#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l5p s THR 2 N 0.00 0.09 0.18 2.61 -4.23 -1.26 -0.17 115.64 112.85 1l5p s THR 2 Ca 0.00 -0.71 0.05 0.00 -1.18 0.00 0.00 61.69 59.86 1l5p s THR 2 Cb 0.00 -0.61 -0.05 0.00 1.34 0.00 0.00 72.50 73.19 1l5p s THR 2 CO 0.00 -0.39 -0.10 0.27 -0.54 0.00 0.00 174.62 173.87 1l5p s ILE 3 N -1.70 1.31 -0.21 2.99 -5.25 0.20 -0.09 121.20 118.44 1l5p s ILE 3 Ca -0.12 -2.10 -0.06 0.00 -0.99 0.00 0.00 60.65 57.39 1l5p s ILE 3 Cb -0.05 -1.99 -0.03 0.00 2.95 0.00 0.00 42.46 43.34 1l5p s ILE 3 CO 0.01 -0.63 0.02 -0.89 -1.79 0.00 0.00 174.94 171.66 1l5p s THR 4 N -3.24 4.09 -0.10 8.37 2.01 -0.25 -0.51 115.64 126.01 1l5p s THR 4 Ca 0.20 -0.26 -0.04 0.00 0.31 0.00 0.00 61.69 61.91 1l5p s THR 4 Cb 0.02 -2.87 -0.04 0.00 0.01 0.00 0.00 72.50 69.63 1l5p s THR 4 CO 0.04 0.41 0.04 0.00 -0.69 0.00 0.00 174.62 174.42 1l5p s ALA 5 N 1.14 3.46 -0.28 7.40 0.00 -0.24 -0.16 121.76 133.08 1l5p s ALA 5 Ca 0.03 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.25 1l5p s ALA 5 Cb -0.14 -1.65 0.08 0.00 0.00 0.00 0.00 23.12 21.40 1l5p s ALA 5 CO 0.02 0.56 -0.01 0.08 0.00 0.00 0.00 175.76 176.40 1l5p s VAL 6 N -0.81 1.72 -0.10 0.00 1.01 0.61 -0.48 120.40 122.35 1l5p s VAL 6 Ca 0.13 -1.60 0.04 0.00 0.00 0.00 0.00 61.98 60.55 1l5p s VAL 6 Cb -0.12 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1l5p s VAL 6 CO 0.03 -0.30 -0.22 -0.75 0.00 0.00 0.00 175.10 173.86 1l5p s LYS 7 N 1.26 3.01 -1.33 2.72 2.20 -0.71 -0.90 119.74 125.99 1l5p s LYS 7 Ca 0.00 -0.84 -0.05 0.00 -0.36 0.00 0.00 55.97 54.72 1l5p s LYS 7 Cb -0.19 -2.34 -0.00 0.00 -1.51 0.00 0.00 37.83 33.79 1l5p s LYS 7 CO -0.09 0.23 0.55 0.41 -0.36 0.00 0.00 175.35 176.09 1l5p n GLY 8 N 3.39 -0.40 3.92 5.54 0.00 -1.26 -0.94 105.19 115.44 1l5p n GLY 8 Ca -0.18 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1l5p n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l5p n GLY 9 N -1.84 0.21 3.55 -0.02 0.00 -1.26 -4.94 105.19 100.89 1l5p n GLY 9 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1l5p n GLY 9 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1l5p s VAL 10 N -1.50 4.35 0.15 1.61 -7.23 -0.11 -5.08 120.40 112.59 1l5p s VAL 10 Ca 0.00 -0.19 -0.27 0.00 -1.81 0.00 0.00 61.98 59.72 1l5p s VAL 10 Cb 0.00 -2.95 -0.07 0.00 0.56 0.00 0.00 36.38 33.91 1l5p s VAL 10 CO 0.00 0.45 0.82 -0.75 -0.31 0.00 0.00 175.10 175.32 1l5p s LYS 11 N 0.57 4.62 -0.11 4.82 2.20 -1.26 -1.73 119.74 128.85 1l5p s LYS 11 Ca 0.01 1.23 -0.04 0.00 -0.36 0.00 0.00 55.97 56.82 1l5p s LYS 11 Cb -0.14 -3.30 0.05 0.00 -1.51 0.00 0.00 37.83 32.94 1l5p s LYS 11 CO 0.02 0.47 0.09 0.15 -0.36 0.00 0.00 175.35 175.72 1l5p s LYS 12 N -0.83 0.01 0.01 4.03 1.02 0.36 -5.00 119.74 119.35 1l5p s LYS 12 Ca 0.38 0.20 -0.28 0.00 0.02 0.00 0.00 55.97 56.30 1l5p s LYS 12 Cb -0.23 -1.07 -0.04 0.00 -0.52 0.00 0.00 37.83 35.96 1l5p s LYS 12 CO 0.27 -0.49 0.88 -1.14 -0.92 0.00 0.00 175.35 173.95 1l5p s GLN 13 N 2.18 4.55 0.03 1.68 0.74 -1.26 -1.08 119.66 126.50 1l5p s GLN 13 Ca 0.04 1.25 0.07 0.00 0.05 0.00 0.00 55.36 56.77 1l5p s GLN 13 Cb -0.14 -3.43 -0.02 0.00 1.10 0.00 0.00 33.01 30.52 1l5p s GLN 13 CO -0.06 0.07 -0.21 -0.51 -0.55 0.00 0.00 175.29 174.03 1l5p s LEU 14 N 0.62 2.14 0.07 3.68 1.43 0.33 -4.98 118.68 121.98 1l5p s LEU 14 Ca 0.46 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.98 1l5p s LEU 14 Cb -0.21 -1.00 -0.06 0.00 0.03 0.00 0.00 46.19 44.96 1l5p s LEU 14 CO 0.25 0.18 0.37 -0.54 0.23 0.00 0.00 176.35 176.85 1l5p s LYS 15 N -1.01 3.71 0.11 1.70 1.02 -1.26 -0.63 119.74 123.37 1l5p s LYS 15 Ca 0.08 0.09 0.04 0.00 0.02 0.00 0.00 55.97 56.20 1l5p s LYS 15 Cb -0.09 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.19 1l5p s LYS 15 CO 0.01 0.56 -0.11 -0.59 -0.92 0.00 0.00 175.35 174.31 1l5p s PHE 16 N -1.41 1.16 -0.11 3.18 -0.12 0.76 -4.93 117.98 116.52 1l5p s PHE 16 Ca 0.33 -0.66 -0.02 0.00 -0.05 0.00 0.00 56.93 56.54 1l5p s PHE 16 Cb -0.14 -0.62 -0.03 0.00 -0.63 0.00 0.00 43.02 41.60 1l5p s PHE 16 CO 0.18 0.04 -0.04 -1.21 -0.05 0.00 0.00 175.22 174.15 1l5p s GLU 17 N -2.95 3.16 0.14 1.99 0.41 -1.26 -1.68 118.70 118.51 1l5p s GLU 17 Ca 0.08 -0.49 -0.30 0.00 -0.41 0.00 0.00 54.97 53.85 1l5p s GLU 17 Cb -0.02 -2.77 -0.17 0.00 -1.78 0.00 0.00 34.13 29.39 1l5p s GLU 17 CO 0.01 0.52 0.64 -0.25 -0.49 0.00 0.00 175.26 175.69 1l5p n ASP 18 N 2.68 -0.86 -0.06 -0.19 8.00 -1.26 -1.45 116.55 123.40 1l5p n ASP 18 Ca -0.18 1.09 -0.01 0.00 0.71 0.00 0.00 54.79 56.40 1l5p n ASP 18 Cb 0.53 -0.90 -0.00 0.00 -0.02 0.00 0.00 41.12 40.73 1l5p n ASP 18 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1l5p n ASP 19 N 1.77 -3.80 -4.86 -2.24 8.00 0.14 -5.00 116.55 110.56 1l5p n ASP 19 Ca 0.18 0.02 -0.35 0.00 0.71 0.00 0.00 54.79 55.35 1l5p n ASP 19 Cb 0.19 -1.37 -0.06 0.00 -0.02 0.00 0.00 41.12 39.87 1l5p n ASP 19 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1l5p s GLN 20 N -0.81 3.84 0.33 -1.24 -0.21 -0.53 -4.77 119.66 116.27 1l5p s GLN 20 Ca 0.00 0.29 -0.07 0.00 0.02 0.00 0.00 55.36 55.60 1l5p s GLN 20 Cb 0.00 -2.97 -0.06 0.00 1.00 0.00 0.00 33.01 30.98 1l5p s GLN 20 CO 0.00 0.53 0.64 0.95 -2.12 0.00 0.00 175.29 175.28 1l5p s THR 21 N -1.43 4.93 0.42 -0.19 -4.23 -1.26 0.81 115.64 114.70 1l5p s THR 21 Ca 0.35 0.27 0.11 0.00 -1.18 0.00 0.00 61.69 61.24 1l5p s THR 21 Cb -0.14 -3.73 0.30 0.00 1.34 0.00 0.00 72.50 70.27 1l5p s THR 21 CO 0.18 -0.39 2.01 0.25 -0.54 0.00 0.00 174.62 176.13 1l5p h LEU 22 N 1.53 0.43 -0.00 4.79 5.85 -1.11 -1.46 115.31 125.34 1l5p h LEU 22 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1l5p h LEU 22 Cb 1.19 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1l5p h LEU 22 CO 0.65 0.28 0.00 0.15 -0.34 0.00 0.00 178.44 179.18 1l5p h PHE 23 N 0.49 0.00 0.12 1.25 3.57 -1.74 0.63 116.94 121.27 1l5p h PHE 23 Ca 0.23 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1l5p h PHE 23 Cb 0.30 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 1l5p h PHE 23 CO -0.00 0.02 -0.13 1.15 -2.23 0.00 0.00 178.31 177.11 1l5p h THR 24 N -0.01 0.70 -0.20 4.41 2.02 -1.63 0.28 112.91 118.48 1l5p h THR 24 Ca 0.00 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1l5p h THR 24 Cb 0.01 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1l5p h THR 24 CO -0.00 0.00 0.02 0.58 0.37 0.00 0.00 175.52 176.49 1l5p h VAL 25 N -0.29 0.89 -0.03 3.16 2.07 -1.08 -0.15 116.25 120.82 1l5p h VAL 25 Ca 0.01 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1l5p h VAL 25 Cb 0.28 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1l5p h VAL 25 CO -0.04 0.02 0.00 -0.07 0.02 0.00 0.00 177.57 177.50 1l5p h LEU 26 N 0.09 0.05 -0.71 2.57 3.38 0.49 -3.06 115.31 118.12 1l5p h LEU 26 Ca 0.09 -0.29 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 1l5p h LEU 26 Cb 0.10 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1l5p h LEU 26 CO -0.14 0.32 -0.20 0.71 0.09 0.00 0.00 178.44 179.22 1l5p h THR 27 N -0.22 1.27 0.00 0.22 1.35 -0.41 -2.27 112.91 112.84 1l5p h THR 27 Ca 0.01 -1.30 0.00 0.00 -0.55 0.00 0.00 66.41 64.57 1l5p h THR 27 Cb 0.30 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1l5p h THR 27 CO 0.00 0.44 0.00 -0.62 -0.25 0.00 0.00 175.52 175.09 1l5p n GLU 28 N -4.12 0.46 -0.06 4.72 1.02 -0.07 -2.24 120.64 120.34 1l5p n GLU 28 Ca 0.00 0.05 0.04 0.00 -0.02 0.00 0.00 57.16 57.24 1l5p n GLU 28 Cb 0.42 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.41 1l5p n GLU 28 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1l5p n ALA 29 N -1.16 2.35 -0.96 0.62 0.00 -1.00 -4.98 120.51 115.38 1l5p n ALA 29 Ca 0.12 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1l5p n ALA 29 Cb 0.12 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1l5p n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l5p n GLY 30 N 0.43 0.71 0.13 0.00 0.00 -0.95 -4.87 105.19 100.64 1l5p n GLY 30 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.11 1l5p n GLY 30 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1l5p h LEU 31 N 0.00 0.00 -7.62 0.99 3.38 -1.66 -3.45 115.31 106.94 1l5p h LEU 31 Ca 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 1l5p h LEU 31 Cb 0.05 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.48 1l5p h LEU 31 CO 0.00 0.54 -0.73 -0.32 0.09 0.00 0.00 178.44 178.02 1l5p s MET 32 N -2.94 0.04 0.16 1.13 0.00 -1.11 -4.96 119.30 111.61 1l5p s MET 32 Ca 0.03 0.09 -0.21 0.00 0.00 0.00 0.00 55.69 55.60 1l5p s MET 32 Cb 0.08 -0.19 -0.08 0.00 0.00 0.00 0.00 34.83 34.64 1l5p s MET 32 CO 0.76 -0.09 0.68 -1.54 0.00 0.00 0.00 175.02 174.83 1l5p s SER 33 N 0.63 7.15 0.00 1.11 1.04 -1.26 -3.62 113.70 118.74 1l5p s SER 33 Ca -0.05 1.42 0.22 0.00 0.48 0.00 0.00 55.95 58.01 1l5p s SER 33 Cb -0.08 -2.42 0.52 0.00 0.10 0.00 0.00 66.02 64.14 1l5p s SER 33 CO -0.02 0.16 1.44 0.00 0.98 0.00 0.00 173.24 175.81 1l5p n ALA 34 N 1.28 2.38 -2.00 5.32 0.00 -1.26 -4.92 120.51 121.31 1l5p n ALA 34 Ca -0.06 -1.15 -0.41 0.00 0.00 0.00 0.00 53.44 51.82 1l5p n ALA 34 Cb 0.50 -0.85 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 1l5p n ALA 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1l5p s ASP 35 N -1.19 7.03 -1.78 0.00 -1.08 -1.26 -2.99 116.67 115.41 1l5p s ASP 35 Ca 0.42 2.31 0.00 0.00 -0.52 0.00 0.00 52.55 54.76 1l5p s ASP 35 Cb 0.23 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 1l5p s ASP 35 CO 0.31 -0.40 0.00 -0.67 0.52 0.00 0.00 175.17 174.93 1l5p n ASP 36 N 2.31 -5.26 -4.70 -0.34 2.03 -1.26 -4.97 116.55 104.36 1l5p n ASP 36 Ca 0.04 0.42 -0.23 0.00 0.52 0.00 0.00 54.79 55.54 1l5p n ASP 36 Cb 0.44 -4.24 -0.07 0.00 -0.72 0.00 0.00 41.12 36.53 1l5p n ASP 36 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1l5p s THR 37 N -2.54 3.30 -1.81 5.18 -4.23 -1.16 -4.98 115.64 109.39 1l5p s THR 37 Ca 0.00 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1l5p s THR 37 Cb 0.00 -2.95 0.00 0.00 1.34 0.00 0.00 72.50 70.89 1l5p s THR 37 CO 0.00 -0.28 0.65 0.00 -0.54 0.00 0.00 174.62 174.45 1l5p n GLN 39 N -0.38 -7.04 -2.70 0.00 6.02 -1.26 -3.18 117.38 108.83 1l5p n GLN 39 Ca 0.00 0.82 -0.08 0.00 -0.01 0.00 0.00 57.00 57.73 1l5p n GLN 39 Cb 0.03 -5.82 0.02 0.00 1.02 0.00 0.00 30.24 25.49 1l5p n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1l5p n GLY 40 N -1.55 0.36 0.87 1.08 0.00 -1.26 -4.96 105.19 99.74 1l5p n GLY 40 Ca -0.15 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.54 1l5p n GLY 40 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1l5p n ASN 41 N 0.12 3.14 -3.92 1.61 4.05 -1.19 -4.94 115.26 114.13 1l5p n ASN 41 Ca -0.02 -1.93 -0.28 0.00 0.45 0.00 0.00 54.58 52.80 1l5p n ASN 41 Cb 0.53 -0.26 0.01 0.00 1.23 0.00 0.00 39.78 41.29 1l5p n ASN 41 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1l5p n LYS 42 N 0.97 -4.53 0.00 1.20 5.02 -1.26 -4.85 118.16 114.71 1l5p n LYS 42 Ca 0.15 0.53 0.00 0.00 -2.02 0.00 0.00 58.31 56.97 1l5p n LYS 42 Cb 0.49 -5.14 0.00 0.00 -0.02 0.00 0.00 35.03 30.35 1l5p n LYS 42 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l5p n ALA 43 N -4.47 0.95 -0.08 7.82 0.00 -1.26 -4.86 120.51 118.61 1l5p n ALA 43 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 1l5p n ALA 43 Cb 0.59 0.02 -0.15 0.00 0.00 0.00 0.00 19.45 19.91 1l5p n ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l5p n GLY 45 N 1.77 -0.01 0.01 0.00 0.00 -1.26 -4.94 105.19 100.76 1l5p n GLY 45 Ca -0.30 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.35 1l5p n GLY 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l5p n LYS 46 N -1.98 0.57 -0.39 1.61 5.02 -1.26 -4.49 118.16 117.24 1l5p n LYS 46 Ca -0.12 -0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 1l5p n LYS 46 Cb 0.58 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1l5p n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l5p s ILE 48 N 0.07 2.63 0.30 0.00 -1.09 -1.26 -1.21 121.20 120.64 1l5p s ILE 48 Ca 0.00 0.55 -0.04 0.00 -2.23 0.00 0.00 60.65 58.93 1l5p s ILE 48 Cb 0.00 -3.35 -0.01 0.00 -1.58 0.00 0.00 42.46 37.52 1l5p s ILE 48 CO 0.00 0.10 0.42 0.00 -1.23 0.00 0.00 174.94 174.22 1l5p s LYS 50 N -3.44 2.62 -0.44 0.00 3.01 0.43 -1.27 119.74 120.65 1l5p s LYS 50 Ca 0.30 -0.71 -0.26 0.00 -1.01 0.00 0.00 55.97 54.29 1l5p s LYS 50 Cb 0.01 -2.18 0.03 0.00 -1.01 0.00 0.00 37.83 34.68 1l5p s LYS 50 CO 0.17 -0.05 0.97 -1.58 0.51 0.00 0.00 175.35 175.37 1l5p s HIS 51 N 0.94 2.93 -0.05 3.18 5.65 -0.59 -0.08 115.29 127.27 1l5p s HIS 51 Ca -0.06 0.53 0.14 0.00 0.25 0.00 0.00 55.06 55.93 1l5p s HIS 51 Cb -0.15 -4.00 -0.22 0.00 -1.18 0.00 0.00 32.58 27.03 1l5p s HIS 51 CO -0.02 -1.08 0.33 1.33 -0.65 0.00 0.00 174.74 174.65 1l5p n VAL 52 N 6.41 0.00 -3.54 0.89 0.24 -0.45 -4.89 118.33 116.98 1l5p n VAL 52 Ca 0.08 -0.32 -0.12 0.00 -2.04 0.00 0.00 64.34 61.93 1l5p n VAL 52 Cb 0.48 0.21 -0.04 0.00 -1.47 0.00 0.00 33.84 33.03 1l5p n VAL 52 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1l5p s SER 53 N -3.59 -0.41 0.00 -1.34 0.01 -1.06 -4.95 113.70 102.36 1l5p s SER 53 Ca -0.05 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1l5p s SER 53 Cb 0.09 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.84 1l5p s SER 53 CO 0.60 -0.84 0.00 0.61 0.41 0.00 0.00 173.24 174.02 1l5p n GLY 54 N -0.06 -0.61 3.68 3.44 0.00 -1.26 -0.98 105.19 109.41 1l5p n GLY 54 Ca -0.17 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 1l5p n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l5p s LYS 55 N -2.14 4.33 -0.09 1.61 1.02 -1.26 -4.93 119.74 118.28 1l5p s LYS 55 Ca 0.00 0.94 -0.04 0.00 0.02 0.00 0.00 55.97 56.89 1l5p s LYS 55 Cb 0.00 -3.54 0.05 0.00 -0.52 0.00 0.00 37.83 33.82 1l5p s LYS 55 CO 0.00 -0.20 0.20 0.08 -0.92 0.00 0.00 175.35 174.51 1l5p s VAL 56 N 1.70 -0.16 0.24 3.17 1.01 -1.26 -4.29 120.40 120.80 1l5p s VAL 56 Ca 0.37 0.23 -0.31 0.00 0.00 0.00 0.00 61.98 62.27 1l5p s VAL 56 Cb -0.17 -0.33 -0.14 0.00 0.00 0.00 0.00 36.38 35.74 1l5p s VAL 56 CO 0.14 0.09 1.23 0.00 0.00 0.00 0.00 175.10 176.57 1l5p n ALA 57 N 4.67 0.24 -1.61 5.51 0.00 -1.26 -4.89 120.51 123.17 1l5p n ALA 57 Ca -0.18 0.42 -0.38 0.00 0.00 0.00 0.00 53.44 53.30 1l5p n ALA 57 Cb 0.51 -2.14 0.05 0.00 0.00 0.00 0.00 19.45 17.87 1l5p n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l5p n ALA 58 N 1.26 0.09 -1.77 0.00 0.00 -1.26 -4.92 120.51 113.91 1l5p n ALA 58 Ca 0.12 0.02 -0.39 0.00 0.00 0.00 0.00 53.44 53.18 1l5p n ALA 58 Cb 0.30 -2.09 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 1l5p n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l5p s ALA 59 N -1.51 3.29 0.75 0.00 0.00 -1.26 -5.03 121.76 118.00 1l5p s ALA 59 Ca 0.74 0.97 -0.11 0.00 0.00 0.00 0.00 51.96 53.57 1l5p s ALA 59 Cb -0.43 -3.37 0.05 0.00 0.00 0.00 0.00 23.12 19.37 1l5p s ALA 59 CO 0.48 -0.40 1.12 -1.21 0.00 0.00 0.00 175.76 175.76 1l5p s GLU 60 N -1.94 2.37 0.21 0.00 0.41 -1.26 -4.81 118.70 113.68 1l5p s GLU 60 Ca 0.51 0.20 -0.09 0.00 -0.41 0.00 0.00 54.97 55.19 1l5p s GLU 60 Cb -0.32 -2.01 0.31 0.00 -1.78 0.00 0.00 34.13 30.33 1l5p s GLU 60 CO 0.41 -1.31 1.72 -0.44 -0.49 0.00 0.00 175.26 175.15 1l5p h ASP 61 N -0.82 0.11 -0.92 -0.19 3.32 -1.98 -0.56 116.42 115.38 1l5p h ASP 61 Ca -0.45 0.10 0.01 0.00 0.02 0.00 0.00 57.03 56.70 1l5p h ASP 61 Cb 1.30 0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.92 1l5p h ASP 61 CO 0.64 0.06 0.60 0.44 -1.72 0.00 0.00 179.24 179.26 1l5p h ASP 62 N 0.33 1.07 -0.23 6.45 3.45 -2.00 -2.39 116.42 123.10 1l5p h ASP 62 Ca 0.33 -0.04 -0.13 0.00 0.43 0.00 0.00 57.03 57.62 1l5p h ASP 62 Cb 0.46 -0.27 -0.00 0.00 -0.56 0.00 0.00 39.33 38.97 1l5p h ASP 62 CO -0.37 0.78 -0.36 -0.08 -1.57 0.00 0.00 179.24 177.64 1l5p h GLU 63 N 1.25 0.65 -0.41 3.56 4.81 -1.74 -3.05 114.58 119.65 1l5p h GLU 63 Ca 0.34 -0.39 0.12 0.00 -0.13 0.00 0.00 59.36 59.29 1l5p h GLU 63 Cb -0.12 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1l5p h GLU 63 CO -0.07 1.01 0.37 0.87 -0.73 0.00 0.00 179.01 180.46 1l5p h LYS 64 N 0.35 0.00 -0.51 1.92 1.57 -0.80 0.76 116.57 119.85 1l5p h LYS 64 Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1l5p h LYS 64 Cb 0.95 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 1l5p h LYS 64 CO 0.08 0.00 0.21 0.93 -0.57 0.00 0.00 179.45 180.11 1l5p h GLU 65 N 0.00 0.72 -0.00 3.15 5.08 -1.32 -2.11 114.58 120.11 1l5p h GLU 65 Ca 0.19 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1l5p h GLU 65 Cb 0.93 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1l5p h GLU 65 CO -0.00 0.59 -0.23 1.19 -1.00 0.00 0.00 179.01 179.55 1l5p n PHE 66 N -4.36 0.00 0.57 4.33 3.72 0.25 -3.95 117.46 118.03 1l5p n PHE 66 Ca 0.04 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.53 1l5p n PHE 66 Cb 0.15 -0.31 0.10 0.00 -0.94 0.00 0.00 39.48 38.48 1l5p n PHE 66 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1l5p n LEU 67 N -1.32 2.57 -0.25 4.37 4.77 -0.81 -4.60 117.00 121.73 1l5p n LEU 67 Ca 0.08 -1.15 0.01 0.00 -0.03 0.00 0.00 56.01 54.92 1l5p n LEU 67 Cb 0.32 -0.05 0.13 0.00 -2.33 0.00 0.00 43.42 41.49 1l5p n LEU 67 CO 0.29 0.49 1.09 -0.33 -1.33 0.00 0.00 177.39 177.61 1l5p h GLU 68 N 3.32 0.66 -0.63 3.23 5.08 -1.64 -1.60 114.58 123.00 1l5p h GLU 68 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1l5p h GLU 68 Cb 0.73 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1l5p h GLU 68 CO 0.00 0.44 0.00 -0.40 -1.00 0.00 0.00 179.01 178.05 1l5p n ASP 69 N -4.81 4.99 -4.76 1.42 3.85 -1.26 -4.95 116.55 111.03 1l5p n ASP 69 Ca 0.11 -2.65 -0.23 0.00 -0.71 0.00 0.00 54.79 51.30 1l5p n ASP 69 Cb 0.24 -0.62 -0.06 0.00 -1.35 0.00 0.00 41.12 39.33 1l5p n ASP 69 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1l5p s GLN 70 N -2.26 2.39 0.69 0.11 -1.52 -0.60 -5.10 119.66 113.36 1l5p s GLN 70 Ca 0.50 -1.58 -0.17 0.00 -1.95 0.00 0.00 55.36 52.15 1l5p s GLN 70 Cb 0.35 -2.18 0.01 0.00 -0.22 0.00 0.00 33.01 30.97 1l5p s GLN 70 CO 0.19 0.03 1.24 -2.30 -0.25 0.00 0.00 175.29 174.20 1l5p n PRO 71 N -1.22 0.86 -0.45 2.91 -0.02 -1.26 -4.86 135.00 130.96 1l5p n PRO 71 Ca -0.02 0.35 0.38 0.00 -2.02 0.00 0.00 63.50 62.20 1l5p n PRO 71 Cb 0.62 -2.48 0.69 0.00 -0.02 0.00 0.00 33.50 32.32 1l5p n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l5p h ALA 72 N 0.16 3.01 -0.52 3.55 0.00 -1.98 0.10 119.26 123.59 1l5p h ALA 72 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1l5p h ALA 72 Cb 1.33 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1l5p h ALA 72 CO 0.51 -1.52 0.00 0.27 0.00 0.00 0.00 179.25 178.51 1l5p n ASN 73 N -4.38 4.61 -4.78 0.00 6.94 -1.26 -4.98 115.26 111.40 1l5p n ASN 73 Ca 0.34 -2.63 -0.37 0.00 -0.02 0.00 0.00 54.58 51.90 1l5p n ASN 73 Cb 1.43 -0.56 -0.04 0.00 -2.36 0.00 0.00 39.78 38.25 1l5p n ASN 73 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1l5p s ALA 74 N -2.17 3.10 0.09 -2.53 0.00 0.36 -1.54 121.76 119.07 1l5p s ALA 74 Ca 0.47 0.70 -0.09 0.00 0.00 0.00 0.00 51.96 53.04 1l5p s ALA 74 Cb 0.33 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 20.18 1l5p s ALA 74 CO 0.18 -0.20 0.20 1.03 0.00 0.00 0.00 175.76 176.97 1l5p s ARG 75 N -2.46 0.87 -0.29 0.00 1.81 -0.40 -4.89 118.95 113.59 1l5p s ARG 75 Ca 0.57 -0.97 -0.17 0.00 -1.72 0.00 0.00 55.73 53.43 1l5p s ARG 75 Cb -0.22 0.35 -0.02 0.00 -0.45 0.00 0.00 34.95 34.61 1l5p s ARG 75 CO 0.28 -0.28 0.49 -0.51 -0.68 0.00 0.00 175.30 174.60 1l5p s LEU 76 N -2.87 4.15 0.32 2.53 1.43 -1.26 -1.66 118.68 121.32 1l5p s LEU 76 Ca 0.06 0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.50 1l5p s LEU 76 Cb 0.05 -2.60 0.70 0.00 0.03 0.00 0.00 46.19 44.38 1l5p s LEU 76 CO -0.10 -0.34 1.85 0.00 0.23 0.00 0.00 176.35 177.99 1l5p h ALA 77 N 8.20 1.69 0.00 4.21 0.00 -1.51 -0.23 119.26 131.63 1l5p h ALA 77 Ca -0.29 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1l5p h ALA 77 Cb 1.14 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1l5p h ALA 77 CO 0.72 0.06 0.00 0.00 0.00 0.00 0.00 179.25 180.03 1l5p n ALA 79 N -1.48 3.08 -2.59 0.00 0.00 -0.10 -4.75 120.51 114.68 1l5p n ALA 79 Ca 0.06 -0.26 -0.41 0.00 0.00 0.00 0.00 53.44 52.83 1l5p n ALA 79 Cb 0.27 -1.23 -0.11 0.00 0.00 0.00 0.00 19.45 18.39 1l5p n ALA 79 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1l5p s ILE 80 N -3.04 5.05 -0.37 0.00 1.01 -1.07 -5.03 121.20 117.76 1l5p s ILE 80 Ca 0.11 -0.59 -0.18 0.00 0.00 0.00 0.00 60.65 59.99 1l5p s ILE 80 Cb 0.17 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1l5p s ILE 80 CO 0.66 -0.20 0.51 -0.89 0.00 0.00 0.00 174.94 175.02 1l5p s THR 81 N 1.65 5.01 0.23 2.92 2.01 -1.26 -1.53 115.64 124.67 1l5p s THR 81 Ca 0.04 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.92 1l5p s THR 81 Cb -0.19 -4.00 -0.09 0.00 0.01 0.00 0.00 72.50 68.24 1l5p s THR 81 CO 0.09 -0.29 1.10 -0.76 -0.69 0.00 0.00 174.62 174.07 1l5p s LEU 82 N 2.38 4.52 0.31 4.42 1.43 0.24 -4.87 118.68 127.11 1l5p s LEU 82 Ca 0.18 2.19 -0.04 0.00 -1.03 0.00 0.00 54.13 55.42 1l5p s LEU 82 Cb -0.16 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.44 1l5p s LEU 82 CO 0.14 -0.19 0.43 -0.94 0.23 0.00 0.00 176.35 176.02 1l5p s SER 83 N -0.49 0.63 0.39 2.29 1.04 -1.26 0.24 113.70 116.54 1l5p s SER 83 Ca 0.47 -1.36 0.18 0.00 0.48 0.00 0.00 55.95 55.72 1l5p s SER 83 Cb -0.31 0.61 1.11 0.00 0.10 0.00 0.00 66.02 67.53 1l5p s SER 83 CO 0.38 -1.20 1.75 1.23 0.98 0.00 0.00 173.24 176.37 1l5p h GLY 84 N 2.20 1.34 2.00 7.32 0.00 -1.98 0.18 103.07 114.14 1l5p h GLY 84 Ca -0.29 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1l5p h GLY 84 CO 0.40 -0.19 0.00 1.05 0.00 0.00 0.00 176.54 177.80 1l5p h GLU 85 N 0.38 0.00 -0.02 4.80 4.11 -1.96 -1.66 114.58 120.23 1l5p h GLU 85 Ca 0.63 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.06 1l5p h GLU 85 Cb 1.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.84 1l5p h GLU 85 CO -0.34 0.00 -0.12 0.09 0.07 0.00 0.00 179.01 178.71 1l5p n ASN 86 N -2.83 1.91 -4.64 3.06 4.13 0.64 -4.46 115.26 113.07 1l5p n ASN 86 Ca -0.02 -1.53 -0.45 0.00 1.68 0.00 0.00 54.58 54.27 1l5p n ASN 86 Cb 0.11 0.09 -0.04 0.00 -1.54 0.00 0.00 39.78 38.41 1l5p n ASN 86 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1l5p n ASP 87 N 0.32 3.62 0.00 6.41 4.64 -0.63 -1.09 116.55 129.82 1l5p n ASP 87 Ca 0.15 0.75 0.00 0.00 -1.38 0.00 0.00 54.79 54.30 1l5p n ASP 87 Cb 0.44 -1.46 0.00 0.00 -1.04 0.00 0.00 41.12 39.05 1l5p n ASP 87 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1l5p n GLY 88 N 4.90 0.42 3.76 0.27 0.00 0.86 -4.94 105.19 110.47 1l5p n GLY 88 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 1l5p n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l5p s ALA 89 N -2.00 2.86 -0.09 4.61 0.00 -0.25 -4.61 121.76 122.29 1l5p s ALA 89 Ca 0.00 1.08 0.05 0.00 0.00 0.00 0.00 51.96 53.09 1l5p s ALA 89 Cb 0.00 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 1l5p s ALA 89 CO 0.00 -0.97 -0.24 0.08 0.00 0.00 0.00 175.76 174.63 1l5p s VAL 90 N -1.47 2.08 0.02 0.00 1.01 -0.15 -1.09 120.40 120.80 1l5p s VAL 90 Ca 0.68 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.69 1l5p s VAL 90 Cb -0.33 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 1l5p s VAL 90 CO 0.39 0.56 -0.18 -0.36 0.00 0.00 0.00 175.10 175.51 1l5p s PHE 91 N 0.16 1.61 -0.16 5.22 0.40 0.77 -1.34 117.98 124.64 1l5p s PHE 91 Ca -0.13 -0.34 -0.03 0.00 -0.60 0.00 0.00 56.93 55.82 1l5p s PHE 91 Cb -0.16 -1.00 -0.02 0.00 0.51 0.00 0.00 43.02 42.35 1l5p s PHE 91 CO 0.07 0.03 -0.04 -2.00 0.70 0.00 0.00 175.22 173.98 1l5p s GLU 92 N -0.83 3.61 0.00 0.44 2.12 0.89 -0.29 118.70 124.64 1l5p s GLU 92 Ca 0.06 -0.55 0.26 0.00 0.36 0.00 0.00 54.97 55.11 1l5p s GLU 92 Cb -0.08 -2.91 0.67 0.00 0.26 0.00 0.00 34.13 32.07 1l5p s GLU 92 CO 0.01 0.19 1.53 1.28 -0.54 0.00 0.00 175.26 177.72