#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 -0.10 1.17 1.61 0.01 -1.26 -5.16 113.70 109.98 1l1p s SER 2 Ca 0.00 0.22 -0.18 0.00 1.31 0.00 0.00 55.95 57.30 1l1p s SER 2 Cb 0.00 0.18 0.27 0.00 0.21 0.00 0.00 66.02 66.69 1l1p s SER 2 CO 0.00 -0.08 1.11 -1.00 0.41 0.00 0.00 173.24 173.68 1l1p s HIS 3 N 0.47 0.74 -0.01 2.43 4.02 -1.26 -5.04 115.29 116.64 1l1p s HIS 3 Ca -0.03 0.57 -0.04 0.00 1.02 0.00 0.00 55.06 56.58 1l1p s HIS 3 Cb -0.05 -3.42 -0.02 0.00 -1.02 0.00 0.00 32.58 28.07 1l1p s HIS 3 CO -0.02 -3.73 -0.08 -0.12 1.02 0.00 0.00 174.74 171.81 1l1p n MET 4 N -4.67 0.13 -2.76 1.40 0.00 -1.26 -5.03 117.12 104.92 1l1p n MET 4 Ca 0.12 0.05 -0.39 0.00 -0.00 0.00 0.00 57.70 57.48 1l1p n MET 4 Cb 0.59 -0.71 -0.06 0.00 0.00 0.00 0.00 33.22 33.03 1l1p n MET 4 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 175.97 177.11 1l1p s GLN 5 N -2.16 4.74 0.49 2.12 -2.07 -1.26 -5.04 119.66 116.47 1l1p s GLN 5 Ca -0.08 1.42 -0.18 0.00 -1.82 0.00 0.00 55.36 54.71 1l1p s GLN 5 Cb 0.02 -3.07 -0.09 0.00 -1.09 0.00 0.00 33.01 28.78 1l1p s GLN 5 CO 0.10 0.41 0.97 0.00 -1.32 0.00 0.00 175.29 175.46 1l1p s ALA 6 N -1.37 3.06 -0.03 2.60 0.00 -1.26 -5.07 121.76 119.69 1l1p s ALA 6 Ca 0.45 0.24 0.02 0.00 0.00 0.00 0.00 51.96 52.67 1l1p s ALA 6 Cb -0.23 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1l1p s ALA 6 CO 0.29 -0.13 -0.07 0.99 0.00 0.00 0.00 175.76 176.84 1l1p s THR 7 N -2.49 3.65 0.08 0.00 2.01 -1.26 -5.12 115.64 112.50 1l1p s THR 7 Ca 0.60 -0.63 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 1l1p s THR 7 Cb -0.10 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.85 1l1p s THR 7 CO 0.26 0.50 0.06 0.26 -0.69 0.00 0.00 174.62 175.01 1l1p s TRP 8 N -0.90 0.45 0.00 4.92 0.52 -1.26 -4.90 118.94 117.77 1l1p s TRP 8 Ca 0.15 -0.93 0.11 0.00 0.02 0.00 0.00 56.10 55.44 1l1p s TRP 8 Cb -0.11 -0.29 0.18 0.00 -1.15 0.00 0.00 33.47 32.10 1l1p s TRP 8 CO 0.04 -0.46 1.01 0.36 0.02 0.00 0.00 176.95 177.92 1l1p n LYS 9 N 0.02 0.00 -2.00 4.98 0.00 -1.26 -5.05 118.16 114.85 1l1p n LYS 9 Ca -0.13 -1.28 -0.41 0.00 -0.00 0.00 0.00 58.31 56.49 1l1p n LYS 9 Cb 0.62 -0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.63 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1l1p s GLU 10 N 0.00 4.25 0.00 -1.58 4.04 -1.23 -4.67 118.70 119.50 1l1p s GLU 10 Ca 0.14 2.33 0.00 0.00 0.04 0.00 0.00 54.97 57.48 1l1p s GLU 10 Cb 0.16 -3.02 0.00 0.00 0.02 0.00 0.00 34.13 31.29 1l1p s GLU 10 CO -0.07 -0.33 0.00 1.63 -1.84 0.00 0.00 175.26 174.65 1l1p n LYS 11 N 0.64 1.41 -0.27 -4.83 4.76 -1.08 -4.65 118.16 114.13 1l1p n LYS 11 Ca 0.01 0.00 0.05 0.00 -2.87 0.00 0.00 58.31 55.50 1l1p n LYS 11 Cb 0.41 0.00 0.07 0.00 -1.84 0.00 0.00 35.03 33.67 1l1p n LYS 11 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1l1p n ASP 12 N 0.00 1.23 0.00 4.39 5.75 -1.26 -4.28 116.55 122.38 1l1p n ASP 12 Ca 0.00 -2.57 0.00 0.00 -0.01 0.00 0.00 54.79 52.21 1l1p n ASP 12 Cb 0.00 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.77 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1l1p n GLY 13 N -0.75 3.81 0.86 6.12 0.00 -1.26 -5.02 105.19 108.95 1l1p n GLY 13 Ca 0.08 -1.98 -0.07 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.88 -1.55 4.61 0.00 -1.26 -4.21 120.51 114.22 1l1p n ALA 14 Ca 0.00 -0.40 -0.34 0.00 0.00 0.00 0.00 53.44 52.70 1l1p n ALA 14 Cb 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 19.45 19.47 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 -1.48 2.95 0.11 0.00 0.11 0.12 -4.35 120.40 117.86 1l1p s VAL 15 Ca 0.18 0.49 0.02 0.00 -2.93 0.00 0.00 61.98 59.73 1l1p s VAL 15 Cb -0.02 -3.05 -0.04 0.00 -1.53 0.00 0.00 36.38 31.74 1l1p s VAL 15 CO 0.14 -0.23 -0.07 -1.83 -3.33 0.00 0.00 175.10 169.78 1l1p s GLU 16 N -3.82 0.87 0.00 1.54 -1.05 -1.26 -5.01 118.70 109.98 1l1p s GLU 16 Ca 0.71 -1.36 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 1l1p s GLU 16 Cb -0.24 -0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.20 1l1p s GLU 16 CO 0.39 -0.02 0.06 0.00 0.95 0.00 0.00 175.26 176.64 1l1p n ALA 17 N -0.07 0.00 -3.28 -0.84 0.00 -1.26 -1.42 120.51 113.64 1l1p n ALA 17 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.04 1l1p n ALA 17 Cb 0.61 0.03 -0.06 0.00 0.00 0.00 0.00 19.45 20.02 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 -1.88 2.86 -0.77 0.00 0.28 -1.21 -4.31 120.64 115.61 1l1p n GLU 18 Ca 0.00 -4.71 0.00 0.00 -0.16 0.00 0.00 57.16 52.29 1l1p n GLU 18 Cb 0.00 -2.27 0.00 0.00 1.43 0.00 0.00 31.44 30.60 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1l1p n ASP 19 N 0.62 0.10 -3.59 -1.84 5.75 -0.51 -4.43 116.55 112.65 1l1p n ASP 19 Ca 0.30 -0.74 -0.16 0.00 -0.01 0.00 0.00 54.79 54.19 1l1p n ASP 19 Cb 0.40 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 40.35 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1l1p s ARG 20 N -0.70 0.15 0.58 0.11 3.52 -1.01 0.11 118.95 121.71 1l1p s ARG 20 Ca 0.00 0.50 0.02 0.00 -0.13 0.00 0.00 55.73 56.12 1l1p s ARG 20 Cb 0.00 -0.53 0.06 0.00 -1.56 0.00 0.00 34.95 32.91 1l1p s ARG 20 CO 0.00 -0.44 0.80 0.14 -0.81 0.00 0.00 175.30 174.99 1l1p s VAL 21 N 2.36 2.54 -0.23 7.11 -7.23 0.20 -3.23 120.40 121.93 1l1p s VAL 21 Ca 0.04 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 59.52 1l1p s VAL 21 Cb -0.13 -2.84 0.05 0.00 0.56 0.00 0.00 36.38 34.01 1l1p s VAL 21 CO -0.09 0.00 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.67 1l1p s THR 22 N -2.80 2.02 0.09 5.32 2.01 0.34 -0.70 115.64 121.92 1l1p s THR 22 Ca 0.59 -1.32 0.06 0.00 0.31 0.00 0.00 61.69 61.33 1l1p s THR 22 Cb -0.09 -2.05 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1l1p s THR 22 CO 0.39 0.16 -0.16 0.27 -0.69 0.00 0.00 174.62 174.59 1l1p s ILE 23 N 1.22 1.32 -0.16 1.82 -4.36 0.17 -0.70 121.20 120.50 1l1p s ILE 23 Ca -0.04 -1.46 0.00 0.00 -0.26 0.00 0.00 60.65 58.90 1l1p s ILE 23 Cb -0.17 -1.30 0.00 0.00 1.25 0.00 0.00 42.46 42.24 1l1p s ILE 23 CO -0.08 -0.22 -0.16 -1.81 0.24 0.00 0.00 174.94 172.92 1l1p s ASP 24 N -1.94 3.58 0.14 4.36 1.11 -0.46 0.14 116.67 123.60 1l1p s ASP 24 Ca 0.03 -0.51 -0.03 0.00 0.18 0.00 0.00 52.55 52.22 1l1p s ASP 24 Cb -0.09 -1.55 -0.03 0.00 1.07 0.00 0.00 42.92 42.31 1l1p s ASP 24 CO 0.03 0.06 0.12 0.72 1.18 0.00 0.00 175.17 177.28 1l1p s PHE 25 N 0.97 0.75 -0.21 4.23 -0.12 0.28 0.85 117.98 124.72 1l1p s PHE 25 Ca -0.03 -1.12 -0.05 0.00 -0.05 0.00 0.00 56.93 55.69 1l1p s PHE 25 Cb -0.15 -0.37 0.11 0.00 -0.63 0.00 0.00 43.02 41.98 1l1p s PHE 25 CO -0.03 -0.58 0.38 0.99 -0.05 0.00 0.00 175.22 175.93 1l1p s THR 26 N -4.03 -0.60 0.28 -4.49 2.01 -0.83 0.16 115.64 108.13 1l1p s THR 26 Ca 0.23 0.08 -0.21 0.00 0.31 0.00 0.00 61.69 62.10 1l1p s THR 26 Cb 0.06 -0.70 0.04 0.00 0.01 0.00 0.00 72.50 71.91 1l1p s THR 26 CO 0.02 -0.01 0.79 -0.83 -0.69 0.00 0.00 174.62 173.90 1l1p s GLY 27 N 2.56 -0.01 0.47 4.40 0.00 0.11 -2.84 107.32 112.01 1l1p s GLY 27 Ca 0.05 -0.33 0.07 0.00 0.00 0.00 0.00 44.72 44.50 1l1p s GLY 27 CO -0.13 -0.01 0.33 -0.56 0.00 0.00 0.00 173.10 172.72 1l1p s SER 28 N -2.98 4.69 0.00 1.64 0.01 -0.59 -4.04 113.70 112.44 1l1p s SER 28 Ca 0.13 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.34 1l1p s SER 28 Cb -0.05 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.03 1l1p s SER 28 CO 0.07 -0.80 0.00 0.55 0.41 0.00 0.00 173.24 173.47 1l1p n VAL 29 N -1.54 0.00 -0.94 3.43 3.14 -1.23 0.27 118.33 121.45 1l1p n VAL 29 Ca -0.00 0.17 -0.23 0.00 -2.96 0.00 0.00 64.34 61.32 1l1p n VAL 29 Cb 0.64 -1.12 0.10 0.00 -1.06 0.00 0.00 33.84 32.40 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 -2.30 5.32 0.00 6.55 2.03 -1.26 -4.57 116.55 122.32 1l1p n ASP 30 Ca 0.00 -3.37 0.00 0.00 0.52 0.00 0.00 54.79 51.94 1l1p n ASP 30 Cb 0.00 -0.88 0.00 0.00 -0.72 0.00 0.00 41.12 39.52 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 -0.61 0.94 2.82 0.27 0.00 -1.26 -5.02 105.19 102.33 1l1p n GLY 31 Ca 0.48 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.25 1l1p n GLY 31 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1l1p s GLU 32 N -0.83 1.00 -0.08 1.61 2.02 -1.26 -4.94 118.70 116.22 1l1p s GLU 32 Ca 0.00 -0.11 -0.32 0.00 0.02 0.00 0.00 54.97 54.56 1l1p s GLU 32 Cb 0.00 -1.35 -0.10 0.00 0.10 0.00 0.00 34.13 32.78 1l1p s GLU 32 CO 0.00 -0.33 1.98 -0.85 0.02 0.00 0.00 175.26 176.08 1l1p n GLU 33 N 5.05 2.30 0.00 1.61 0.00 -1.26 -3.58 120.64 124.76 1l1p n GLU 33 Ca -0.09 0.81 0.00 0.00 0.00 0.00 0.00 57.16 57.88 1l1p n GLU 33 Cb 0.50 -2.82 0.00 0.00 0.00 0.00 0.00 31.44 29.11 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 7.77 0.00 0.13 -1.84 -1.74 -1.26 -4.73 117.46 115.79 1l1p n PHE 34 Ca 0.24 0.00 -0.12 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 41.27 1l1p n PHE 34 CO 0.00 0.00 0.00 0.93 -0.56 0.00 0.00 176.76 177.13 1l1p h GLU 35 N 0.00 -0.38 -0.40 3.97 5.08 -1.96 -3.14 114.58 117.75 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 0.09 0.20 0.05 -3.84 0.00 -1.26 -4.14 105.19 96.28 1l1p n GLY 36 Ca -0.09 -0.08 0.03 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 0.41 -0.56 3.11 -0.02 0.00 -1.19 -4.37 105.19 102.56 1l1p n GLY 37 Ca 0.03 0.06 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 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 -3.09 0.23 0.01 1.61 -2.85 -1.26 0.09 119.74 114.48 1l1p s LYS 38 Ca -0.01 0.80 0.03 0.00 -1.00 0.00 0.00 55.97 55.79 1l1p s LYS 38 Cb 0.02 0.05 -0.01 0.00 -2.06 0.00 0.00 37.83 35.82 1l1p s LYS 38 CO 0.06 -0.24 -0.09 0.00 0.10 0.00 0.00 175.35 175.17 1l1p s ALA 39 N 2.18 0.71 -0.01 0.59 0.00 0.41 -4.98 121.76 120.67 1l1p s ALA 39 Ca -0.02 -0.49 -0.06 0.00 0.00 0.00 0.00 51.96 51.38 1l1p s ALA 39 Cb -0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 1l1p s ALA 39 CO -0.10 0.13 -0.12 -1.13 0.00 0.00 0.00 175.76 174.54 1l1p n SER 40 N 2.45 1.32 -3.95 0.00 3.41 -1.26 1.00 113.62 116.58 1l1p n SER 40 Ca -0.16 0.20 -0.41 0.00 -0.26 0.00 0.00 58.87 58.24 1l1p n SER 40 Cb 0.56 -0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 64.05 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 -3.78 5.94 -4.52 4.04 8.00 -1.26 -2.52 116.55 122.45 1l1p n ASP 41 Ca -0.06 -3.39 -0.43 0.00 0.71 0.00 0.00 54.79 51.62 1l1p n ASP 41 Cb 0.22 -1.19 -0.06 0.00 -0.02 0.00 0.00 41.12 40.07 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 -2.61 3.02 -0.77 1.24 5.36 0.37 -4.85 117.98 119.74 1l1p s PHE 42 Ca 0.32 -0.04 -0.24 0.00 -0.96 0.00 0.00 56.93 56.01 1l1p s PHE 42 Cb 0.05 -3.51 0.06 0.00 -0.34 0.00 0.00 43.02 39.28 1l1p s PHE 42 CO 0.07 -0.96 1.16 0.08 -1.46 0.00 0.00 175.22 174.11 1l1p s VAL 43 N 3.02 4.11 -0.05 3.12 1.01 -1.26 0.42 120.40 130.79 1l1p s VAL 43 Ca 0.24 -0.30 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 1l1p s VAL 43 Cb -0.14 -4.83 -0.05 0.00 0.00 0.00 0.00 36.38 31.37 1l1p s VAL 43 CO 0.19 -1.66 0.57 -0.22 0.00 0.00 0.00 175.10 173.98 1l1p s LEU 44 N 4.59 4.36 -0.50 3.92 0.20 0.12 -4.88 118.68 126.49 1l1p s LEU 44 Ca 0.31 1.06 -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 0.07 0.05 0.54 0.00 -0.29 0.00 0.00 176.35 176.72 1l1p s ALA 45 N 0.15 3.46 -1.14 5.97 0.00 -1.26 0.60 121.76 129.54 1l1p s ALA 45 Ca 0.30 -1.94 -0.23 0.00 0.00 0.00 0.00 51.96 50.09 1l1p s ALA 45 Cb -0.17 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 1l1p s ALA 45 CO 0.15 -1.94 1.93 -1.64 0.00 0.00 0.00 175.76 174.27 1l1p s MET 46 N 2.24 2.55 0.00 0.00 -1.94 0.31 -3.53 119.30 118.94 1l1p s MET 46 Ca 0.10 -1.04 0.00 0.00 -1.71 0.00 0.00 55.69 53.04 1l1p s MET 46 Cb -0.22 -5.22 0.00 0.00 2.01 0.00 0.00 34.83 31.40 1l1p s MET 46 CO 0.09 -3.82 0.00 0.41 -0.01 0.00 0.00 175.02 171.69 1l1p n GLY 47 N 5.98 0.77 1.22 -0.03 0.00 -1.26 -2.40 105.19 109.47 1l1p n GLY 47 Ca 0.44 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1l1p n GLY 47 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1l1p n GLN 48 N 0.00 0.00 -0.12 1.61 7.27 -1.23 -4.73 117.38 120.19 1l1p n GLN 48 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.86 1l1p n GLN 48 Cb 0.00 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.58 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 3.04 -0.49 0.00 1.69 0.00 -1.26 -5.00 105.19 103.18 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 -4.33 0.00 -1.51 1.61 1.85 -1.26 -5.10 116.66 107.92 1l1p n ARG 50 Ca -0.37 0.00 -0.54 0.00 -1.00 0.00 0.00 57.85 55.94 1l1p n ARG 50 Cb 0.73 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 32.06 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 1.00 -1.18 2.89 1.56 -1.26 -4.91 117.12 115.22 1l1p n MET 51 Ca 0.00 0.31 -0.30 0.00 -0.27 0.00 0.00 57.70 57.44 1l1p n MET 51 Cb 0.00 -2.23 0.12 0.00 2.15 0.00 0.00 33.22 33.26 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 5.88 2.87 -0.37 1.12 -4.36 -1.26 -4.71 121.20 120.37 1l1p s ILE 52 Ca 1.07 0.28 0.19 0.00 -0.26 0.00 0.00 60.65 61.93 1l1p s ILE 52 Cb -1.00 -2.73 0.19 0.00 1.25 0.00 0.00 42.46 40.17 1l1p s ILE 52 CO 0.57 -0.37 1.58 -0.81 0.24 0.00 0.00 174.94 176.14 1l1p n PRO 53 N -3.79 0.13 0.03 0.37 -0.04 -1.26 -0.87 135.00 129.57 1l1p n PRO 53 Ca 0.08 0.58 -0.02 0.00 -0.04 0.00 0.00 63.50 64.10 1l1p n PRO 53 Cb 0.54 -1.88 -0.01 0.00 -0.04 0.00 0.00 33.50 32.11 1l1p n PRO 53 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1l1p h GLY 54 N 0.40 -0.16 0.93 0.55 0.00 -1.91 -2.87 103.07 100.01 1l1p h GLY 54 Ca 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 47.33 47.32 1l1p h GLY 54 CO 0.00 -0.06 -0.07 0.74 0.00 0.00 0.00 176.54 177.15 1l1p h PHE 55 N -0.74 0.73 0.00 5.60 0.04 -1.70 -2.26 116.94 118.61 1l1p h PHE 55 Ca -0.02 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1l1p h PHE 55 Cb 0.12 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.09 1l1p h PHE 55 CO 0.01 0.81 0.00 -1.91 -0.60 0.00 0.00 178.31 176.62 1l1p n GLU 56 N -4.43 0.13 0.00 1.51 2.13 -0.04 -0.63 120.64 119.30 1l1p n GLU 56 Ca -0.02 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.39 1l1p n GLU 56 Cb 0.33 -1.90 0.00 0.00 0.27 0.00 0.00 31.44 30.14 1l1p n GLU 56 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1l1p n ASP 57 N -2.17 0.00 -0.03 4.31 2.03 -0.86 -3.98 116.55 115.86 1l1p n ASP 57 Ca -0.01 0.36 -0.15 0.00 0.52 0.00 0.00 54.79 55.51 1l1p n ASP 57 Cb 0.05 -0.33 -0.11 0.00 -0.72 0.00 0.00 41.12 40.01 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 0.18 -3.02 0.27 0.00 -1.53 -3.25 103.07 95.72 1l1p h GLY 58 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1l1p h GLY 58 CO 0.00 0.27 0.00 1.39 0.00 0.00 0.00 176.54 178.20 1l1p n ILE 59 N -4.54 1.67 -0.03 2.60 -0.00 0.20 -4.21 119.36 115.05 1l1p n ILE 59 Ca -0.09 -0.40 -0.09 0.00 -0.00 0.00 0.00 62.75 62.17 1l1p n ILE 59 Cb 0.48 -1.39 -0.02 0.00 -0.00 0.00 0.00 39.64 38.71 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 1.27 -0.25 0.00 0.38 1.79 -1.63 -3.43 116.57 114.70 1l1p h LYS 60 Ca 0.00 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1l1p h LYS 60 Cb 0.87 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1l1p h LYS 60 CO 0.00 -0.16 0.00 0.41 -1.08 0.00 0.00 179.45 178.62 1l1p n GLY 61 N -1.37 0.92 0.00 3.86 0.00 -1.26 -4.83 105.19 102.51 1l1p n GLY 61 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -3.81 1.61 1.44 -1.26 0.14 115.22 113.34 1l1p n HIS 62 Ca 0.00 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.40 1l1p n HIS 62 Cb 0.00 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.01 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 -1.16 2.73 -0.60 -1.40 1.02 -1.26 -4.99 119.74 114.08 1l1p s LYS 63 Ca 0.00 -3.31 -0.26 0.00 0.02 0.00 0.00 55.97 52.42 1l1p s LYS 63 Cb 0.00 -3.60 -0.09 0.00 -0.52 0.00 0.00 37.83 33.62 1l1p s LYS 63 CO 0.00 -1.27 2.41 0.00 -0.92 0.00 0.00 175.35 175.57 1l1p s ALA 64 N -1.40 1.30 0.00 5.17 0.00 -1.26 -1.82 121.76 123.75 1l1p s ALA 64 Ca 0.25 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.95 1l1p s ALA 64 Cb -0.06 -4.43 0.00 0.00 0.00 0.00 0.00 23.12 18.63 1l1p s ALA 64 CO -0.15 -4.98 0.00 0.41 0.00 0.00 0.00 175.76 171.04 1l1p n GLY 65 N 6.28 1.27 3.99 0.00 0.00 0.38 -4.79 105.19 112.33 1l1p n GLY 65 Ca 0.40 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 -0.23 2.87 -0.24 1.61 2.56 0.23 -4.84 118.70 120.66 1l1p s GLU 66 Ca 0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 54.97 53.90 1l1p s GLU 66 Cb 0.00 -2.71 0.08 0.00 2.00 0.00 0.00 34.13 33.50 1l1p s GLU 66 CO 0.00 -0.26 0.08 -1.21 -0.56 0.00 0.00 175.26 173.30 1l1p s GLU 67 N -4.39 0.49 0.19 4.30 8.01 -1.26 0.67 118.70 126.71 1l1p s GLU 67 Ca 0.52 -0.55 0.00 0.00 0.01 0.00 0.00 54.97 54.96 1l1p s GLU 67 Cb -0.10 -1.86 -0.04 0.00 -4.31 0.00 0.00 34.13 27.82 1l1p s GLU 67 CO 0.34 -0.80 0.06 -0.59 0.01 0.00 0.00 175.26 174.28 1l1p s PHE 68 N 1.89 1.20 -0.20 1.61 -0.12 0.30 -4.96 117.98 117.70 1l1p s PHE 68 Ca 0.04 -1.18 0.01 0.00 -0.05 0.00 0.00 56.93 55.75 1l1p s PHE 68 Cb -0.17 -0.67 0.04 0.00 -0.63 0.00 0.00 43.02 41.59 1l1p s PHE 68 CO -0.18 -0.39 -0.11 0.99 -0.05 0.00 0.00 175.22 175.48 1l1p s THR 69 N -3.86 1.66 0.23 -4.49 2.01 -1.26 0.70 115.64 110.63 1l1p s THR 69 Ca 0.30 -1.02 0.05 0.00 0.31 0.00 0.00 61.69 61.33 1l1p s THR 69 Cb 0.07 -1.73 -0.05 0.00 0.01 0.00 0.00 72.50 70.80 1l1p s THR 69 CO 0.07 0.18 -0.04 0.27 -0.69 0.00 0.00 174.62 174.41 1l1p s ILE 70 N 1.39 1.23 0.17 1.82 -0.00 -0.95 -4.96 121.20 119.90 1l1p s ILE 70 Ca -0.01 -2.07 -0.04 0.00 -0.00 0.00 0.00 60.65 58.53 1l1p s ILE 70 Cb -0.16 -2.27 -0.05 0.00 -0.00 0.00 0.00 42.46 39.98 1l1p s ILE 70 CO -0.08 -0.40 0.40 -0.62 -0.00 0.00 0.00 174.94 174.23 1l1p s ASP 71 N -3.31 6.46 -0.10 4.36 -1.08 -1.26 -2.43 116.67 119.29 1l1p s ASP 71 Ca 0.26 0.55 -0.06 0.00 -0.52 0.00 0.00 52.55 52.78 1l1p s ASP 71 Cb 0.04 -2.07 0.04 0.00 -1.46 0.00 0.00 42.92 39.47 1l1p s ASP 71 CO 0.08 0.00 0.25 -0.69 0.52 0.00 0.00 175.17 175.34 1l1p s VAL 72 N -1.76 -0.03 -0.12 1.11 1.01 -0.84 -3.81 120.40 115.97 1l1p s VAL 72 Ca 0.41 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.43 1l1p s VAL 72 Cb -0.12 -0.38 0.06 0.00 0.00 0.00 0.00 36.38 35.94 1l1p s VAL 72 CO 0.26 0.04 0.27 -0.89 0.00 0.00 0.00 175.10 174.78 1l1p s THR 73 N 0.92 -0.24 -0.04 3.92 2.01 -1.26 -0.24 115.64 120.72 1l1p s THR 73 Ca -0.06 0.21 -0.25 0.00 0.31 0.00 0.00 61.69 61.89 1l1p s THR 73 Cb -0.08 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.96 1l1p s THR 73 CO -0.06 0.09 0.77 -0.36 -0.69 0.00 0.00 174.62 174.37 1l1p s PHE 74 N 1.86 3.62 1.13 4.92 0.40 -1.19 -4.90 117.98 123.83 1l1p s PHE 74 Ca -0.04 1.38 -0.17 0.00 -0.60 0.00 0.00 56.93 57.50 1l1p s PHE 74 Cb -0.11 -2.88 0.25 0.00 0.51 0.00 0.00 43.02 40.80 1l1p s PHE 74 CO -0.09 0.09 1.10 -1.25 0.70 0.00 0.00 175.22 175.77 1l1p s PRO 75 N 0.72 -0.65 0.14 0.24 0.04 -1.26 -4.03 135.00 130.20 1l1p s PRO 75 Ca 0.41 0.15 0.20 0.00 0.04 0.00 0.00 61.00 61.80 1l1p s PRO 75 Cb -0.19 -1.64 0.83 0.00 0.04 0.00 0.00 34.50 33.54 1l1p s PRO 75 CO 0.21 -3.38 1.62 -1.91 0.04 0.00 0.00 177.00 173.59 1l1p n GLU 76 N -4.56 0.11 0.01 4.56 2.13 -1.26 -2.60 120.64 119.03 1l1p n GLU 76 Ca 0.10 0.32 -0.09 0.00 0.66 0.00 0.00 57.16 58.16 1l1p n GLU 76 Cb 0.59 -1.70 -0.13 0.00 0.27 0.00 0.00 31.44 30.46 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 0.02 0.02 5.31 9.09 -2.03 -3.39 114.58 123.59 1l1p h GLU 77 Ca 0.00 -0.03 -0.00 0.00 0.05 0.00 0.00 59.36 59.38 1l1p h GLU 77 Cb 0.34 0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.45 1l1p h GLU 77 CO 0.00 0.69 -0.01 -0.92 0.05 0.00 0.00 179.01 178.83 1l1p h TYR 78 N 0.00 -0.02 -5.22 2.06 5.03 -1.85 -3.48 116.97 113.49 1l1p h TYR 78 Ca -0.20 -0.00 -0.28 0.00 2.58 0.00 0.00 58.73 60.83 1l1p h TYR 78 Cb 1.94 0.01 0.01 0.00 1.55 0.00 0.00 36.73 40.24 1l1p h TYR 78 CO 0.00 -0.01 -0.83 0.72 -1.32 0.00 0.00 178.16 176.72 1l1p n HIS 79 N -2.10 -1.79 -3.24 -3.82 8.25 -1.20 -4.92 115.22 106.39 1l1p n HIS 79 Ca -0.00 0.75 -0.34 0.00 -0.26 0.00 0.00 57.72 57.87 1l1p n HIS 79 Cb 0.01 -1.25 -0.06 0.00 1.12 0.00 0.00 29.99 29.81 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 -1.14 3.46 0.59 -1.41 0.00 -1.26 -4.68 121.76 117.32 1l1p s ALA 80 Ca 0.24 -0.04 0.30 0.00 0.00 0.00 0.00 51.96 52.46 1l1p s ALA 80 Cb -0.02 -2.65 1.39 0.00 0.00 0.00 0.00 23.12 21.84 1l1p s ALA 80 CO 0.60 0.40 1.78 1.05 0.00 0.00 0.00 175.76 179.59 1l1p h GLU 81 N 2.91 0.00 0.06 0.00 4.11 -1.97 1.29 114.58 120.97 1l1p h GLU 81 Ca -0.48 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 58.58 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 1l1p h GLU 81 CO 0.66 0.00 -2.24 0.27 0.07 0.00 0.00 179.01 177.77 1l1p n ASN 82 N -3.70 1.95 -0.29 3.06 6.94 -1.26 -4.71 115.26 117.24 1l1p n ASN 82 Ca 0.14 0.04 0.02 0.00 -0.02 0.00 0.00 54.58 54.76 1l1p n ASN 82 Cb 0.92 -0.56 0.03 0.00 -2.36 0.00 0.00 39.78 37.82 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 0.69 -2.88 -4.53 -0.00 -0.94 -5.00 117.00 101.00 1l1p n LEU 83 Ca -0.38 -1.42 -0.39 0.00 -0.00 0.00 0.00 56.01 53.82 1l1p n LEU 83 Cb 1.02 -0.10 -0.05 0.00 -0.00 0.00 0.00 43.42 44.29 1l1p n LEU 83 CO 0.35 0.34 0.44 2.29 -0.00 0.00 0.00 177.39 180.80 1l1p n LYS 84 N -0.38 0.00 -3.82 1.47 2.85 0.44 -1.45 118.16 117.28 1l1p n LYS 84 Ca 0.04 0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 57.02 1l1p n LYS 84 Cb 0.63 -0.95 0.01 0.00 -0.65 0.00 0.00 35.03 34.07 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 1.29 -0.58 3.35 2.58 0.00 -1.26 -4.77 105.19 105.79 1l1p n GLY 85 Ca 0.14 0.28 -0.46 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 -6.28 3.86 -0.81 1.61 2.36 -0.52 -4.83 119.74 115.12 1l1p s LYS 86 Ca 0.22 -2.72 -0.25 0.00 -2.55 0.00 0.00 55.97 50.67 1l1p s LYS 86 Cb -0.08 -4.54 0.01 0.00 -1.05 0.00 0.00 37.83 32.17 1l1p s LYS 86 CO 0.87 -1.33 1.58 0.00 1.55 0.00 0.00 175.35 178.02 1l1p s ALA 87 N -0.16 2.41 0.01 3.13 0.00 -1.26 -3.14 121.76 122.76 1l1p s ALA 87 Ca 0.25 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.77 1l1p s ALA 87 Cb -0.09 -4.39 -0.00 0.00 0.00 0.00 0.00 23.12 18.64 1l1p s ALA 87 CO -0.08 -3.78 0.01 0.00 0.00 0.00 0.00 175.76 171.90 1l1p n ALA 88 N 10.86 0.02 -2.84 0.00 0.00 0.67 -4.52 120.51 124.71 1l1p n ALA 88 Ca 0.21 -0.06 -0.17 0.00 0.00 0.00 0.00 53.44 53.41 1l1p n ALA 88 Cb 0.50 0.05 -0.15 0.00 0.00 0.00 0.00 19.45 19.85 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 -2.05 0.58 0.15 0.00 1.02 0.14 -1.99 119.74 117.60 1l1p s LYS 89 Ca 0.01 -0.22 -0.01 0.00 0.02 0.00 0.00 55.97 55.77 1l1p s LYS 89 Cb 0.00 -0.56 -0.04 0.00 -0.52 0.00 0.00 37.83 36.71 1l1p s LYS 89 CO 0.01 0.12 0.07 -0.06 -0.92 0.00 0.00 175.35 174.57 1l1p s PHE 90 N -0.03 0.96 -0.29 3.18 0.08 -1.02 -1.54 117.98 119.33 1l1p s PHE 90 Ca 0.01 -1.26 0.01 0.00 0.12 0.00 0.00 56.93 55.81 1l1p s PHE 90 Cb -0.04 -0.51 0.08 0.00 -0.57 0.00 0.00 43.02 41.98 1l1p s PHE 90 CO -0.00 -0.54 0.02 0.00 -0.10 0.00 0.00 175.22 174.60 1l1p s ALA 91 N -4.06 2.16 0.30 5.36 0.00 -1.13 -2.23 121.76 122.16 1l1p s ALA 91 Ca 0.28 -1.83 0.05 0.00 0.00 0.00 0.00 51.96 50.46 1l1p s ALA 91 Cb 0.07 -1.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 1l1p s ALA 91 CO 0.05 -1.48 0.44 0.42 0.00 0.00 0.00 175.76 175.18 1l1p s ILE 92 N 1.29 4.63 -0.25 0.00 1.01 0.22 -1.97 121.20 126.13 1l1p s ILE 92 Ca 0.04 -0.94 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 1l1p s ILE 92 Cb -0.18 -3.63 0.08 0.00 0.01 0.00 0.00 42.46 38.74 1l1p s ILE 92 CO -0.12 -0.26 0.07 0.20 0.00 0.00 0.00 174.94 174.83 1l1p s ASN 93 N -4.09 3.40 0.65 3.58 -0.87 0.25 0.11 114.94 117.98 1l1p s ASN 93 Ca 0.40 -1.19 -0.16 0.00 -1.57 0.00 0.00 52.86 50.35 1l1p s ASN 93 Cb -0.09 -0.64 -0.00 0.00 -0.02 0.00 0.00 41.25 40.49 1l1p s ASN 93 CO 0.31 -0.37 1.15 -0.22 -2.57 0.00 0.00 177.10 175.40 1l1p s LEU 94 N 1.82 3.46 0.00 0.60 2.96 0.21 -1.36 118.68 126.38 1l1p s LEU 94 Ca 0.05 2.17 0.00 0.00 -0.22 0.00 0.00 54.13 56.13 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 -0.19 -1.74 0.00 0.29 -1.32 0.00 0.00 176.35 173.39 1l1p n LYS 95 N -2.23 0.00 -2.30 1.98 5.02 0.13 0.78 118.16 121.54 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 35.49 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 1.67 3.12 -0.38 1.97 1.02 -1.17 -3.10 119.74 122.85 1l1p s LYS 96 Ca 0.00 0.45 -0.05 0.00 0.02 0.00 0.00 55.97 56.38 1l1p s LYS 96 Cb 0.00 -4.20 0.08 0.00 -0.52 0.00 0.00 37.83 33.19 1l1p s LYS 96 CO 0.00 -2.17 0.18 0.54 -0.92 0.00 0.00 175.35 172.98 1l1p s VAL 97 N 6.82 3.64 0.36 3.17 0.11 -1.26 0.13 120.40 133.36 1l1p s VAL 97 Ca 0.55 -1.58 0.05 0.00 -2.93 0.00 0.00 61.98 58.07 1l1p s VAL 97 Cb -0.12 -3.27 -0.07 0.00 -1.53 0.00 0.00 36.38 31.40 1l1p s VAL 97 CO 0.23 -0.46 0.04 -1.61 -3.33 0.00 0.00 175.10 169.97 1l1p s GLU 98 N 1.30 1.76 -0.98 1.54 8.01 -1.20 -4.29 118.70 124.84 1l1p s GLU 98 Ca 0.03 -1.99 -0.15 0.00 0.01 0.00 0.00 54.97 52.87 1l1p s GLU 98 Cb -0.22 -1.16 0.19 0.00 -4.31 0.00 0.00 34.13 28.63 1l1p s GLU 98 CO -0.00 -0.13 1.08 -1.21 0.01 0.00 0.00 175.26 175.00 1l1p s GLU 99 N -3.82 3.79 0.79 1.61 2.02 -1.26 -2.40 118.70 119.43 1l1p s GLU 99 Ca 0.36 -2.36 -0.11 0.00 0.02 0.00 0.00 54.97 52.88 1l1p s GLU 99 Cb 0.09 -4.74 0.07 0.00 0.10 0.00 0.00 34.13 29.64 1l1p s GLU 99 CO 0.16 -1.55 1.09 -0.98 0.02 0.00 0.00 175.26 174.01 1l1p s ARG 100 N 1.10 2.11 -0.43 1.61 1.04 -1.26 -2.64 118.95 120.47 1l1p s ARG 100 Ca 0.30 1.14 0.04 0.00 -1.04 0.00 0.00 55.73 56.16 1l1p s ARG 100 Cb -0.07 -1.88 0.27 0.00 -2.04 0.00 0.00 34.95 31.23 1l1p s ARG 100 CO -0.07 -1.74 1.05 -1.91 -0.04 0.00 0.00 175.30 172.59 1l1p n GLU 101 N -3.58 0.61 -2.45 3.89 2.13 -1.26 -4.48 120.64 115.49 1l1p n GLU 101 Ca 0.09 -1.44 -0.41 0.00 0.66 0.00 0.00 57.16 56.07 1l1p n GLU 101 Cb 0.53 -1.01 -0.04 0.00 0.27 0.00 0.00 31.44 31.20 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 -0.83 4.51 -0.16 4.31 1.02 -1.26 -4.83 118.68 121.44 1l1p s LEU 102 Ca 0.28 2.23 -0.29 0.00 0.02 0.00 0.00 54.13 56.37 1l1p s LEU 102 Cb 0.24 -3.62 -0.03 0.00 0.02 0.00 0.00 46.19 42.80 1l1p s LEU 102 CO -0.17 -0.22 1.52 -2.16 0.02 0.00 0.00 176.35 175.34 1l1p s PRO 103 N -0.98 4.04 -0.01 1.29 0.04 -1.26 -4.94 135.00 133.18 1l1p s PRO 103 Ca 0.47 1.80 -0.13 0.00 0.04 0.00 0.00 61.00 63.18 1l1p s PRO 103 Cb -0.32 -3.94 -0.07 0.00 0.04 0.00 0.00 34.50 30.21 1l1p s PRO 103 CO 0.39 -0.99 0.70 1.49 0.04 0.00 0.00 177.00 178.63 1l1p h GLU 104 N 9.60 -0.47 -5.98 4.56 4.57 -2.07 -3.41 114.58 121.39 1l1p h GLU 104 Ca -0.33 0.03 -0.61 0.00 -1.18 0.00 0.00 59.36 57.27 1l1p h GLU 104 Cb 1.14 0.11 -0.12 0.00 -0.16 0.00 0.00 28.75 29.72 1l1p h GLU 104 CO 0.98 -0.31 0.49 -0.51 -1.18 0.00 0.00 179.01 178.48 1l1p s LEU 105 N -7.75 4.11 0.00 1.64 1.02 -1.26 -5.35 118.68 111.09 1l1p s LEU 105 Ca -0.07 -0.02 0.15 0.00 0.02 0.00 0.00 54.13 54.21 1l1p s LEU 105 Cb 0.01 -3.07 0.12 0.00 0.02 0.00 0.00 46.19 43.27 1l1p s LEU 105 CO 0.21 -1.02 0.99 0.41 0.02 0.00 0.00 176.35 176.96