#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 -2.71 -3.32 1.61 2.88 -1.26 -5.08 113.62 105.74 1l1p n SER 2 Ca 0.00 1.35 -0.19 0.00 -1.33 0.00 0.00 58.87 58.71 1l1p n SER 2 Cb 0.00 -5.23 -0.07 0.00 -0.75 0.00 0.00 64.21 58.16 1l1p n SER 2 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1l1p s HIS 3 N -0.96 1.66 -0.41 0.66 4.02 -1.26 -5.12 115.29 113.88 1l1p s HIS 3 Ca -0.20 -1.61 0.06 0.00 1.02 0.00 0.00 55.06 54.33 1l1p s HIS 3 Cb 0.01 -0.61 0.21 0.00 -1.02 0.00 0.00 32.58 31.17 1l1p s HIS 3 CO 0.78 -0.92 0.46 0.00 1.02 0.00 0.00 174.74 176.08 1l1p n MET 4 N -0.62 0.46 -0.12 1.40 -0.00 -1.26 -4.96 117.12 112.03 1l1p n MET 4 Ca 0.06 -3.08 -0.22 0.00 -0.00 0.00 0.00 57.70 54.46 1l1p n MET 4 Cb 0.62 -1.44 -0.09 0.00 -0.00 0.00 0.00 33.22 32.31 1l1p n MET 4 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 1l1p n GLN 5 N 2.15 0.56 -3.08 3.17 7.27 -1.26 -4.96 117.38 121.22 1l1p n GLN 5 Ca 0.25 0.38 -0.34 0.00 0.07 0.00 0.00 57.00 57.36 1l1p n GLN 5 Cb 0.51 -1.59 -0.06 0.00 2.41 0.00 0.00 30.24 31.51 1l1p n GLN 5 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1l1p s ALA 6 N -2.53 3.32 -0.03 1.69 0.00 -1.26 -5.08 121.76 117.87 1l1p s ALA 6 Ca -0.32 0.13 0.06 0.00 0.00 0.00 0.00 51.96 51.83 1l1p s ALA 6 Cb 0.09 -2.83 -0.02 0.00 0.00 0.00 0.00 23.12 20.36 1l1p s ALA 6 CO 0.49 0.31 -0.22 0.99 0.00 0.00 0.00 175.76 177.33 1l1p s THR 7 N -1.84 2.43 0.07 0.00 2.01 -1.26 -5.13 115.64 111.91 1l1p s THR 7 Ca 0.51 -0.96 -0.04 0.00 0.31 0.00 0.00 61.69 61.50 1l1p s THR 7 Cb -0.12 -1.89 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 1l1p s THR 7 CO 0.18 0.58 0.07 0.26 -0.69 0.00 0.00 174.62 175.03 1l1p s TRP 8 N -0.63 0.36 0.00 4.92 0.52 -1.26 -4.79 118.94 118.06 1l1p s TRP 8 Ca 0.10 -0.86 0.17 0.00 0.02 0.00 0.00 56.10 55.53 1l1p s TRP 8 Cb -0.10 -0.24 0.27 0.00 -1.15 0.00 0.00 33.47 32.25 1l1p s TRP 8 CO -0.00 -0.46 1.11 0.36 0.02 0.00 0.00 176.95 177.98 1l1p n LYS 9 N 0.03 0.00 -1.87 4.98 2.85 -1.26 -5.03 118.16 117.85 1l1p n LYS 9 Ca -0.14 -1.63 -0.41 0.00 -1.05 0.00 0.00 58.31 55.07 1l1p n LYS 9 Cb 0.62 0.18 -0.01 0.00 -0.65 0.00 0.00 35.03 35.16 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1l1p s GLU 10 N 0.00 4.18 0.00 -1.58 2.02 -1.23 -4.72 118.70 117.36 1l1p s GLU 10 Ca 0.22 2.48 0.00 0.00 0.02 0.00 0.00 54.97 57.68 1l1p s GLU 10 Cb 0.25 -3.03 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1l1p s GLU 10 CO -0.11 -0.51 0.00 1.63 0.02 0.00 0.00 175.26 176.29 1l1p n LYS 11 N 1.65 1.42 -0.22 1.61 5.02 -1.15 -4.64 118.16 121.85 1l1p n LYS 11 Ca 0.05 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.39 1l1p n LYS 11 Cb 0.39 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.47 1l1p n LYS 11 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1l1p n ASP 12 N 0.00 1.32 -0.07 4.39 8.00 -1.26 -4.27 116.55 124.66 1l1p n ASP 12 Ca 0.00 -2.49 0.00 0.00 0.71 0.00 0.00 54.79 53.01 1l1p n ASP 12 Cb 0.00 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l1p n GLY 13 N -0.76 2.73 0.22 0.44 0.00 -1.26 -5.01 105.19 101.56 1l1p n GLY 13 Ca 0.08 -2.04 -0.02 0.00 0.00 0.00 0.00 46.02 44.04 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 -0.22 -1.75 4.61 0.00 -1.26 -4.22 120.51 114.66 1l1p n ALA 14 Ca 0.00 -0.10 -0.35 0.00 0.00 0.00 0.00 53.44 52.98 1l1p n ALA 14 Cb 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 19.45 19.46 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 -1.13 2.95 0.15 0.00 0.11 0.16 -4.52 120.40 118.11 1l1p s VAL 15 Ca 0.05 0.58 0.01 0.00 -2.93 0.00 0.00 61.98 59.69 1l1p s VAL 15 Cb -0.00 -3.23 -0.04 0.00 -1.53 0.00 0.00 36.38 31.57 1l1p s VAL 15 CO 0.04 -0.13 0.01 -1.61 -3.33 0.00 0.00 175.10 170.07 1l1p s GLU 16 N -3.33 1.02 0.00 1.54 2.02 -1.26 -5.02 118.70 113.66 1l1p s GLU 16 Ca 0.74 -1.48 0.00 0.00 0.02 0.00 0.00 54.97 54.26 1l1p s GLU 16 Cb -0.26 -0.13 0.00 0.00 0.10 0.00 0.00 34.13 33.84 1l1p s GLU 16 CO 0.30 -0.15 0.03 0.00 0.02 0.00 0.00 175.26 175.46 1l1p n ALA 17 N -0.17 0.00 -3.39 5.21 0.00 -1.26 -1.78 120.51 119.12 1l1p n ALA 17 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.08 1l1p n ALA 17 Cb 0.63 0.01 -0.07 0.00 0.00 0.00 0.00 19.45 20.02 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 -1.54 2.71 -1.48 0.00 -0.58 -1.22 -4.37 120.64 114.15 1l1p n GLU 18 Ca 0.00 -4.66 -0.05 0.00 -0.42 0.00 0.00 57.16 52.03 1l1p n GLU 18 Cb 0.00 -2.28 0.02 0.00 -0.57 0.00 0.00 31.44 28.60 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1l1p n ASP 19 N 0.91 0.52 -3.60 1.62 9.92 -0.73 -4.43 116.55 120.76 1l1p n ASP 19 Ca 0.29 -1.37 -0.20 0.00 -0.53 0.00 0.00 54.79 52.99 1l1p n ASP 19 Cb 0.40 -0.10 -0.15 0.00 -0.64 0.00 0.00 41.12 40.63 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1l1p s ARG 20 N -2.63 0.08 0.52 -1.24 1.81 -1.17 0.21 118.95 116.53 1l1p s ARG 20 Ca 0.14 0.26 0.02 0.00 -1.72 0.00 0.00 55.73 54.44 1l1p s ARG 20 Cb -0.01 -0.99 0.03 0.00 -0.45 0.00 0.00 34.95 33.52 1l1p s ARG 20 CO 0.09 -0.51 0.74 0.14 -0.68 0.00 0.00 175.30 175.08 1l1p s VAL 21 N 2.25 2.92 -0.22 3.52 -7.23 0.23 -3.36 120.40 118.50 1l1p s VAL 21 Ca 0.04 -0.67 0.02 0.00 -1.81 0.00 0.00 61.98 59.55 1l1p s VAL 21 Cb -0.14 -3.08 0.05 0.00 0.56 0.00 0.00 36.38 33.76 1l1p s VAL 21 CO -0.08 -0.05 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.64 1l1p s THR 22 N -2.68 1.91 0.10 5.32 2.01 0.23 -0.55 115.64 121.96 1l1p s THR 22 Ca 0.56 -1.24 0.04 0.00 0.31 0.00 0.00 61.69 61.36 1l1p s THR 22 Cb -0.10 -1.95 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 1l1p s THR 22 CO 0.38 0.15 -0.11 0.27 -0.69 0.00 0.00 174.62 174.62 1l1p s ILE 23 N 1.27 0.99 -0.14 1.82 -0.00 0.11 -0.56 121.20 124.68 1l1p s ILE 23 Ca -0.03 -1.59 0.03 0.00 -0.00 0.00 0.00 60.65 59.05 1l1p s ILE 23 Cb -0.17 -1.32 0.01 0.00 -0.00 0.00 0.00 42.46 40.98 1l1p s ILE 23 CO -0.08 -0.50 -0.22 1.51 -0.00 0.00 0.00 174.94 175.65 1l1p s ASP 24 N -2.34 3.09 0.19 4.36 -4.77 -0.76 0.11 116.67 116.56 1l1p s ASP 24 Ca 0.04 -0.60 -0.03 0.00 -3.30 0.00 0.00 52.55 48.66 1l1p s ASP 24 Cb -0.04 -1.44 -0.03 0.00 -1.09 0.00 0.00 42.92 40.32 1l1p s ASP 24 CO 0.01 0.08 0.17 0.72 0.70 0.00 0.00 175.17 176.85 1l1p s PHE 25 N 0.81 0.95 -0.21 2.11 -0.12 0.28 0.41 117.98 122.19 1l1p s PHE 25 Ca -0.07 -1.22 -0.05 0.00 -0.05 0.00 0.00 56.93 55.54 1l1p s PHE 25 Cb -0.16 -0.41 0.11 0.00 -0.63 0.00 0.00 43.02 41.93 1l1p s PHE 25 CO -0.02 -0.67 0.38 0.99 -0.05 0.00 0.00 175.22 175.86 1l1p s THR 26 N -4.11 -0.61 0.26 -4.49 2.01 0.41 0.16 115.64 109.28 1l1p s THR 26 Ca 0.33 0.06 -0.18 0.00 0.31 0.00 0.00 61.69 62.20 1l1p s THR 26 Cb 0.06 -0.72 0.01 0.00 0.01 0.00 0.00 72.50 71.86 1l1p s THR 26 CO 0.09 -0.02 0.63 -0.83 -0.69 0.00 0.00 174.62 173.79 1l1p s GLY 27 N 2.56 0.13 0.39 4.40 0.00 0.17 -2.67 107.32 112.30 1l1p s GLY 27 Ca 0.06 -0.50 0.08 0.00 0.00 0.00 0.00 44.72 44.35 1l1p s GLY 27 CO -0.14 -0.28 0.25 -1.35 0.00 0.00 0.00 173.10 171.58 1l1p s SER 28 N -2.95 4.80 0.00 1.64 1.04 -0.59 -4.01 113.70 113.64 1l1p s SER 28 Ca 0.15 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1l1p s SER 28 Cb -0.04 -0.63 0.00 0.00 0.10 0.00 0.00 66.02 65.45 1l1p s SER 28 CO 0.07 -0.50 0.00 0.52 0.98 0.00 0.00 173.24 174.32 1l1p n VAL 29 N -1.34 0.00 -1.36 5.02 0.31 -0.32 0.13 118.33 120.77 1l1p n VAL 29 Ca -0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.04 1l1p n VAL 29 Cb 0.62 -0.70 0.03 0.00 -0.91 0.00 0.00 33.84 32.88 1l1p n VAL 29 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1l1p n ASP 30 N -0.82 7.08 0.00 4.52 8.00 -1.26 -4.33 116.55 129.74 1l1p n ASP 30 Ca 0.00 -3.48 0.00 0.00 0.71 0.00 0.00 54.79 52.02 1l1p n ASP 30 Cb 0.00 -1.07 0.00 0.00 -0.02 0.00 0.00 41.12 40.03 1l1p n ASP 30 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l1p n GLY 31 N -0.12 0.93 3.06 0.44 0.00 -1.26 -5.03 105.19 103.20 1l1p n GLY 31 Ca 0.49 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.27 1l1p n GLY 31 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1l1p s GLU 32 N -0.84 1.66 -0.22 1.61 -1.05 -1.26 -4.94 118.70 113.65 1l1p s GLU 32 Ca 0.00 -0.46 -0.29 0.00 -0.15 0.00 0.00 54.97 54.07 1l1p s GLU 32 Cb 0.00 -1.40 -0.02 0.00 -0.44 0.00 0.00 34.13 32.27 1l1p s GLU 32 CO 0.00 0.10 1.42 -1.21 0.95 0.00 0.00 175.26 176.52 1l1p s GLU 33 N 0.42 3.97 0.00 -4.83 2.02 -1.26 -1.17 118.70 117.85 1l1p s GLU 33 Ca -0.10 1.55 0.00 0.00 0.02 0.00 0.00 54.97 56.44 1l1p s GLU 33 Cb -0.14 -3.91 0.00 0.00 0.10 0.00 0.00 34.13 30.18 1l1p s GLU 33 CO 0.03 -1.06 0.00 1.97 0.02 0.00 0.00 175.26 176.22 1l1p n PHE 34 N 7.62 0.00 0.13 1.61 -1.74 -1.26 -4.76 117.46 119.06 1l1p n PHE 34 Ca 0.16 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.93 1l1p n PHE 34 Cb 0.45 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.38 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 -0.37 -0.36 3.97 5.08 -1.96 -3.13 114.58 117.80 1l1p h GLU 35 Ca 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1l1p h GLU 35 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1l1p h GLU 35 CO 0.00 -0.03 0.00 0.41 -1.00 0.00 0.00 179.01 178.39 1l1p n GLY 36 N 0.12 -0.02 0.00 -3.84 0.00 -1.26 -4.08 105.19 96.11 1l1p n GLY 36 Ca -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 0.36 -0.48 3.30 -0.02 0.00 -1.18 -4.38 105.19 102.78 1l1p n GLY 37 Ca 0.01 0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.95 0.36 0.03 1.61 -2.85 -1.26 0.46 119.74 115.15 1l1p s LYS 38 Ca -0.00 0.99 0.03 0.00 -1.00 0.00 0.00 55.97 56.00 1l1p s LYS 38 Cb 0.00 0.25 -0.02 0.00 -2.06 0.00 0.00 37.83 36.01 1l1p s LYS 38 CO 0.01 -0.22 -0.10 0.00 0.10 0.00 0.00 175.35 175.14 1l1p s ALA 39 N 2.27 0.77 0.01 0.59 0.00 0.42 -4.97 121.76 120.85 1l1p s ALA 39 Ca -0.04 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.19 1l1p s ALA 39 Cb -0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 1l1p s ALA 39 CO -0.13 0.10 -0.10 0.45 0.00 0.00 0.00 175.76 176.08 1l1p n SER 40 N 1.93 1.21 -3.96 0.00 2.88 -1.26 0.99 113.62 115.41 1l1p n SER 40 Ca -0.19 0.18 -0.41 0.00 -1.33 0.00 0.00 58.87 57.12 1l1p n SER 40 Cb 0.55 -0.41 -0.01 0.00 -0.75 0.00 0.00 64.21 63.60 1l1p n SER 40 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1l1p n ASP 41 N -3.69 5.94 -4.56 -3.46 8.00 -1.26 -2.60 116.55 114.92 1l1p n ASP 41 Ca -0.06 -3.38 -0.43 0.00 0.71 0.00 0.00 54.79 51.63 1l1p n ASP 41 Cb 0.22 -1.19 -0.05 0.00 -0.02 0.00 0.00 41.12 40.08 1l1p n ASP 41 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1l1p s PHE 42 N -2.60 3.04 -0.75 1.24 5.36 0.31 -4.86 117.98 119.73 1l1p s PHE 42 Ca 0.32 0.29 -0.21 0.00 -0.96 0.00 0.00 56.93 56.38 1l1p s PHE 42 Cb 0.05 -3.53 0.10 0.00 -0.34 0.00 0.00 43.02 39.30 1l1p s PHE 42 CO 0.07 -0.88 0.98 0.08 -1.46 0.00 0.00 175.22 174.01 1l1p s VAL 43 N 3.17 4.56 -0.01 3.12 1.01 -1.26 0.07 120.40 131.06 1l1p s VAL 43 Ca 0.30 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 1l1p s VAL 43 Cb -0.13 -4.69 -0.05 0.00 0.00 0.00 0.00 36.38 31.51 1l1p s VAL 43 CO 0.20 -1.42 0.58 -0.22 0.00 0.00 0.00 175.10 174.24 1l1p s LEU 44 N 3.31 4.42 -0.49 3.92 0.20 0.28 -4.88 118.68 125.44 1l1p s LEU 44 Ca 0.24 1.14 -0.16 0.00 0.69 0.00 0.00 54.13 56.04 1l1p s LEU 44 Cb -0.14 -2.89 0.08 0.00 -0.43 0.00 0.00 46.19 42.81 1l1p s LEU 44 CO 0.02 0.12 0.43 0.00 -0.29 0.00 0.00 176.35 176.63 1l1p s ALA 45 N -0.23 3.55 -1.10 5.97 0.00 -1.26 0.74 121.76 129.43 1l1p s ALA 45 Ca 0.30 -2.14 -0.23 0.00 0.00 0.00 0.00 51.96 49.90 1l1p s ALA 45 Cb -0.18 -3.13 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 1l1p s ALA 45 CO 0.17 -1.80 1.94 -1.33 0.00 0.00 0.00 175.76 174.74 1l1p n MET 46 N 5.31 1.44 0.00 0.00 2.81 0.57 -3.64 117.12 123.61 1l1p n MET 46 Ca -0.12 -2.30 0.00 0.00 -1.81 0.00 0.00 57.70 53.47 1l1p n MET 46 Cb 0.43 -3.61 0.00 0.00 -0.71 0.00 0.00 33.22 29.33 1l1p n MET 46 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1l1p n GLY 47 N 5.62 0.76 1.49 3.03 0.00 -1.26 -2.42 105.19 112.41 1l1p n GLY 47 Ca 0.45 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1l1p n GLY 47 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1l1p n GLN 48 N 0.00 0.00 -0.11 1.61 1.13 -1.24 -4.70 117.38 114.07 1l1p n GLN 48 Ca 0.00 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 54.89 1l1p n GLN 48 Cb 0.00 -0.09 -0.06 0.00 0.11 0.00 0.00 30.24 30.20 1l1p n GLN 48 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1l1p n GLY 49 N 2.55 -0.51 0.00 1.08 0.00 -1.26 -4.99 105.19 102.06 1l1p n GLY 49 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -4.38 0.00 -1.46 1.61 1.85 -1.26 -5.12 116.66 107.91 1l1p n ARG 50 Ca -0.31 0.00 -0.55 0.00 -1.00 0.00 0.00 57.85 55.99 1l1p n ARG 50 Cb 0.67 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.99 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 0.75 -1.20 2.89 1.56 -1.26 -4.91 117.12 114.96 1l1p n MET 51 Ca 0.00 0.23 -0.31 0.00 -0.27 0.00 0.00 57.70 57.35 1l1p n MET 51 Cb 0.00 -2.08 0.10 0.00 2.15 0.00 0.00 33.22 33.39 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 5.97 3.14 -0.04 1.12 -4.36 -1.26 -4.74 121.20 121.03 1l1p s ILE 52 Ca 1.10 0.38 0.25 0.00 -0.26 0.00 0.00 60.65 62.11 1l1p s ILE 52 Cb -1.11 -2.80 0.25 0.00 1.25 0.00 0.00 42.46 40.05 1l1p s ILE 52 CO 0.59 -0.48 1.75 1.55 0.24 0.00 0.00 174.94 178.59 1l1p h PRO 53 N -1.19 0.00 0.39 0.37 0.13 -1.92 -1.20 132.00 128.58 1l1p h PRO 53 Ca -0.44 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.68 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 0.50 0.00 -0.19 0.78 -0.23 0.00 0.00 178.00 178.86 1l1p h GLY 54 N 0.00 -0.55 0.89 1.56 0.00 -1.90 -2.88 103.07 100.19 1l1p h GLY 54 Ca 0.00 0.20 -0.12 0.00 0.00 0.00 0.00 47.33 47.41 1l1p h GLY 54 CO 0.00 -0.20 -0.36 0.74 0.00 0.00 0.00 176.54 176.72 1l1p h PHE 55 N -1.05 0.71 -0.09 5.60 0.04 -1.69 -2.91 116.94 117.55 1l1p h PHE 55 Ca -0.05 -0.26 0.03 0.00 2.80 0.00 0.00 57.97 60.48 1l1p h PHE 55 Cb 0.40 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 1l1p h PHE 55 CO 0.01 1.00 0.28 1.49 -0.60 0.00 0.00 178.31 180.49 1l1p h GLU 56 N 0.22 0.00 0.00 1.51 4.81 -1.37 0.15 114.58 119.89 1l1p h GLU 56 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1l1p h GLU 56 Cb 0.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1l1p h GLU 56 CO 0.08 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.89 1l1p n ASP 57 N -3.17 0.00 0.12 1.04 2.03 -1.09 -3.65 116.55 111.84 1l1p n ASP 57 Ca -0.00 0.21 -0.13 0.00 0.52 0.00 0.00 54.79 55.38 1l1p n ASP 57 Cb 0.36 -0.21 -0.08 0.00 -0.72 0.00 0.00 41.12 40.47 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 -0.31 -3.04 0.27 0.00 -1.51 -2.99 103.07 95.49 1l1p h GLY 58 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.39 1l1p h GLY 58 CO 0.00 -0.11 0.07 1.39 0.00 0.00 0.00 176.54 177.89 1l1p n ILE 59 N -5.10 2.09 -0.10 2.60 -0.00 0.51 -4.30 119.36 115.06 1l1p n ILE 59 Ca -0.09 -0.68 -0.06 0.00 -0.00 0.00 0.00 62.75 61.92 1l1p n ILE 59 Cb 0.22 -1.45 0.00 0.00 -0.00 0.00 0.00 39.64 38.42 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 1.04 -0.10 0.00 0.38 2.10 -1.52 -3.43 116.57 115.04 1l1p h LYS 60 Ca 0.05 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 1l1p h LYS 60 Cb 0.99 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.35 1l1p h LYS 60 CO 0.13 -0.07 0.00 0.41 -2.00 0.00 0.00 179.45 177.92 1l1p n GLY 61 N -1.35 0.82 0.00 0.07 0.00 -1.26 -4.81 105.19 98.66 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 -3.92 1.61 1.44 -1.26 0.36 115.22 113.46 1l1p n HIS 62 Ca 0.00 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.42 1l1p n HIS 62 Cb 0.00 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 29.98 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 -1.22 2.26 -0.63 -1.40 -0.14 -1.26 -4.97 119.74 112.38 1l1p s LYS 63 Ca 0.00 -3.02 -0.26 0.00 -1.36 0.00 0.00 55.97 51.33 1l1p s LYS 63 Cb 0.00 -3.39 -0.10 0.00 -1.68 0.00 0.00 37.83 32.66 1l1p s LYS 63 CO 0.00 -1.21 2.41 0.00 -0.76 0.00 0.00 175.35 175.79 1l1p s ALA 64 N -0.92 1.21 0.00 5.17 0.00 -1.25 -1.77 121.76 124.20 1l1p s ALA 64 Ca 0.21 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1l1p s ALA 64 Cb -0.14 -4.45 0.00 0.00 0.00 0.00 0.00 23.12 18.53 1l1p s ALA 64 CO -0.09 -5.11 0.00 0.41 0.00 0.00 0.00 175.76 170.97 1l1p n GLY 65 N 6.36 1.32 3.99 0.00 0.00 0.58 -4.80 105.19 112.65 1l1p n GLY 65 Ca 0.41 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.24 2.85 -0.23 1.61 2.56 0.18 -4.84 118.70 120.59 1l1p s GLU 66 Ca 0.00 -1.03 -0.03 0.00 0.00 0.00 0.00 54.97 53.91 1l1p s GLU 66 Cb 0.00 -2.70 0.07 0.00 2.00 0.00 0.00 34.13 33.51 1l1p s GLU 66 CO 0.00 -0.29 0.07 -1.83 -0.56 0.00 0.00 175.26 172.65 1l1p s GLU 67 N -4.42 0.52 0.16 4.30 -1.05 -1.26 0.78 118.70 117.73 1l1p s GLU 67 Ca 0.53 -0.52 -0.01 0.00 -0.15 0.00 0.00 54.97 54.81 1l1p s GLU 67 Cb -0.10 -1.91 -0.04 0.00 -0.44 0.00 0.00 34.13 31.64 1l1p s GLU 67 CO 0.34 -0.77 0.09 -0.59 0.95 0.00 0.00 175.26 175.29 1l1p s PHE 68 N 1.88 0.95 -0.11 4.83 -0.12 0.49 -4.95 117.98 120.95 1l1p s PHE 68 Ca 0.03 -1.26 0.02 0.00 -0.05 0.00 0.00 56.93 55.66 1l1p s PHE 68 Cb -0.17 -0.49 0.02 0.00 -0.63 0.00 0.00 43.02 41.75 1l1p s PHE 68 CO -0.16 -0.57 -0.15 0.99 -0.05 0.00 0.00 175.22 175.28 1l1p s THR 69 N -4.08 1.50 0.22 -4.49 2.01 -1.26 0.16 115.64 109.68 1l1p s THR 69 Ca 0.29 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.68 1l1p s THR 69 Cb 0.07 -1.37 -0.05 0.00 0.01 0.00 0.00 72.50 71.16 1l1p s THR 69 CO 0.05 0.44 0.03 0.27 -0.69 0.00 0.00 174.62 174.72 1l1p s ILE 70 N 1.05 0.77 0.17 1.82 -0.00 -0.08 -4.94 121.20 119.99 1l1p s ILE 70 Ca -0.05 -2.00 -0.06 0.00 -0.00 0.00 0.00 60.65 58.54 1l1p s ILE 70 Cb -0.15 -2.34 -0.06 0.00 -0.00 0.00 0.00 42.46 39.92 1l1p s ILE 70 CO -0.03 -0.29 0.42 1.51 -0.00 0.00 0.00 174.94 176.55 1l1p s ASP 71 N -3.26 6.51 -0.08 4.36 1.47 -1.26 -1.61 116.67 122.79 1l1p s ASP 71 Ca 0.29 0.65 -0.05 0.00 1.18 0.00 0.00 52.55 54.63 1l1p s ASP 71 Cb 0.06 -2.12 0.04 0.00 -0.34 0.00 0.00 42.92 40.57 1l1p s ASP 71 CO 0.08 0.01 0.20 0.68 0.68 0.00 0.00 175.17 176.82 1l1p s VAL 72 N -1.72 -0.04 -0.17 2.11 -7.23 -0.39 -3.81 120.40 109.15 1l1p s VAL 72 Ca 0.42 0.13 -0.07 0.00 -1.81 0.00 0.00 61.98 60.66 1l1p s VAL 72 Cb -0.12 -0.31 0.08 0.00 0.56 0.00 0.00 36.38 36.59 1l1p s VAL 72 CO 0.24 0.05 0.37 -0.89 -0.31 0.00 0.00 175.10 174.57 1l1p s THR 73 N 1.02 -0.46 -0.03 5.32 2.01 -1.26 0.59 115.64 122.83 1l1p s THR 73 Ca -0.08 0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.86 1l1p s THR 73 Cb -0.09 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 1l1p s THR 73 CO -0.06 0.08 0.75 -0.36 -0.69 0.00 0.00 174.62 174.33 1l1p s PHE 74 N 2.31 3.63 1.21 4.92 0.40 -1.14 -4.90 117.98 124.40 1l1p s PHE 74 Ca -0.03 1.36 -0.20 0.00 -0.60 0.00 0.00 56.93 57.46 1l1p s PHE 74 Cb -0.11 -2.84 0.30 0.00 0.51 0.00 0.00 43.02 40.88 1l1p s PHE 74 CO -0.11 0.13 0.96 -0.35 0.70 0.00 0.00 175.22 176.54 1l1p n PRO 75 N 3.54 -3.49 0.00 0.24 -0.04 -1.26 -4.06 135.00 129.93 1l1p n PRO 75 Ca -0.01 -1.55 0.12 0.00 -0.04 0.00 0.00 63.50 62.02 1l1p n PRO 75 Cb 0.51 -1.59 0.53 0.00 -0.04 0.00 0.00 33.50 32.91 1l1p n PRO 75 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1l1p n GLU 76 N -4.88 0.04 -0.01 0.54 2.13 -1.26 -3.09 120.64 114.10 1l1p n GLU 76 Ca 0.14 0.08 -0.07 0.00 0.66 0.00 0.00 57.16 57.96 1l1p n GLU 76 Cb 0.55 -1.50 -0.13 0.00 0.27 0.00 0.00 31.44 30.63 1l1p n GLU 76 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1l1p h GLU 77 N 0.00 0.00 0.00 5.31 4.11 -2.03 -3.40 114.58 118.56 1l1p h GLU 77 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1l1p h GLU 77 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1l1p h GLU 77 CO 0.00 0.47 0.00 0.98 0.07 0.00 0.00 179.01 180.53 1l1p n TYR 78 N -3.03 0.00 -3.46 2.06 4.19 -1.18 -4.95 117.16 110.80 1l1p n TYR 78 Ca -0.15 0.00 -0.21 0.00 3.31 0.00 0.00 57.90 60.85 1l1p n TYR 78 Cb 1.01 -0.49 0.00 0.00 0.49 0.00 0.00 39.34 40.35 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 -1.98 -1.63 -2.85 2.98 8.25 -1.23 -4.91 115.22 113.84 1l1p n HIS 79 Ca 0.00 0.67 -0.33 0.00 -0.26 0.00 0.00 57.72 57.81 1l1p n HIS 79 Cb 0.00 -2.05 -0.06 0.00 1.12 0.00 0.00 29.99 29.00 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 -2.59 3.13 0.54 -1.41 0.00 -1.26 -4.65 121.76 115.52 1l1p s ALA 80 Ca 0.03 0.26 0.31 0.00 0.00 0.00 0.00 51.96 52.56 1l1p s ALA 80 Cb -0.00 -3.03 1.48 0.00 0.00 0.00 0.00 23.12 21.56 1l1p s ALA 80 CO 0.70 0.13 1.90 0.93 0.00 0.00 0.00 175.76 179.42 1l1p h GLU 81 N 1.84 0.00 0.04 0.00 3.07 -1.97 1.13 114.58 118.69 1l1p h GLU 81 Ca -0.48 0.00 -0.36 0.00 -0.50 0.00 0.00 59.36 58.02 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.04 1l1p h GLU 81 CO 0.62 0.00 -2.17 0.27 -1.40 0.00 0.00 179.01 176.33 1l1p n ASN 82 N -4.27 1.44 -0.36 1.42 6.94 -1.26 -4.69 115.26 114.47 1l1p n ASN 82 Ca 0.18 0.10 0.02 0.00 -0.02 0.00 0.00 54.58 54.86 1l1p n ASN 82 Cb 0.93 -0.21 0.03 0.00 -2.36 0.00 0.00 39.78 38.16 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 -3.19 0.56 -3.03 -4.53 -0.00 -1.05 -5.00 117.00 100.76 1l1p n LEU 83 Ca -0.34 -1.42 -0.41 0.00 -0.00 0.00 0.00 56.01 53.85 1l1p n LEU 83 Cb 1.05 -0.10 -0.06 0.00 -0.00 0.00 0.00 43.42 44.32 1l1p n LEU 83 CO 0.38 0.34 0.49 2.29 -0.00 0.00 0.00 177.39 180.89 1l1p n LYS 84 N -0.33 0.00 -3.89 1.47 2.85 0.39 -1.17 118.16 117.48 1l1p n LYS 84 Ca 0.04 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 57.00 1l1p n LYS 84 Cb 0.66 -0.99 0.00 0.00 -0.65 0.00 0.00 35.03 34.05 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 1.48 -0.51 3.34 2.58 0.00 -1.26 -4.77 105.19 106.05 1l1p n GLY 85 Ca 0.15 0.26 -0.46 0.00 0.00 0.00 0.00 46.02 45.97 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 -6.46 3.47 -0.86 1.61 2.36 -0.32 -4.82 119.74 114.72 1l1p s LYS 86 Ca 0.19 -2.22 -0.24 0.00 -2.55 0.00 0.00 55.97 51.15 1l1p s LYS 86 Cb -0.07 -4.44 0.06 0.00 -1.05 0.00 0.00 37.83 32.33 1l1p s LYS 86 CO 0.89 -1.35 1.27 0.00 1.55 0.00 0.00 175.35 177.71 1l1p s ALA 87 N 0.73 2.88 0.21 3.13 0.00 -1.26 -2.90 121.76 124.56 1l1p s ALA 87 Ca 0.16 -1.99 0.03 0.00 0.00 0.00 0.00 51.96 50.16 1l1p s ALA 87 Cb -0.14 -4.27 -0.01 0.00 0.00 0.00 0.00 23.12 18.70 1l1p s ALA 87 CO -0.06 -3.29 0.10 0.00 0.00 0.00 0.00 175.76 172.50 1l1p n ALA 88 N 8.52 0.33 -2.34 0.00 0.00 0.20 -4.39 120.51 122.82 1l1p n ALA 88 Ca 0.16 -1.12 -0.30 0.00 0.00 0.00 0.00 53.44 52.19 1l1p n ALA 88 Cb 0.49 0.79 -0.16 0.00 0.00 0.00 0.00 19.45 20.57 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 -2.83 2.01 0.05 0.00 3.01 0.34 -1.26 119.74 121.06 1l1p s LYS 89 Ca 0.14 -0.88 0.02 0.00 -1.01 0.00 0.00 55.97 54.23 1l1p s LYS 89 Cb 0.01 -1.94 -0.03 0.00 -1.01 0.00 0.00 37.83 34.86 1l1p s LYS 89 CO 0.10 0.53 -0.07 -0.06 0.51 0.00 0.00 175.35 176.36 1l1p s PHE 90 N -0.58 0.67 -0.29 3.18 0.08 -0.64 -1.54 117.98 118.86 1l1p s PHE 90 Ca 0.09 -0.62 0.02 0.00 0.12 0.00 0.00 56.93 56.55 1l1p s PHE 90 Cb -0.10 -0.40 0.08 0.00 -0.57 0.00 0.00 43.02 42.04 1l1p s PHE 90 CO -0.01 -0.12 0.02 0.00 -0.10 0.00 0.00 175.22 175.00 1l1p s ALA 91 N -1.98 2.26 0.33 5.36 0.00 -1.09 -0.90 121.76 125.74 1l1p s ALA 91 Ca -0.05 -1.90 0.07 0.00 0.00 0.00 0.00 51.96 50.07 1l1p s ALA 91 Cb -0.06 -1.69 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1l1p s ALA 91 CO -0.01 -1.49 0.32 0.42 0.00 0.00 0.00 175.76 175.00 1l1p s ILE 92 N 1.24 3.77 -0.25 0.00 1.01 0.41 -0.45 121.20 126.94 1l1p s ILE 92 Ca 0.04 -1.29 -0.03 0.00 0.00 0.00 0.00 60.65 59.38 1l1p s ILE 92 Cb -0.19 -3.27 0.08 0.00 0.01 0.00 0.00 42.46 39.10 1l1p s ILE 92 CO -0.11 -0.19 0.08 0.20 0.00 0.00 0.00 174.94 174.92 1l1p s ASN 93 N -4.02 3.35 0.69 3.58 0.01 0.16 0.18 114.94 118.90 1l1p s ASN 93 Ca 0.41 -1.16 -0.16 0.00 -0.71 0.00 0.00 52.86 51.24 1l1p s ASN 93 Cb -0.07 -0.59 0.02 0.00 0.41 0.00 0.00 41.25 41.02 1l1p s ASN 93 CO 0.27 -0.37 1.19 -0.22 -1.51 0.00 0.00 177.10 176.46 1l1p s LEU 94 N 1.87 3.40 0.00 0.60 2.96 0.23 -1.82 118.68 125.92 1l1p s LEU 94 Ca 0.05 2.31 0.00 0.00 -0.22 0.00 0.00 54.13 56.27 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 -2.02 0.00 0.29 -1.32 0.00 0.00 176.35 173.10 1l1p n LYS 95 N -2.43 0.00 -2.32 1.98 4.76 0.27 0.50 118.16 120.92 1l1p n LYS 95 Ca 0.13 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.16 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 1.76 3.13 -0.36 1.97 3.01 -1.16 -3.22 119.74 124.87 1l1p s LYS 96 Ca 0.00 0.43 -0.05 0.00 -1.01 0.00 0.00 55.97 55.35 1l1p s LYS 96 Cb 0.00 -4.20 0.07 0.00 -1.01 0.00 0.00 37.83 32.69 1l1p s LYS 96 CO 0.00 -2.15 0.13 0.54 0.51 0.00 0.00 175.35 174.39 1l1p s VAL 97 N 6.73 3.51 0.29 3.17 0.11 -1.26 0.74 120.40 133.69 1l1p s VAL 97 Ca 0.54 -1.50 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 1l1p s VAL 97 Cb -0.11 -3.14 -0.01 0.00 -1.53 0.00 0.00 36.38 31.59 1l1p s VAL 97 CO 0.23 -0.36 0.05 -0.62 -3.33 0.00 0.00 175.10 171.07 1l1p n GLU 98 N 4.72 0.95 -3.58 1.54 1.02 -1.22 -4.36 120.64 119.72 1l1p n GLU 98 Ca -0.09 -2.25 -0.40 0.00 -0.02 0.00 0.00 57.16 54.40 1l1p n GLU 98 Cb 0.43 0.93 -0.06 0.00 -0.02 0.00 0.00 31.44 32.71 1l1p n GLU 98 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1l1p s GLU 99 N -3.06 3.06 1.03 3.49 2.12 -1.26 -3.03 118.70 121.05 1l1p s GLU 99 Ca 0.07 -2.68 -0.12 0.00 0.36 0.00 0.00 54.97 52.60 1l1p s GLU 99 Cb 0.00 -4.01 0.21 0.00 0.26 0.00 0.00 34.13 30.59 1l1p s GLU 99 CO 0.05 -1.23 1.08 -0.98 -0.54 0.00 0.00 175.26 173.64 1l1p s ARG 100 N -0.28 0.18 -0.38 4.30 1.70 -1.26 -2.95 118.95 120.25 1l1p s ARG 100 Ca 0.20 0.67 0.04 0.00 -0.47 0.00 0.00 55.73 56.17 1l1p s ARG 100 Cb -0.15 -1.69 0.31 0.00 -0.57 0.00 0.00 34.95 32.85 1l1p s ARG 100 CO -0.07 -2.94 1.26 -1.91 -1.08 0.00 0.00 175.30 170.56 1l1p n GLU 101 N -4.35 0.49 -2.48 3.89 2.13 -1.26 -4.70 120.64 114.36 1l1p n GLU 101 Ca 0.05 -1.20 -0.40 0.00 0.66 0.00 0.00 57.16 56.27 1l1p n GLU 101 Cb 0.56 -0.55 -0.04 0.00 0.27 0.00 0.00 31.44 31.68 1l1p n GLU 101 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1l1p s LEU 102 N -1.43 4.55 -0.26 4.31 1.02 -1.26 -4.82 118.68 120.79 1l1p s LEU 102 Ca 0.22 2.26 -0.29 0.00 0.02 0.00 0.00 54.13 56.34 1l1p s LEU 102 Cb 0.28 -3.63 -0.03 0.00 0.02 0.00 0.00 46.19 42.84 1l1p s LEU 102 CO -0.14 -0.15 1.71 -2.16 0.02 0.00 0.00 176.35 175.63 1l1p s PRO 103 N -1.37 3.61 -0.13 1.29 0.04 -1.26 -4.90 135.00 132.28 1l1p s PRO 103 Ca 0.45 1.61 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 1l1p s PRO 103 Cb -0.32 -4.11 -0.06 0.00 0.04 0.00 0.00 34.50 30.05 1l1p s PRO 103 CO 0.41 -1.52 0.05 0.93 0.04 0.00 0.00 177.00 176.91 1l1p h GLU 104 N 11.66 0.00 -5.49 4.56 4.39 -2.05 -3.45 114.58 124.19 1l1p h GLU 104 Ca -0.34 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.76 1l1p h GLU 104 Cb 1.16 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.71 1l1p h GLU 104 CO 1.01 0.21 -0.24 -0.51 -1.16 0.00 0.00 179.01 178.32 1l1p s LEU 105 N -8.35 4.20 0.00 1.33 2.01 -1.26 -5.35 118.68 111.27 1l1p s LEU 105 Ca -0.10 0.55 0.25 0.00 0.01 0.00 0.00 54.13 54.85 1l1p s LEU 105 Cb 0.01 -2.49 0.51 0.00 0.01 0.00 0.00 46.19 44.23 1l1p s LEU 105 CO 0.20 -0.00 1.44 0.41 1.01 0.00 0.00 176.35 179.41