#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1p s SER 2 N 0.00 0.12 -0.09 1.61 0.01 -1.26 -5.16 113.70 108.93 1l1p s SER 2 Ca 0.00 -1.29 0.03 0.00 1.31 0.00 0.00 55.95 56.00 1l1p s SER 2 Cb 0.00 0.43 -0.01 0.00 0.21 0.00 0.00 66.02 66.65 1l1p s SER 2 CO 0.00 -0.92 -0.18 -2.28 0.41 0.00 0.00 173.24 170.28 1l1p s HIS 3 N -4.11 2.66 0.02 2.43 5.04 -1.26 -5.12 115.29 114.95 1l1p s HIS 3 Ca 0.35 -0.61 0.05 0.00 -1.54 0.00 0.00 55.06 53.32 1l1p s HIS 3 Cb 0.05 -1.72 -0.03 0.00 0.04 0.00 0.00 32.58 30.92 1l1p s HIS 3 CO 0.12 -0.15 -0.13 -1.64 -2.34 0.00 0.00 174.74 170.60 1l1p s MET 4 N -0.03 2.28 0.44 2.88 -1.94 -1.26 -5.11 119.30 116.57 1l1p s MET 4 Ca -0.05 -0.87 -0.24 0.00 -1.71 0.00 0.00 55.69 52.82 1l1p s MET 4 Cb -0.14 -2.33 -0.08 0.00 2.01 0.00 0.00 34.83 34.29 1l1p s MET 4 CO 0.04 0.57 1.18 -0.65 -0.01 0.00 0.00 175.02 176.15 1l1p s GLN 5 N -1.43 3.85 0.45 2.03 1.11 -1.26 -5.02 119.66 119.39 1l1p s GLN 5 Ca 0.16 1.84 -0.16 0.00 0.01 0.00 0.00 55.36 57.21 1l1p s GLN 5 Cb -0.11 -2.52 -0.08 0.00 -1.01 0.00 0.00 33.01 29.29 1l1p s GLN 5 CO 0.06 -0.49 0.89 0.00 0.01 0.00 0.00 175.29 175.77 1l1p s ALA 6 N -1.47 3.16 -0.08 6.09 0.00 -1.26 -5.08 121.76 123.13 1l1p s ALA 6 Ca 0.61 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.72 1l1p s ALA 6 Cb -0.30 -2.98 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1l1p s ALA 6 CO 0.37 -0.04 -0.20 0.99 0.00 0.00 0.00 175.76 176.88 1l1p s THR 7 N -2.40 2.48 0.04 0.00 2.01 -1.26 -5.13 115.64 111.38 1l1p s THR 7 Ca 0.57 -0.90 -0.00 0.00 0.31 0.00 0.00 61.69 61.66 1l1p s THR 7 Cb -0.10 -1.96 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 1l1p s THR 7 CO 0.26 0.56 -0.03 0.26 -0.69 0.00 0.00 174.62 174.98 1l1p s TRP 8 N -0.10 0.44 -0.23 4.92 0.52 -1.26 -4.70 118.94 118.52 1l1p s TRP 8 Ca -0.04 -0.83 0.19 0.00 0.02 0.00 0.00 56.10 55.44 1l1p s TRP 8 Cb -0.14 -0.32 0.44 0.00 -1.15 0.00 0.00 33.47 32.30 1l1p s TRP 8 CO 0.04 -0.29 1.23 0.36 0.02 0.00 0.00 176.95 178.31 1l1p n LYS 9 N 0.73 1.28 -1.77 4.98 2.85 -1.26 -4.98 118.16 119.99 1l1p n LYS 9 Ca -0.18 -2.51 -0.41 0.00 -1.05 0.00 0.00 58.31 54.16 1l1p n LYS 9 Cb 0.58 -0.70 0.01 0.00 -0.65 0.00 0.00 35.03 34.27 1l1p n LYS 9 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1l1p n GLU 10 N -0.66 2.51 0.00 -1.58 0.00 -1.23 -4.62 120.64 115.06 1l1p n GLU 10 Ca -0.02 0.88 0.00 0.00 0.00 0.00 0.00 57.16 58.02 1l1p n GLU 10 Cb 0.86 -2.64 0.00 0.00 0.00 0.00 0.00 31.44 29.66 1l1p n GLU 10 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1l1p n LYS 11 N 0.22 1.07 -0.30 3.44 4.76 -0.99 -4.74 118.16 121.62 1l1p n LYS 11 Ca 0.03 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.51 1l1p n LYS 11 Cb 0.40 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.65 1l1p n LYS 11 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1l1p n ASP 12 N 0.00 1.08 0.00 4.39 2.03 -1.26 -4.52 116.55 118.26 1l1p n ASP 12 Ca 0.00 -2.49 0.00 0.00 0.52 0.00 0.00 54.79 52.82 1l1p n ASP 12 Cb 0.00 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.10 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l1p n GLY 13 N -0.66 4.71 0.00 0.27 0.00 -1.26 -5.06 105.19 103.19 1l1p n GLY 13 Ca 0.07 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.59 4.61 0.00 -1.26 -4.30 120.51 114.97 1l1p n ALA 14 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 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 -0.90 2.94 0.13 0.00 0.11 0.15 -4.41 120.40 118.41 1l1p s VAL 15 Ca 0.00 0.50 0.02 0.00 -2.93 0.00 0.00 61.98 59.57 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 -0.20 -0.05 -1.61 -3.33 0.00 0.00 175.10 169.91 1l1p s GLU 16 N -3.71 0.94 0.00 1.54 2.02 -1.26 -4.98 118.70 113.24 1l1p s GLU 16 Ca 0.72 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 54.30 1l1p s GLU 16 Cb -0.25 -0.25 0.00 0.00 0.10 0.00 0.00 34.13 33.73 1l1p s GLU 16 CO 0.37 -0.05 0.05 0.00 0.02 0.00 0.00 175.26 175.65 1l1p n ALA 17 N -0.12 0.00 -3.32 5.21 0.00 -1.26 -1.66 120.51 119.36 1l1p n ALA 17 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.05 1l1p n ALA 17 Cb 0.62 0.02 -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 -1.44 2.83 -1.01 0.00 4.71 -1.20 -4.29 120.64 120.24 1l1p n GLU 18 Ca 0.00 -4.69 0.00 0.00 -0.01 0.00 0.00 57.16 52.46 1l1p n GLU 18 Cb 0.00 -2.28 0.00 0.00 -1.01 0.00 0.00 31.44 28.15 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1l1p n ASP 19 N 0.73 0.03 -3.61 1.62 5.75 -0.66 -4.31 116.55 116.10 1l1p n ASP 19 Ca 0.30 -0.99 -0.19 0.00 -0.01 0.00 0.00 54.79 53.90 1l1p n ASP 19 Cb 0.40 0.00 -0.15 0.00 -1.03 0.00 0.00 41.12 40.34 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1l1p s ARG 20 N -1.96 0.07 0.49 0.11 1.81 -0.47 0.16 118.95 119.16 1l1p s ARG 20 Ca 0.00 0.33 0.01 0.00 -1.72 0.00 0.00 55.73 54.36 1l1p s ARG 20 Cb 0.00 -0.83 0.01 0.00 -0.45 0.00 0.00 34.95 33.68 1l1p s ARG 20 CO 0.00 -0.47 0.70 0.14 -0.68 0.00 0.00 175.30 175.00 1l1p s VAL 21 N 2.26 3.40 -0.24 3.52 -7.23 0.24 -3.17 120.40 119.18 1l1p s VAL 21 Ca 0.04 -0.60 0.01 0.00 -1.81 0.00 0.00 61.98 59.61 1l1p s VAL 21 Cb -0.14 -3.26 0.04 0.00 0.56 0.00 0.00 36.38 33.59 1l1p s VAL 21 CO -0.08 -0.17 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.54 1l1p s THR 22 N -2.62 2.41 0.11 5.32 2.01 0.34 -0.35 115.64 122.87 1l1p s THR 22 Ca 0.52 -1.28 0.05 0.00 0.31 0.00 0.00 61.69 61.29 1l1p s THR 22 Cb -0.10 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 1l1p s THR 22 CO 0.38 0.16 -0.13 0.27 -0.69 0.00 0.00 174.62 174.61 1l1p s ILE 23 N 1.22 1.19 -0.12 1.82 -4.36 -0.05 -0.29 121.20 120.61 1l1p s ILE 23 Ca -0.03 -1.67 0.02 0.00 -0.26 0.00 0.00 60.65 58.71 1l1p s ILE 23 Cb -0.17 -1.45 0.01 0.00 1.25 0.00 0.00 42.46 42.10 1l1p s ILE 23 CO -0.06 -0.45 -0.18 1.51 0.24 0.00 0.00 174.94 176.00 1l1p s ASP 24 N -2.41 2.69 0.22 4.36 -4.77 -0.72 0.11 116.67 116.16 1l1p s ASP 24 Ca 0.07 -0.49 -0.04 0.00 -3.30 0.00 0.00 52.55 48.79 1l1p s ASP 24 Cb -0.05 -1.22 -0.03 0.00 -1.09 0.00 0.00 42.92 40.53 1l1p s ASP 24 CO 0.02 0.04 0.23 0.72 0.70 0.00 0.00 175.17 176.89 1l1p s PHE 25 N 0.90 0.96 -0.21 2.11 -0.12 0.35 0.50 117.98 122.48 1l1p s PHE 25 Ca -0.07 -1.21 -0.05 0.00 -0.05 0.00 0.00 56.93 55.54 1l1p s PHE 25 Cb -0.15 -0.36 0.10 0.00 -0.63 0.00 0.00 43.02 41.98 1l1p s PHE 25 CO -0.01 -0.75 0.39 0.99 -0.05 0.00 0.00 175.22 175.79 1l1p s THR 26 N -4.08 -0.62 0.28 -4.49 2.01 -0.25 0.18 115.64 108.67 1l1p s THR 26 Ca 0.34 0.11 -0.18 0.00 0.31 0.00 0.00 61.69 62.28 1l1p s THR 26 Cb 0.05 -0.69 0.01 0.00 0.01 0.00 0.00 72.50 71.88 1l1p s THR 26 CO 0.12 0.02 0.64 -0.83 -0.69 0.00 0.00 174.62 173.87 1l1p s GLY 27 N 2.58 0.18 0.41 4.40 0.00 0.31 -2.64 107.32 112.56 1l1p s GLY 27 Ca 0.03 -0.55 0.08 0.00 0.00 0.00 0.00 44.72 44.27 1l1p s GLY 27 CO -0.13 -0.30 0.27 -0.56 0.00 0.00 0.00 173.10 172.37 1l1p s SER 28 N -2.97 4.74 0.00 1.64 0.01 -0.57 -4.00 113.70 112.55 1l1p s SER 28 Ca 0.15 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.52 1l1p s SER 28 Cb -0.04 -0.55 0.00 0.00 0.21 0.00 0.00 66.02 65.64 1l1p s SER 28 CO 0.08 -0.57 0.00 0.55 0.41 0.00 0.00 173.24 173.71 1l1p n VAL 29 N -1.37 0.00 -1.07 3.43 3.14 -1.21 0.11 118.33 121.36 1l1p n VAL 29 Ca 0.01 0.16 -0.26 0.00 -2.96 0.00 0.00 64.34 61.29 1l1p n VAL 29 Cb 0.63 -1.08 0.08 0.00 -1.06 0.00 0.00 33.84 32.41 1l1p n VAL 29 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1l1p n ASP 30 N -2.13 6.38 0.00 6.55 8.00 -1.26 -4.62 116.55 129.47 1l1p n ASP 30 Ca 0.00 -3.46 0.00 0.00 0.71 0.00 0.00 54.79 52.04 1l1p n ASP 30 Cb 0.00 -0.95 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 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 -0.52 1.24 2.83 0.44 0.00 -1.26 -5.02 105.19 102.89 1l1p n GLY 31 Ca 0.50 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.29 1l1p n GLY 31 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1l1p s GLU 32 N -0.83 0.85 -0.00 1.61 2.02 -1.26 -4.94 118.70 116.15 1l1p s GLU 32 Ca 0.00 -0.02 -0.33 0.00 0.02 0.00 0.00 54.97 54.64 1l1p s GLU 32 Cb 0.00 -1.06 -0.11 0.00 0.10 0.00 0.00 34.13 33.06 1l1p s GLU 32 CO 0.00 -0.24 1.87 -0.85 0.02 0.00 0.00 175.26 176.07 1l1p n GLU 33 N 4.81 2.44 0.00 1.61 0.00 -1.26 -3.29 120.64 124.95 1l1p n GLU 33 Ca -0.13 0.89 0.00 0.00 0.00 0.00 0.00 57.16 57.93 1l1p n GLU 33 Cb 0.50 -2.77 0.00 0.00 0.00 0.00 0.00 31.44 29.18 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 6.42 0.00 0.18 -1.84 -1.74 -1.26 -4.76 117.46 114.46 1l1p n PHE 34 Ca 0.21 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.99 1l1p n PHE 34 Cb 0.33 0.00 -0.06 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 -0.51 0.00 3.97 5.08 -1.96 -3.19 114.58 117.98 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 -0.24 0.00 0.41 -1.00 0.00 0.00 179.01 178.18 1l1p n GLY 36 N 0.18 -0.92 0.00 -3.84 0.00 -1.26 -4.01 105.19 95.35 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 0.44 -0.39 3.23 -0.02 0.00 -1.21 -4.31 105.19 102.93 1l1p n GLY 37 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.77 0.31 0.04 1.61 0.00 -1.26 0.12 119.74 117.78 1l1p s LYS 38 Ca 0.00 0.95 0.03 0.00 0.00 0.00 0.00 55.97 56.95 1l1p s LYS 38 Cb 0.00 0.22 -0.02 0.00 0.00 0.00 0.00 37.83 38.03 1l1p s LYS 38 CO 0.00 -0.24 -0.10 0.00 0.00 0.00 0.00 175.35 175.01 1l1p s ALA 39 N 2.36 0.80 0.02 0.59 0.00 0.48 -4.96 121.76 121.04 1l1p s ALA 39 Ca -0.03 -0.71 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 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 -0.12 0.10 -0.09 -1.13 0.00 0.00 0.00 175.76 174.51 1l1p n SER 40 N 1.84 1.24 -3.96 0.00 3.41 -1.26 0.13 113.62 115.02 1l1p n SER 40 Ca -0.19 0.18 -0.41 0.00 -0.26 0.00 0.00 58.87 58.19 1l1p n SER 40 Cb 0.55 -0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1l1p n SER 40 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1l1p n ASP 41 N -3.70 5.91 -4.44 4.04 8.00 -1.25 -2.49 116.55 122.62 1l1p n ASP 41 Ca -0.05 -3.37 -0.44 0.00 0.71 0.00 0.00 54.79 51.64 1l1p n ASP 41 Cb 0.19 -1.19 -0.05 0.00 -0.02 0.00 0.00 41.12 40.05 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 -2.57 2.91 -0.80 1.24 5.36 0.31 -4.87 117.98 119.57 1l1p s PHE 42 Ca 0.32 -0.58 -0.26 0.00 -0.96 0.00 0.00 56.93 55.46 1l1p s PHE 42 Cb 0.04 -3.91 0.04 0.00 -0.34 0.00 0.00 43.02 38.85 1l1p s PHE 42 CO 0.07 -1.29 1.29 0.54 -1.46 0.00 0.00 175.22 174.37 1l1p s VAL 43 N 3.16 3.84 0.08 3.12 0.11 -1.26 -0.87 120.40 128.58 1l1p s VAL 43 Ca 0.18 0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 59.08 1l1p s VAL 43 Cb -0.19 -4.93 -0.07 0.00 -1.53 0.00 0.00 36.38 29.66 1l1p s VAL 43 CO 0.11 -1.84 0.56 -0.22 -3.33 0.00 0.00 175.10 170.38 1l1p s LEU 44 N 5.36 4.50 -0.43 2.54 0.20 0.53 -4.87 118.68 126.50 1l1p s LEU 44 Ca 0.36 1.23 -0.10 0.00 0.69 0.00 0.00 54.13 56.31 1l1p s LEU 44 Cb -0.07 -2.93 0.08 0.00 -0.43 0.00 0.00 46.19 42.84 1l1p s LEU 44 CO 0.08 0.26 0.29 0.00 -0.29 0.00 0.00 176.35 176.69 1l1p s ALA 45 N -1.15 3.35 -1.00 5.97 0.00 -1.26 0.79 121.76 128.46 1l1p s ALA 45 Ca 0.30 -2.16 -0.24 0.00 0.00 0.00 0.00 51.96 49.87 1l1p s ALA 45 Cb -0.19 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 1l1p s ALA 45 CO 0.19 -1.68 1.88 -1.64 0.00 0.00 0.00 175.76 174.51 1l1p s MET 46 N 1.47 2.73 0.00 0.00 -1.94 0.42 -3.46 119.30 118.52 1l1p s MET 46 Ca 0.03 -0.68 0.00 0.00 -1.71 0.00 0.00 55.69 53.33 1l1p s MET 46 Cb -0.23 -5.16 0.00 0.00 2.01 0.00 0.00 34.83 31.44 1l1p s MET 46 CO 0.03 -3.34 0.00 0.41 -0.01 0.00 0.00 175.02 172.11 1l1p n GLY 47 N 6.53 0.84 1.12 -0.03 0.00 -1.26 -2.40 105.19 109.99 1l1p n GLY 47 Ca 0.41 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.13 0.00 -0.11 1.61 7.27 -1.22 -4.65 117.38 120.15 1l1p n GLN 48 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 57.00 56.89 1l1p n GLN 48 Cb 0.05 -0.07 -0.06 0.00 2.41 0.00 0.00 30.24 32.57 1l1p n GLN 48 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1l1p n GLY 49 N 3.27 -0.54 0.00 1.69 0.00 -1.26 -4.98 105.19 103.37 1l1p n GLY 49 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -5.10 116.66 107.92 1l1p n ARG 50 Ca -0.32 0.00 -0.57 0.00 -1.00 0.00 0.00 57.85 55.97 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 0.62 -1.14 2.89 1.56 -1.26 -4.90 117.12 114.88 1l1p n MET 51 Ca 0.00 0.19 -0.31 0.00 -0.27 0.00 0.00 57.70 57.31 1l1p n MET 51 Cb 0.00 -1.97 0.11 0.00 2.15 0.00 0.00 33.22 33.51 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 5.72 3.02 0.63 1.12 -4.36 -1.26 -4.73 121.20 121.34 1l1p s ILE 52 Ca 1.11 0.33 0.43 0.00 -0.26 0.00 0.00 60.65 62.26 1l1p s ILE 52 Cb -1.18 -2.73 0.44 0.00 1.25 0.00 0.00 42.46 40.24 1l1p s ILE 52 CO 0.61 -0.43 2.35 1.55 0.24 0.00 0.00 174.94 179.26 1l1p h PRO 53 N -1.32 0.00 0.57 0.37 0.13 -1.93 -0.59 132.00 129.24 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 -0.28 0.78 -0.23 0.00 0.00 178.00 178.77 1l1p h GLY 54 N 0.13 -0.80 0.74 1.56 0.00 -1.91 -2.54 103.07 100.25 1l1p h GLY 54 Ca -0.00 0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.54 1l1p h GLY 54 CO 0.00 -0.29 -0.25 0.74 0.00 0.00 0.00 176.54 176.74 1l1p h PHE 55 N -1.16 0.48 -0.09 5.60 0.04 -1.69 -2.91 116.94 117.21 1l1p h PHE 55 Ca -0.08 -0.18 0.03 0.00 2.80 0.00 0.00 57.97 60.54 1l1p h PHE 55 Cb 0.62 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 1l1p h PHE 55 CO 0.00 0.87 0.35 1.49 -0.60 0.00 0.00 178.31 180.42 1l1p h GLU 56 N -0.04 0.00 0.00 1.51 4.22 -1.23 0.67 114.58 119.72 1l1p h GLU 56 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1l1p h GLU 56 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1l1p h GLU 56 CO 0.06 0.00 0.00 -3.47 -2.18 0.00 0.00 179.01 173.42 1l1p n ASP 57 N -3.09 0.00 0.15 1.04 -0.08 -0.96 -3.64 116.55 109.97 1l1p n ASP 57 Ca 0.00 0.08 -0.14 0.00 -1.51 0.00 0.00 54.79 53.22 1l1p n ASP 57 Cb 0.43 -0.08 -0.08 0.00 2.34 0.00 0.00 41.12 43.73 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 -0.38 -2.71 0.27 0.00 -1.50 -2.92 103.07 95.84 1l1p h GLY 58 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.45 1l1p h GLY 58 CO 0.00 -0.14 0.02 1.39 0.00 0.00 0.00 176.54 177.82 1l1p n ILE 59 N -5.15 1.72 -0.10 2.60 -0.00 0.22 -4.26 119.36 114.39 1l1p n ILE 59 Ca -0.10 -0.40 -0.06 0.00 -0.00 0.00 0.00 62.75 62.20 1l1p n ILE 59 Cb 0.23 -1.32 0.00 0.00 -0.00 0.00 0.00 39.64 38.55 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 0.70 -0.08 0.00 0.38 2.10 -1.48 -3.43 116.57 114.77 1l1p h LYS 60 Ca 0.02 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1l1p h LYS 60 Cb 1.01 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.36 1l1p h LYS 60 CO 0.04 -0.05 0.00 0.41 -2.00 0.00 0.00 179.45 177.85 1l1p n GLY 61 N -1.33 0.82 0.00 0.07 0.00 -1.26 -4.81 105.19 98.68 1l1p n GLY 61 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1l1p n GLY 61 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1l1p n HIS 62 N 0.00 0.00 -3.37 1.61 1.44 -1.26 0.33 115.22 113.96 1l1p n HIS 62 Ca 0.00 -0.25 -0.25 0.00 -2.01 0.00 0.00 57.72 55.22 1l1p n HIS 62 Cb 0.00 -0.02 -0.10 0.00 0.12 0.00 0.00 29.99 29.99 1l1p n HIS 62 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1l1p s LYS 63 N -0.49 0.74 -0.60 -1.40 -0.14 -1.26 -5.01 119.74 111.58 1l1p s LYS 63 Ca 0.00 -1.59 -0.26 0.00 -1.36 0.00 0.00 55.97 52.76 1l1p s LYS 63 Cb 0.00 -1.19 -0.10 0.00 -1.68 0.00 0.00 37.83 34.86 1l1p s LYS 63 CO 0.00 -1.29 2.42 0.00 -0.76 0.00 0.00 175.35 175.71 1l1p s ALA 64 N 0.67 1.27 0.00 5.17 0.00 -1.25 -1.80 121.76 125.80 1l1p s ALA 64 Ca 0.25 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.94 1l1p s ALA 64 Cb -0.09 -4.43 0.00 0.00 0.00 0.00 0.00 23.12 18.60 1l1p s ALA 64 CO -0.09 -5.02 0.00 0.41 0.00 0.00 0.00 175.76 171.06 1l1p n GLY 65 N 6.30 1.26 3.99 0.00 0.00 -0.02 -4.81 105.19 111.93 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 2.96 -0.22 1.61 2.56 0.84 -4.84 118.70 121.36 1l1p s GLU 66 Ca 0.00 -1.02 -0.02 0.00 0.00 0.00 0.00 54.97 53.92 1l1p s GLU 66 Cb 0.00 -2.74 0.07 0.00 2.00 0.00 0.00 34.13 33.45 1l1p s GLU 66 CO 0.00 -0.16 0.04 -1.83 -0.56 0.00 0.00 175.26 172.75 1l1p s GLU 67 N -4.33 0.74 0.16 4.30 -1.05 -1.26 0.13 118.70 117.39 1l1p s GLU 67 Ca 0.50 -0.59 -0.01 0.00 -0.15 0.00 0.00 54.97 54.72 1l1p s GLU 67 Cb -0.10 -2.11 -0.04 0.00 -0.44 0.00 0.00 34.13 31.44 1l1p s GLU 67 CO 0.33 -0.70 0.09 -0.59 0.95 0.00 0.00 175.26 175.34 1l1p s PHE 68 N 1.78 0.94 -0.09 4.83 -0.12 0.43 -4.95 117.98 120.79 1l1p s PHE 68 Ca 0.01 -1.26 0.02 0.00 -0.05 0.00 0.00 56.93 55.65 1l1p s PHE 68 Cb -0.17 -0.49 0.01 0.00 -0.63 0.00 0.00 43.02 41.74 1l1p s PHE 68 CO -0.11 -0.57 -0.16 0.99 -0.05 0.00 0.00 175.22 175.32 1l1p s THR 69 N -4.08 1.47 0.21 -4.49 2.01 -1.26 0.14 115.64 109.65 1l1p s THR 69 Ca 0.29 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1l1p s THR 69 Cb 0.07 -1.33 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 1l1p s THR 69 CO 0.05 0.43 0.07 0.27 -0.69 0.00 0.00 174.62 174.75 1l1p s ILE 70 N 0.71 0.47 0.16 1.82 -0.00 -0.15 -4.94 121.20 119.28 1l1p s ILE 70 Ca -0.13 -1.99 -0.06 0.00 -0.00 0.00 0.00 60.65 58.47 1l1p s ILE 70 Cb -0.16 -2.41 -0.06 0.00 -0.00 0.00 0.00 42.46 39.83 1l1p s ILE 70 CO 0.03 -0.19 0.42 -1.81 -0.00 0.00 0.00 174.94 173.39 1l1p s ASP 71 N -3.22 6.54 -0.09 4.36 1.11 -1.26 -1.71 116.67 122.40 1l1p s ASP 71 Ca 0.33 0.69 -0.05 0.00 0.18 0.00 0.00 52.55 53.70 1l1p s ASP 71 Cb 0.07 -2.13 0.04 0.00 1.07 0.00 0.00 42.92 41.97 1l1p s ASP 71 CO 0.09 0.03 0.21 0.68 1.18 0.00 0.00 175.17 177.36 1l1p s VAL 72 N -1.67 -0.03 -0.16 -1.27 -7.23 -0.56 -3.85 120.40 105.63 1l1p s VAL 72 Ca 0.42 0.13 -0.06 0.00 -1.81 0.00 0.00 61.98 60.65 1l1p s VAL 72 Cb -0.12 -0.32 0.07 0.00 0.56 0.00 0.00 36.38 36.57 1l1p s VAL 72 CO 0.23 0.05 0.33 -0.89 -0.31 0.00 0.00 175.10 174.51 1l1p s THR 73 N 0.99 -0.47 -0.05 5.32 2.01 -1.26 0.61 115.64 122.78 1l1p s THR 73 Ca -0.07 0.22 -0.25 0.00 0.31 0.00 0.00 61.69 61.90 1l1p s THR 73 Cb -0.09 -0.54 -0.04 0.00 0.01 0.00 0.00 72.50 71.85 1l1p s THR 73 CO -0.06 0.09 0.76 -0.36 -0.69 0.00 0.00 174.62 174.37 1l1p s PHE 74 N 2.40 3.60 1.09 4.92 0.40 -1.19 -4.92 117.98 124.28 1l1p s PHE 74 Ca -0.01 1.35 -0.15 0.00 -0.60 0.00 0.00 56.93 57.52 1l1p s PHE 74 Cb -0.12 -2.87 0.23 0.00 0.51 0.00 0.00 43.02 40.77 1l1p s PHE 74 CO -0.10 0.07 1.10 -1.25 0.70 0.00 0.00 175.22 175.73 1l1p s PRO 75 N 0.84 -0.33 0.08 0.24 0.04 -1.26 -4.12 135.00 130.49 1l1p s PRO 75 Ca 0.41 0.26 0.17 0.00 0.04 0.00 0.00 61.00 61.88 1l1p s PRO 75 Cb -0.18 -1.67 0.73 0.00 0.04 0.00 0.00 34.50 33.41 1l1p s PRO 75 CO 0.20 -3.19 1.54 -0.85 0.04 0.00 0.00 177.00 174.74 1l1p n GLU 76 N -4.45 0.06 0.04 4.56 0.28 -1.26 -2.52 120.64 117.35 1l1p n GLU 76 Ca 0.08 0.30 -0.16 0.00 -0.16 0.00 0.00 57.16 57.22 1l1p n GLU 76 Cb 0.58 -1.61 -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 0.21 0.03 3.44 4.39 -2.03 -3.40 114.58 117.23 1l1p h GLU 77 Ca 0.00 -0.37 -0.00 0.00 0.34 0.00 0.00 59.36 59.33 1l1p h GLU 77 Cb 0.28 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1l1p h GLU 77 CO 0.00 1.04 -0.02 -0.92 -1.16 0.00 0.00 179.01 177.95 1l1p h TYR 78 N 0.06 -0.04 -5.21 4.33 5.03 -1.84 -3.48 116.97 115.82 1l1p h TYR 78 Ca -0.29 -0.00 -0.27 0.00 2.58 0.00 0.00 58.73 60.76 1l1p h TYR 78 Cb 2.02 0.01 0.01 0.00 1.55 0.00 0.00 36.73 40.32 1l1p h TYR 78 CO 0.06 -0.03 -0.76 0.72 -1.32 0.00 0.00 178.16 176.83 1l1p n HIS 79 N -2.18 -1.58 -3.00 -3.82 8.25 -1.17 -4.91 115.22 106.82 1l1p n HIS 79 Ca -0.01 0.66 -0.34 0.00 -0.26 0.00 0.00 57.72 57.78 1l1p n HIS 79 Cb 0.02 -1.26 -0.06 0.00 1.12 0.00 0.00 29.99 29.80 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 -1.37 3.24 0.59 -1.41 0.00 -1.26 -4.65 121.76 116.90 1l1p s ALA 80 Ca 0.18 0.22 0.29 0.00 0.00 0.00 0.00 51.96 52.65 1l1p s ALA 80 Cb -0.02 -2.94 1.50 0.00 0.00 0.00 0.00 23.12 21.66 1l1p s ALA 80 CO 0.56 0.25 1.93 0.93 0.00 0.00 0.00 175.76 179.43 1l1p h GLU 81 N 2.43 0.00 0.05 0.00 4.39 -1.97 1.52 114.58 121.00 1l1p h GLU 81 Ca -0.48 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 58.85 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.78 1l1p h GLU 81 CO 0.64 0.00 -2.20 0.27 -1.16 0.00 0.00 179.01 176.56 1l1p n ASN 82 N -3.76 1.72 -0.35 1.42 6.94 -1.26 -4.70 115.26 115.26 1l1p n ASN 82 Ca 0.08 0.07 0.02 0.00 -0.02 0.00 0.00 54.58 54.73 1l1p n ASN 82 Cb 0.62 -0.41 0.03 0.00 -2.36 0.00 0.00 39.78 37.67 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 -3.27 0.55 -3.17 -4.53 -0.00 -0.99 -4.98 117.00 100.62 1l1p n LEU 83 Ca -0.36 -1.38 -0.43 0.00 -0.00 0.00 0.00 56.01 53.83 1l1p n LEU 83 Cb 1.04 -0.09 -0.06 0.00 -0.00 0.00 0.00 43.42 44.31 1l1p n LEU 83 CO 0.36 0.33 0.57 2.29 -0.00 0.00 0.00 177.39 180.95 1l1p n LYS 84 N -0.32 0.00 -3.76 1.47 2.85 0.52 -1.44 118.16 117.48 1l1p n LYS 84 Ca 0.03 0.00 -0.26 0.00 -1.05 0.00 0.00 58.31 57.03 1l1p n LYS 84 Cb 0.66 -1.03 0.02 0.00 -0.65 0.00 0.00 35.03 34.03 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 1.79 -0.54 3.34 2.58 0.00 -1.26 -4.77 105.19 106.33 1l1p n GLY 85 Ca 0.17 0.27 -0.47 0.00 0.00 0.00 0.00 46.02 45.99 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 -6.12 3.54 -0.84 1.61 2.47 -0.52 -4.82 119.74 115.07 1l1p s LYS 86 Ca 0.18 -2.32 -0.25 0.00 -1.56 0.00 0.00 55.97 52.02 1l1p s LYS 86 Cb -0.06 -4.45 0.02 0.00 -1.46 0.00 0.00 37.83 31.88 1l1p s LYS 86 CO 0.85 -1.34 1.47 0.00 0.16 0.00 0.00 175.35 176.50 1l1p s ALA 87 N 0.53 2.57 0.10 3.13 0.00 -1.26 -3.16 121.76 123.67 1l1p s ALA 87 Ca 0.18 -1.62 0.01 0.00 0.00 0.00 0.00 51.96 50.54 1l1p s ALA 87 Cb -0.12 -4.39 -0.01 0.00 0.00 0.00 0.00 23.12 18.61 1l1p s ALA 87 CO -0.08 -3.62 0.05 0.00 0.00 0.00 0.00 175.76 172.12 1l1p n ALA 88 N 10.02 0.17 -2.51 0.00 0.00 0.20 -4.54 120.51 123.86 1l1p n ALA 88 Ca 0.19 -0.54 -0.26 0.00 0.00 0.00 0.00 53.44 52.83 1l1p n ALA 88 Cb 0.50 0.39 -0.16 0.00 0.00 0.00 0.00 19.45 20.19 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 -2.39 1.57 0.06 0.00 3.01 0.29 -1.49 119.74 120.79 1l1p s LYS 89 Ca 0.08 -0.67 0.02 0.00 -1.01 0.00 0.00 55.97 54.38 1l1p s LYS 89 Cb 0.00 -1.50 -0.03 0.00 -1.01 0.00 0.00 37.83 35.29 1l1p s LYS 89 CO 0.05 0.39 -0.07 -0.06 0.51 0.00 0.00 175.35 176.18 1l1p s PHE 90 N -0.39 0.69 -0.30 3.18 0.08 -0.69 -1.51 117.98 119.04 1l1p s PHE 90 Ca 0.06 -0.68 0.02 0.00 0.12 0.00 0.00 56.93 56.45 1l1p s PHE 90 Cb -0.08 -0.42 0.09 0.00 -0.57 0.00 0.00 43.02 42.04 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 2.27 0.31 5.36 0.00 -1.08 -0.97 121.76 125.37 1l1p s ALA 91 Ca -0.02 -1.93 0.07 0.00 0.00 0.00 0.00 51.96 50.07 1l1p s ALA 91 Cb -0.04 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1l1p s ALA 91 CO -0.02 -1.50 0.36 0.42 0.00 0.00 0.00 175.76 175.01 1l1p s ILE 92 N 1.23 4.07 -0.25 0.00 1.01 0.38 -1.09 121.20 126.55 1l1p s ILE 92 Ca 0.04 -1.18 -0.03 0.00 0.00 0.00 0.00 60.65 59.49 1l1p s ILE 92 Cb -0.19 -3.38 0.08 0.00 0.01 0.00 0.00 42.46 38.98 1l1p s ILE 92 CO -0.11 -0.21 0.08 0.20 0.00 0.00 0.00 174.94 174.90 1l1p s ASN 93 N -4.04 3.39 0.77 3.58 0.01 0.18 0.16 114.94 118.98 1l1p s ASN 93 Ca 0.41 -1.18 -0.13 0.00 -0.71 0.00 0.00 52.86 51.24 1l1p s ASN 93 Cb -0.08 -0.62 0.06 0.00 0.41 0.00 0.00 41.25 41.03 1l1p s ASN 93 CO 0.28 -0.37 1.17 -0.22 -1.51 0.00 0.00 177.10 176.45 1l1p s LEU 94 N 1.84 3.19 0.00 0.60 2.96 0.35 -1.76 118.68 125.86 1l1p s LEU 94 Ca 0.05 2.22 0.00 0.00 -0.22 0.00 0.00 54.13 56.17 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 -0.20 -2.35 0.00 0.29 -1.32 0.00 0.00 176.35 172.77 1l1p n LYS 95 N -3.11 0.00 -2.19 1.98 5.02 0.60 -0.11 118.16 120.34 1l1p n LYS 95 Ca 0.12 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.01 1l1p n LYS 95 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.49 1l1p n LYS 95 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1l1p s LYS 96 N 2.05 3.03 -0.33 1.97 1.02 -1.17 -3.24 119.74 123.07 1l1p s LYS 96 Ca 0.00 0.64 -0.05 0.00 0.02 0.00 0.00 55.97 56.58 1l1p s LYS 96 Cb 0.00 -4.25 0.04 0.00 -0.52 0.00 0.00 37.83 33.11 1l1p s LYS 96 CO 0.00 -2.26 0.07 0.54 -0.92 0.00 0.00 175.35 172.78 1l1p s VAL 97 N 7.41 3.53 0.11 3.17 0.11 -1.26 0.13 120.40 133.60 1l1p s VAL 97 Ca 0.62 -1.21 -0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1l1p s VAL 97 Cb -0.13 -3.01 -0.04 0.00 -1.53 0.00 0.00 36.38 31.67 1l1p s VAL 97 CO 0.24 -0.16 0.01 -1.61 -3.33 0.00 0.00 175.10 170.26 1l1p s GLU 98 N 1.36 0.85 -0.69 1.54 8.01 -1.19 -4.33 118.70 124.24 1l1p s GLU 98 Ca -0.03 -1.38 -0.20 0.00 0.01 0.00 0.00 54.97 53.38 1l1p s GLU 98 Cb -0.20 0.12 0.10 0.00 -4.31 0.00 0.00 34.13 29.85 1l1p s GLU 98 CO 0.02 -0.18 0.88 -2.00 0.01 0.00 0.00 175.26 173.99 1l1p s GLU 99 N -3.97 3.20 0.90 1.61 -6.30 -1.26 -1.37 118.70 111.51 1l1p s GLU 99 Ca 0.18 -1.31 -0.12 0.00 -2.50 0.00 0.00 54.97 51.22 1l1p s GLU 99 Cb 0.07 -4.39 0.13 0.00 0.00 0.00 0.00 34.13 29.95 1l1p s GLU 99 CO -0.02 -1.67 1.13 -0.98 0.02 0.00 0.00 175.26 173.74 1l1p s ARG 100 N 3.01 1.20 -0.30 4.30 1.70 -1.26 -2.35 118.95 125.25 1l1p s ARG 100 Ca 0.19 0.37 -0.11 0.00 -0.47 0.00 0.00 55.73 55.71 1l1p s ARG 100 Cb -0.17 -1.84 0.18 0.00 -0.57 0.00 0.00 34.95 32.55 1l1p s ARG 100 CO 0.04 -2.17 1.01 -2.00 -1.08 0.00 0.00 175.30 171.10 1l1p s GLU 101 N -5.22 0.20 0.40 3.89 2.12 -1.26 -4.67 118.70 114.16 1l1p s GLU 101 Ca 0.63 0.30 -0.24 0.00 0.36 0.00 0.00 54.97 56.02 1l1p s GLU 101 Cb -0.15 0.16 -0.09 0.00 0.26 0.00 0.00 34.13 34.31 1l1p s GLU 101 CO 0.54 -0.28 1.07 -0.51 -0.54 0.00 0.00 175.26 175.54 1l1p s LEU 102 N 2.95 4.15 0.48 2.70 1.43 -1.26 -4.30 118.68 124.84 1l1p s LEU 102 Ca 0.09 2.09 -0.22 0.00 -1.03 0.00 0.00 54.13 55.06 1l1p s LEU 102 Cb -0.08 -4.15 -0.08 0.00 0.03 0.00 0.00 46.19 41.91 1l1p s LEU 102 CO -0.16 -0.52 1.02 -2.65 0.23 0.00 0.00 176.35 174.27 1l1p n PRO 103 N -0.03 1.27 -2.90 1.29 -0.02 -1.26 -4.92 135.00 128.43 1l1p n PRO 103 Ca 0.05 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.56 1l1p n PRO 103 Cb 0.49 -2.13 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 1l1p n PRO 103 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1l1p s GLU 104 N -2.29 3.13 -0.52 -0.52 2.12 -1.26 -5.00 118.70 114.36 1l1p s GLU 104 Ca 0.67 -0.96 -0.22 0.00 0.36 0.00 0.00 54.97 54.82 1l1p s GLU 104 Cb -0.50 -4.28 0.05 0.00 0.26 0.00 0.00 34.13 29.66 1l1p s GLU 104 CO 0.54 -1.78 0.78 -1.17 -0.54 0.00 0.00 175.26 173.09 1l1p s LEU 105 N 3.79 4.49 0.00 2.70 0.20 -1.26 -5.36 118.68 123.24 1l1p s LEU 105 Ca 0.21 -0.55 0.15 0.00 0.69 0.00 0.00 54.13 54.63 1l1p s LEU 105 Cb -0.17 -2.68 0.12 0.00 -0.43 0.00 0.00 46.19 43.03 1l1p s LEU 105 CO 0.08 -1.04 0.98 0.41 -0.29 0.00 0.00 176.35 176.49