#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 5.11 0.48 1.61 0.01 -1.26 -5.11 113.70 114.54 1l1p s SER 2 Ca 0.00 -0.02 -0.16 0.00 1.31 0.00 0.00 55.95 57.08 1l1p s SER 2 Cb 0.00 -1.33 -0.08 0.00 0.21 0.00 0.00 66.02 64.82 1l1p s SER 2 CO 0.00 0.27 0.94 -2.28 0.41 0.00 0.00 173.24 172.58 1l1p s HIS 3 N -1.10 3.43 -0.39 2.43 5.65 -1.26 -5.06 115.29 118.99 1l1p s HIS 3 Ca 0.20 1.41 0.05 0.00 0.25 0.00 0.00 55.06 56.97 1l1p s HIS 3 Cb -0.12 -2.73 0.17 0.00 -1.18 0.00 0.00 32.58 28.72 1l1p s HIS 3 CO 0.11 -0.27 0.48 1.41 -0.65 0.00 0.00 174.74 175.82 1l1p s MET 4 N -3.87 0.73 0.27 2.88 -2.45 -1.26 -5.15 119.30 110.45 1l1p s MET 4 Ca 0.58 -0.65 0.01 0.00 -1.25 0.00 0.00 55.69 54.37 1l1p s MET 4 Cb -0.10 -0.39 -0.04 0.00 1.25 0.00 0.00 34.83 35.55 1l1p s MET 4 CO 0.28 -1.20 0.45 -1.14 1.05 0.00 0.00 175.02 174.47 1l1p s GLN 5 N 1.56 3.49 0.41 4.11 2.00 -1.26 -5.08 119.66 124.89 1l1p s GLN 5 Ca 0.17 -0.41 -0.24 0.00 -2.00 0.00 0.00 55.36 52.88 1l1p s GLN 5 Cb -0.10 -2.77 -0.09 0.00 0.80 0.00 0.00 33.01 30.85 1l1p s GLN 5 CO -0.04 0.30 1.09 0.00 -0.50 0.00 0.00 175.29 176.13 1l1p s ALA 6 N -2.08 3.08 0.02 1.58 0.00 -1.26 -5.06 121.76 118.04 1l1p s ALA 6 Ca 0.38 0.79 0.06 0.00 0.00 0.00 0.00 51.96 53.19 1l1p s ALA 6 Cb -0.10 -3.31 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 1l1p s ALA 6 CO 0.32 -0.35 -0.18 0.99 0.00 0.00 0.00 175.76 176.54 1l1p s THR 7 N -1.59 1.43 0.08 0.00 2.01 -1.26 -5.15 115.64 111.16 1l1p s THR 7 Ca 0.59 -0.97 -0.02 0.00 0.31 0.00 0.00 61.69 61.59 1l1p s THR 7 Cb -0.25 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 70.99 1l1p s THR 7 CO 0.31 0.24 0.03 0.26 -0.69 0.00 0.00 174.62 174.76 1l1p s TRP 8 N -0.65 0.57 0.00 4.92 0.52 -1.26 -4.90 118.94 118.13 1l1p s TRP 8 Ca 0.06 -1.05 0.00 0.00 0.02 0.00 0.00 56.10 55.13 1l1p s TRP 8 Cb -0.08 -0.37 0.00 0.00 -1.15 0.00 0.00 33.47 31.87 1l1p s TRP 8 CO 0.01 -0.44 0.82 1.63 0.02 0.00 0.00 176.95 178.99 1l1p n LYS 9 N 0.03 0.00 -2.03 4.98 5.02 -1.26 -5.05 118.16 119.85 1l1p n LYS 9 Ca -0.12 -0.66 -0.40 0.00 -2.02 0.00 0.00 58.31 55.12 1l1p n LYS 9 Cb 0.62 -0.33 -0.00 0.00 -0.02 0.00 0.00 35.03 35.30 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1l1p s GLU 10 N 0.00 3.95 0.00 1.97 -1.05 -1.24 -4.73 118.70 117.60 1l1p s GLU 10 Ca 0.00 2.19 0.00 0.00 -0.15 0.00 0.00 54.97 57.01 1l1p s GLU 10 Cb 0.00 -2.76 0.00 0.00 -0.44 0.00 0.00 34.13 30.93 1l1p s GLU 10 CO 0.00 -0.52 0.00 0.36 0.95 0.00 0.00 175.26 176.05 1l1p n LYS 11 N 0.11 1.84 -0.47 -4.83 2.85 -1.20 -4.69 118.16 111.78 1l1p n LYS 11 Ca 0.04 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 57.34 1l1p n LYS 11 Cb 0.43 0.00 0.07 0.00 -0.65 0.00 0.00 35.03 34.88 1l1p n LYS 11 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1l1p n ASP 12 N 0.00 1.08 -0.14 -5.58 2.03 -1.26 -4.36 116.55 108.33 1l1p n ASP 12 Ca 0.00 -2.55 0.00 0.00 0.52 0.00 0.00 54.79 52.76 1l1p n ASP 12 Cb 0.00 -0.32 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 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 -0.55 2.52 0.54 0.27 0.00 -1.26 -5.01 105.19 101.70 1l1p n GLY 13 Ca 0.08 -2.05 -0.05 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.52 -1.77 4.61 0.00 -1.26 -4.23 120.51 114.34 1l1p n ALA 14 Ca 0.00 -0.25 -0.35 0.00 0.00 0.00 0.00 53.44 52.84 1l1p n ALA 14 Cb 0.00 -0.02 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 -1.30 2.94 0.15 0.00 0.11 0.12 -4.47 120.40 117.94 1l1p s VAL 15 Ca 0.11 0.59 0.01 0.00 -2.93 0.00 0.00 61.98 59.76 1l1p s VAL 15 Cb -0.01 -3.24 -0.04 0.00 -1.53 0.00 0.00 36.38 31.56 1l1p s VAL 15 CO 0.08 -0.12 -0.01 -1.61 -3.33 0.00 0.00 175.10 170.11 1l1p s GLU 16 N -3.29 1.01 0.00 1.54 2.02 -1.26 -5.02 118.70 113.70 1l1p s GLU 16 Ca 0.75 -1.47 0.00 0.00 0.02 0.00 0.00 54.97 54.27 1l1p s GLU 16 Cb -0.27 -0.18 0.00 0.00 0.10 0.00 0.00 34.13 33.79 1l1p s GLU 16 CO 0.29 -0.12 0.01 0.00 0.02 0.00 0.00 175.26 175.47 1l1p n ALA 17 N -0.17 0.00 -3.50 5.21 0.00 -1.26 -1.82 120.51 118.97 1l1p n ALA 17 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 1l1p n ALA 17 Cb 0.63 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 20.00 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 -1.57 2.54 -1.66 0.00 0.28 -1.23 -4.37 120.64 114.63 1l1p n GLU 18 Ca 0.00 -4.63 -0.06 0.00 -0.16 0.00 0.00 57.16 52.31 1l1p n GLU 18 Cb 0.00 -2.29 0.02 0.00 1.43 0.00 0.00 31.44 30.60 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 1.17 0.72 -3.46 -1.84 9.92 -0.76 -4.45 116.55 117.86 1l1p n ASP 19 Ca 0.27 -1.49 -0.16 0.00 -0.53 0.00 0.00 54.79 52.88 1l1p n ASP 19 Cb 0.39 -0.13 -0.12 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 -2.83 0.23 0.60 -1.24 3.52 -1.13 0.18 118.95 118.28 1l1p s ARG 20 Ca 0.19 0.26 0.01 0.00 -0.13 0.00 0.00 55.73 56.06 1l1p s ARG 20 Cb -0.01 -1.04 0.06 0.00 -1.56 0.00 0.00 34.95 32.39 1l1p s ARG 20 CO 0.12 -0.66 0.84 0.14 -0.81 0.00 0.00 175.30 174.92 1l1p s VAL 21 N 2.37 2.49 -0.24 7.11 -7.23 0.18 -3.74 120.40 121.34 1l1p s VAL 21 Ca 0.08 -0.67 -0.00 0.00 -1.81 0.00 0.00 61.98 59.58 1l1p s VAL 21 Cb -0.16 -2.82 0.03 0.00 0.56 0.00 0.00 36.38 34.00 1l1p s VAL 21 CO -0.13 0.00 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.68 1l1p s THR 22 N -2.86 2.63 0.08 5.32 2.01 0.16 -0.43 115.64 122.55 1l1p s THR 22 Ca 0.60 -1.14 0.05 0.00 0.31 0.00 0.00 61.69 61.51 1l1p s THR 22 Cb -0.09 -2.35 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 1l1p s THR 22 CO 0.40 0.19 -0.14 0.27 -0.69 0.00 0.00 174.62 174.65 1l1p s ILE 23 N 1.27 1.13 -0.14 1.82 -4.36 0.28 -0.62 121.20 120.59 1l1p s ILE 23 Ca -0.01 -1.39 0.02 0.00 -0.26 0.00 0.00 60.65 59.01 1l1p s ILE 23 Cb -0.17 -1.16 0.01 0.00 1.25 0.00 0.00 42.46 42.39 1l1p s ILE 23 CO -0.06 -0.28 -0.21 1.51 0.24 0.00 0.00 174.94 176.15 1l1p s ASP 24 N -1.90 3.25 0.19 4.36 -4.77 -0.75 0.94 116.67 118.00 1l1p s ASP 24 Ca 0.00 -0.56 -0.03 0.00 -3.30 0.00 0.00 52.55 48.65 1l1p s ASP 24 Cb -0.09 -1.47 -0.03 0.00 -1.09 0.00 0.00 42.92 40.24 1l1p s ASP 24 CO 0.02 0.09 0.17 0.72 0.70 0.00 0.00 175.17 176.88 1l1p s PHE 25 N 0.74 0.91 -0.20 2.11 -0.12 0.27 0.38 117.98 122.08 1l1p s PHE 25 Ca -0.08 -1.20 -0.05 0.00 -0.05 0.00 0.00 56.93 55.55 1l1p s PHE 25 Cb -0.16 -0.40 0.10 0.00 -0.63 0.00 0.00 43.02 41.94 1l1p s PHE 25 CO 0.00 -0.66 0.36 0.99 -0.05 0.00 0.00 175.22 175.85 1l1p s THR 26 N -4.10 -0.56 0.27 -4.49 2.01 -0.16 0.17 115.64 108.78 1l1p s THR 26 Ca 0.31 0.08 -0.18 0.00 0.31 0.00 0.00 61.69 62.22 1l1p s THR 26 Cb 0.06 -0.67 0.01 0.00 0.01 0.00 0.00 72.50 71.91 1l1p s THR 26 CO 0.08 -0.01 0.64 -0.83 -0.69 0.00 0.00 174.62 173.81 1l1p s GLY 27 N 2.53 0.16 0.49 4.40 0.00 0.16 -2.53 107.32 112.52 1l1p s GLY 27 Ca 0.05 -0.53 0.07 0.00 0.00 0.00 0.00 44.72 44.30 1l1p s GLY 27 CO -0.13 -0.29 0.38 -1.35 0.00 0.00 0.00 173.10 171.71 1l1p s SER 28 N -2.96 4.75 0.01 1.64 1.04 -0.52 -3.98 113.70 113.68 1l1p s SER 28 Ca 0.15 -1.05 -0.00 0.00 0.48 0.00 0.00 55.95 55.53 1l1p s SER 28 Cb -0.04 -0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.06 1l1p s SER 28 CO 0.08 -0.90 -0.00 0.55 0.98 0.00 0.00 173.24 173.95 1l1p n VAL 29 N -1.65 0.07 -1.06 5.02 3.14 -1.18 0.11 118.33 122.79 1l1p n VAL 29 Ca 0.01 0.03 -0.25 0.00 -2.96 0.00 0.00 64.34 61.16 1l1p n VAL 29 Cb 0.63 -1.04 0.08 0.00 -1.06 0.00 0.00 33.84 32.45 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 -2.56 6.36 0.00 6.55 -0.08 -1.26 -4.64 116.55 120.92 1l1p n ASP 30 Ca -0.00 -3.44 0.00 0.00 -1.51 0.00 0.00 54.79 49.84 1l1p n ASP 30 Cb 0.00 -0.95 0.00 0.00 2.34 0.00 0.00 41.12 42.51 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 -0.49 2.17 2.90 0.27 0.00 -1.26 -5.02 105.19 103.77 1l1p n GLY 31 Ca 0.49 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.31 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 0.83 -0.03 1.61 2.02 -1.26 -4.93 118.70 116.11 1l1p s GLU 32 Ca 0.00 -0.12 -0.32 0.00 0.02 0.00 0.00 54.97 54.55 1l1p s GLU 32 Cb 0.00 -0.82 -0.10 0.00 0.10 0.00 0.00 34.13 33.31 1l1p s GLU 32 CO 0.00 -0.06 1.93 -0.85 0.02 0.00 0.00 175.26 176.31 1l1p n GLU 33 N 3.94 2.53 0.00 1.61 0.28 -1.26 -3.10 120.64 124.63 1l1p n GLU 33 Ca -0.25 0.93 0.00 0.00 -0.16 0.00 0.00 57.16 57.68 1l1p n GLU 33 Cb 0.51 -2.83 0.00 0.00 1.43 0.00 0.00 31.44 30.55 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 7.12 0.00 0.11 -1.84 -1.74 -1.26 -4.74 117.46 115.10 1l1p n PHE 34 Ca 0.21 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.99 1l1p n PHE 34 Cb 0.35 0.00 -0.08 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 -0.31 -0.35 3.97 3.07 -1.96 -3.15 114.58 115.86 1l1p h GLU 35 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1l1p h GLU 35 Cb 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1l1p h GLU 35 CO 0.00 0.06 0.00 0.41 -1.40 0.00 0.00 179.01 178.08 1l1p n GLY 36 N 0.17 0.14 0.00 -3.84 0.00 -1.26 -4.14 105.19 96.26 1l1p n GLY 36 Ca -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 0.50 -0.44 3.17 -0.02 0.00 -1.19 -4.43 105.19 102.78 1l1p n GLY 37 Ca 0.04 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 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 0.31 -0.03 1.61 2.20 -1.26 0.36 119.74 120.06 1l1p s LYS 38 Ca -0.00 0.55 -0.06 0.00 -0.36 0.00 0.00 55.97 56.10 1l1p s LYS 38 Cb 0.00 0.02 0.01 0.00 -1.51 0.00 0.00 37.83 36.35 1l1p s LYS 38 CO 0.00 -0.11 0.14 0.00 -0.36 0.00 0.00 175.35 175.02 1l1p s ALA 39 N 0.84 -0.34 0.02 3.13 0.00 0.46 -4.95 121.76 120.92 1l1p s ALA 39 Ca -0.06 0.16 -0.03 0.00 0.00 0.00 0.00 51.96 52.03 1l1p s ALA 39 Cb -0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1l1p s ALA 39 CO -0.06 -0.13 -0.06 0.43 0.00 0.00 0.00 175.76 175.93 1l1p n SER 40 N 2.28 0.97 -3.94 0.00 7.64 -1.26 0.97 113.62 120.28 1l1p n SER 40 Ca -0.17 0.14 -0.41 0.00 1.01 0.00 0.00 58.87 59.44 1l1p n SER 40 Cb 0.57 -0.36 -0.00 0.00 -1.01 0.00 0.00 64.21 63.41 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 -3.40 6.03 -4.47 6.43 8.00 -1.25 -2.24 116.55 125.65 1l1p n ASP 41 Ca -0.03 -3.41 -0.43 0.00 0.71 0.00 0.00 54.79 51.63 1l1p n ASP 41 Cb 0.10 -1.19 -0.06 0.00 -0.02 0.00 0.00 41.12 39.95 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 -2.70 2.99 -0.73 1.24 5.36 0.27 -4.85 117.98 119.56 1l1p s PHE 42 Ca 0.32 -0.37 -0.27 0.00 -0.96 0.00 0.00 56.93 55.65 1l1p s PHE 42 Cb 0.06 -3.63 0.03 0.00 -0.34 0.00 0.00 43.02 39.13 1l1p s PHE 42 CO 0.08 -1.09 1.30 0.54 -1.46 0.00 0.00 175.22 174.60 1l1p s VAL 43 N 2.94 3.71 -0.04 3.12 0.11 -1.26 -0.56 120.40 128.42 1l1p s VAL 43 Ca 0.19 0.41 -0.17 0.00 -2.93 0.00 0.00 61.98 59.48 1l1p s VAL 43 Cb -0.17 -4.87 -0.05 0.00 -1.53 0.00 0.00 36.38 29.75 1l1p s VAL 43 CO 0.14 -1.81 0.47 -0.22 -3.33 0.00 0.00 175.10 170.35 1l1p s LEU 44 N 5.88 4.40 -0.47 2.54 0.20 0.42 -4.88 118.68 126.76 1l1p s LEU 44 Ca 0.37 0.95 -0.16 0.00 0.69 0.00 0.00 54.13 55.98 1l1p s LEU 44 Cb -0.08 -2.69 0.07 0.00 -0.43 0.00 0.00 46.19 43.06 1l1p s LEU 44 CO 0.15 0.17 0.41 0.00 -0.29 0.00 0.00 176.35 176.80 1l1p s ALA 45 N -0.32 3.54 -1.14 5.97 0.00 -1.26 0.52 121.76 129.08 1l1p s ALA 45 Ca 0.26 -2.07 -0.23 0.00 0.00 0.00 0.00 51.96 49.92 1l1p s ALA 45 Cb -0.16 -3.09 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1l1p s ALA 45 CO 0.13 -1.75 1.94 -1.33 0.00 0.00 0.00 175.76 174.75 1l1p n MET 46 N 5.29 1.54 -0.03 0.00 2.81 0.47 -3.68 117.12 123.51 1l1p n MET 46 Ca -0.12 -2.38 0.00 0.00 -1.81 0.00 0.00 57.70 53.39 1l1p n MET 46 Cb 0.44 -3.65 0.00 0.00 -0.71 0.00 0.00 33.22 29.30 1l1p n MET 46 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1l1p n GLY 47 N 5.66 0.79 1.33 3.03 0.00 -1.26 -2.61 105.19 112.14 1l1p n GLY 47 Ca 0.45 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.02 0.00 -0.11 1.61 1.13 -1.24 -4.63 117.38 114.12 1l1p n GLN 48 Ca 0.00 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 54.89 1l1p n GLN 48 Cb 0.01 -0.17 -0.06 0.00 0.11 0.00 0.00 30.24 30.13 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 2.88 -0.52 2.65 1.08 0.00 -1.26 -4.98 105.19 105.03 1l1p n GLY 49 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 46.02 45.75 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 0.02 -1.49 1.61 1.85 -1.26 -5.10 116.66 107.92 1l1p n ARG 50 Ca -0.30 -0.54 -0.58 0.00 -1.00 0.00 0.00 57.85 55.44 1l1p n ARG 50 Cb 0.66 -0.03 -0.09 0.00 -1.05 0.00 0.00 32.46 31.95 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 0.86 0.62 -1.60 2.89 1.56 -1.26 -4.89 117.12 115.29 1l1p n MET 51 Ca -0.05 0.19 -0.33 0.00 -0.27 0.00 0.00 57.70 57.25 1l1p n MET 51 Cb 0.75 -1.95 0.06 0.00 2.15 0.00 0.00 33.22 34.24 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 5.43 3.06 0.64 1.12 -4.36 -1.26 -4.73 121.20 121.10 1l1p s ILE 52 Ca 1.10 0.47 0.30 0.00 -0.26 0.00 0.00 60.65 62.25 1l1p s ILE 52 Cb -1.20 -2.98 0.30 0.00 1.25 0.00 0.00 42.46 39.83 1l1p s ILE 52 CO 0.63 -0.33 1.91 1.55 0.24 0.00 0.00 174.94 178.94 1l1p h PRO 53 N -0.24 0.00 0.26 0.37 0.13 -1.92 -1.59 132.00 129.00 1l1p h PRO 53 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1l1p h PRO 53 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1l1p h PRO 53 CO 0.53 0.00 -0.13 0.78 -0.23 0.00 0.00 178.00 178.95 1l1p h GLY 54 N 0.00 -0.36 0.59 1.56 0.00 -1.90 -3.10 103.07 99.86 1l1p h GLY 54 Ca 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 1l1p h GLY 54 CO 0.00 -0.13 -0.05 0.74 0.00 0.00 0.00 176.54 177.09 1l1p h PHE 55 N -1.03 0.15 0.00 5.60 0.04 -1.64 -2.87 116.94 117.19 1l1p h PHE 55 Ca -0.04 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1l1p h PHE 55 Cb 0.41 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.52 1l1p h PHE 55 CO 0.03 0.58 0.31 1.05 -0.60 0.00 0.00 178.31 179.68 1l1p h GLU 56 N -0.32 0.00 0.00 1.51 4.11 -1.47 0.66 114.58 119.07 1l1p h GLU 56 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1l1p h GLU 56 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1l1p h GLU 56 CO 0.01 0.00 0.00 -3.47 0.07 0.00 0.00 179.01 175.62 1l1p n ASP 57 N -2.65 0.00 0.20 3.06 -0.08 -1.09 -3.82 116.55 112.18 1l1p n ASP 57 Ca -0.02 0.22 -0.14 0.00 -1.51 0.00 0.00 54.79 53.34 1l1p n ASP 57 Cb 0.35 -0.22 -0.08 0.00 2.34 0.00 0.00 41.12 43.51 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 -0.55 -3.07 0.27 0.00 -1.49 -3.04 103.07 95.18 1l1p h GLY 58 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1l1p h GLY 58 CO 0.00 -0.20 0.00 1.39 0.00 0.00 0.00 176.54 177.73 1l1p n ILE 59 N -5.21 1.75 -0.03 2.60 -0.00 0.21 -4.22 119.36 114.47 1l1p n ILE 59 Ca -0.10 -0.43 -0.09 0.00 -0.00 0.00 0.00 62.75 62.13 1l1p n ILE 59 Cb 0.28 -1.43 -0.02 0.00 -0.00 0.00 0.00 39.64 38.47 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 1.29 -0.26 0.00 0.38 1.79 -1.57 -3.43 116.57 114.77 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 0.89 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.60 1l1p h LYS 60 CO 0.00 -0.18 0.00 0.41 -1.08 0.00 0.00 179.45 178.60 1l1p n GLY 61 N -1.37 0.92 0.06 3.86 0.00 -1.26 -4.81 105.19 102.59 1l1p n GLY 61 Ca -0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.24 1.61 1.44 -1.26 0.11 115.22 113.88 1l1p n HIS 62 Ca 0.00 -0.41 -0.21 0.00 -2.01 0.00 0.00 57.72 55.09 1l1p n HIS 62 Cb 0.00 -0.05 -0.07 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 -0.97 0.91 -0.55 -1.40 1.02 -1.26 -5.03 119.74 112.46 1l1p s LYS 63 Ca 0.05 -1.75 -0.26 0.00 0.02 0.00 0.00 55.97 54.04 1l1p s LYS 63 Cb 0.05 -1.04 -0.08 0.00 -0.52 0.00 0.00 37.83 36.24 1l1p s LYS 63 CO 0.01 -1.36 2.42 0.00 -0.92 0.00 0.00 175.35 175.50 1l1p n ALA 64 N 3.01 0.69 -0.06 5.17 0.00 -1.26 -1.85 120.51 126.21 1l1p n ALA 64 Ca 0.25 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1l1p n ALA 64 Cb 0.49 -3.23 0.00 0.00 0.00 0.00 0.00 19.45 16.71 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 6.16 1.31 4.00 0.00 0.00 0.63 -4.82 105.19 112.47 1l1p n GLY 65 Ca 0.39 -0.02 -0.18 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 -0.43 2.82 -0.26 1.61 2.56 0.15 -4.85 118.70 120.30 1l1p s GLU 66 Ca 0.00 -1.09 -0.03 0.00 0.00 0.00 0.00 54.97 53.85 1l1p s GLU 66 Cb 0.00 -2.71 0.09 0.00 2.00 0.00 0.00 34.13 33.51 1l1p s GLU 66 CO 0.00 -0.31 0.09 -1.21 -0.56 0.00 0.00 175.26 173.27 1l1p s GLU 67 N -4.42 0.49 0.20 4.30 2.02 -1.26 0.43 118.70 120.46 1l1p s GLU 67 Ca 0.54 -0.67 0.01 0.00 0.02 0.00 0.00 54.97 54.87 1l1p s GLU 67 Cb -0.10 -1.76 -0.05 0.00 0.10 0.00 0.00 34.13 32.33 1l1p s GLU 67 CO 0.34 -0.88 0.06 -0.59 0.02 0.00 0.00 175.26 174.21 1l1p s PHE 68 N 1.86 1.24 -0.08 1.61 -0.12 0.48 -4.95 117.98 118.03 1l1p s PHE 68 Ca 0.06 -1.17 0.02 0.00 -0.05 0.00 0.00 56.93 55.80 1l1p s PHE 68 Cb -0.17 -0.70 0.01 0.00 -0.63 0.00 0.00 43.02 41.54 1l1p s PHE 68 CO -0.23 -0.38 -0.15 0.99 -0.05 0.00 0.00 175.22 175.41 1l1p s THR 69 N -3.84 1.35 0.22 -4.49 2.01 -1.26 0.17 115.64 109.79 1l1p s THR 69 Ca 0.31 -0.59 0.02 0.00 0.31 0.00 0.00 61.69 61.73 1l1p s THR 69 Cb 0.07 -1.22 -0.05 0.00 0.01 0.00 0.00 72.50 71.32 1l1p s THR 69 CO 0.08 0.40 0.04 0.27 -0.69 0.00 0.00 174.62 174.73 1l1p s ILE 70 N 0.68 0.68 0.18 1.82 -0.00 -0.19 -4.93 121.20 119.45 1l1p s ILE 70 Ca -0.14 -2.00 -0.08 0.00 -0.00 0.00 0.00 60.65 58.43 1l1p s ILE 70 Cb -0.16 -2.38 -0.07 0.00 -0.00 0.00 0.00 42.46 39.85 1l1p s ILE 70 CO 0.04 -0.24 0.48 -1.81 -0.00 0.00 0.00 174.94 173.40 1l1p s ASP 71 N -3.26 6.60 -0.09 4.36 1.11 -1.26 -1.75 116.67 122.38 1l1p s ASP 71 Ca 0.31 0.82 -0.05 0.00 0.18 0.00 0.00 52.55 53.80 1l1p s ASP 71 Cb 0.07 -2.18 0.04 0.00 1.07 0.00 0.00 42.92 41.91 1l1p s ASP 71 CO 0.09 0.01 0.22 0.68 1.18 0.00 0.00 175.17 177.34 1l1p s VAL 72 N -1.70 -0.04 -0.14 -1.27 -7.23 -0.52 -3.80 120.40 105.71 1l1p s VAL 72 Ca 0.43 0.13 -0.06 0.00 -1.81 0.00 0.00 61.98 60.67 1l1p s VAL 72 Cb -0.12 -0.33 0.07 0.00 0.56 0.00 0.00 36.38 36.55 1l1p s VAL 72 CO 0.22 0.05 0.31 -0.89 -0.31 0.00 0.00 175.10 174.48 1l1p s THR 73 N 1.04 -0.38 -0.08 5.32 2.01 -1.26 0.89 115.64 123.18 1l1p s THR 73 Ca -0.08 0.22 -0.24 0.00 0.31 0.00 0.00 61.69 61.90 1l1p s THR 73 Cb -0.09 -0.50 -0.03 0.00 0.01 0.00 0.00 72.50 71.89 1l1p s THR 73 CO -0.06 0.09 0.76 -0.36 -0.69 0.00 0.00 174.62 174.36 1l1p s PHE 74 N 2.22 3.55 1.11 4.92 0.40 -1.18 -4.91 117.98 124.08 1l1p s PHE 74 Ca -0.02 1.29 -0.19 0.00 -0.60 0.00 0.00 56.93 57.42 1l1p s PHE 74 Cb -0.11 -2.89 0.28 0.00 0.51 0.00 0.00 43.02 40.81 1l1p s PHE 74 CO -0.10 -0.00 0.97 -0.35 0.70 0.00 0.00 175.22 176.44 1l1p n PRO 75 N 4.14 -3.01 0.00 0.24 -0.04 -1.26 -4.08 135.00 130.99 1l1p n PRO 75 Ca 0.01 -1.56 0.12 0.00 -0.04 0.00 0.00 63.50 62.03 1l1p n PRO 75 Cb 0.51 -1.48 0.57 0.00 -0.04 0.00 0.00 33.50 33.05 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 0.15 0.03 0.54 4.71 -1.26 -3.13 120.64 117.13 1l1p n GLU 76 Ca 0.14 0.07 -0.18 0.00 -0.01 0.00 0.00 57.16 57.17 1l1p n GLU 76 Cb 0.53 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 29.32 1l1p n GLU 76 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1l1p h GLU 77 N 0.00 0.24 0.01 3.49 5.08 -2.03 -3.40 114.58 117.97 1l1p h GLU 77 Ca 0.00 -0.40 -0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1l1p h GLU 77 Cb 0.34 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1l1p h GLU 77 CO 0.00 1.08 -0.01 -0.92 -1.00 0.00 0.00 179.01 178.16 1l1p h TYR 78 N 0.06 -0.01 -6.64 4.33 5.03 -1.90 -3.47 116.97 114.37 1l1p h TYR 78 Ca -0.33 -0.00 -0.42 0.00 2.58 0.00 0.00 58.73 60.55 1l1p h TYR 78 Cb 2.04 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 40.32 1l1p h TYR 78 CO 0.06 -0.01 -0.85 0.72 -1.32 0.00 0.00 178.16 176.76 1l1p n HIS 79 N -2.06 -1.40 -2.57 -3.82 8.25 -1.21 -4.87 115.22 107.54 1l1p n HIS 79 Ca -0.00 0.43 -0.40 0.00 -0.26 0.00 0.00 57.72 57.49 1l1p n HIS 79 Cb 0.01 -2.15 -0.05 0.00 1.12 0.00 0.00 29.99 28.92 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 -3.15 3.38 0.61 -1.41 0.00 -1.26 -4.62 121.76 115.30 1l1p s ALA 80 Ca 0.14 0.81 0.27 0.00 0.00 0.00 0.00 51.96 53.18 1l1p s ALA 80 Cb -0.08 -3.29 1.29 0.00 0.00 0.00 0.00 23.12 21.04 1l1p s ALA 80 CO 0.73 -0.04 1.70 1.49 0.00 0.00 0.00 175.76 179.64 1l1p h GLU 81 N 3.92 0.00 0.06 0.00 4.81 -1.97 1.82 114.58 123.21 1l1p h GLU 81 Ca -0.46 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.39 1l1p h GLU 81 Cb 1.21 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.54 1l1p h GLU 81 CO 0.67 0.00 -2.23 0.27 -0.73 0.00 0.00 179.01 177.00 1l1p n ASN 82 N -3.44 1.93 -0.27 1.04 6.94 -1.26 -4.69 115.26 115.50 1l1p n ASN 82 Ca 0.11 0.05 0.03 0.00 -0.02 0.00 0.00 54.58 54.74 1l1p n ASN 82 Cb 0.89 -0.55 0.04 0.00 -2.36 0.00 0.00 39.78 37.80 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 -3.33 0.77 -2.85 -4.53 -0.00 -0.76 -5.00 117.00 101.29 1l1p n LEU 83 Ca -0.38 -1.47 -0.38 0.00 -0.00 0.00 0.00 56.01 53.77 1l1p n LEU 83 Cb 1.03 -0.11 -0.05 0.00 -0.00 0.00 0.00 43.42 44.28 1l1p n LEU 83 CO 0.35 0.35 0.46 2.29 -0.00 0.00 0.00 177.39 180.85 1l1p n LYS 84 N -0.41 0.00 -3.88 1.47 2.85 0.61 -1.60 118.16 117.19 1l1p n LYS 84 Ca 0.04 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 57.03 1l1p n LYS 84 Cb 0.62 -0.93 -0.00 0.00 -0.65 0.00 0.00 35.03 34.06 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 1.40 -0.41 3.33 2.58 0.00 -1.26 -4.79 105.19 106.05 1l1p n GLY 85 Ca 0.15 0.22 -0.47 0.00 0.00 0.00 0.00 46.02 45.92 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 -6.42 3.49 -0.78 1.61 2.47 -0.63 -4.81 119.74 114.67 1l1p s LYS 86 Ca 0.12 -2.27 -0.26 0.00 -1.56 0.00 0.00 55.97 51.99 1l1p s LYS 86 Cb -0.04 -4.43 0.02 0.00 -1.46 0.00 0.00 37.83 31.92 1l1p s LYS 86 CO 0.88 -1.33 1.43 0.00 0.16 0.00 0.00 175.35 176.50 1l1p s ALA 87 N 0.59 2.60 0.04 3.13 0.00 -1.26 -3.12 121.76 123.74 1l1p s ALA 87 Ca 0.16 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 50.70 1l1p s ALA 87 Cb -0.14 -4.33 -0.00 0.00 0.00 0.00 0.00 23.12 18.65 1l1p s ALA 87 CO -0.07 -3.51 0.02 0.00 0.00 0.00 0.00 175.76 172.20 1l1p n ALA 88 N 10.03 0.07 -2.53 0.00 0.00 0.26 -4.58 120.51 123.75 1l1p n ALA 88 Ca 0.13 -0.21 -0.25 0.00 0.00 0.00 0.00 53.44 53.11 1l1p n ALA 88 Cb 0.50 0.15 -0.15 0.00 0.00 0.00 0.00 19.45 19.95 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 -2.15 1.41 0.06 0.00 1.02 0.30 -1.43 119.74 118.94 1l1p s LYS 89 Ca 0.03 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.43 1l1p s LYS 89 Cb 0.00 -1.35 -0.03 0.00 -0.52 0.00 0.00 37.83 35.93 1l1p s LYS 89 CO 0.02 0.36 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.69 1l1p s PHE 90 N -0.37 0.68 -0.30 3.18 0.08 -0.72 -1.43 117.98 119.10 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 -0.07 -0.41 0.09 0.00 -0.57 0.00 0.00 43.02 42.06 1l1p s PHE 90 CO -0.00 -0.14 0.02 0.00 -0.10 0.00 0.00 175.22 174.99 1l1p s ALA 91 N -2.27 2.33 0.29 5.36 0.00 -1.05 -1.02 121.76 125.39 1l1p s ALA 91 Ca -0.03 -1.98 0.06 0.00 0.00 0.00 0.00 51.96 50.02 1l1p s ALA 91 Cb -0.04 -1.72 -0.02 0.00 0.00 0.00 0.00 23.12 21.34 1l1p s ALA 91 CO -0.02 -1.52 0.36 0.42 0.00 0.00 0.00 175.76 175.01 1l1p s ILE 92 N 1.20 4.46 -0.25 0.00 1.01 0.46 -0.99 121.20 127.10 1l1p s ILE 92 Ca 0.05 -1.11 -0.03 0.00 0.00 0.00 0.00 60.65 59.56 1l1p s ILE 92 Cb -0.19 -3.53 0.08 0.00 0.01 0.00 0.00 42.46 38.83 1l1p s ILE 92 CO -0.11 -0.25 0.08 0.20 0.00 0.00 0.00 174.94 174.86 1l1p s ASN 93 N -4.03 3.31 0.67 3.58 0.01 0.16 0.18 114.94 118.82 1l1p s ASN 93 Ca 0.39 -1.14 -0.16 0.00 -0.71 0.00 0.00 52.86 51.24 1l1p s ASN 93 Cb -0.09 -0.58 0.01 0.00 0.41 0.00 0.00 41.25 41.00 1l1p s ASN 93 CO 0.29 -0.37 1.16 -0.22 -1.51 0.00 0.00 177.10 176.45 1l1p s LEU 94 N 1.88 3.43 0.00 0.60 2.96 0.17 -1.80 118.68 125.91 1l1p s LEU 94 Ca 0.05 2.20 0.00 0.00 -0.22 0.00 0.00 54.13 56.16 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 -1.84 0.00 0.29 -1.32 0.00 0.00 176.35 173.29 1l1p n LYS 95 N -2.33 0.00 -2.26 1.98 4.76 0.21 0.32 118.16 120.85 1l1p n LYS 95 Ca 0.12 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.15 1l1p n LYS 95 Cb 0.51 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.67 1l1p n LYS 95 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1l1p s LYS 96 N 1.87 3.07 -0.35 1.97 1.02 -1.20 -3.25 119.74 122.86 1l1p s LYS 96 Ca 0.00 0.52 -0.07 0.00 0.02 0.00 0.00 55.97 56.45 1l1p s LYS 96 Cb 0.00 -4.22 0.05 0.00 -0.52 0.00 0.00 37.83 33.13 1l1p s LYS 96 CO 0.00 -2.21 0.12 0.54 -0.92 0.00 0.00 175.35 172.88 1l1p s VAL 97 N 7.09 3.81 0.33 3.17 0.11 -1.26 0.41 120.40 134.05 1l1p s VAL 97 Ca 0.58 -1.20 0.03 0.00 -2.93 0.00 0.00 61.98 58.46 1l1p s VAL 97 Cb -0.12 -3.19 -0.05 0.00 -1.53 0.00 0.00 36.38 31.49 1l1p s VAL 97 CO 0.23 -0.23 0.10 -1.61 -3.33 0.00 0.00 175.10 170.26 1l1p s GLU 98 N 1.39 1.66 -0.99 1.54 2.02 -1.25 -4.38 118.70 118.70 1l1p s GLU 98 Ca -0.01 -1.94 -0.15 0.00 0.02 0.00 0.00 54.97 52.89 1l1p s GLU 98 Cb -0.20 -0.55 0.18 0.00 0.10 0.00 0.00 34.13 33.66 1l1p s GLU 98 CO 0.02 -0.32 1.10 -2.00 0.02 0.00 0.00 175.26 174.08 1l1p s GLU 99 N -3.87 3.80 0.78 1.61 -6.30 -1.26 -2.82 118.70 110.64 1l1p s GLU 99 Ca 0.33 -2.34 -0.12 0.00 -2.50 0.00 0.00 54.97 50.34 1l1p s GLU 99 Cb 0.06 -4.77 0.07 0.00 0.00 0.00 0.00 34.13 29.49 1l1p s GLU 99 CO 0.15 -1.57 1.14 -0.98 0.02 0.00 0.00 175.26 174.02 1l1p s ARG 100 N 1.21 1.94 -0.42 4.30 1.04 -1.26 -3.25 118.95 122.51 1l1p s ARG 100 Ca 0.31 1.49 0.02 0.00 -1.04 0.00 0.00 55.73 56.50 1l1p s ARG 100 Cb -0.06 -1.84 0.25 0.00 -2.04 0.00 0.00 34.95 31.26 1l1p s ARG 100 CO -0.07 -1.93 1.03 -1.91 -0.04 0.00 0.00 175.30 172.37 1l1p n GLU 101 N -3.33 0.46 -0.04 3.89 2.13 -1.26 -4.68 120.64 117.80 1l1p n GLU 101 Ca 0.11 -1.29 -0.11 0.00 0.66 0.00 0.00 57.16 56.53 1l1p n GLU 101 Cb 0.52 -0.87 -0.10 0.00 0.27 0.00 0.00 31.44 31.26 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 3.78 -0.03 -9.15 4.31 4.07 -1.95 -3.45 115.31 112.89 1l1p h LEU 102 Ca -0.15 -0.70 -0.56 0.00 0.08 0.00 0.00 57.88 56.55 1l1p h LEU 102 Cb 1.12 0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.86 1l1p h LEU 102 CO 0.07 0.78 1.25 -2.84 -1.08 0.00 0.00 178.44 176.62 1l1p s PRO 103 N -2.49 3.79 -0.19 1.13 0.02 -1.26 -4.96 135.00 131.04 1l1p s PRO 103 Ca -0.15 2.12 -0.25 0.00 0.02 0.00 0.00 61.00 62.74 1l1p s PRO 103 Cb -0.02 -4.15 -0.01 0.00 0.02 0.00 0.00 34.50 30.34 1l1p s PRO 103 CO 0.55 -1.33 0.83 -1.21 -0.33 0.00 0.00 177.00 175.51 1l1p s GLU 104 N 4.94 4.27 -0.51 5.54 0.41 -1.26 -5.02 118.70 127.08 1l1p s GLU 104 Ca 0.84 1.00 -0.10 0.00 -0.41 0.00 0.00 54.97 56.31 1l1p s GLU 104 Cb -0.34 -3.59 0.13 0.00 -1.78 0.00 0.00 34.13 28.55 1l1p s GLU 104 CO 0.35 -0.38 0.39 -0.51 -0.49 0.00 0.00 175.26 174.62 1l1p s LEU 105 N 2.34 5.78 0.00 1.80 2.01 -1.26 -5.30 118.68 124.05 1l1p s LEU 105 Ca 0.37 -2.00 0.08 0.00 0.01 0.00 0.00 54.13 52.60 1l1p s LEU 105 Cb -0.16 -2.03 0.07 0.00 0.01 0.00 0.00 46.19 44.07 1l1p s LEU 105 CO 0.11 -0.68 0.77 0.35 1.01 0.00 0.00 176.35 177.90