#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 5.93 -0.15 1.61 1.04 -1.26 -4.89 113.70 115.97 1l1p s SER 2 Ca 0.00 -1.69 0.05 0.00 0.48 0.00 0.00 55.95 54.79 1l1p s SER 2 Cb 0.00 -2.10 -0.23 0.00 0.10 0.00 0.00 66.02 63.79 1l1p s SER 2 CO 0.00 -0.71 0.23 0.00 0.98 0.00 0.00 173.24 173.75 1l1p n HIS 3 N 5.07 0.66 -3.33 5.02 -0.00 -1.26 -4.91 115.22 116.48 1l1p n HIS 3 Ca -0.11 0.17 -0.05 0.00 -0.00 0.00 0.00 57.72 57.73 1l1p n HIS 3 Cb 0.41 -1.10 -0.06 0.00 -0.00 0.00 0.00 29.99 29.25 1l1p n HIS 3 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 1l1p s MET 4 N -2.55 0.42 0.00 -1.40 -2.45 -1.26 -5.13 119.30 106.93 1l1p s MET 4 Ca -0.19 0.74 -0.30 0.00 -1.25 0.00 0.00 55.69 54.69 1l1p s MET 4 Cb 0.07 -0.07 -0.06 0.00 1.25 0.00 0.00 34.83 36.03 1l1p s MET 4 CO 0.75 -0.59 1.41 1.14 1.05 0.00 0.00 175.02 178.78 1l1p s GLN 5 N 2.65 4.28 0.17 4.11 -2.07 -1.26 -5.00 119.66 122.54 1l1p s GLN 5 Ca 0.13 1.98 -0.20 0.00 -1.82 0.00 0.00 55.36 55.44 1l1p s GLN 5 Cb -0.15 -3.58 -0.08 0.00 -1.09 0.00 0.00 33.01 28.12 1l1p s GLN 5 CO -0.17 -0.58 0.69 0.00 -1.32 0.00 0.00 175.29 173.90 1l1p s ALA 6 N 2.42 3.48 0.11 2.60 0.00 -1.26 -5.08 121.76 124.03 1l1p s ALA 6 Ca 0.64 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.80 1l1p s ALA 6 Cb -0.32 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 1l1p s ALA 6 CO 0.27 0.35 -0.11 -0.08 0.00 0.00 0.00 175.76 176.18 1l1p s THR 7 N -1.34 1.07 0.31 0.00 -1.32 -1.26 -5.17 115.64 107.93 1l1p s THR 7 Ca 0.38 -1.77 0.05 0.00 -1.21 0.00 0.00 61.69 59.13 1l1p s THR 7 Cb -0.19 -1.53 -0.03 0.00 -1.51 0.00 0.00 72.50 69.24 1l1p s THR 7 CO 0.22 -0.59 0.22 0.26 -2.21 0.00 0.00 174.62 172.52 1l1p s TRP 8 N -2.64 1.62 0.00 9.09 0.52 -1.26 -5.03 118.94 121.24 1l1p s TRP 8 Ca 0.09 -1.54 0.00 0.00 0.02 0.00 0.00 56.10 54.67 1l1p s TRP 8 Cb -0.02 -0.73 0.00 0.00 -1.15 0.00 0.00 33.47 31.57 1l1p s TRP 8 CO 0.01 -0.74 0.80 1.63 0.02 0.00 0.00 176.95 178.67 1l1p n LYS 9 N -0.56 0.00 -2.16 4.98 4.76 -1.26 -5.03 118.16 118.88 1l1p n LYS 9 Ca 0.05 -0.80 -0.41 0.00 -2.87 0.00 0.00 58.31 54.28 1l1p n LYS 9 Cb 0.64 -0.50 -0.03 0.00 -1.84 0.00 0.00 35.03 33.30 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1l1p s GLU 10 N 0.00 4.35 0.00 1.97 -1.05 -1.23 -4.44 118.70 118.30 1l1p s GLU 10 Ca 0.00 2.12 0.00 0.00 -0.15 0.00 0.00 54.97 56.94 1l1p s GLU 10 Cb 0.00 -3.18 0.00 0.00 -0.44 0.00 0.00 34.13 30.51 1l1p s GLU 10 CO 0.00 -0.31 0.00 1.63 0.95 0.00 0.00 175.26 177.53 1l1p n LYS 11 N 2.67 2.15 -0.56 -4.83 5.02 -1.18 -4.65 118.16 116.79 1l1p n LYS 11 Ca 0.07 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.38 1l1p n LYS 11 Cb 0.42 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.46 1l1p n LYS 11 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1l1p n ASP 12 N 0.00 0.58 0.00 4.39 5.68 -1.26 -4.38 116.55 121.56 1l1p n ASP 12 Ca 0.00 -2.25 0.00 0.00 -0.50 0.00 0.00 54.79 52.04 1l1p n ASP 12 Cb 0.00 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1l1p n GLY 13 N -0.22 2.75 1.48 6.12 0.00 -1.26 -5.00 105.19 109.07 1l1p n GLY 13 Ca 0.04 -2.03 -0.13 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.51 -1.77 4.61 0.00 -1.26 -4.25 120.51 113.33 1l1p n ALA 14 Ca 0.00 -0.69 -0.36 0.00 0.00 0.00 0.00 53.44 52.39 1l1p n ALA 14 Cb 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 19.45 19.41 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 -1.82 2.95 0.18 0.00 0.11 0.17 -4.49 120.40 117.50 1l1p s VAL 15 Ca 0.30 0.60 0.01 0.00 -2.93 0.00 0.00 61.98 59.96 1l1p s VAL 15 Cb -0.03 -3.25 -0.04 0.00 -1.53 0.00 0.00 36.38 31.52 1l1p s VAL 15 CO 0.23 -0.11 0.04 -1.61 -3.33 0.00 0.00 175.10 170.31 1l1p s GLU 16 N -3.24 1.11 0.00 1.54 2.02 -1.26 -5.02 118.70 113.85 1l1p s GLU 16 Ca 0.74 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 54.18 1l1p s GLU 16 Cb -0.27 -0.11 0.00 0.00 0.10 0.00 0.00 34.13 33.85 1l1p s GLU 16 CO 0.30 -0.20 0.03 0.00 0.02 0.00 0.00 175.26 175.41 1l1p n ALA 17 N -0.24 0.00 -3.46 5.21 0.00 -1.26 -2.00 120.51 118.76 1l1p n ALA 17 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.10 1l1p n ALA 17 Cb 0.64 0.02 -0.08 0.00 0.00 0.00 0.00 19.45 20.03 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 -1.37 2.62 -1.44 0.00 1.02 -1.23 -4.40 120.64 115.83 1l1p n GLU 18 Ca 0.00 -4.64 -0.04 0.00 -0.02 0.00 0.00 57.16 52.46 1l1p n GLU 18 Cb 0.00 -2.29 0.02 0.00 -0.02 0.00 0.00 31.44 29.15 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1l1p n ASP 19 N 1.07 0.48 -3.60 1.62 9.92 -0.85 -4.41 116.55 120.77 1l1p n ASP 19 Ca 0.28 -1.35 -0.21 0.00 -0.53 0.00 0.00 54.79 52.98 1l1p n ASP 19 Cb 0.39 -0.10 -0.16 0.00 -0.64 0.00 0.00 41.12 40.62 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1l1p s ARG 20 N -2.60 0.06 0.46 -1.24 6.06 -0.98 0.22 118.95 120.93 1l1p s ARG 20 Ca 0.14 0.20 0.02 0.00 -2.50 0.00 0.00 55.73 53.58 1l1p s ARG 20 Cb -0.01 -1.14 0.00 0.00 0.06 0.00 0.00 34.95 33.86 1l1p s ARG 20 CO 0.09 -0.54 0.67 0.14 -2.50 0.00 0.00 175.30 173.16 1l1p s VAL 21 N 2.22 3.68 -0.24 7.11 -7.23 0.21 -3.18 120.40 122.97 1l1p s VAL 21 Ca 0.04 -0.61 0.02 0.00 -1.81 0.00 0.00 61.98 59.62 1l1p s VAL 21 Cb -0.14 -3.35 0.05 0.00 0.56 0.00 0.00 36.38 33.49 1l1p s VAL 21 CO -0.08 -0.23 -0.12 -0.89 -0.31 0.00 0.00 175.10 173.47 1l1p s THR 22 N -2.55 2.25 0.14 5.32 2.01 0.25 -0.62 115.64 122.44 1l1p s THR 22 Ca 0.50 -1.40 0.05 0.00 0.31 0.00 0.00 61.69 61.16 1l1p s THR 22 Cb -0.10 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 1l1p s THR 22 CO 0.37 0.13 -0.12 0.27 -0.69 0.00 0.00 174.62 174.57 1l1p s ILE 23 N 1.18 1.28 -0.11 1.82 -4.36 0.53 -0.15 121.20 121.38 1l1p s ILE 23 Ca -0.05 -1.89 0.02 0.00 -0.26 0.00 0.00 60.65 58.47 1l1p s ILE 23 Cb -0.18 -1.68 0.01 0.00 1.25 0.00 0.00 42.46 41.86 1l1p s ILE 23 CO -0.07 -0.57 -0.15 1.51 0.24 0.00 0.00 174.94 175.90 1l1p s ASP 24 N -2.81 2.46 0.17 4.36 -4.77 -0.66 0.13 116.67 115.56 1l1p s ASP 24 Ca 0.13 -0.43 -0.03 0.00 -3.30 0.00 0.00 52.55 48.92 1l1p s ASP 24 Cb -0.02 -1.10 -0.03 0.00 -1.09 0.00 0.00 42.92 40.68 1l1p s ASP 24 CO 0.02 0.01 0.14 0.72 0.70 0.00 0.00 175.17 176.77 1l1p s PHE 25 N 1.00 0.91 -0.16 2.11 -0.12 0.30 0.41 117.98 122.44 1l1p s PHE 25 Ca -0.06 -1.22 -0.04 0.00 -0.05 0.00 0.00 56.93 55.56 1l1p s PHE 25 Cb -0.15 -0.42 0.08 0.00 -0.63 0.00 0.00 43.02 41.90 1l1p s PHE 25 CO -0.02 -0.63 0.26 0.99 -0.05 0.00 0.00 175.22 175.77 1l1p s THR 26 N -4.09 -0.41 0.17 -4.49 2.01 0.09 0.13 115.64 109.05 1l1p s THR 26 Ca 0.30 0.15 -0.24 0.00 0.31 0.00 0.00 61.69 62.21 1l1p s THR 26 Cb 0.06 -0.54 0.06 0.00 0.01 0.00 0.00 72.50 72.10 1l1p s THR 26 CO 0.07 0.01 0.77 -0.83 -0.69 0.00 0.00 174.62 173.95 1l1p s GLY 27 N 2.40 -0.34 0.49 4.40 0.00 0.11 -2.43 107.32 111.96 1l1p s GLY 27 Ca 0.04 0.26 0.06 0.00 0.00 0.00 0.00 44.72 45.08 1l1p s GLY 27 CO -0.10 0.08 0.35 -0.56 0.00 0.00 0.00 173.10 172.87 1l1p s SER 28 N -2.80 4.67 0.00 1.64 0.01 -0.78 -4.01 113.70 112.43 1l1p s SER 28 Ca 0.07 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 56.22 1l1p s SER 28 Cb -0.03 0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1l1p s SER 28 CO -0.03 -0.90 0.00 0.55 0.41 0.00 0.00 173.24 173.27 1l1p n VAL 29 N -1.61 0.00 -0.89 3.43 3.14 -1.24 0.41 118.33 121.57 1l1p n VAL 29 Ca -0.01 0.14 -0.22 0.00 -2.96 0.00 0.00 64.34 61.29 1l1p n VAL 29 Cb 0.64 -1.04 0.11 0.00 -1.06 0.00 0.00 33.84 32.49 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 -2.06 4.85 0.00 6.55 2.03 -1.26 -4.62 116.55 122.03 1l1p n ASP 30 Ca 0.00 -3.34 0.00 0.00 0.52 0.00 0.00 54.79 51.97 1l1p n ASP 30 Cb 0.00 -0.85 0.00 0.00 -0.72 0.00 0.00 41.12 39.55 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 -0.65 0.54 2.81 0.27 0.00 -1.26 -5.03 105.19 101.88 1l1p n GLY 31 Ca 0.48 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.82 1.00 -0.07 1.61 2.02 -1.26 -4.97 118.70 116.21 1l1p s GLU 32 Ca 0.00 -0.36 -0.32 0.00 0.02 0.00 0.00 54.97 54.30 1l1p s GLU 32 Cb 0.00 -1.84 -0.10 0.00 0.10 0.00 0.00 34.13 32.29 1l1p s GLU 32 CO 0.00 -0.48 1.95 -0.85 0.02 0.00 0.00 175.26 175.90 1l1p n GLU 33 N 4.99 2.36 0.00 1.61 0.28 -1.26 -3.71 120.64 124.91 1l1p n GLU 33 Ca -0.10 0.85 0.00 0.00 -0.16 0.00 0.00 57.16 57.75 1l1p n GLU 33 Cb 0.48 -2.81 0.00 0.00 1.43 0.00 0.00 31.44 30.54 1l1p n GLU 33 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1l1p n PHE 34 N 7.47 0.00 0.17 -1.84 -1.74 -1.26 -4.75 117.46 115.50 1l1p n PHE 34 Ca 0.23 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 57.01 1l1p n PHE 34 Cb 0.34 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.28 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 -0.46 -0.13 3.97 5.08 -1.96 -3.13 114.58 117.94 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 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1l1p h GLU 35 CO 0.00 -0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.26 1l1p n GLY 36 N 0.09 -0.66 0.04 -3.84 0.00 -1.26 -4.01 105.19 95.55 1l1p n GLY 36 Ca -0.09 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.96 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 0.43 -0.54 3.15 -0.02 0.00 -1.18 -4.32 105.19 102.70 1l1p n GLY 37 Ca 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 1l1p n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1l1p s LYS 38 N -3.04 0.25 0.02 1.61 2.20 -1.26 0.09 119.74 119.61 1l1p s LYS 38 Ca -0.00 0.87 0.03 0.00 -0.36 0.00 0.00 55.97 56.51 1l1p s LYS 38 Cb 0.01 0.13 -0.02 0.00 -1.51 0.00 0.00 37.83 36.45 1l1p s LYS 38 CO 0.04 -0.25 -0.09 0.00 -0.36 0.00 0.00 175.35 174.68 1l1p s ALA 39 N 2.37 0.76 0.01 3.13 0.00 0.34 -4.97 121.76 123.40 1l1p s ALA 39 Ca -0.02 -0.60 -0.05 0.00 0.00 0.00 0.00 51.96 51.30 1l1p s ALA 39 Cb -0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 1l1p s ALA 39 CO -0.11 0.12 -0.10 0.43 0.00 0.00 0.00 175.76 176.10 1l1p n SER 40 N 2.18 1.22 -3.93 0.00 7.64 -1.26 0.11 113.62 119.58 1l1p n SER 40 Ca -0.17 0.18 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 1l1p n SER 40 Cb 0.56 -0.42 -0.00 0.00 -1.01 0.00 0.00 64.21 63.34 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 -3.70 6.01 -4.51 6.43 8.00 -1.25 -2.63 116.55 124.89 1l1p n ASP 41 Ca -0.06 -3.40 -0.43 0.00 0.71 0.00 0.00 54.79 51.61 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 -2.69 2.97 -0.79 1.24 5.36 0.36 -4.86 117.98 119.56 1l1p s PHE 42 Ca 0.32 -0.05 -0.22 0.00 -0.96 0.00 0.00 56.93 56.02 1l1p s PHE 42 Cb 0.06 -3.68 0.08 0.00 -0.34 0.00 0.00 43.02 39.13 1l1p s PHE 42 CO 0.08 -1.07 1.10 0.08 -1.46 0.00 0.00 175.22 173.95 1l1p s VAL 43 N 3.25 4.35 -0.03 3.12 1.01 -1.26 -0.34 120.40 130.50 1l1p s VAL 43 Ca 0.26 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 61.32 1l1p s VAL 43 Cb -0.14 -4.78 -0.05 0.00 0.00 0.00 0.00 36.38 31.42 1l1p s VAL 43 CO 0.19 -1.56 0.57 -0.22 0.00 0.00 0.00 175.10 174.08 1l1p s LEU 44 N 3.88 4.38 -0.51 3.92 0.20 0.21 -4.88 118.68 125.87 1l1p s LEU 44 Ca 0.29 1.08 -0.18 0.00 0.69 0.00 0.00 54.13 56.01 1l1p s LEU 44 Cb -0.10 -2.87 0.07 0.00 -0.43 0.00 0.00 46.19 42.86 1l1p s LEU 44 CO 0.02 0.07 0.58 0.00 -0.29 0.00 0.00 176.35 176.73 1l1p s ALA 45 N 0.01 3.44 -1.13 5.97 0.00 -1.26 0.65 121.76 129.44 1l1p s ALA 45 Ca 0.30 -1.93 -0.24 0.00 0.00 0.00 0.00 51.96 50.09 1l1p s ALA 45 Cb -0.17 -3.31 -0.11 0.00 0.00 0.00 0.00 23.12 19.53 1l1p s ALA 45 CO 0.16 -1.99 1.98 -1.64 0.00 0.00 0.00 175.76 174.27 1l1p s MET 46 N 2.36 2.21 0.00 0.00 -1.94 0.59 -3.71 119.30 118.81 1l1p s MET 46 Ca 0.11 -0.91 0.00 0.00 -1.71 0.00 0.00 55.69 53.18 1l1p s MET 46 Cb -0.22 -5.17 0.00 0.00 2.01 0.00 0.00 34.83 31.46 1l1p s MET 46 CO 0.09 -4.26 0.00 0.41 -0.01 0.00 0.00 175.02 171.26 1l1p n GLY 47 N 5.98 0.76 1.63 -0.03 0.00 -1.26 -2.38 105.19 109.89 1l1p n GLY 47 Ca 0.44 -0.68 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 -4.69 117.38 114.08 1l1p n GLN 48 Ca 0.00 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.90 1l1p n GLN 48 Cb 0.00 -0.09 -0.05 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 2.26 -0.51 2.65 1.08 0.00 -1.26 -4.99 105.19 104.42 1l1p n GLY 49 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 46.02 45.72 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 -4.39 0.04 -1.46 1.61 -4.01 -1.26 -5.11 116.66 102.07 1l1p n ARG 50 Ca -0.27 -0.55 -0.54 0.00 -1.04 0.00 0.00 57.85 55.44 1l1p n ARG 50 Cb 0.64 -0.06 -0.08 0.00 -3.04 0.00 0.00 32.46 29.92 1l1p n ARG 50 CO 0.00 0.00 0.00 -0.12 -3.04 0.00 0.00 177.63 174.47 1l1p n MET 51 N 1.26 0.86 -1.28 2.89 1.56 -1.26 -4.90 117.12 116.24 1l1p n MET 51 Ca -0.01 0.26 -0.32 0.00 -0.27 0.00 0.00 57.70 57.36 1l1p n MET 51 Cb 0.73 -2.17 0.09 0.00 2.15 0.00 0.00 33.22 34.03 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 6.15 3.09 0.65 1.12 -4.36 -1.26 -4.75 121.20 121.84 1l1p s ILE 52 Ca 1.09 0.39 0.38 0.00 -0.26 0.00 0.00 60.65 62.25 1l1p s ILE 52 Cb -1.05 -2.82 0.40 0.00 1.25 0.00 0.00 42.46 40.23 1l1p s ILE 52 CO 0.57 -0.43 2.24 1.55 0.24 0.00 0.00 174.94 179.11 1l1p h PRO 53 N -0.98 0.00 0.62 0.37 0.13 -1.93 -1.01 132.00 129.21 1l1p h PRO 53 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 1l1p h PRO 53 Cb 1.24 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.38 1l1p h PRO 53 CO 0.50 0.00 -0.30 0.78 -0.23 0.00 0.00 178.00 178.75 1l1p h GLY 54 N 0.00 -0.87 0.89 1.56 0.00 -1.91 -2.39 103.07 100.35 1l1p h GLY 54 Ca 0.01 0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.57 1l1p h GLY 54 CO -0.00 -0.32 -0.24 0.74 0.00 0.00 0.00 176.54 176.72 1l1p h PHE 55 N -1.09 0.69 -0.03 5.60 0.04 -1.68 -2.80 116.94 117.66 1l1p h PHE 55 Ca -0.09 -0.21 0.01 0.00 2.80 0.00 0.00 57.97 60.48 1l1p h PHE 55 Cb 0.64 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.65 1l1p h PHE 55 CO 0.02 0.91 0.27 1.49 -0.60 0.00 0.00 178.31 180.40 1l1p h GLU 56 N 0.27 0.00 0.00 1.51 4.81 -1.29 0.11 114.58 119.99 1l1p h GLU 56 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1l1p h GLU 56 Cb 0.80 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.18 1l1p h GLU 56 CO 0.06 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.87 1l1p n ASP 57 N -3.00 0.00 0.21 1.04 2.03 -0.90 -3.80 116.55 112.12 1l1p n ASP 57 Ca -0.02 0.23 -0.14 0.00 0.52 0.00 0.00 54.79 55.39 1l1p n ASP 57 Cb 0.33 -0.23 -0.08 0.00 -0.72 0.00 0.00 41.12 40.42 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 -0.56 -3.16 0.27 0.00 -1.51 -3.04 103.07 95.07 1l1p h GLY 58 Ca 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 1l1p h GLY 58 CO 0.00 -0.20 -0.01 1.39 0.00 0.00 0.00 176.54 177.72 1l1p n ILE 59 N -5.21 1.77 -0.03 2.60 -0.00 0.38 -4.26 119.36 114.61 1l1p n ILE 59 Ca -0.10 -0.46 -0.09 0.00 -0.00 0.00 0.00 62.75 62.10 1l1p n ILE 59 Cb 0.28 -1.45 -0.03 0.00 -0.00 0.00 0.00 39.64 38.45 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 1.44 -0.30 0.00 0.38 1.79 -1.54 -3.43 116.57 114.91 1l1p h LYS 60 Ca 0.00 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1l1p h LYS 60 Cb 0.88 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.60 1l1p h LYS 60 CO 0.01 -0.20 0.00 0.41 -1.08 0.00 0.00 179.45 178.59 1l1p n GLY 61 N -1.40 0.88 0.00 3.86 0.00 -1.26 -4.81 105.19 102.46 1l1p n GLY 61 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.44 115.22 113.58 1l1p n HIS 62 Ca 0.00 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.41 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 -1.37 2.53 -0.54 -1.40 1.02 -1.26 -4.98 119.74 113.74 1l1p s LYS 63 Ca 0.00 -3.23 -0.26 0.00 0.02 0.00 0.00 55.97 52.50 1l1p s LYS 63 Cb 0.00 -3.50 -0.08 0.00 -0.52 0.00 0.00 37.83 33.73 1l1p s LYS 63 CO 0.00 -1.26 2.42 0.00 -0.92 0.00 0.00 175.35 175.59 1l1p n ALA 64 N 2.21 0.70 -0.00 5.17 0.00 -1.26 -1.64 120.51 125.69 1l1p n ALA 64 Ca 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1l1p n ALA 64 Cb 0.35 -3.22 0.00 0.00 0.00 0.00 0.00 19.45 16.57 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 6.15 1.33 4.00 0.00 0.00 -0.01 -4.79 105.19 111.87 1l1p n GLY 65 Ca 0.39 -0.00 -0.18 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 -0.33 2.75 -0.27 1.61 2.12 0.71 -4.84 118.70 120.45 1l1p s GLU 66 Ca 0.00 -1.13 -0.02 0.00 0.36 0.00 0.00 54.97 54.18 1l1p s GLU 66 Cb 0.00 -2.69 0.09 0.00 0.26 0.00 0.00 34.13 31.79 1l1p s GLU 66 CO 0.00 -0.39 0.09 -1.83 -0.54 0.00 0.00 175.26 172.59 1l1p s GLU 67 N -4.46 0.52 0.20 4.30 -1.05 -1.26 0.67 118.70 117.62 1l1p s GLU 67 Ca 0.56 -0.70 0.01 0.00 -0.15 0.00 0.00 54.97 54.68 1l1p s GLU 67 Cb -0.10 -1.78 -0.05 0.00 -0.44 0.00 0.00 34.13 31.76 1l1p s GLU 67 CO 0.34 -0.89 0.06 -0.59 0.95 0.00 0.00 175.26 175.13 1l1p s PHE 68 N 1.84 1.25 -0.11 4.83 -0.12 0.42 -4.95 117.98 121.14 1l1p s PHE 68 Ca 0.06 -1.15 0.02 0.00 -0.05 0.00 0.00 56.93 55.81 1l1p s PHE 68 Cb -0.17 -0.70 0.02 0.00 -0.63 0.00 0.00 43.02 41.54 1l1p s PHE 68 CO -0.23 -0.36 -0.15 0.99 -0.05 0.00 0.00 175.22 175.42 1l1p s THR 69 N -3.82 1.49 0.23 -4.49 2.01 -1.26 0.15 115.64 109.94 1l1p s THR 69 Ca 0.30 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.70 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 0.08 0.44 0.03 0.27 -0.69 0.00 0.00 174.62 174.75 1l1p s ILE 70 N 1.05 0.80 0.17 1.82 -0.00 -0.35 -4.93 121.20 119.75 1l1p s ILE 70 Ca -0.05 -2.01 -0.06 0.00 -0.00 0.00 0.00 60.65 58.53 1l1p s ILE 70 Cb -0.15 -2.39 -0.06 0.00 -0.00 0.00 0.00 42.46 39.87 1l1p s ILE 70 CO -0.03 -0.26 0.42 1.51 -0.00 0.00 0.00 174.94 176.59 1l1p s ASP 71 N -3.28 6.52 -0.08 4.36 -4.77 -1.26 -1.84 116.67 116.32 1l1p s ASP 71 Ca 0.30 0.67 -0.05 0.00 -3.30 0.00 0.00 52.55 50.17 1l1p s ASP 71 Cb 0.07 -2.12 0.04 0.00 -1.09 0.00 0.00 42.92 39.81 1l1p s ASP 71 CO 0.09 0.02 0.20 0.68 0.70 0.00 0.00 175.17 176.85 1l1p s VAL 72 N -1.71 -0.03 -0.17 2.11 -7.23 -0.53 -3.83 120.40 109.01 1l1p s VAL 72 Ca 0.43 0.12 -0.06 0.00 -1.81 0.00 0.00 61.98 60.65 1l1p s VAL 72 Cb -0.12 -0.30 0.08 0.00 0.56 0.00 0.00 36.38 36.60 1l1p s VAL 72 CO 0.24 0.05 0.36 -0.89 -0.31 0.00 0.00 175.10 174.55 1l1p s THR 73 N 0.91 -0.49 -0.05 5.32 2.01 -1.26 0.65 115.64 122.72 1l1p s THR 73 Ca -0.07 0.20 -0.24 0.00 0.31 0.00 0.00 61.69 61.89 1l1p s THR 73 Cb -0.08 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.81 1l1p s THR 73 CO -0.05 0.08 0.74 -0.36 -0.69 0.00 0.00 174.62 174.34 1l1p s PHE 74 N 2.38 3.60 1.09 4.92 0.40 -1.17 -4.91 117.98 124.29 1l1p s PHE 74 Ca -0.02 1.33 -0.18 0.00 -0.60 0.00 0.00 56.93 57.45 1l1p s PHE 74 Cb -0.12 -2.85 0.27 0.00 0.51 0.00 0.00 43.02 40.84 1l1p s PHE 74 CO -0.11 0.09 0.90 -0.35 0.70 0.00 0.00 175.22 176.45 1l1p n PRO 75 N 3.70 -3.15 0.00 0.24 -0.04 -1.26 -4.07 135.00 130.43 1l1p n PRO 75 Ca -0.00 -1.46 0.12 0.00 -0.04 0.00 0.00 63.50 62.12 1l1p n PRO 75 Cb 0.51 -1.45 0.54 0.00 -0.04 0.00 0.00 33.50 33.06 1l1p n PRO 75 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1l1p n GLU 76 N -4.54 0.02 -0.01 0.54 4.71 -1.26 -3.22 120.64 116.88 1l1p n GLU 76 Ca 0.13 0.07 -0.12 0.00 -0.01 0.00 0.00 57.16 57.23 1l1p n GLU 76 Cb 0.51 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 29.30 1l1p n GLU 76 CO 0.00 0.00 0.00 1.05 0.09 0.00 0.00 177.13 178.27 1l1p h GLU 77 N 0.00 0.07 0.04 3.49 4.11 -2.03 -3.40 114.58 116.85 1l1p h GLU 77 Ca 0.00 -0.12 -0.00 0.00 0.07 0.00 0.00 59.36 59.31 1l1p h GLU 77 Cb 0.42 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1l1p h GLU 77 CO 0.00 0.69 -0.02 -0.92 0.07 0.00 0.00 179.01 178.83 1l1p h TYR 78 N 0.02 -0.05 -6.27 2.06 5.03 -1.90 -3.47 116.97 112.38 1l1p h TYR 78 Ca -0.31 -0.00 -0.38 0.00 2.58 0.00 0.00 58.73 60.62 1l1p h TYR 78 Cb 2.02 0.02 0.00 0.00 1.55 0.00 0.00 36.73 40.31 1l1p h TYR 78 CO 0.02 -0.03 -0.88 0.72 -1.32 0.00 0.00 178.16 176.67 1l1p n HIS 79 N -2.19 -1.64 -2.83 -3.82 8.25 -1.23 -4.90 115.22 106.86 1l1p n HIS 79 Ca -0.01 0.67 -0.35 0.00 -0.26 0.00 0.00 57.72 57.78 1l1p n HIS 79 Cb 0.02 -2.02 -0.07 0.00 1.12 0.00 0.00 29.99 29.04 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 -2.55 3.16 0.60 -1.41 0.00 -1.26 -4.65 121.76 115.64 1l1p s ALA 80 Ca 0.04 0.44 0.29 0.00 0.00 0.00 0.00 51.96 52.72 1l1p s ALA 80 Cb -0.00 -3.13 1.54 0.00 0.00 0.00 0.00 23.12 21.52 1l1p s ALA 80 CO 0.70 0.17 1.95 1.05 0.00 0.00 0.00 175.76 179.63 1l1p h GLU 81 N 2.65 0.00 0.05 0.00 4.11 -1.97 1.47 114.58 120.88 1l1p h GLU 81 Ca -0.48 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 58.58 1l1p h GLU 81 Cb 1.19 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 1l1p h GLU 81 CO 0.63 0.00 -2.21 0.27 0.07 0.00 0.00 179.01 177.78 1l1p n ASN 82 N -3.62 1.70 -0.35 3.06 6.94 -1.26 -4.70 115.26 117.03 1l1p n ASN 82 Ca 0.05 0.07 0.02 0.00 -0.02 0.00 0.00 54.58 54.70 1l1p n ASN 82 Cb 0.55 -0.39 0.03 0.00 -2.36 0.00 0.00 39.78 37.61 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 -3.26 0.53 -2.70 -4.53 -0.00 -1.00 -4.99 117.00 101.06 1l1p n LEU 83 Ca -0.36 -1.35 -0.36 0.00 -0.00 0.00 0.00 56.01 53.93 1l1p n LEU 83 Cb 1.04 -0.09 -0.05 0.00 -0.00 0.00 0.00 43.42 44.32 1l1p n LEU 83 CO 0.36 0.33 0.43 2.29 -0.00 0.00 0.00 177.39 180.80 1l1p n LYS 84 N -0.31 0.00 -3.97 1.47 2.85 0.50 -1.27 118.16 117.43 1l1p n LYS 84 Ca 0.03 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.98 1l1p n LYS 84 Cb 0.65 -0.89 -0.01 0.00 -0.65 0.00 0.00 35.03 34.14 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 1.28 -0.48 3.34 2.58 0.00 -1.26 -4.78 105.19 105.86 1l1p n GLY 85 Ca 0.14 0.25 -0.47 0.00 0.00 0.00 0.00 46.02 45.94 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 -6.70 3.48 -0.75 1.61 2.36 -0.40 -4.82 119.74 114.53 1l1p s LYS 86 Ca 0.19 -2.25 -0.27 0.00 -2.55 0.00 0.00 55.97 51.09 1l1p s LYS 86 Cb -0.08 -4.43 0.03 0.00 -1.05 0.00 0.00 37.83 32.29 1l1p s LYS 86 CO 0.91 -1.34 1.29 0.00 1.55 0.00 0.00 175.35 177.76 1l1p s ALA 87 N 0.66 2.75 0.11 3.13 0.00 -1.26 -3.06 121.76 124.08 1l1p s ALA 87 Ca 0.16 -1.39 0.02 0.00 0.00 0.00 0.00 51.96 50.75 1l1p s ALA 87 Cb -0.14 -4.27 -0.01 0.00 0.00 0.00 0.00 23.12 18.71 1l1p s ALA 87 CO -0.06 -3.30 0.08 0.00 0.00 0.00 0.00 175.76 172.47 1l1p n ALA 88 N 9.38 0.21 -2.46 0.00 0.00 0.21 -4.52 120.51 123.34 1l1p n ALA 88 Ca 0.04 -0.61 -0.27 0.00 0.00 0.00 0.00 53.44 52.60 1l1p n ALA 88 Cb 0.49 0.48 -0.16 0.00 0.00 0.00 0.00 19.45 20.26 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 -2.43 1.71 0.06 0.00 1.02 0.17 -1.46 119.74 118.81 1l1p s LYS 89 Ca 0.11 -0.74 0.02 0.00 0.02 0.00 0.00 55.97 55.38 1l1p s LYS 89 Cb 0.01 -1.64 -0.03 0.00 -0.52 0.00 0.00 37.83 35.65 1l1p s LYS 89 CO 0.08 0.43 -0.07 -0.06 -0.92 0.00 0.00 175.35 174.82 1l1p s PHE 90 N -0.45 0.69 -0.30 3.18 0.08 -0.76 -1.87 117.98 118.56 1l1p s PHE 90 Ca 0.07 -0.68 0.02 0.00 0.12 0.00 0.00 56.93 56.46 1l1p s PHE 90 Cb -0.08 -0.42 0.09 0.00 -0.57 0.00 0.00 43.02 42.03 1l1p s PHE 90 CO -0.00 -0.14 0.02 0.00 -0.10 0.00 0.00 175.22 175.00 1l1p s ALA 91 N -2.28 2.30 0.31 5.36 0.00 -1.02 -1.21 121.76 125.21 1l1p s ALA 91 Ca -0.02 -1.94 0.07 0.00 0.00 0.00 0.00 51.96 50.06 1l1p s ALA 91 Cb -0.04 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1l1p s ALA 91 CO -0.02 -1.50 0.35 0.42 0.00 0.00 0.00 175.76 175.01 1l1p s ILE 92 N 1.22 4.15 -0.25 0.00 1.01 0.39 -0.73 121.20 126.98 1l1p s ILE 92 Ca 0.04 -1.18 -0.03 0.00 0.00 0.00 0.00 60.65 59.48 1l1p s ILE 92 Cb -0.19 -3.41 0.08 0.00 0.01 0.00 0.00 42.46 38.96 1l1p s ILE 92 CO -0.11 -0.22 0.08 0.20 0.00 0.00 0.00 174.94 174.89 1l1p s ASN 93 N -4.03 3.38 0.81 3.58 0.01 0.16 0.16 114.94 119.01 1l1p s ASN 93 Ca 0.40 -1.18 -0.12 0.00 -0.71 0.00 0.00 52.86 51.25 1l1p s ASN 93 Cb -0.08 -0.59 0.08 0.00 0.41 0.00 0.00 41.25 41.08 1l1p s ASN 93 CO 0.28 -0.38 1.16 -0.22 -1.51 0.00 0.00 177.10 176.43 1l1p s LEU 94 N 1.87 3.09 0.00 0.60 2.96 0.21 -1.65 118.68 125.76 1l1p s LEU 94 Ca 0.05 2.19 0.00 0.00 -0.22 0.00 0.00 54.13 56.15 1l1p s LEU 94 Cb -0.17 -4.57 0.00 0.00 0.50 0.00 0.00 46.19 41.95 1l1p s LEU 94 CO -0.21 -2.54 0.00 0.29 -1.32 0.00 0.00 176.35 172.57 1l1p n LYS 95 N -3.44 0.00 -2.23 1.98 5.02 0.79 -0.21 118.16 120.08 1l1p n LYS 95 Ca 0.12 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 56.00 1l1p n LYS 95 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.50 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 2.06 3.06 -0.37 1.97 1.02 -1.15 -3.11 119.74 123.20 1l1p s LYS 96 Ca 0.00 0.58 -0.05 0.00 0.02 0.00 0.00 55.97 56.53 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 -2.23 0.15 0.54 -0.92 0.00 0.00 175.35 172.90 1l1p s VAL 97 N 7.21 3.54 0.33 3.17 0.11 -1.26 0.86 120.40 134.36 1l1p s VAL 97 Ca 0.60 -1.56 0.04 0.00 -2.93 0.00 0.00 61.98 58.12 1l1p s VAL 97 Cb -0.13 -3.19 -0.06 0.00 -1.53 0.00 0.00 36.38 31.47 1l1p s VAL 97 CO 0.24 -0.41 0.06 -1.61 -3.33 0.00 0.00 175.10 170.04 1l1p s GLU 98 N 1.29 1.65 -1.06 1.54 2.02 -1.19 -4.39 118.70 118.55 1l1p s GLU 98 Ca 0.02 -1.92 -0.15 0.00 0.02 0.00 0.00 54.97 52.94 1l1p s GLU 98 Cb -0.22 -0.87 0.18 0.00 0.10 0.00 0.00 34.13 33.32 1l1p s GLU 98 CO -0.01 -0.19 1.22 -2.00 0.02 0.00 0.00 175.26 174.31 1l1p s GLU 99 N -3.89 3.89 0.36 1.61 -6.30 -1.26 -2.33 118.70 110.78 1l1p s GLU 99 Ca 0.37 -2.38 -0.28 0.00 -2.50 0.00 0.00 54.97 50.17 1l1p s GLU 99 Cb 0.09 -4.89 -0.10 0.00 0.00 0.00 0.00 34.13 29.23 1l1p s GLU 99 CO 0.16 -1.65 1.40 -0.98 0.02 0.00 0.00 175.26 174.20 1l1p s ARG 100 N 1.43 4.19 -0.45 4.30 1.70 -1.26 -3.10 118.95 125.77 1l1p s ARG 100 Ca 0.35 2.39 0.07 0.00 -0.47 0.00 0.00 55.73 58.07 1l1p s ARG 100 Cb -0.05 -2.99 0.26 0.00 -0.57 0.00 0.00 34.95 31.60 1l1p s ARG 100 CO -0.05 -0.39 0.77 -1.91 -1.08 0.00 0.00 175.30 172.64 1l1p n GLU 101 N 0.56 0.78 0.08 3.89 2.13 -1.26 -4.62 120.64 122.20 1l1p n GLU 101 Ca 0.01 -2.36 -0.06 0.00 0.66 0.00 0.00 57.16 55.40 1l1p n GLU 101 Cb 0.41 -1.36 -0.04 0.00 0.27 0.00 0.00 31.44 30.72 1l1p n GLU 101 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1l1p h LEU 102 N 3.87 -0.25 -9.79 4.31 4.07 -1.94 -3.44 115.31 112.13 1l1p h LEU 102 Ca -0.05 -0.10 -0.53 0.00 0.08 0.00 0.00 57.88 57.28 1l1p h LEU 102 Cb 0.98 0.06 0.06 0.00 1.08 0.00 0.00 40.66 42.85 1l1p h LEU 102 CO 0.37 0.25 0.73 -2.16 -1.08 0.00 0.00 178.44 176.54 1l1p s PRO 103 N -2.73 4.28 -0.33 1.13 0.04 -1.26 -4.99 135.00 131.14 1l1p s PRO 103 Ca -0.07 2.29 -0.17 0.00 0.04 0.00 0.00 61.00 63.09 1l1p s PRO 103 Cb 0.00 -3.09 -0.01 0.00 0.04 0.00 0.00 34.50 31.44 1l1p s PRO 103 CO 0.22 -0.36 0.47 -2.00 0.04 0.00 0.00 177.00 175.37 1l1p s GLU 104 N -0.87 3.71 -0.06 4.56 2.56 -1.26 -5.06 118.70 122.28 1l1p s GLU 104 Ca 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 54.97 55.39 1l1p s GLU 104 Cb -0.41 -3.77 -0.03 0.00 2.00 0.00 0.00 34.13 31.91 1l1p s GLU 104 CO 0.47 -0.54 0.02 -0.51 -0.56 0.00 0.00 175.26 174.13 1l1p s LEU 105 N 2.28 3.63 0.00 2.70 1.43 -1.26 -5.30 118.68 122.15 1l1p s LEU 105 Ca 0.17 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.39 1l1p s LEU 105 Cb -0.16 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.14 1l1p s LEU 105 CO 0.12 0.35 0.00 0.41 0.23 0.00 0.00 176.35 177.46