s GLU 101 Ca 0.64 0.03 -0.23 0.00 -0.41 0.00 0.00 54.97 55.01 1l1p s GLU 101 Cb -0.16 0.02 -0.18 0.00 -1.78 0.00 0.00 34.13 32.03 1l1p s GLU 101 CO 0.55 -0.02 0.86 -0.07 -0.49 0.00 0.00 175.26 176.09 1l1p h LEU 102 N 7.77 -0.09 -9.66 1.80 3.38 -1.97 -3.40 115.31 113.15 1l1p h LEU 102 Ca -0.10 -0.53 -0.53 0.00 0.09 0.00 0.00 57.88 56.82 1l1p h LEU 102 Cb 1.17 0.02 0.04 0.00 0.09 0.00 0.00 40.66 41.98 1l1p h LEU 102 CO -0.18 0.57 0.74 -2.16 0.09 0.00 0.00 178.44 177.50 1l1p s PRO 103 N -3.12 4.31 -0.15 1.13 0.04 -1.26 -4.96 135.00 130.98 1l1p s PRO 103 Ca -0.14 2.19 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 1l1p s PRO 103 Cb -0.00 -3.17 -0.15 0.00 0.04 0.00 0.00 34.50 31.21 1l1p s PRO 103 CO 0.54 -0.41 0.30 0.93 0.04 0.00 0.00 177.00 178.40 1l1p h GLU 104 N 5.85 0.00 -3.60 4.56 4.39 -2.06 -3.42 114.58 120.30 1l1p h GLU 104 Ca -0.44 0.00 -0.72 0.00 0.34 0.00 0.00 59.36 58.54 1l1p h GLU 104 Cb 1.21 0.00 -0.33 0.00 -0.10 0.00 0.00 28.75 29.53 1l1p h GLU 104 CO 0.82 0.65 -0.20 -0.51 -1.16 0.00 0.00 179.01 178.61 1l1p s LEU 105 N -8.17 5.69 0.00 1.33 1.43 -1.26 -5.24 118.68 112.46 1l1p s LEU 105 Ca -0.18 -2.93 0.00 0.00 -1.03 0.00 0.00 54.13 49.99 1l1p s LEU 105 Cb 0.01 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1l1p s LEU 105 CO 0.45 -0.40 0.00 0.41 0.23 0.00 0.00 176.35 177.05