#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 6.13 -0.26 1.61 0.15 -1.26 -4.02 113.70 116.06 1l1p s SER 2 Ca 0.00 1.94 -0.02 0.00 0.70 0.00 0.00 55.95 58.57 1l1p s SER 2 Cb 0.00 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 61.79 1l1p s SER 2 CO 0.00 -1.41 0.05 1.41 1.20 0.00 0.00 173.24 174.49 1l1p n HIS 3 N 9.14 -3.85 0.31 3.44 -0.00 -1.26 -4.95 115.22 118.05 1l1p n HIS 3 Ca 0.22 1.83 -0.15 0.00 -0.00 0.00 0.00 57.72 59.62 1l1p n HIS 3 Cb 0.44 -3.84 -0.08 0.00 -0.00 0.00 0.00 29.99 26.51 1l1p n HIS 3 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 1l1p h MET 4 N 3.05 -0.76 -5.56 -0.41 0.00 -2.09 -3.42 114.93 105.74 1l1p h MET 4 Ca -0.11 0.05 -0.59 0.00 0.00 0.00 0.00 59.70 59.05 1l1p h MET 4 Cb 0.26 0.17 -0.10 0.00 0.00 0.00 0.00 31.60 31.93 1l1p h MET 4 CO 0.08 -0.45 -0.14 1.14 0.00 0.00 0.00 176.91 177.53 1l1p s GLN 5 N -5.15 4.24 0.43 1.72 0.00 -1.26 -5.06 119.66 114.58 1l1p s GLN 5 Ca -0.15 0.34 -0.24 0.00 -0.00 0.00 0.00 55.36 55.30 1l1p s GLN 5 Cb 0.02 -3.51 -0.08 0.00 0.00 0.00 0.00 33.01 29.45 1l1p s GLN 5 CO 0.53 0.00 1.19 0.00 0.00 0.00 0.00 175.29 177.01 1l1p s ALA 6 N 1.15 3.08 0.14 2.60 0.00 -1.26 -5.05 121.76 122.42 1l1p s ALA 6 Ca 0.23 1.00 0.05 0.00 0.00 0.00 0.00 51.96 53.23 1l1p s ALA 6 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1l1p s ALA 6 CO 0.09 -0.64 -0.11 0.95 0.00 0.00 0.00 175.76 176.05 1l1p s THR 7 N -1.44 1.19 0.31 0.00 -4.23 -1.26 -5.17 115.64 105.04 1l1p s THR 7 Ca 0.60 -1.98 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 1l1p s THR 7 Cb -0.31 -1.76 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 1l1p s THR 7 CO 0.39 -0.68 0.26 0.26 -0.54 0.00 0.00 174.62 174.30 1l1p s TRP 8 N -3.07 1.67 -0.00 3.99 0.52 -1.26 -5.06 118.94 115.73 1l1p s TRP 8 Ca 0.15 -1.62 0.00 0.00 0.02 0.00 0.00 56.10 54.65 1l1p s TRP 8 Cb 0.01 -0.69 0.00 0.00 -1.15 0.00 0.00 33.47 31.64 1l1p s TRP 8 CO 0.01 -0.84 0.67 1.63 0.02 0.00 0.00 176.95 178.43 1l1p n LYS 9 N -0.57 0.08 -2.19 4.98 4.76 -1.26 -5.04 118.16 118.91 1l1p n LYS 9 Ca 0.07 -0.69 -0.41 0.00 -2.87 0.00 0.00 58.31 54.41 1l1p n LYS 9 Cb 0.63 -0.52 -0.03 0.00 -1.84 0.00 0.00 35.03 33.27 1l1p n LYS 9 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1l1p s GLU 10 N -0.05 4.40 0.00 1.97 -1.05 -1.23 -4.51 118.70 118.23 1l1p s GLU 10 Ca 0.00 2.11 0.00 0.00 -0.15 0.00 0.00 54.97 56.93 1l1p s GLU 10 Cb 0.00 -3.14 0.00 0.00 -0.44 0.00 0.00 34.13 30.56 1l1p s GLU 10 CO 0.00 -0.18 0.00 1.63 0.95 0.00 0.00 175.26 177.66 1l1p n LYS 11 N 1.67 3.19 -0.69 -4.83 5.02 -1.21 -4.66 118.16 116.65 1l1p n LYS 11 Ca 0.03 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.32 1l1p n LYS 11 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.44 1l1p n LYS 11 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1l1p n ASP 12 N 0.00 0.16 -1.13 4.39 8.00 -1.26 -4.46 116.55 122.25 1l1p n ASP 12 Ca 0.00 -1.94 0.00 0.00 0.71 0.00 0.00 54.79 53.56 1l1p n ASP 12 Cb 0.00 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1l1p n ASP 12 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l1p n GLY 13 N 0.09 1.38 1.21 0.44 0.00 -1.26 -4.95 105.19 102.10 1l1p n GLY 13 Ca 0.01 -1.99 -0.10 0.00 0.00 0.00 0.00 46.02 43.93 1l1p n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l1p n ALA 14 N -3.00 -1.27 -1.76 4.61 0.00 -1.26 -4.04 120.51 113.78 1l1p n ALA 14 Ca 0.00 -0.57 -0.37 0.00 0.00 0.00 0.00 53.44 52.51 1l1p n ALA 14 Cb 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 19.45 19.42 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 -1.66 2.87 0.16 0.00 0.11 0.16 -4.55 120.40 117.49 1l1p s VAL 15 Ca 0.25 0.61 0.01 0.00 -2.93 0.00 0.00 61.98 59.93 1l1p s VAL 15 Cb -0.03 -3.29 -0.05 0.00 -1.53 0.00 0.00 36.38 31.49 1l1p s VAL 15 CO 0.19 -0.04 0.01 -1.61 -3.33 0.00 0.00 175.10 170.31 1l1p s GLU 16 N -2.92 1.07 0.00 1.54 2.02 -1.26 -5.02 118.70 114.13 1l1p s GLU 16 Ca 0.68 -1.51 0.00 0.00 0.02 0.00 0.00 54.97 54.16 1l1p s GLU 16 Cb -0.30 -0.19 0.00 0.00 0.10 0.00 0.00 34.13 33.74 1l1p s GLU 16 CO 0.35 -0.14 0.01 0.00 0.02 0.00 0.00 175.26 175.50 1l1p n ALA 17 N -0.21 0.00 -3.47 5.21 0.00 -1.26 -1.72 120.51 119.05 1l1p n ALA 17 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1l1p n ALA 17 Cb 0.63 0.01 -0.08 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.52 2.58 -2.10 0.00 1.02 -1.24 -4.42 120.64 114.96 1l1p n GLU 18 Ca 0.00 -4.64 -0.11 0.00 -0.02 0.00 0.00 57.16 52.40 1l1p n GLU 18 Cb 0.00 -2.29 0.04 0.00 -0.02 0.00 0.00 31.44 29.17 1l1p n GLU 18 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1l1p n ASP 19 N 1.10 1.18 -3.57 1.62 9.92 -0.70 -4.47 116.55 121.63 1l1p n ASP 19 Ca 0.28 -1.85 -0.21 0.00 -0.53 0.00 0.00 54.79 52.48 1l1p n ASP 19 Cb 0.39 -0.23 -0.15 0.00 -0.64 0.00 0.00 41.12 40.50 1l1p n ASP 19 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1l1p s ARG 20 N -3.44 0.11 0.52 -1.24 1.81 -1.16 0.20 118.95 115.74 1l1p s ARG 20 Ca 0.33 0.18 0.01 0.00 -1.72 0.00 0.00 55.73 54.53 1l1p s ARG 20 Cb -0.03 -1.23 0.02 0.00 -0.45 0.00 0.00 34.95 33.27 1l1p s ARG 20 CO 0.21 -0.59 0.74 0.14 -0.68 0.00 0.00 175.30 175.13 1l1p s VAL 21 N 2.25 2.96 -0.23 3.52 -7.23 0.14 -3.54 120.40 118.28 1l1p s VAL 21 Ca 0.04 -0.65 0.00 0.00 -1.81 0.00 0.00 61.98 59.57 1l1p s VAL 21 Cb -0.15 -3.10 0.03 0.00 0.56 0.00 0.00 36.38 33.72 1l1p s VAL 21 CO -0.10 -0.07 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.62 1l1p s THR 22 N -2.70 2.48 0.16 5.32 2.01 0.14 -0.60 115.64 122.45 1l1p s THR 22 Ca 0.55 -1.16 0.07 0.00 0.31 0.00 0.00 61.69 61.46 1l1p s THR 22 Cb -0.10 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.11 1l1p s THR 22 CO 0.38 0.23 -0.15 0.27 -0.69 0.00 0.00 174.62 174.67 1l1p s ILE 23 N 1.26 1.54 -0.12 1.82 -4.36 -0.01 -0.12 121.20 121.21 1l1p s ILE 23 Ca -0.01 -1.95 0.01 0.00 -0.26 0.00 0.00 60.65 58.44 1l1p s ILE 23 Cb -0.17 -1.79 0.02 0.00 1.25 0.00 0.00 42.46 41.78 1l1p s ILE 23 CO -0.07 -0.49 -0.12 1.51 0.24 0.00 0.00 174.94 176.02 1l1p s ASP 24 N -2.84 2.36 0.22 4.36 -4.77 -0.74 0.11 116.67 115.37 1l1p s ASP 24 Ca 0.15 -0.39 -0.02 0.00 -3.30 0.00 0.00 52.55 49.00 1l1p s ASP 24 Cb -0.03 -1.01 -0.03 0.00 -1.09 0.00 0.00 42.92 40.76 1l1p s ASP 24 CO 0.05 -0.05 0.18 0.72 0.70 0.00 0.00 175.17 176.77 1l1p s PHE 25 N 1.36 1.12 -0.21 2.11 -0.12 0.31 -0.28 117.98 122.28 1l1p s PHE 25 Ca 0.00 -1.33 -0.06 0.00 -0.05 0.00 0.00 56.93 55.49 1l1p s PHE 25 Cb -0.13 -0.49 0.10 0.00 -0.63 0.00 0.00 43.02 41.87 1l1p s PHE 25 CO -0.06 -0.70 0.41 0.99 -0.05 0.00 0.00 175.22 175.81 1l1p s THR 26 N -4.07 -0.65 0.25 -4.49 2.01 -0.28 0.18 115.64 108.59 1l1p s THR 26 Ca 0.37 0.12 -0.22 0.00 0.31 0.00 0.00 61.69 62.28 1l1p s THR 26 Cb 0.06 -0.70 0.03 0.00 0.01 0.00 0.00 72.50 71.90 1l1p s THR 26 CO 0.13 0.03 0.74 -0.83 -0.69 0.00 0.00 174.62 174.00 1l1p s GLY 27 N 2.60 -0.15 0.53 4.40 0.00 0.25 -2.51 107.32 112.44 1l1p s GLY 27 Ca 0.02 -0.19 0.06 0.00 0.00 0.00 0.00 44.72 44.60 1l1p s GLY 27 CO -0.13 -0.06 0.39 -1.35 0.00 0.00 0.00 173.10 171.94 1l1p s SER 28 N -2.90 4.64 0.00 1.64 1.04 -0.66 -3.94 113.70 113.52 1l1p s SER 28 Ca 0.10 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 55.33 1l1p s SER 28 Cb -0.05 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.37 1l1p s SER 28 CO 0.05 -1.04 0.00 0.55 0.98 0.00 0.00 173.24 173.78 1l1p n VAL 29 N -1.71 0.00 -1.08 5.02 3.14 -1.15 0.82 118.33 123.37 1l1p n VAL 29 Ca -0.01 0.08 -0.26 0.00 -2.96 0.00 0.00 64.34 61.18 1l1p n VAL 29 Cb 0.64 -0.95 0.08 0.00 -1.06 0.00 0.00 33.84 32.55 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 -2.05 6.46 0.00 6.55 9.92 -1.26 -4.63 116.55 131.54 1l1p n ASP 30 Ca 0.00 -3.46 0.00 0.00 -0.53 0.00 0.00 54.79 50.80 1l1p n ASP 30 Cb 0.00 -0.96 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 1l1p n ASP 30 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1l1p n GLY 31 N -0.51 0.86 2.93 0.44 0.00 -1.26 -5.03 105.19 102.62 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 -0.82 1.21 -0.05 1.61 2.02 -1.26 -4.95 118.70 116.46 1l1p s GLU 32 Ca 0.00 -0.22 -0.30 0.00 0.02 0.00 0.00 54.97 54.48 1l1p s GLU 32 Cb 0.00 -1.14 -0.07 0.00 0.10 0.00 0.00 34.13 33.02 1l1p s GLU 32 CO 0.00 -0.08 1.89 -1.83 0.02 0.00 0.00 175.26 175.25 1l1p s GLU 33 N 1.01 3.97 0.00 1.61 1.03 -1.26 -2.92 118.70 122.14 1l1p s GLU 33 Ca -0.09 2.32 0.00 0.00 0.03 0.00 0.00 54.97 57.23 1l1p s GLU 33 Cb -0.14 -4.13 0.00 0.00 -0.80 0.00 0.00 34.13 29.05 1l1p s GLU 33 CO -0.00 -1.13 0.00 1.97 -1.33 0.00 0.00 175.26 174.77 1l1p n PHE 34 N 8.12 0.00 0.16 4.83 -1.74 -1.26 -4.77 117.46 122.79 1l1p n PHE 34 Ca 0.20 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.99 1l1p n PHE 34 Cb 0.42 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.36 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 -0.44 -0.76 3.97 3.07 -1.96 -3.21 114.58 115.25 1l1p h GLU 35 Ca 0.00 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.89 1l1p h GLU 35 Cb 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1l1p h GLU 35 CO 0.00 -0.14 0.00 0.41 -1.40 0.00 0.00 179.01 177.88 1l1p n GLY 36 N 0.18 1.30 0.00 -3.84 0.00 -1.26 -4.13 105.19 97.45 1l1p n GLY 36 Ca -0.08 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.81 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 0.24 -0.62 3.22 -0.02 0.00 -1.21 -4.44 105.19 102.36 1l1p n GLY 37 Ca 0.05 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.81 0.29 0.03 1.61 0.00 -1.26 0.87 119.74 118.48 1l1p s LYS 38 Ca 0.04 0.96 0.03 0.00 0.00 0.00 0.00 55.97 57.01 1l1p s LYS 38 Cb 0.04 0.24 -0.02 0.00 0.00 0.00 0.00 37.83 38.09 1l1p s LYS 38 CO 0.11 -0.25 -0.10 0.00 0.00 0.00 0.00 175.35 175.10 1l1p s ALA 39 N 2.48 0.83 0.03 0.59 0.00 0.47 -4.97 121.76 121.19 1l1p s ALA 39 Ca -0.02 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.19 1l1p s ALA 39 Cb -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1l1p s ALA 39 CO -0.12 0.11 -0.09 0.45 0.00 0.00 0.00 175.76 176.12 1l1p n SER 40 N 1.89 1.30 -3.92 0.00 2.88 -1.26 0.12 113.62 114.63 1l1p n SER 40 Ca -0.19 0.18 -0.40 0.00 -1.33 0.00 0.00 58.87 57.13 1l1p n SER 40 Cb 0.55 -0.43 -0.01 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 5.97 -4.44 -3.46 5.75 -1.25 -2.53 116.55 112.86 1l1p n ASP 41 Ca -0.04 -3.41 -0.44 0.00 -0.01 0.00 0.00 54.79 50.90 1l1p n ASP 41 Cb 0.14 -1.18 -0.06 0.00 -1.03 0.00 0.00 41.12 39.00 1l1p n ASP 41 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1l1p s PHE 42 N -2.70 3.00 -0.77 2.11 5.36 0.29 -4.88 117.98 120.39 1l1p s PHE 42 Ca 0.32 -0.59 -0.26 0.00 -0.96 0.00 0.00 56.93 55.44 1l1p s PHE 42 Cb 0.06 -3.71 0.03 0.00 -0.34 0.00 0.00 43.02 39.07 1l1p s PHE 42 CO 0.08 -1.14 1.29 0.54 -1.46 0.00 0.00 175.22 174.54 1l1p s VAL 43 N 2.80 3.76 0.02 3.12 0.11 -1.26 -0.83 120.40 128.12 1l1p s VAL 43 Ca 0.16 0.24 -0.20 0.00 -2.93 0.00 0.00 61.98 59.25 1l1p s VAL 43 Cb -0.20 -4.93 -0.06 0.00 -1.53 0.00 0.00 36.38 29.67 1l1p s VAL 43 CO 0.11 -1.86 0.57 -0.22 -3.33 0.00 0.00 175.10 170.38 1l1p s LEU 44 N 5.59 4.45 -0.48 2.54 0.20 0.23 -4.89 118.68 126.33 1l1p s LEU 44 Ca 0.36 1.17 -0.16 0.00 0.69 0.00 0.00 54.13 56.19 1l1p s LEU 44 Cb -0.07 -2.89 0.07 0.00 -0.43 0.00 0.00 46.19 42.87 1l1p s LEU 44 CO 0.12 0.17 0.42 0.00 -0.29 0.00 0.00 176.35 176.76 1l1p s ALA 45 N -0.51 3.55 -1.11 5.97 0.00 -1.26 0.27 121.76 128.68 1l1p s ALA 45 Ca 0.30 -2.11 -0.23 0.00 0.00 0.00 0.00 51.96 49.92 1l1p s ALA 45 Cb -0.18 -3.10 -0.12 0.00 0.00 0.00 0.00 23.12 19.72 1l1p s ALA 45 CO 0.17 -1.76 1.95 -1.33 0.00 0.00 0.00 175.76 174.79 1l1p n MET 46 N 5.27 1.40 0.00 0.00 2.81 0.53 -3.35 117.12 123.77 1l1p n MET 46 Ca -0.12 -2.29 0.00 0.00 -1.81 0.00 0.00 57.70 53.48 1l1p n MET 46 Cb 0.44 -3.64 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 5.67 0.77 0.73 3.03 0.00 -1.26 -2.56 105.19 111.57 1l1p n GLY 47 Ca 0.45 -0.79 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 -1.06 0.00 0.00 0.00 173.32 172.26 1l1p n GLN 48 N 0.00 0.00 -0.11 1.61 1.13 -1.21 -4.72 117.38 114.08 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 0.00 -0.07 -0.06 0.00 0.11 0.00 0.00 30.24 30.22 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 3.26 -0.57 2.66 1.08 0.00 -1.26 -4.99 105.19 105.36 1l1p n GLY 49 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.40 0.04 -1.51 1.61 1.85 -1.26 -5.12 116.66 107.88 1l1p n ARG 50 Ca -0.29 -0.56 -0.54 0.00 -1.00 0.00 0.00 57.85 55.46 1l1p n ARG 50 Cb 0.64 -0.07 -0.08 0.00 -1.05 0.00 0.00 32.46 31.89 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 1.50 0.97 -1.40 2.89 0.00 -1.26 -4.91 117.12 114.91 1l1p n MET 51 Ca 0.00 0.30 -0.32 0.00 -0.00 0.00 0.00 57.70 57.69 1l1p n MET 51 Cb 0.72 -2.21 0.08 0.00 0.00 0.00 0.00 33.22 31.81 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 5.87 3.12 0.56 1.12 -4.36 -1.26 -4.72 121.20 121.53 1l1p s ILE 52 Ca 1.07 0.43 0.29 0.00 -0.26 0.00 0.00 60.65 62.18 1l1p s ILE 52 Cb -1.02 -2.89 0.29 0.00 1.25 0.00 0.00 42.46 40.09 1l1p s ILE 52 CO 0.57 -0.41 1.87 1.55 0.24 0.00 0.00 174.94 178.76 1l1p h PRO 53 N -0.73 0.00 0.12 0.37 0.13 -1.93 -1.27 132.00 128.69 1l1p h PRO 53 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.68 1l1p h PRO 53 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1l1p h PRO 53 CO 0.51 0.00 -0.06 0.78 -0.23 0.00 0.00 178.00 179.01 1l1p h GLY 54 N 0.00 -0.17 0.87 1.56 0.00 -1.90 -3.00 103.07 100.44 1l1p h GLY 54 Ca 0.00 0.06 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 1l1p h GLY 54 CO 0.00 -0.06 -0.14 0.74 0.00 0.00 0.00 176.54 177.08 1l1p h PHE 55 N -1.01 0.64 0.00 5.60 0.04 -1.66 -2.30 116.94 118.26 1l1p h PHE 55 Ca -0.02 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.59 1l1p h PHE 55 Cb 0.33 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1l1p h PHE 55 CO 0.05 0.81 0.00 -0.85 -0.60 0.00 0.00 178.31 177.73 1l1p n GLU 56 N -4.45 0.05 0.00 1.51 0.28 -0.51 -0.83 120.64 116.69 1l1p n GLU 56 Ca -0.04 0.50 0.00 0.00 -0.16 0.00 0.00 57.16 57.46 1l1p n GLU 56 Cb 0.36 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.60 1l1p n GLU 56 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1l1p n ASP 57 N -1.73 0.00 -0.03 -1.84 2.03 -0.87 -3.91 116.55 110.20 1l1p n ASP 57 Ca 0.00 0.14 -0.13 0.00 0.52 0.00 0.00 54.79 55.32 1l1p n ASP 57 Cb 0.04 -0.14 -0.09 0.00 -0.72 0.00 0.00 41.12 40.21 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 0.16 -2.81 0.27 0.00 -1.55 -3.14 103.07 96.01 1l1p h GLY 58 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1l1p h GLY 58 CO 0.00 0.15 0.00 1.39 0.00 0.00 0.00 176.54 178.09 1l1p n ILE 59 N -4.72 1.81 -0.06 2.60 -0.00 -0.01 -4.26 119.36 114.72 1l1p n ILE 59 Ca -0.08 -0.41 -0.08 0.00 -0.00 0.00 0.00 62.75 62.19 1l1p n ILE 59 Cb 0.30 -1.40 -0.02 0.00 -0.00 0.00 0.00 39.64 38.52 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 0.81 -0.24 0.00 0.38 1.79 -1.60 -3.43 116.57 114.27 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 1.00 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 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 -1.39 0.92 0.01 3.86 0.00 -1.26 -4.78 105.19 102.55 1l1p n GLY 61 Ca -0.00 0.00 0.00 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 -3.27 1.61 1.44 -1.26 0.39 115.22 114.13 1l1p n HIS 62 Ca 0.00 -0.41 -0.19 0.00 -2.01 0.00 0.00 57.72 55.11 1l1p n HIS 62 Cb 0.00 -0.04 -0.07 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 -0.85 0.82 -0.54 -1.40 1.02 -1.26 -5.03 119.74 112.50 1l1p s LYS 63 Ca 0.01 -1.43 -0.26 0.00 0.02 0.00 0.00 55.97 54.31 1l1p s LYS 63 Cb 0.01 -0.91 -0.08 0.00 -0.52 0.00 0.00 37.83 36.32 1l1p s LYS 63 CO 0.00 -1.30 2.42 0.00 -0.92 0.00 0.00 175.35 175.55 1l1p n ALA 64 N 3.43 0.70 -0.08 5.17 0.00 -1.26 -2.02 120.51 126.46 1l1p n ALA 64 Ca 0.20 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1l1p n ALA 64 Cb 0.48 -3.23 0.00 0.00 0.00 0.00 0.00 19.45 16.69 1l1p n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l1p n GLY 65 N 6.15 1.12 3.99 0.00 0.00 0.21 -4.83 105.19 111.83 1l1p n GLY 65 Ca 0.39 -0.02 -0.20 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.28 3.02 -0.29 1.61 2.56 0.18 -4.86 118.70 120.65 1l1p s GLU 66 Ca 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 54.97 54.02 1l1p s GLU 66 Cb 0.00 -2.74 0.09 0.00 2.00 0.00 0.00 34.13 33.48 1l1p s GLU 66 CO 0.00 -0.11 0.09 -2.00 -0.56 0.00 0.00 175.26 172.68 1l1p s GLU 67 N -4.32 0.64 0.21 4.30 2.12 -1.26 0.38 118.70 120.77 1l1p s GLU 67 Ca 0.48 -0.88 0.01 0.00 0.36 0.00 0.00 54.97 54.95 1l1p s GLU 67 Cb -0.10 -1.89 -0.05 0.00 0.26 0.00 0.00 34.13 32.36 1l1p s GLU 67 CO 0.33 -0.93 0.06 -0.59 -0.54 0.00 0.00 175.26 173.60 1l1p s PHE 68 N 1.73 1.34 -0.06 5.30 -0.12 0.43 -4.95 117.98 121.64 1l1p s PHE 68 Ca 0.08 -1.14 0.03 0.00 -0.05 0.00 0.00 56.93 55.84 1l1p s PHE 68 Cb -0.17 -0.76 0.01 0.00 -0.63 0.00 0.00 43.02 41.46 1l1p s PHE 68 CO -0.24 -0.33 -0.15 0.99 -0.05 0.00 0.00 175.22 175.45 1l1p s THR 69 N -3.77 1.31 0.24 -4.49 2.01 -1.26 0.17 115.64 109.85 1l1p s THR 69 Ca 0.32 -0.60 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1l1p s THR 69 Cb 0.07 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.38 1l1p s THR 69 CO 0.09 0.39 0.16 0.27 -0.69 0.00 0.00 174.62 174.84 1l1p s ILE 70 N 0.45 0.05 0.17 1.82 -5.25 0.29 -4.91 121.20 113.81 1l1p s ILE 70 Ca -0.12 -2.00 -0.05 0.00 -0.99 0.00 0.00 60.65 57.49 1l1p s ILE 70 Cb -0.15 -2.51 -0.06 0.00 2.95 0.00 0.00 42.46 42.70 1l1p s ILE 70 CO 0.04 0.00 0.41 1.51 -1.79 0.00 0.00 174.94 175.11 1l1p s ASP 71 N -3.23 6.50 -0.09 4.36 -4.77 -1.26 -1.17 116.67 117.01 1l1p s ASP 71 Ca 0.39 0.62 -0.05 0.00 -3.30 0.00 0.00 52.55 50.21 1l1p s ASP 71 Cb 0.06 -2.10 0.04 0.00 -1.09 0.00 0.00 42.92 39.82 1l1p s ASP 71 CO 0.16 0.02 0.22 0.68 0.70 0.00 0.00 175.17 176.94 1l1p s VAL 72 N -1.72 -0.03 -0.17 2.11 -7.23 -0.31 -3.90 120.40 109.14 1l1p s VAL 72 Ca 0.42 0.12 -0.07 0.00 -1.81 0.00 0.00 61.98 60.64 1l1p s VAL 72 Cb -0.12 -0.33 0.08 0.00 0.56 0.00 0.00 36.38 36.56 1l1p s VAL 72 CO 0.25 0.05 0.37 -0.89 -0.31 0.00 0.00 175.10 174.57 1l1p s THR 73 N 1.00 -0.42 -0.08 5.32 2.01 -1.26 0.12 115.64 122.33 1l1p s THR 73 Ca -0.07 0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.86 1l1p s THR 73 Cb -0.09 -0.59 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 1l1p s THR 73 CO -0.06 0.07 0.76 -0.36 -0.69 0.00 0.00 174.62 174.34 1l1p s PHE 74 N 2.22 3.55 1.26 4.92 0.40 -1.20 -4.91 117.98 124.23 1l1p s PHE 74 Ca -0.03 1.30 -0.21 0.00 -0.60 0.00 0.00 56.93 57.39 1l1p s PHE 74 Cb -0.11 -2.89 0.32 0.00 0.51 0.00 0.00 43.02 40.85 1l1p s PHE 74 CO -0.12 0.00 0.95 -0.35 0.70 0.00 0.00 175.22 176.41 1l1p n PRO 75 N 4.11 -3.73 0.00 0.24 -0.04 -1.26 -4.13 135.00 130.19 1l1p n PRO 75 Ca 0.01 -1.55 0.12 0.00 -0.04 0.00 0.00 63.50 62.04 1l1p n PRO 75 Cb 0.51 -1.65 0.56 0.00 -0.04 0.00 0.00 33.50 32.87 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 -5.06 0.07 -0.04 0.54 4.71 -1.26 -3.21 120.64 116.40 1l1p n GLU 76 Ca 0.14 0.06 -0.10 0.00 -0.01 0.00 0.00 57.16 57.26 1l1p n GLU 76 Cb 0.56 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 29.35 1l1p n GLU 76 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 1l1p n GLU 77 N -1.46 0.65 0.05 3.49 0.00 -1.26 -4.50 120.64 117.61 1l1p n GLU 77 Ca 0.07 0.23 -0.02 0.00 0.00 0.00 0.00 57.16 57.45 1l1p n GLU 77 Cb 0.28 -1.73 -0.01 0.00 0.00 0.00 0.00 31.44 29.97 1l1p n GLU 77 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 1l1p h TYR 78 N 0.00 -0.12 -5.87 -1.84 5.03 -1.90 -3.47 116.97 108.80 1l1p h TYR 78 Ca -0.35 -0.00 -0.33 0.00 2.58 0.00 0.00 58.73 60.63 1l1p h TYR 78 Cb 2.06 0.04 0.01 0.00 1.55 0.00 0.00 36.73 40.38 1l1p h TYR 78 CO 0.01 -0.07 -0.85 0.72 -1.32 0.00 0.00 178.16 176.65 1l1p n HIS 79 N -2.47 -1.67 -3.04 -3.82 8.25 -1.23 -4.91 115.22 106.32 1l1p n HIS 79 Ca -0.02 0.69 -0.34 0.00 -0.26 0.00 0.00 57.72 57.80 1l1p n HIS 79 Cb 0.05 -1.67 -0.06 0.00 1.12 0.00 0.00 29.99 29.42 1l1p n HIS 79 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1l1p s ALA 80 N -2.00 3.29 0.57 -1.41 0.00 -1.26 -4.68 121.76 116.27 1l1p s ALA 80 Ca 0.12 0.18 0.29 0.00 0.00 0.00 0.00 51.96 52.56 1l1p s ALA 80 Cb -0.01 -2.88 1.46 0.00 0.00 0.00 0.00 23.12 21.69 1l1p s ALA 80 CO 0.65 0.28 1.89 0.93 0.00 0.00 0.00 175.76 179.51 1l1p h GLU 81 N 2.64 0.00 0.04 0.00 3.07 -1.97 1.24 114.58 119.61 1l1p h GLU 81 Ca -0.48 0.00 -0.36 0.00 -0.50 0.00 0.00 59.36 58.02 1l1p h GLU 81 Cb 1.18 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 29.04 1l1p h GLU 81 CO 0.65 0.00 -2.17 0.27 -1.40 0.00 0.00 179.01 176.36 1l1p n ASN 82 N -3.92 1.54 -0.29 1.42 6.94 -1.26 -4.70 115.26 114.99 1l1p n ASN 82 Ca 0.12 0.10 0.02 0.00 -0.02 0.00 0.00 54.58 54.79 1l1p n ASN 82 Cb 0.76 -0.29 0.02 0.00 -2.36 0.00 0.00 39.78 37.91 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 -3.22 0.52 -2.73 -4.53 -0.00 -1.01 -5.03 117.00 101.00 1l1p n LEU 83 Ca -0.34 -1.21 -0.39 0.00 -0.00 0.00 0.00 56.01 54.07 1l1p n LEU 83 Cb 1.05 -0.07 -0.06 0.00 -0.00 0.00 0.00 43.42 44.34 1l1p n LEU 83 CO 0.38 0.29 0.64 2.29 -0.00 0.00 0.00 177.39 180.99 1l1p n LYS 84 N -0.28 0.00 -3.61 1.47 2.85 0.42 -1.27 118.16 117.75 1l1p n LYS 84 Ca 0.03 0.00 -0.22 0.00 -1.05 0.00 0.00 58.31 57.06 1l1p n LYS 84 Cb 0.62 -0.87 0.04 0.00 -0.65 0.00 0.00 35.03 34.18 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 2.23 -0.60 3.33 2.58 0.00 -1.26 -4.78 105.19 106.69 1l1p n GLY 85 Ca 0.18 0.28 -0.47 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.69 3.49 -0.72 1.61 2.47 -0.39 -4.81 119.74 115.69 1l1p s LYS 86 Ca 0.19 -2.28 -0.27 0.00 -1.56 0.00 0.00 55.97 52.04 1l1p s LYS 86 Cb -0.05 -4.42 0.02 0.00 -1.46 0.00 0.00 37.83 31.92 1l1p s LYS 86 CO 0.81 -1.32 1.39 0.00 0.16 0.00 0.00 175.35 176.39 1l1p s ALA 87 N 0.56 2.64 0.11 3.13 0.00 -1.26 -3.21 121.76 123.72 1l1p s ALA 87 Ca 0.16 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 50.89 1l1p s ALA 87 Cb -0.14 -4.27 -0.01 0.00 0.00 0.00 0.00 23.12 18.71 1l1p s ALA 87 CO -0.07 -3.41 0.06 0.00 0.00 0.00 0.00 175.76 172.34 1l1p n ALA 88 N 10.04 0.18 -2.57 0.00 0.00 0.32 -4.52 120.51 123.96 1l1p n ALA 88 Ca 0.07 -0.57 -0.25 0.00 0.00 0.00 0.00 53.44 52.69 1l1p n ALA 88 Cb 0.50 0.42 -0.15 0.00 0.00 0.00 0.00 19.45 20.21 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 -2.42 1.44 0.06 0.00 3.01 0.24 -1.17 119.74 120.91 1l1p s LYS 89 Ca 0.08 -0.61 0.01 0.00 -1.01 0.00 0.00 55.97 54.45 1l1p s LYS 89 Cb 0.00 -1.36 -0.03 0.00 -1.01 0.00 0.00 37.83 35.43 1l1p s LYS 89 CO 0.06 0.35 -0.06 -0.06 0.51 0.00 0.00 175.35 176.14 1l1p s PHE 90 N -0.33 0.70 -0.30 3.18 0.08 -0.31 -1.65 117.98 119.35 1l1p s PHE 90 Ca 0.05 -0.73 0.02 0.00 0.12 0.00 0.00 56.93 56.39 1l1p s PHE 90 Cb -0.07 -0.42 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 0.00 175.22 174.98 1l1p s ALA 91 N -2.55 2.32 0.30 5.36 0.00 -1.05 -0.54 121.76 125.60 1l1p s ALA 91 Ca -0.00 -1.96 0.07 0.00 0.00 0.00 0.00 51.96 50.06 1l1p s ALA 91 Cb -0.02 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.36 1l1p s ALA 91 CO -0.03 -1.51 0.34 0.42 0.00 0.00 0.00 175.76 174.98 1l1p s ILE 92 N 1.21 4.25 -0.24 0.00 1.01 0.46 -1.13 121.20 126.75 1l1p s ILE 92 Ca 0.04 -1.19 -0.03 0.00 0.00 0.00 0.00 60.65 59.47 1l1p s ILE 92 Cb -0.19 -3.44 0.08 0.00 0.01 0.00 0.00 42.46 38.92 1l1p s ILE 92 CO -0.11 -0.24 0.08 0.20 0.00 0.00 0.00 174.94 174.87 1l1p s ASN 93 N -4.01 3.29 0.64 3.58 -0.87 0.61 0.16 114.94 118.35 1l1p s ASN 93 Ca 0.39 -1.12 -0.17 0.00 -1.57 0.00 0.00 52.86 50.39 1l1p s ASN 93 Cb -0.08 -0.58 -0.01 0.00 -0.02 0.00 0.00 41.25 40.56 1l1p s ASN 93 CO 0.28 -0.37 1.16 -0.22 -2.57 0.00 0.00 177.10 175.39 1l1p s LEU 94 N 1.87 3.51 0.00 0.60 2.96 0.16 -1.79 118.68 126.00 1l1p s LEU 94 Ca 0.04 2.23 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 1l1p s LEU 94 Cb -0.17 -4.58 0.00 0.00 0.50 0.00 0.00 46.19 41.94 1l1p s LEU 94 CO -0.19 -1.70 0.00 0.29 -1.32 0.00 0.00 176.35 173.43 1l1p n LYS 95 N -2.06 0.00 -2.25 1.98 4.76 0.83 0.47 118.16 121.89 1l1p n LYS 95 Ca 0.12 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.16 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 1.78 3.05 -0.26 1.97 1.02 -1.20 -3.10 119.74 123.00 1l1p s LYS 96 Ca 0.00 0.52 -0.06 0.00 0.02 0.00 0.00 55.97 56.45 1l1p s LYS 96 Cb 0.00 -4.23 -0.00 0.00 -0.52 0.00 0.00 37.83 33.07 1l1p s LYS 96 CO 0.00 -2.24 0.03 0.54 -0.92 0.00 0.00 175.35 172.75 1l1p s VAL 97 N 7.19 3.78 0.27 3.17 0.11 -1.26 0.24 120.40 133.90 1l1p s VAL 97 Ca 0.58 -0.53 0.06 0.00 -2.93 0.00 0.00 61.98 59.17 1l1p s VAL 97 Cb -0.12 -2.84 -0.02 0.00 -1.53 0.00 0.00 36.38 31.87 1l1p s VAL 97 CO 0.23 0.26 0.23 -0.62 -3.33 0.00 0.00 175.10 171.87 1l1p n GLU 98 N 4.84 0.34 -3.49 1.54 4.71 -1.23 -4.20 120.64 123.16 1l1p n GLU 98 Ca -0.16 -2.73 -0.42 0.00 -0.01 0.00 0.00 57.16 53.84 1l1p n GLU 98 Cb 0.50 2.22 -0.04 0.00 -1.01 0.00 0.00 31.44 33.10 1l1p n GLU 98 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1l1p s GLU 99 N -3.11 3.36 0.30 3.49 2.02 -1.26 -3.00 118.70 120.50 1l1p s GLU 99 Ca 0.32 -2.73 -0.29 0.00 0.02 0.00 0.00 54.97 52.29 1l1p s GLU 99 Cb 0.02 -4.18 -0.10 0.00 0.10 0.00 0.00 34.13 29.96 1l1p s GLU 99 CO 0.23 -1.25 1.42 -0.98 0.02 0.00 0.00 175.26 174.70 1l1p s ARG 100 N -0.35 4.26 -0.47 1.61 1.70 -1.26 -3.36 118.95 121.08 1l1p s ARG 100 Ca 0.21 2.34 0.04 0.00 -0.47 0.00 0.00 55.73 57.85 1l1p s ARG 100 Cb -0.12 -3.07 0.21 0.00 -0.57 0.00 0.00 34.95 31.40 1l1p s ARG 100 CO -0.08 -0.38 0.88 -1.91 -1.08 0.00 0.00 175.30 172.73 1l1p n GLU 101 N 1.51 0.49 0.05 3.89 2.13 -1.26 -4.74 120.64 122.70 1l1p n GLU 101 Ca 0.04 -1.63 -0.09 0.00 0.66 0.00 0.00 57.16 56.13 1l1p n GLU 101 Cb 0.40 -1.09 -0.07 0.00 0.27 0.00 0.00 31.44 30.95 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 4.44 -0.18 -9.25 4.31 4.07 -1.93 -3.44 115.31 113.34 1l1p h LEU 102 Ca -0.03 -0.32 -0.55 0.00 0.08 0.00 0.00 57.88 57.06 1l1p h LEU 102 Cb 1.11 0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.88 1l1p h LEU 102 CO 0.06 0.39 1.06 -2.16 -1.08 0.00 0.00 178.44 176.71 1l1p s PRO 103 N -3.08 4.19 -0.14 1.13 0.04 -1.26 -4.90 135.00 130.99 1l1p s PRO 103 Ca -0.11 2.12 -0.08 0.00 0.04 0.00 0.00 61.00 62.97 1l1p s PRO 103 Cb 0.00 -3.96 -0.25 0.00 0.04 0.00 0.00 34.50 30.33 1l1p s PRO 103 CO 0.41 -0.83 0.31 -1.91 0.04 0.00 0.00 177.00 175.02 1l1p n GLU 104 N 7.06 0.74 -3.38 4.56 0.00 -1.26 -4.98 120.64 123.38 1l1p n GLU 104 Ca 0.17 0.28 -0.22 0.00 0.00 0.00 0.00 57.16 57.39 1l1p n GLU 104 Cb 0.43 -1.70 0.03 0.00 0.00 0.00 0.00 31.44 30.20 1l1p n GLU 104 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1l1p n LEU 105 N -3.56 0.00 -0.13 4.31 4.77 -1.26 -5.27 117.00 115.86 1l1p n LEU 105 Ca -0.33 -2.62 0.02 0.00 -0.03 0.00 0.00 56.01 53.05 1l1p n LEU 105 Cb 1.01 -0.20 0.01 0.00 -2.33 0.00 0.00 43.42 41.91 1l1p n LEU 105 CO 0.40 -0.63 0.30 0.41 -1.33 0.00 0.00 177.39 176.53