#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 7.52 -0.04 1.61 0.01 -1.26 -5.05 113.70 116.49 1l1p s SER 2 Ca 0.00 1.99 0.05 0.00 1.31 0.00 0.00 55.95 59.30 1l1p s SER 2 Cb 0.00 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.60 1l1p s SER 2 CO 0.00 0.03 -0.18 -1.00 0.41 0.00 0.00 173.24 172.51 1l1p s HIS 3 N -0.88 2.59 -0.23 2.43 0.09 -1.26 -5.10 115.29 112.93 1l1p s HIS 3 Ca 0.43 -0.26 -0.25 0.00 -0.00 0.00 0.00 55.06 54.98 1l1p s HIS 3 Cb -0.27 -1.60 -0.01 0.00 -0.00 0.00 0.00 32.58 30.71 1l1p s HIS 3 CO 0.33 0.10 0.84 -1.64 -0.00 0.00 0.00 174.74 174.38 1l1p s MET 4 N -0.65 4.20 -0.02 1.40 1.00 -1.26 -4.92 119.30 119.05 1l1p s MET 4 Ca 0.10 0.98 0.17 0.00 0.00 0.00 0.00 55.69 56.93 1l1p s MET 4 Cb -0.11 -3.64 -0.19 0.00 0.00 0.00 0.00 34.83 30.89 1l1p s MET 4 CO 0.00 -0.50 0.62 0.94 0.00 0.00 0.00 175.02 176.08 1l1p n GLN 5 N 5.93 0.64 -1.78 2.03 7.27 -1.26 -4.94 117.38 125.26 1l1p n GLN 5 Ca 0.06 0.16 -0.38 0.00 0.07 0.00 0.00 57.00 56.91 1l1p n GLN 5 Cb 0.48 -1.73 0.05 0.00 2.41 0.00 0.00 30.24 31.45 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 -2.82 2.64 -0.03 1.69 0.00 -1.26 -5.03 121.76 116.95 1l1p s ALA 6 Ca -0.05 1.27 0.04 0.00 0.00 0.00 0.00 51.96 53.22 1l1p s ALA 6 Cb 0.08 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 1l1p s ALA 6 CO 0.83 -1.44 -0.16 -0.08 0.00 0.00 0.00 175.76 174.90 1l1p s THR 7 N -1.35 1.32 0.09 0.00 -1.32 -1.26 -5.14 115.64 107.98 1l1p s THR 7 Ca 0.76 -0.68 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 1l1p s THR 7 Cb -0.39 -1.13 -0.04 0.00 -1.51 0.00 0.00 72.50 69.43 1l1p s THR 7 CO 0.44 0.38 -0.06 0.26 -2.21 0.00 0.00 174.62 173.43 1l1p s TRP 8 N -0.11 0.84 -0.21 9.09 0.52 -1.26 -4.60 118.94 123.21 1l1p s TRP 8 Ca 0.00 -0.94 0.19 0.00 0.02 0.00 0.00 56.10 55.37 1l1p s TRP 8 Cb -0.09 -0.50 0.42 0.00 -1.15 0.00 0.00 33.47 32.15 1l1p s TRP 8 CO 0.01 -0.19 1.22 0.36 0.02 0.00 0.00 176.95 178.37 1l1p n LYS 9 N -0.02 1.16 -2.35 4.98 2.85 -1.26 -5.01 118.16 118.50 1l1p n LYS 9 Ca -0.12 -2.44 -0.42 0.00 -1.05 0.00 0.00 58.31 54.28 1l1p n LYS 9 Cb 0.61 -0.62 -0.03 0.00 -0.65 0.00 0.00 35.03 34.33 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 -1.80 4.44 0.00 -1.58 4.04 -1.21 -4.65 118.70 117.95 1l1p s GLU 10 Ca 0.21 1.88 0.00 0.00 0.04 0.00 0.00 54.97 57.10 1l1p s GLU 10 Cb 0.33 -3.27 0.00 0.00 0.02 0.00 0.00 34.13 31.21 1l1p s GLU 10 CO -0.08 -0.20 0.00 1.63 -1.84 0.00 0.00 175.26 174.77 1l1p n LYS 11 N 3.16 2.47 -0.36 -4.83 5.02 -1.13 -4.66 118.16 117.84 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 0.45 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.49 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 0.53 -0.60 4.39 5.68 -1.26 -4.31 116.55 120.98 1l1p n ASP 12 Ca 0.00 -2.15 0.00 0.00 -0.50 0.00 0.00 54.79 52.14 1l1p n ASP 12 Cb 0.00 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.75 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 -0.31 1.84 0.41 6.12 0.00 -1.26 -4.98 105.19 107.01 1l1p n GLY 13 Ca 0.03 -2.05 -0.04 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.43 -1.77 4.61 0.00 -1.26 -4.16 120.51 114.50 1l1p n ALA 14 Ca 0.00 -0.19 -0.36 0.00 0.00 0.00 0.00 53.44 52.88 1l1p n ALA 14 Cb 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.23 2.91 0.19 0.00 0.11 0.16 -4.53 120.40 118.01 1l1p s VAL 15 Ca 0.08 0.62 0.01 0.00 -2.93 0.00 0.00 61.98 59.76 1l1p s VAL 15 Cb -0.01 -3.28 -0.05 0.00 -1.53 0.00 0.00 36.38 31.52 1l1p s VAL 15 CO 0.07 -0.08 0.04 -1.61 -3.33 0.00 0.00 175.10 170.19 1l1p s GLU 16 N -3.06 1.15 0.00 1.54 0.41 -1.26 -5.02 118.70 112.46 1l1p s GLU 16 Ca 0.71 -1.58 0.00 0.00 -0.41 0.00 0.00 54.97 53.69 1l1p s GLU 16 Cb -0.29 -0.13 0.00 0.00 -1.78 0.00 0.00 34.13 31.94 1l1p s GLU 16 CO 0.33 -0.21 0.03 0.00 -0.49 0.00 0.00 175.26 174.92 1l1p n ALA 17 N -0.27 0.00 -3.40 5.21 0.00 -1.26 -1.77 120.51 119.03 1l1p n ALA 17 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.12 1l1p n ALA 17 Cb 0.64 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 20.03 1l1p n ALA 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1l1p n GLU 18 N -1.35 2.69 -2.18 0.00 0.28 -1.23 -4.33 120.64 114.52 1l1p n GLU 18 Ca 0.00 -4.67 -0.12 0.00 -0.16 0.00 0.00 57.16 52.22 1l1p n GLU 18 Cb 0.00 -2.28 0.04 0.00 1.43 0.00 0.00 31.44 30.63 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1l1p n ASP 19 N 0.90 1.26 -3.63 -1.84 9.92 -0.73 -4.39 116.55 118.04 1l1p n ASP 19 Ca 0.29 -1.92 -0.20 0.00 -0.53 0.00 0.00 54.79 52.44 1l1p n ASP 19 Cb 0.40 -0.26 -0.16 0.00 -0.64 0.00 0.00 41.12 40.46 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 -3.59 0.03 0.51 -1.24 3.52 -1.16 0.18 118.95 117.22 1l1p s ARG 20 Ca 0.37 0.32 0.02 0.00 -0.13 0.00 0.00 55.73 56.30 1l1p s ARG 20 Cb -0.03 -0.82 0.02 0.00 -1.56 0.00 0.00 34.95 32.56 1l1p s ARG 20 CO 0.23 -0.44 0.73 0.14 -0.81 0.00 0.00 175.30 175.15 1l1p s VAL 21 N 2.23 3.04 -0.24 7.11 -7.23 0.30 -3.37 120.40 122.23 1l1p s VAL 21 Ca 0.04 -0.65 0.02 0.00 -1.81 0.00 0.00 61.98 59.58 1l1p s VAL 21 Cb -0.13 -3.13 0.05 0.00 0.56 0.00 0.00 36.38 33.73 1l1p s VAL 21 CO -0.07 -0.08 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.62 1l1p s THR 22 N -2.68 2.21 0.18 5.32 2.01 0.25 -0.36 115.64 122.57 1l1p s THR 22 Ca 0.55 -1.39 0.07 0.00 0.31 0.00 0.00 61.69 61.23 1l1p s THR 22 Cb -0.10 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 1l1p s THR 22 CO 0.38 0.15 -0.15 0.27 -0.69 0.00 0.00 174.62 174.58 1l1p s ILE 23 N 1.18 1.64 -0.11 1.82 -4.36 0.18 -0.67 121.20 120.88 1l1p s ILE 23 Ca -0.04 -2.07 0.01 0.00 -0.26 0.00 0.00 60.65 58.28 1l1p s ILE 23 Cb -0.18 -1.92 0.02 0.00 1.25 0.00 0.00 42.46 41.64 1l1p s ILE 23 CO -0.07 -0.53 -0.12 1.51 0.24 0.00 0.00 174.94 175.97 1l1p s ASP 24 N -3.06 2.23 0.20 4.36 -4.77 -0.75 0.14 116.67 115.02 1l1p s ASP 24 Ca 0.19 -0.36 -0.03 0.00 -3.30 0.00 0.00 52.55 49.05 1l1p s ASP 24 Cb -0.02 -0.96 -0.03 0.00 -1.09 0.00 0.00 42.92 40.82 1l1p s ASP 24 CO 0.06 -0.04 0.17 0.72 0.70 0.00 0.00 175.17 176.78 1l1p s PHE 25 N 1.23 1.00 -0.18 2.11 -0.12 0.33 0.03 117.98 122.37 1l1p s PHE 25 Ca -0.03 -1.26 -0.05 0.00 -0.05 0.00 0.00 56.93 55.54 1l1p s PHE 25 Cb -0.14 -0.44 0.09 0.00 -0.63 0.00 0.00 43.02 41.89 1l1p s PHE 25 CO -0.04 -0.67 0.32 0.99 -0.05 0.00 0.00 175.22 175.77 1l1p s THR 26 N -4.12 -0.50 0.29 -4.49 2.01 -0.37 0.13 115.64 108.59 1l1p s THR 26 Ca 0.34 0.15 -0.20 0.00 0.31 0.00 0.00 61.69 62.30 1l1p s THR 26 Cb 0.06 -0.59 0.02 0.00 0.01 0.00 0.00 72.50 72.00 1l1p s THR 26 CO 0.10 0.03 0.71 -0.83 -0.69 0.00 0.00 174.62 173.94 1l1p s GLY 27 N 2.48 0.03 0.52 4.40 0.00 0.84 -2.43 107.32 113.16 1l1p s GLY 27 Ca 0.03 -0.42 0.06 0.00 0.00 0.00 0.00 44.72 44.38 1l1p s GLY 27 CO -0.11 -0.17 0.36 -1.35 0.00 0.00 0.00 173.10 171.83 1l1p s SER 28 N -2.95 4.63 0.00 1.64 1.04 -0.51 -4.00 113.70 113.55 1l1p s SER 28 Ca 0.13 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 55.35 1l1p s SER 28 Cb -0.05 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.32 1l1p s SER 28 CO 0.08 -1.00 0.00 0.55 0.98 0.00 0.00 173.24 173.85 1l1p n VAL 29 N -1.68 0.00 -1.09 5.02 3.14 -1.21 0.77 118.33 123.29 1l1p n VAL 29 Ca -0.02 0.03 -0.26 0.00 -2.96 0.00 0.00 64.34 61.13 1l1p n VAL 29 Cb 0.64 -0.81 0.08 0.00 -1.06 0.00 0.00 33.84 32.69 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 -1.78 6.61 0.00 6.55 -0.08 -1.26 -4.57 116.55 122.02 1l1p n ASP 30 Ca 0.00 -3.46 0.00 0.00 -1.51 0.00 0.00 54.79 49.82 1l1p n ASP 30 Cb 0.00 -0.97 0.00 0.00 2.34 0.00 0.00 41.12 42.49 1l1p n ASP 30 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1l1p n GLY 31 N -0.48 1.61 2.87 0.27 0.00 -1.26 -5.02 105.19 103.19 1l1p n GLY 31 Ca 0.49 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.27 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 1.13 -0.03 1.61 0.41 -1.26 -4.96 118.70 114.77 1l1p s GLU 32 Ca 0.00 -0.13 -0.32 0.00 -0.41 0.00 0.00 54.97 54.11 1l1p s GLU 32 Cb 0.00 -1.24 -0.11 0.00 -1.78 0.00 0.00 34.13 31.00 1l1p s GLU 32 CO 0.00 -0.22 1.93 -0.85 -0.49 0.00 0.00 175.26 175.63 1l1p n GLU 33 N 4.74 2.48 0.00 1.61 0.28 -1.26 -3.33 120.64 125.17 1l1p n GLU 33 Ca -0.14 0.91 0.00 0.00 -0.16 0.00 0.00 57.16 57.77 1l1p n GLU 33 Cb 0.50 -2.81 0.00 0.00 1.43 0.00 0.00 31.44 30.57 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 7.04 0.00 0.08 -1.84 -1.74 -1.26 -4.76 117.46 114.98 1l1p n PHE 34 Ca 0.22 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.98 1l1p n PHE 34 Cb 0.34 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.26 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 -0.24 -0.25 3.97 5.08 -1.96 -3.15 114.58 118.02 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 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.58 1l1p n GLY 36 N 0.20 -0.25 0.00 -3.84 0.00 -1.26 -4.12 105.19 95.92 1l1p n GLY 36 Ca -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 0.46 -0.44 3.15 -0.02 0.00 -1.19 -4.34 105.19 102.81 1l1p n GLY 37 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.88 0.26 0.02 1.61 2.20 -1.26 -0.11 119.74 119.57 1l1p s LYS 38 Ca 0.00 0.84 0.03 0.00 -0.36 0.00 0.00 55.97 56.48 1l1p s LYS 38 Cb 0.00 0.10 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 1l1p s LYS 38 CO 0.00 -0.24 -0.09 0.00 -0.36 0.00 0.00 175.35 174.66 1l1p s ALA 39 N 2.22 0.73 0.01 3.13 0.00 0.36 -4.97 121.76 123.25 1l1p s ALA 39 Ca -0.03 -0.53 -0.05 0.00 0.00 0.00 0.00 51.96 51.35 1l1p s ALA 39 Cb -0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1l1p s ALA 39 CO -0.11 0.13 -0.11 0.45 0.00 0.00 0.00 175.76 176.13 1l1p n SER 40 N 2.35 1.30 -3.95 0.00 2.88 -1.26 0.12 113.62 115.06 1l1p n SER 40 Ca -0.16 0.19 -0.41 0.00 -1.33 0.00 0.00 58.87 57.16 1l1p n SER 40 Cb 0.56 -0.45 -0.00 0.00 -0.75 0.00 0.00 64.21 63.57 1l1p n SER 40 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1l1p n ASP 41 N -3.73 5.98 -4.49 -3.46 5.68 -1.25 -2.53 116.55 112.75 1l1p n ASP 41 Ca -0.04 -3.39 -0.43 0.00 -0.50 0.00 0.00 54.79 50.43 1l1p n ASP 41 Cb 0.16 -1.19 -0.06 0.00 -1.14 0.00 0.00 41.12 38.89 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 -2.63 2.97 -0.80 2.11 5.36 0.38 -4.87 117.98 120.50 1l1p s PHE 42 Ca 0.32 -0.27 -0.26 0.00 -0.96 0.00 0.00 56.93 55.76 1l1p s PHE 42 Cb 0.05 -3.68 0.03 0.00 -0.34 0.00 0.00 43.02 39.08 1l1p s PHE 42 CO 0.07 -1.10 1.31 0.54 -1.46 0.00 0.00 175.22 174.58 1l1p s VAL 43 N 3.10 3.77 -0.10 3.12 0.11 -1.26 -0.65 120.40 128.50 1l1p s VAL 43 Ca 0.22 0.16 -0.19 0.00 -2.93 0.00 0.00 61.98 59.24 1l1p s VAL 43 Cb -0.16 -4.94 -0.04 0.00 -1.53 0.00 0.00 36.38 29.70 1l1p s VAL 43 CO 0.16 -1.87 0.52 -0.22 -3.33 0.00 0.00 175.10 170.35 1l1p s LEU 44 N 5.56 4.30 -0.51 2.54 0.20 0.51 -4.88 118.68 126.40 1l1p s LEU 44 Ca 0.37 0.90 -0.18 0.00 0.69 0.00 0.00 54.13 55.91 1l1p s LEU 44 Cb -0.06 -2.76 0.07 0.00 -0.43 0.00 0.00 46.19 43.00 1l1p s LEU 44 CO 0.10 0.00 0.58 0.00 -0.29 0.00 0.00 176.35 176.74 1l1p s ALA 45 N 0.52 3.43 -1.11 5.97 0.00 -1.26 0.11 121.76 129.42 1l1p s ALA 45 Ca 0.28 -1.88 -0.23 0.00 0.00 0.00 0.00 51.96 50.13 1l1p s ALA 45 Cb -0.16 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1l1p s ALA 45 CO 0.12 -1.97 1.93 -1.64 0.00 0.00 0.00 175.76 174.20 1l1p s MET 46 N 2.40 2.55 0.00 0.00 -1.94 0.49 -3.56 119.30 119.24 1l1p s MET 46 Ca 0.12 -0.94 0.00 0.00 -1.71 0.00 0.00 55.69 53.17 1l1p s MET 46 Cb -0.21 -5.20 0.00 0.00 2.01 0.00 0.00 34.83 31.43 1l1p s MET 46 CO 0.10 -3.76 0.00 0.41 -0.01 0.00 0.00 175.02 171.76 1l1p n GLY 47 N 6.11 0.84 1.13 -0.03 0.00 -1.26 -2.47 105.19 109.51 1l1p n GLY 47 Ca 0.43 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.02 0.00 -0.11 1.61 0.00 -1.23 -4.64 117.38 112.99 1l1p n GLN 48 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.00 56.83 1l1p n GLN 48 Cb 0.01 -0.16 -0.06 0.00 0.00 0.00 0.00 30.24 30.03 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 3.27 -0.51 0.00 1.69 0.00 -1.26 -4.99 105.19 103.39 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 -1.45 1.61 1.85 -1.26 -5.11 116.66 107.91 1l1p n ARG 50 Ca -0.30 0.00 -0.58 0.00 -1.00 0.00 0.00 57.85 55.97 1l1p n ARG 50 Cb 0.66 0.00 -0.09 0.00 -1.05 0.00 0.00 32.46 31.98 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 0.50 -1.16 2.89 0.00 -1.26 -4.90 117.12 113.20 1l1p n MET 51 Ca 0.00 0.16 -0.30 0.00 -0.00 0.00 0.00 57.70 57.55 1l1p n MET 51 Cb 0.00 -1.88 0.13 0.00 0.00 0.00 0.00 33.22 31.47 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 5.53 2.86 0.24 1.12 -4.36 -1.26 -4.71 121.20 120.62 1l1p s ILE 52 Ca 1.11 0.28 0.34 0.00 -0.26 0.00 0.00 60.65 62.12 1l1p s ILE 52 Cb -1.24 -2.71 0.34 0.00 1.25 0.00 0.00 42.46 40.10 1l1p s ILE 52 CO 0.63 -0.37 2.03 1.55 0.24 0.00 0.00 174.94 179.03 1l1p h PRO 53 N -1.44 0.00 0.36 0.37 0.13 -1.92 -1.08 132.00 128.42 1l1p h PRO 53 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1l1p h PRO 53 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1l1p h PRO 53 CO 0.52 0.00 -0.17 0.78 -0.23 0.00 0.00 178.00 178.90 1l1p h GLY 54 N 0.15 -0.50 0.44 1.56 0.00 -1.91 -3.08 103.07 99.73 1l1p h GLY 54 Ca 0.00 0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.52 1l1p h GLY 54 CO 0.00 -0.18 -0.00 0.74 0.00 0.00 0.00 176.54 177.09 1l1p h PHE 55 N -1.12 0.00 -0.29 5.60 0.04 -1.70 -3.04 116.94 116.43 1l1p h PHE 55 Ca -0.05 -0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.80 1l1p h PHE 55 Cb 0.39 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 1l1p h PHE 55 CO 0.00 0.57 0.57 1.49 -0.60 0.00 0.00 178.31 180.34 1l1p h GLU 56 N -0.56 0.00 0.00 1.51 4.81 -1.37 0.12 114.58 119.09 1l1p h GLU 56 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1l1p h GLU 56 Cb 0.57 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1l1p h GLU 56 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 179.01 174.81 1l1p n ASP 57 N -3.21 0.00 0.11 1.04 -0.08 -1.15 -3.61 116.55 109.64 1l1p n ASP 57 Ca 0.05 0.20 -0.13 0.00 -1.51 0.00 0.00 54.79 53.40 1l1p n ASP 57 Cb 0.69 -0.19 -0.08 0.00 2.34 0.00 0.00 41.12 43.88 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 -0.27 -2.89 0.27 0.00 -1.48 -2.94 103.07 95.76 1l1p h GLY 58 Ca 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 1l1p h GLY 58 CO 0.00 -0.10 0.07 1.39 0.00 0.00 0.00 176.54 177.90 1l1p n ILE 59 N -5.11 1.93 -0.11 2.60 -0.00 0.41 -4.32 119.36 114.78 1l1p n ILE 59 Ca -0.09 -0.58 -0.06 0.00 -0.00 0.00 0.00 62.75 62.02 1l1p n ILE 59 Cb 0.20 -1.37 0.01 0.00 -0.00 0.00 0.00 39.64 38.48 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 0.87 -0.08 0.00 0.38 2.10 -1.53 -3.43 116.57 114.87 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 1.02 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.37 1l1p h LYS 60 CO 0.12 -0.06 0.00 0.41 -2.00 0.00 0.00 179.45 177.93 1l1p n GLY 61 N -1.35 0.79 0.00 0.07 0.00 -1.26 -4.79 105.19 98.65 1l1p n GLY 61 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.77 1.61 1.44 -1.26 0.37 115.22 113.61 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 -0.98 1.58 -0.59 -1.40 -0.14 -1.26 -4.98 119.74 111.97 1l1p s LYS 63 Ca 0.00 -2.34 -0.26 0.00 -1.36 0.00 0.00 55.97 52.01 1l1p s LYS 63 Cb 0.00 -2.64 -0.09 0.00 -1.68 0.00 0.00 37.83 33.43 1l1p s LYS 63 CO 0.00 -1.19 2.39 0.00 -0.76 0.00 0.00 175.35 175.80 1l1p s ALA 64 N -0.07 1.37 0.00 5.17 0.00 -1.26 -1.94 121.76 125.03 1l1p s ALA 64 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1l1p s ALA 64 Cb -0.20 -4.42 0.00 0.00 0.00 0.00 0.00 23.12 18.51 1l1p s ALA 64 CO -0.04 -4.88 0.00 0.41 0.00 0.00 0.00 175.76 171.25 1l1p n GLY 65 N 6.24 1.28 3.98 0.00 0.00 0.25 -4.80 105.19 112.14 1l1p n GLY 65 Ca 0.39 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.21 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 3.17 -0.26 1.61 2.56 0.44 -4.84 118.70 121.15 1l1p s GLU 66 Ca 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 54.97 54.12 1l1p s GLU 66 Cb 0.00 -2.78 0.08 0.00 2.00 0.00 0.00 34.13 33.43 1l1p s GLU 66 CO 0.00 0.06 0.04 -2.00 -0.56 0.00 0.00 175.26 172.80 1l1p s GLU 67 N -4.22 0.95 0.17 4.30 2.12 -1.26 0.11 118.70 120.86 1l1p s GLU 67 Ca 0.44 -0.90 -0.00 0.00 0.36 0.00 0.00 54.97 54.86 1l1p s GLU 67 Cb -0.10 -2.23 -0.04 0.00 0.26 0.00 0.00 34.13 32.02 1l1p s GLU 67 CO 0.32 -0.79 0.07 -0.59 -0.54 0.00 0.00 175.26 173.74 1l1p s PHE 68 N 1.60 1.05 -0.09 5.30 -0.12 0.39 -4.96 117.98 121.14 1l1p s PHE 68 Ca 0.03 -1.24 0.02 0.00 -0.05 0.00 0.00 56.93 55.68 1l1p s PHE 68 Cb -0.18 -0.56 0.01 0.00 -0.63 0.00 0.00 43.02 41.66 1l1p s PHE 68 CO -0.15 -0.50 -0.14 0.99 -0.05 0.00 0.00 175.22 175.38 1l1p s THR 69 N -4.01 1.34 0.25 -4.49 2.01 -1.26 0.15 115.64 109.63 1l1p s THR 69 Ca 0.29 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.75 1l1p s THR 69 Cb 0.07 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.30 1l1p s THR 69 CO 0.06 0.41 0.06 0.27 -0.69 0.00 0.00 174.62 174.72 1l1p s ILE 70 N 0.91 0.74 0.18 1.82 -0.00 -0.20 -4.93 121.20 119.72 1l1p s ILE 70 Ca -0.09 -2.00 -0.07 0.00 -0.00 0.00 0.00 60.65 58.49 1l1p s ILE 70 Cb -0.15 -2.51 -0.06 0.00 -0.00 0.00 0.00 42.46 39.73 1l1p s ILE 70 CO 0.00 -0.14 0.45 -0.62 -0.00 0.00 0.00 174.94 174.63 1l1p s ASP 71 N -3.31 6.56 -0.10 4.36 2.15 -1.26 -1.68 116.67 123.38 1l1p s ASP 71 Ca 0.34 0.74 -0.05 0.00 0.43 0.00 0.00 52.55 54.01 1l1p s ASP 71 Cb 0.07 -2.15 0.05 0.00 -0.30 0.00 0.00 42.92 40.59 1l1p s ASP 71 CO 0.11 0.00 0.24 0.68 -0.17 0.00 0.00 175.17 176.04 1l1p s VAL 72 N -1.72 -0.06 -0.15 1.11 -7.23 -0.43 -3.77 120.40 108.15 1l1p s VAL 72 Ca 0.44 0.16 -0.06 0.00 -1.81 0.00 0.00 61.98 60.70 1l1p s VAL 72 Cb -0.12 -0.38 0.07 0.00 0.56 0.00 0.00 36.38 36.51 1l1p s VAL 72 CO 0.23 0.06 0.33 -0.89 -0.31 0.00 0.00 175.10 174.52 1l1p s THR 73 N 1.31 -0.37 -0.05 5.32 2.01 -1.26 0.14 115.64 122.74 1l1p s THR 73 Ca -0.09 0.20 -0.25 0.00 0.31 0.00 0.00 61.69 61.86 1l1p s THR 73 Cb -0.10 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 1l1p s THR 73 CO -0.08 0.08 0.78 -0.36 -0.69 0.00 0.00 174.62 174.34 1l1p s PHE 74 N 2.15 3.60 1.00 4.92 0.40 -1.12 -4.91 117.98 124.01 1l1p s PHE 74 Ca -0.03 1.37 -0.17 0.00 -0.60 0.00 0.00 56.93 57.50 1l1p s PHE 74 Cb -0.11 -2.89 0.24 0.00 0.51 0.00 0.00 43.02 40.77 1l1p s PHE 74 CO -0.10 0.06 0.95 -0.35 0.70 0.00 0.00 175.22 176.47 1l1p n PRO 75 N 3.82 -2.53 0.01 0.24 -0.04 -1.26 -4.04 135.00 131.20 1l1p n PRO 75 Ca 0.01 -1.50 0.12 0.00 -0.04 0.00 0.00 63.50 62.08 1l1p n PRO 75 Cb 0.51 -1.33 0.51 0.00 -0.04 0.00 0.00 33.50 33.15 1l1p n PRO 75 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1l1p n GLU 76 N -4.15 0.01 0.04 0.54 0.28 -1.26 -3.15 120.64 112.96 1l1p n GLU 76 Ca 0.13 0.09 -0.18 0.00 -0.16 0.00 0.00 57.16 57.04 1l1p n GLU 76 Cb 0.49 -1.52 -0.14 0.00 1.43 0.00 0.00 31.44 31.70 1l1p n GLU 76 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1l1p h GLU 77 N 0.00 0.26 0.04 3.44 5.08 -2.03 -3.39 114.58 117.98 1l1p h GLU 77 Ca 0.00 -0.45 -0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1l1p h GLU 77 Cb 0.43 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1l1p h GLU 77 CO 0.00 1.12 -0.02 -0.92 -1.00 0.00 0.00 179.01 178.19 1l1p h TYR 78 N 0.07 -0.05 -5.66 4.33 5.03 -1.91 -3.47 116.97 115.31 1l1p h TYR 78 Ca -0.31 -0.00 -0.29 0.00 2.58 0.00 0.00 58.73 60.70 1l1p h TYR 78 Cb 2.04 0.02 0.01 0.00 1.55 0.00 0.00 36.73 40.34 1l1p h TYR 78 CO 0.07 -0.03 -0.75 0.72 -1.32 0.00 0.00 178.16 176.85 1l1p n HIS 79 N -2.21 -1.46 -3.11 -3.82 8.25 -1.19 -4.90 115.22 106.78 1l1p n HIS 79 Ca -0.01 0.61 -0.39 0.00 -0.26 0.00 0.00 57.72 57.67 1l1p n HIS 79 Cb 0.02 -1.50 -0.06 0.00 1.12 0.00 0.00 29.99 29.57 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 3.51 0.61 -1.41 0.00 -1.26 -4.68 121.76 116.57 1l1p s ALA 80 Ca 0.10 0.22 0.26 0.00 0.00 0.00 0.00 51.96 52.54 1l1p s ALA 80 Cb -0.01 -2.82 1.13 0.00 0.00 0.00 0.00 23.12 21.43 1l1p s ALA 80 CO 0.57 0.34 1.56 0.93 0.00 0.00 0.00 175.76 179.16 1l1p h GLU 81 N 4.39 0.00 0.06 0.00 5.08 -1.97 1.64 114.58 123.78 1l1p h GLU 81 Ca -0.48 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.50 1l1p h GLU 81 Cb 1.21 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 1l1p h GLU 81 CO 0.65 0.00 -2.22 0.27 -1.00 0.00 0.00 179.01 176.71 1l1p n ASN 82 N -3.34 1.94 -0.30 1.42 6.94 -1.26 -4.70 115.26 115.96 1l1p n ASN 82 Ca 0.14 0.05 0.02 0.00 -0.02 0.00 0.00 54.58 54.77 1l1p n ASN 82 Cb 1.08 -0.56 0.03 0.00 -2.36 0.00 0.00 39.78 37.96 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 -3.34 0.55 -3.35 -4.53 -0.00 -0.65 -5.04 117.00 100.64 1l1p n LEU 83 Ca -0.38 -1.26 -0.43 0.00 -0.00 0.00 0.00 56.01 53.94 1l1p n LEU 83 Cb 1.03 -0.08 -0.06 0.00 -0.00 0.00 0.00 43.42 44.31 1l1p n LEU 83 CO 0.35 0.30 0.39 2.29 -0.00 0.00 0.00 177.39 180.72 1l1p n LYS 84 N -0.30 0.00 -3.98 1.47 0.00 0.55 -1.29 118.16 114.62 1l1p n LYS 84 Ca 0.03 0.00 -0.27 0.00 -0.00 0.00 0.00 58.31 58.07 1l1p n LYS 84 Cb 0.62 -1.09 -0.02 0.00 -0.00 0.00 0.00 35.03 34.55 1l1p n LYS 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1l1p n GLY 85 N 1.15 -0.27 3.33 2.58 0.00 -1.26 -4.79 105.19 105.94 1l1p n GLY 85 Ca 0.15 0.15 -0.46 0.00 0.00 0.00 0.00 46.02 45.85 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 -6.58 3.28 -0.60 1.61 2.36 -0.41 -4.82 119.74 114.58 1l1p s LYS 86 Ca 0.14 -2.02 -0.26 0.00 -2.55 0.00 0.00 55.97 51.27 1l1p s LYS 86 Cb -0.07 -4.37 0.04 0.00 -1.05 0.00 0.00 37.83 32.37 1l1p s LYS 86 CO 0.89 -1.34 1.11 0.00 1.55 0.00 0.00 175.35 177.56 1l1p s ALA 87 N 1.06 3.01 0.06 3.13 0.00 -1.26 -2.80 121.76 124.97 1l1p s ALA 87 Ca 0.11 -1.12 0.01 0.00 0.00 0.00 0.00 51.96 50.97 1l1p s ALA 87 Cb -0.20 -3.97 -0.00 0.00 0.00 0.00 0.00 23.12 18.95 1l1p s ALA 87 CO -0.02 -2.69 0.04 0.00 0.00 0.00 0.00 175.76 173.09 1l1p n ALA 88 N 8.24 0.12 -2.60 0.00 0.00 0.36 -4.45 120.51 122.18 1l1p n ALA 88 Ca 0.05 -0.35 -0.24 0.00 0.00 0.00 0.00 53.44 52.90 1l1p n ALA 88 Cb 0.48 0.27 -0.15 0.00 0.00 0.00 0.00 19.45 20.05 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 -2.25 1.32 0.06 0.00 3.01 0.23 -1.31 119.74 120.81 1l1p s LYS 89 Ca 0.06 -0.56 0.02 0.00 -1.01 0.00 0.00 55.97 54.48 1l1p s LYS 89 Cb 0.00 -1.26 -0.03 0.00 -1.01 0.00 0.00 37.83 35.53 1l1p s LYS 89 CO 0.04 0.32 -0.06 -0.06 0.51 0.00 0.00 175.35 176.09 1l1p s PHE 90 N -0.29 0.71 -0.30 3.18 0.08 -0.68 -1.43 117.98 119.26 1l1p s PHE 90 Ca 0.04 -0.73 0.02 0.00 0.12 0.00 0.00 56.93 56.39 1l1p s PHE 90 Cb -0.07 -0.43 0.09 0.00 -0.57 0.00 0.00 43.02 42.04 1l1p s PHE 90 CO -0.00 -0.15 0.02 0.00 -0.10 0.00 0.00 175.22 174.99 1l1p s ALA 91 N -2.56 2.33 0.29 5.36 0.00 -1.02 -1.03 121.76 125.14 1l1p s ALA 91 Ca 0.00 -1.98 0.06 0.00 0.00 0.00 0.00 51.96 50.04 1l1p s ALA 91 Cb -0.02 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 1l1p s ALA 91 CO -0.03 -1.52 0.36 0.42 0.00 0.00 0.00 175.76 175.00 1l1p s ILE 92 N 1.20 4.41 -0.25 0.00 1.01 0.40 -1.24 121.20 126.73 1l1p s ILE 92 Ca 0.05 -1.12 -0.03 0.00 0.00 0.00 0.00 60.65 59.55 1l1p s ILE 92 Cb -0.19 -3.51 0.08 0.00 0.01 0.00 0.00 42.46 38.86 1l1p s ILE 92 CO -0.11 -0.24 0.08 0.21 0.00 0.00 0.00 174.94 174.88 1l1p s ASN 93 N -4.03 3.34 0.74 3.58 2.47 0.10 0.15 114.94 121.29 1l1p s ASN 93 Ca 0.39 -1.16 -0.13 0.00 0.42 0.00 0.00 52.86 52.38 1l1p s ASN 93 Cb -0.08 -0.58 0.05 0.00 -1.45 0.00 0.00 41.25 39.18 1l1p s ASN 93 CO 0.29 -0.38 1.14 -0.22 -3.72 0.00 0.00 177.10 174.21 1l1p s LEU 94 N 1.88 3.20 0.00 3.21 2.96 0.30 -1.81 118.68 128.41 1l1p s LEU 94 Ca 0.05 2.08 0.00 0.00 -0.22 0.00 0.00 54.13 56.04 1l1p s LEU 94 Cb -0.17 -4.56 0.00 0.00 0.50 0.00 0.00 46.19 41.97 1l1p s LEU 94 CO -0.20 -2.12 0.00 0.29 -1.32 0.00 0.00 176.35 172.99 1l1p n LYS 95 N -3.04 0.00 -2.30 1.98 5.02 0.15 -0.42 118.16 119.55 1l1p n LYS 95 Ca 0.11 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.99 1l1p n LYS 95 Cb 0.52 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 1.64 3.10 -0.37 1.97 1.02 -1.18 -3.32 119.74 122.60 1l1p s LYS 96 Ca 0.00 0.44 -0.05 0.00 0.02 0.00 0.00 55.97 56.39 1l1p s LYS 96 Cb 0.00 -4.21 0.07 0.00 -0.52 0.00 0.00 37.83 33.17 1l1p s LYS 96 CO 0.00 -2.18 0.14 0.54 -0.92 0.00 0.00 175.35 172.93 1l1p s VAL 97 N 6.87 3.49 0.31 3.17 0.11 -1.26 0.87 120.40 133.97 1l1p s VAL 97 Ca 0.55 -1.57 0.02 0.00 -2.93 0.00 0.00 61.98 58.05 1l1p s VAL 97 Cb -0.12 -3.16 -0.01 0.00 -1.53 0.00 0.00 36.38 31.57 1l1p s VAL 97 CO 0.23 -0.40 0.06 -0.62 -3.33 0.00 0.00 175.10 171.03 1l1p n GLU 98 N 4.71 0.89 -3.57 1.54 4.71 -1.22 -4.37 120.64 123.33 1l1p n GLU 98 Ca -0.09 -2.47 -0.40 0.00 -0.01 0.00 0.00 57.16 54.19 1l1p n GLU 98 Cb 0.43 1.04 -0.07 0.00 -1.01 0.00 0.00 31.44 31.83 1l1p n GLU 98 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1l1p s GLU 99 N -3.16 3.00 1.11 3.49 2.12 -1.26 -2.96 118.70 121.03 1l1p s GLU 99 Ca 0.08 -2.55 -0.17 0.00 0.36 0.00 0.00 54.97 52.69 1l1p s GLU 99 Cb 0.00 -4.01 0.25 0.00 0.26 0.00 0.00 34.13 30.63 1l1p s GLU 99 CO 0.06 -1.22 1.15 -0.98 -0.54 0.00 0.00 175.26 173.73 1l1p s ARG 100 N -0.06 -0.49 0.00 4.30 1.70 -1.26 -2.84 118.95 120.31 1l1p s ARG 100 Ca 0.18 -0.04 0.00 0.00 -0.47 0.00 0.00 55.73 55.40 1l1p s ARG 100 Cb -0.16 -1.68 0.00 0.00 -0.57 0.00 0.00 34.95 32.54 1l1p s ARG 100 CO -0.06 -3.23 0.00 -1.91 -1.08 0.00 0.00 175.30 169.03 1l1p n GLU 101 N -4.42 0.00 -3.46 3.89 2.13 -1.26 -4.69 120.64 112.83 1l1p n GLU 101 Ca 0.12 0.00 -0.43 0.00 0.66 0.00 0.00 57.16 57.51 1l1p n GLU 101 Cb 0.59 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.25 1l1p n GLU 101 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1l1p s LEU 102 N 0.00 6.17 -0.28 4.31 0.20 -1.26 -4.68 118.68 123.14 1l1p s LEU 102 Ca 0.00 -2.53 -0.29 0.00 0.69 0.00 0.00 54.13 52.01 1l1p s LEU 102 Cb 0.00 -2.09 -0.02 0.00 -0.43 0.00 0.00 46.19 43.65 1l1p s LEU 102 CO 0.00 -0.57 1.70 -2.16 -0.29 0.00 0.00 176.35 175.03 1l1p s PRO 103 N 0.43 3.56 -0.14 0.98 0.04 -1.26 -4.99 135.00 133.62 1l1p s PRO 103 Ca 0.14 1.51 -0.09 0.00 0.04 0.00 0.00 61.00 62.61 1l1p s PRO 103 Cb -0.17 -4.12 -0.04 0.00 0.04 0.00 0.00 34.50 30.21 1l1p s PRO 103 CO -0.05 -1.58 0.16 -2.00 0.04 0.00 0.00 177.00 173.57 1l1p s GLU 104 N 5.17 3.72 -0.82 4.56 2.12 -1.26 -5.05 118.70 127.14 1l1p s GLU 104 Ca 0.75 -0.12 -0.05 0.00 0.36 0.00 0.00 54.97 55.92 1l1p s GLU 104 Cb -0.23 -3.27 0.21 0.00 0.26 0.00 0.00 34.13 31.10 1l1p s GLU 104 CO 0.32 0.61 0.70 -1.17 -0.54 0.00 0.00 175.26 175.18 1l1p s LEU 105 N -0.56 5.73 0.00 2.70 1.98 -1.26 -5.34 118.68 121.93 1l1p s LEU 105 Ca 0.14 -3.25 0.31 0.00 -2.89 0.00 0.00 54.13 48.44 1l1p s LEU 105 Cb -0.12 -1.97 1.76 0.00 0.66 0.00 0.00 46.19 46.51 1l1p s LEU 105 CO 0.03 -0.32 2.14 0.35 -1.89 0.00 0.00 176.35 176.66