#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2p n SER 2 N 0.00 -0.16 -3.87 1.61 3.41 -1.26 -5.03 113.62 108.32 1x2p n SER 2 Ca 0.00 0.53 -0.11 0.00 -0.26 0.00 0.00 58.87 59.03 1x2p n SER 2 Cb 0.00 -1.38 -0.11 0.00 -0.26 0.00 0.00 64.21 62.47 1x2p n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x2p s SER 3 N -1.95 0.00 0.00 4.04 0.15 -1.26 -5.11 113.70 109.57 1x2p s SER 3 Ca 0.68 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 57.22 1x2p s SER 3 Cb -0.29 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 1x2p s SER 3 CO 0.56 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.33 1x2p n GLY 4 N 1.87 0.37 0.34 9.45 0.00 -1.26 -4.93 105.19 111.03 1x2p n GLY 4 Ca -0.20 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.24 1x2p n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x2p n SER 5 N -0.39 1.66 -4.91 1.61 7.64 -1.26 -5.02 113.62 112.94 1x2p n SER 5 Ca 0.00 0.27 -0.27 0.00 1.01 0.00 0.00 58.87 59.89 1x2p n SER 5 Cb 0.00 -0.63 -0.01 0.00 -1.01 0.00 0.00 64.21 62.56 1x2p n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x2p s SER 6 N -6.20 6.34 0.54 6.43 0.15 -1.26 -5.11 113.70 114.60 1x2p s SER 6 Ca -0.24 0.77 0.06 0.00 0.70 0.00 0.00 55.95 57.24 1x2p s SER 6 Cb 0.05 -2.17 0.04 0.00 -1.71 0.00 0.00 66.02 62.23 1x2p s SER 6 CO 0.33 -0.40 0.45 -0.83 1.20 0.00 0.00 173.24 173.99 1x2p s GLY 7 N -3.80 2.29 -0.06 9.45 0.00 -1.26 -5.02 107.32 108.93 1x2p s GLY 7 Ca 0.45 -1.38 0.06 0.00 0.00 0.00 0.00 44.72 43.84 1x2p s GLY 7 CO 0.38 -1.91 -0.23 -0.54 0.00 0.00 0.00 173.10 170.80 1x2p s GLU 8 N -4.32 2.39 -0.30 2.90 2.02 -1.24 -4.98 118.70 115.16 1x2p s GLU 8 Ca 0.38 -0.84 -0.20 0.00 0.02 0.00 0.00 54.97 54.33 1x2p s GLU 8 Cb -0.03 -2.02 -0.01 0.00 0.10 0.00 0.00 34.13 32.17 1x2p s GLU 8 CO 0.23 0.34 0.60 -1.21 0.02 0.00 0.00 175.26 175.25 1x2p s GLU 9 N -0.10 3.92 0.32 1.61 2.02 -1.26 -1.67 118.70 123.54 1x2p s GLU 9 Ca -0.04 0.28 0.09 0.00 0.02 0.00 0.00 54.97 55.33 1x2p s GLU 9 Cb -0.13 -3.72 -0.05 0.00 0.10 0.00 0.00 34.13 30.33 1x2p s GLU 9 CO 0.03 -0.53 -0.01 -0.06 0.02 0.00 0.00 175.26 174.71 1x2p s PHE 10 N 2.53 2.55 -0.04 1.61 0.40 0.22 -4.91 117.98 120.34 1x2p s PHE 10 Ca 0.24 -0.38 0.05 0.00 -0.60 0.00 0.00 56.93 56.24 1x2p s PHE 10 Cb -0.15 -1.38 -0.01 0.00 0.51 0.00 0.00 43.02 41.99 1x2p s PHE 10 CO 0.11 0.53 -0.20 0.08 0.70 0.00 0.00 175.22 176.44 1x2p s VAL 11 N -2.48 1.63 -0.16 -0.44 1.01 -1.25 0.14 120.40 118.85 1x2p s VAL 11 Ca 0.34 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 1x2p s VAL 11 Cb -0.02 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1x2p s VAL 11 CO 0.19 0.46 1.50 0.00 0.00 0.00 0.00 175.10 177.25 1x2p s ALA 12 N -0.14 3.50 -0.03 5.51 0.00 -1.18 -2.56 121.76 126.85 1x2p s ALA 12 Ca -0.01 0.58 0.30 0.00 0.00 0.00 0.00 51.96 52.83 1x2p s ALA 12 Cb -0.11 -3.75 1.41 0.00 0.00 0.00 0.00 23.12 20.67 1x2p s ALA 12 CO 0.02 -1.55 1.91 -0.84 0.00 0.00 0.00 175.76 175.30 1x2p h ILE 13 N 5.77 0.00 -2.36 0.00 3.07 0.17 -1.35 117.51 122.81 1x2p h ILE 13 Ca -0.33 -0.22 0.03 0.00 1.55 0.00 0.00 64.86 65.89 1x2p h ILE 13 Cb 1.14 1.03 -0.16 0.00 -0.27 0.00 0.00 36.82 38.57 1x2p h ILE 13 CO 0.98 0.00 0.36 0.00 -1.05 0.00 0.00 178.15 178.44 1x2p s ALA 14 N -3.63 -1.76 0.46 0.16 0.00 -1.23 -4.93 121.76 110.84 1x2p s ALA 14 Ca 0.00 0.98 -0.24 0.00 0.00 0.00 0.00 51.96 52.70 1x2p s ALA 14 Cb 0.09 0.34 -0.08 0.00 0.00 0.00 0.00 23.12 23.47 1x2p s ALA 14 CO 0.40 -0.60 1.37 0.16 0.00 0.00 0.00 175.76 177.08 1x2p s ASP 15 N -2.14 5.86 0.08 0.00 -4.77 -1.26 -4.14 116.67 110.28 1x2p s ASP 15 Ca -0.00 2.79 0.04 0.00 -3.30 0.00 0.00 52.55 52.07 1x2p s ASP 15 Cb -0.01 -2.64 -0.03 0.00 -1.09 0.00 0.00 42.92 39.15 1x2p s ASP 15 CO -0.05 -1.18 -0.11 -0.47 0.70 0.00 0.00 175.17 174.06 1x2p s TYR 16 N -1.26 1.00 -0.17 2.11 6.14 -1.11 -4.91 117.35 119.15 1x2p s TYR 16 Ca 0.63 -0.56 -0.01 0.00 0.64 0.00 0.00 57.07 57.76 1x2p s TYR 16 Cb -0.41 -0.56 0.04 0.00 0.42 0.00 0.00 41.96 41.45 1x2p s TYR 16 CO 0.51 -0.01 -0.04 0.00 0.64 0.00 0.00 175.55 176.66 1x2p s ALA 17 N -1.85 1.41 0.15 3.97 0.00 -1.26 -3.80 121.76 120.38 1x2p s ALA 17 Ca -0.01 -0.81 -0.34 0.00 0.00 0.00 0.00 51.96 50.80 1x2p s ALA 17 Cb -0.07 -1.13 -0.15 0.00 0.00 0.00 0.00 23.12 21.78 1x2p s ALA 17 CO 0.01 -0.84 1.47 0.00 0.00 0.00 0.00 175.76 176.39 1x2p n ALA 18 N 4.90 0.63 0.07 0.00 0.00 -1.26 -4.88 120.51 119.97 1x2p n ALA 18 Ca -0.11 0.46 -0.18 0.00 0.00 0.00 0.00 53.44 53.61 1x2p n ALA 18 Cb 0.47 -2.25 -0.14 0.00 0.00 0.00 0.00 19.45 17.53 1x2p n ALA 18 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1x2p h THR 19 N 3.41 1.12 -4.53 0.00 2.02 -1.96 -3.47 112.91 109.49 1x2p h THR 19 Ca -0.46 -2.74 -0.15 0.00 0.77 0.00 0.00 66.41 63.83 1x2p h THR 19 Cb 1.28 2.76 -0.01 0.00 -1.74 0.00 0.00 68.15 70.44 1x2p h THR 19 CO 0.83 0.82 -0.07 -0.67 0.37 0.00 0.00 175.52 176.81 1x2p n ASP 20 N -3.48 1.34 -1.77 4.18 -0.08 -1.26 -5.02 116.55 110.46 1x2p n ASP 20 Ca -0.18 -1.50 0.08 0.00 -1.51 0.00 0.00 54.79 51.68 1x2p n ASP 20 Cb 1.05 -0.03 0.39 0.00 2.34 0.00 0.00 41.12 44.87 1x2p n ASP 20 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1x2p n GLU 21 N -0.93 4.40 -0.88 -0.67 0.00 -1.26 -4.09 120.64 117.22 1x2p n GLU 21 Ca 0.00 -3.04 0.05 0.00 0.00 0.00 0.00 57.16 54.18 1x2p n GLU 21 Cb 0.17 -2.11 0.13 0.00 0.00 0.00 0.00 31.44 29.63 1x2p n GLU 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1x2p n THR 22 N 0.87 1.33 -4.39 3.84 -2.24 -1.26 -5.06 114.28 107.37 1x2p n THR 22 Ca 0.27 -2.27 -0.20 0.00 -2.27 0.00 0.00 64.05 59.58 1x2p n THR 22 Cb 1.07 0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 69.42 1x2p n THR 22 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1x2p s GLN 23 N -1.95 1.46 -0.12 -0.78 -0.21 -1.26 -3.03 119.66 113.77 1x2p s GLN 23 Ca 0.35 -1.72 -0.04 0.00 0.02 0.00 0.00 55.36 53.97 1x2p s GLN 23 Cb 0.36 -1.09 -0.03 0.00 1.00 0.00 0.00 33.01 33.24 1x2p s GLN 23 CO -0.10 0.07 0.02 -0.51 -2.12 0.00 0.00 175.29 172.65 1x2p s LEU 24 N -3.39 3.66 -0.13 2.90 1.43 -0.91 -4.84 118.68 117.40 1x2p s LEU 24 Ca 0.27 0.12 -0.02 0.00 -1.03 0.00 0.00 54.13 53.47 1x2p s LEU 24 Cb 0.03 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 1x2p s LEU 24 CO 0.10 0.31 -0.04 -0.94 0.23 0.00 0.00 176.35 176.00 1x2p s SER 25 N -0.44 4.77 0.31 2.29 1.04 -1.26 -4.52 113.70 115.89 1x2p s SER 25 Ca 0.09 -0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.47 1x2p s SER 25 Cb -0.12 -1.61 -0.01 0.00 0.10 0.00 0.00 66.02 64.38 1x2p s SER 25 CO 0.02 0.23 0.34 2.22 0.98 0.00 0.00 173.24 177.03 1x2p n PHE 26 N 3.09 -1.00 -4.56 5.02 1.16 -1.25 -5.04 117.46 114.88 1x2p n PHE 26 Ca -0.18 -2.42 -0.23 0.00 -1.87 0.00 0.00 57.45 52.75 1x2p n PHE 26 Cb 0.53 0.37 -0.14 0.00 -1.61 0.00 0.00 39.48 38.63 1x2p n PHE 26 CO 0.00 0.00 0.00 -1.17 -1.87 0.00 0.00 176.76 173.72 1x2p s LEU 27 N 0.00 2.13 -0.34 5.98 2.96 -1.26 -2.74 118.68 125.42 1x2p s LEU 27 Ca 0.33 -0.44 -0.43 0.00 -0.22 0.00 0.00 54.13 53.37 1x2p s LEU 27 Cb 0.01 -0.80 -0.19 0.00 0.50 0.00 0.00 46.19 45.71 1x2p s LEU 27 CO 0.23 0.12 1.37 -1.14 -1.32 0.00 0.00 176.35 175.62 1x2p n ARG 28 N 2.09 0.00 0.00 1.98 0.63 -1.26 0.10 116.66 120.20 1x2p n ARG 28 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 1x2p n ARG 28 Cb 0.54 -1.43 0.00 0.00 0.45 0.00 0.00 32.46 32.03 1x2p n ARG 28 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1x2p n GLY 29 N 3.11 2.54 3.57 5.14 0.00 -0.51 -4.90 105.19 114.14 1x2p n GLY 29 Ca 0.26 -0.19 -0.54 0.00 0.00 0.00 0.00 46.02 45.56 1x2p n GLY 29 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x2p n GLU 30 N 0.00 0.83 -2.39 1.61 1.02 0.29 -4.55 120.64 117.45 1x2p n GLU 30 Ca 0.00 0.30 -0.41 0.00 -0.02 0.00 0.00 57.16 57.03 1x2p n GLU 30 Cb 0.00 -1.90 -0.03 0.00 -0.02 0.00 0.00 31.44 29.49 1x2p n GLU 30 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1x2p s LYS 31 N 0.36 3.14 0.30 3.49 -0.14 -1.26 -3.12 119.74 122.52 1x2p s LYS 31 Ca 0.86 0.23 -0.00 0.00 -1.36 0.00 0.00 55.97 55.70 1x2p s LYS 31 Cb -1.04 -4.19 -0.04 0.00 -1.68 0.00 0.00 37.83 30.88 1x2p s LYS 31 CO 0.50 -2.16 0.50 0.42 -0.76 0.00 0.00 175.35 173.85 1x2p s ILE 32 N 6.48 5.12 -0.08 2.17 -1.09 0.37 -4.86 121.20 129.31 1x2p s ILE 32 Ca 0.49 -0.40 0.04 0.00 -2.23 0.00 0.00 60.65 58.55 1x2p s ILE 32 Cb -0.10 -3.82 -0.01 0.00 -1.58 0.00 0.00 42.46 36.95 1x2p s ILE 32 CO 0.21 -0.43 -0.21 -0.22 -1.23 0.00 0.00 174.94 173.06 1x2p s LEU 33 N -3.97 2.31 -0.53 2.97 1.98 -1.26 0.73 118.68 120.91 1x2p s LEU 33 Ca 0.40 -0.43 -0.03 0.00 -2.89 0.00 0.00 54.13 51.17 1x2p s LEU 33 Cb -0.10 -1.46 0.14 0.00 0.66 0.00 0.00 46.19 45.43 1x2p s LEU 33 CO 0.33 0.23 0.34 -0.63 -1.89 0.00 0.00 176.35 174.73 1x2p s ILE 34 N -0.06 3.57 -0.02 6.68 -1.09 -0.67 -3.03 121.20 126.58 1x2p s ILE 34 Ca -0.05 -2.53 -0.13 0.00 -2.23 0.00 0.00 60.65 55.71 1x2p s ILE 34 Cb -0.14 -3.38 -0.07 0.00 -1.58 0.00 0.00 42.46 37.29 1x2p s ILE 34 CO 0.05 -0.80 0.66 -0.07 -1.23 0.00 0.00 174.94 173.55 1x2p h LEU 35 N 7.52 -0.38 -8.52 2.97 -0.00 -1.41 -3.30 115.31 112.20 1x2p h LEU 35 Ca -0.07 0.01 -0.36 0.00 -0.00 0.00 0.00 57.88 57.46 1x2p h LEU 35 Cb 1.00 0.10 -0.18 0.00 -0.00 0.00 0.00 40.66 41.58 1x2p h LEU 35 CO 0.72 -0.09 -0.74 -0.60 -0.00 0.00 0.00 178.44 177.72 1x2p s ARG 36 N -3.13 0.92 0.14 1.13 3.52 -0.99 -4.95 118.95 115.59 1x2p s ARG 36 Ca -0.07 -1.20 0.23 0.00 -0.13 0.00 0.00 55.73 54.57 1x2p s ARG 36 Cb 0.01 -0.68 0.19 0.00 -1.56 0.00 0.00 34.95 32.91 1x2p s ARG 36 CO 0.20 0.12 1.19 1.96 -0.81 0.00 0.00 175.30 177.96 1x2p h GLN 37 N 3.51 0.00 0.00 5.12 4.20 -1.87 0.49 115.11 126.55 1x2p h GLN 37 Ca -0.38 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.33 1x2p h GLN 37 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1x2p h GLN 37 CO 0.52 0.00 0.00 2.41 -0.67 0.00 0.00 178.83 181.09 1x2p n THR 38 N -2.27 0.00 0.02 -0.54 -1.04 -1.26 -2.63 114.28 106.56 1x2p n THR 38 Ca 0.02 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.02 1x2p n THR 38 Cb 0.47 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.98 1x2p n THR 38 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1x2p n THR 39 N 0.00 0.74 0.00 12.58 -2.24 -1.22 -5.07 114.28 119.06 1x2p n THR 39 Ca 0.00 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1x2p n THR 39 Cb 0.00 -1.44 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 1x2p n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x2p n ALA 40 N -3.17 0.00 0.04 6.98 0.00 -1.08 -4.96 120.51 118.33 1x2p n ALA 40 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.22 1x2p n ALA 40 Cb 0.05 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.35 1x2p n ALA 40 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1x2p h ASP 41 N 0.00 0.49 -3.52 0.00 5.19 -1.91 -3.43 116.42 113.24 1x2p h ASP 41 Ca 0.00 -0.86 -0.64 0.00 -0.62 0.00 0.00 57.03 54.91 1x2p h ASP 41 Cb 0.00 -0.16 -0.21 0.00 0.18 0.00 0.00 39.33 39.14 1x2p h ASP 41 CO 0.00 1.75 -0.62 0.26 -3.12 0.00 0.00 179.24 177.51 1x2p s TRP 42 N -2.58 3.11 0.18 4.55 0.52 -1.26 0.75 118.94 124.21 1x2p s TRP 42 Ca -0.17 -0.31 0.08 0.00 0.02 0.00 0.00 56.10 55.72 1x2p s TRP 42 Cb 0.06 -2.16 -0.04 0.00 -1.15 0.00 0.00 33.47 30.18 1x2p s TRP 42 CO 0.82 -0.21 -0.04 -1.58 0.02 0.00 0.00 176.95 175.97 1x2p s TRP 43 N 1.17 2.76 -0.42 -1.98 0.51 0.50 -3.46 118.94 118.02 1x2p s TRP 43 Ca 0.04 -0.17 -0.11 0.00 -2.12 0.00 0.00 56.10 53.74 1x2p s TRP 43 Cb -0.14 -1.34 0.07 0.00 -0.81 0.00 0.00 33.47 31.24 1x2p s TRP 43 CO 0.03 0.52 0.27 -0.46 -0.51 0.00 0.00 176.95 176.80 1x2p s TRP 44 N -1.74 3.30 0.11 -1.98 -0.11 0.17 0.19 118.94 118.88 1x2p s TRP 44 Ca 0.27 -1.29 0.01 0.00 1.22 0.00 0.00 56.10 56.31 1x2p s TRP 44 Cb -0.09 -2.88 0.01 0.00 -1.50 0.00 0.00 33.47 29.02 1x2p s TRP 44 CO 0.17 -0.79 0.12 0.41 -4.62 0.00 0.00 176.95 172.24 1x2p n GLY 45 N 4.99 2.54 3.06 5.86 0.00 -0.69 -1.03 105.19 119.92 1x2p n GLY 45 Ca -0.11 -2.18 -0.13 0.00 0.00 0.00 0.00 46.02 43.61 1x2p n GLY 45 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x2p s GLU 46 N -2.49 0.19 0.55 1.61 2.12 -1.17 -3.14 118.70 116.37 1x2p s GLU 46 Ca 0.09 0.77 -0.01 0.00 0.36 0.00 0.00 54.97 56.18 1x2p s GLU 46 Cb -0.01 0.02 0.11 0.00 0.26 0.00 0.00 34.13 34.51 1x2p s GLU 46 CO 0.06 -0.26 0.76 0.54 -0.54 0.00 0.00 175.26 175.81 1x2p n ARG 47 N 5.21 -0.01 -1.56 4.30 5.12 0.14 -4.29 116.66 125.57 1x2p n ARG 47 Ca -0.09 -1.95 -0.39 0.00 -1.93 0.00 0.00 57.85 53.49 1x2p n ARG 47 Cb 0.50 -0.54 -0.03 0.00 -1.16 0.00 0.00 32.46 31.23 1x2p n ARG 47 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1x2p n ALA 48 N -2.99 1.14 -0.88 7.54 0.00 -1.26 -1.14 120.51 122.92 1x2p n ALA 48 Ca -0.12 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.64 1x2p n ALA 48 Cb 0.43 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.80 1x2p n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x2p n GLY 49 N 5.95 0.09 3.61 0.00 0.00 -1.26 -4.93 105.19 108.66 1x2p n GLY 49 Ca 0.35 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.13 1x2p n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2p n GLY 52 N 5.35 2.37 3.92 0.00 0.00 -1.19 -4.97 105.19 110.67 1x2p n GLY 52 Ca -0.05 -1.54 -0.26 0.00 0.00 0.00 0.00 46.02 44.18 1x2p n GLY 52 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x2p s TYR 53 N -3.53 3.50 -0.01 1.61 2.02 -1.17 -1.70 117.35 118.08 1x2p s TYR 53 Ca 0.21 0.60 -0.07 0.00 -0.37 0.00 0.00 57.07 57.43 1x2p s TYR 53 Cb -0.01 -2.18 0.01 0.00 -0.40 0.00 0.00 41.96 39.38 1x2p s TYR 53 CO 0.15 -0.17 0.15 0.96 -1.57 0.00 0.00 175.55 175.07 1x2p s ILE 54 N -2.59 0.06 0.77 2.71 -4.36 0.50 -2.15 121.20 116.15 1x2p s ILE 54 Ca 0.45 -0.53 -0.11 0.00 -0.26 0.00 0.00 60.65 60.20 1x2p s ILE 54 Cb -0.10 -0.39 0.05 0.00 1.25 0.00 0.00 42.46 43.27 1x2p s ILE 54 CO 0.41 -0.29 1.09 -2.16 0.24 0.00 0.00 174.94 174.23 1x2p s PRO 55 N -1.04 2.30 -0.81 0.37 0.04 -1.26 0.19 135.00 134.78 1x2p s PRO 55 Ca -0.11 0.71 -0.03 0.00 0.04 0.00 0.00 61.00 61.61 1x2p s PRO 55 Cb -0.06 -1.94 0.20 0.00 0.04 0.00 0.00 34.50 32.75 1x2p s PRO 55 CO 0.01 -1.49 0.69 0.00 0.04 0.00 0.00 177.00 176.25 1x2p s ALA 56 N -3.13 4.05 0.00 8.56 0.00 0.23 -4.43 121.76 127.04 1x2p s ALA 56 Ca 0.60 -3.64 0.00 0.00 0.00 0.00 0.00 51.96 48.92 1x2p s ALA 56 Cb -0.14 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.13 1x2p s ALA 56 CO 0.54 -2.15 0.00 -1.71 0.00 0.00 0.00 175.76 172.44 1x2p n ASN 57 N 2.79 0.00 0.17 0.00 2.85 -1.26 -4.92 115.26 114.90 1x2p n ASN 57 Ca 0.17 0.00 0.03 0.00 -0.11 0.00 0.00 54.58 54.67 1x2p n ASN 57 Cb 0.38 0.00 0.30 0.00 1.24 0.00 0.00 39.78 41.70 1x2p n ASN 57 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 1x2p h HIS 58 N 0.00 0.00 -3.48 1.20 3.86 -1.93 -3.44 115.15 111.36 1x2p h HIS 58 Ca 0.00 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.55 1x2p h HIS 58 Cb 0.00 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.33 1x2p h HIS 58 CO 0.00 0.44 -0.70 0.14 0.86 0.00 0.00 177.93 178.67 1x2p s VAL 59 N -3.75 3.66 0.00 2.45 -7.23 -1.26 0.19 120.40 114.46 1x2p s VAL 59 Ca -0.01 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.06 1x2p s VAL 59 Cb 0.12 -2.71 0.00 0.00 0.56 0.00 0.00 36.38 34.35 1x2p s VAL 59 CO 0.71 0.15 0.00 0.61 -0.31 0.00 0.00 175.10 176.26 1x2p n GLY 60 N 0.74 3.65 3.56 2.32 0.00 -1.06 -4.87 105.19 109.54 1x2p n GLY 60 Ca -0.13 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 1x2p n GLY 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x2p s LYS 61 N 3.50 2.85 -0.10 1.61 2.47 -1.26 -3.78 119.74 125.03 1x2p s LYS 61 Ca 0.00 -0.56 -0.02 0.00 -1.56 0.00 0.00 55.97 53.83 1x2p s LYS 61 Cb 0.00 -2.61 -0.03 0.00 -1.46 0.00 0.00 37.83 33.72 1x2p s LYS 61 CO 0.00 0.60 -0.00 -1.58 0.16 0.00 0.00 175.35 174.53 1x2p s HIS 62 N -0.64 3.14 -0.14 4.03 5.65 -1.26 -5.01 115.29 121.05 1x2p s HIS 62 Ca 0.10 0.13 -0.12 0.00 0.25 0.00 0.00 55.06 55.41 1x2p s HIS 62 Cb -0.11 -1.82 -0.04 0.00 -1.18 0.00 0.00 32.58 29.42 1x2p s HIS 62 CO 0.02 0.39 -0.24 0.43 -0.65 0.00 0.00 174.74 174.69 1x2p n SER 63 N 2.37 1.68 0.00 9.88 7.64 -1.26 -5.13 113.62 128.80 1x2p n SER 63 Ca -0.18 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.14 1x2p n SER 63 Cb 0.53 -0.77 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1x2p n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2p n GLY 64 N 1.55 0.61 0.20 0.23 0.00 -1.26 -4.86 105.19 101.66 1x2p n GLY 64 Ca -0.10 -1.49 -0.18 0.00 0.00 0.00 0.00 46.02 44.26 1x2p n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x2p h PRO 65 N 0.00 0.67 -5.22 1.61 0.13 -2.08 -3.49 132.00 123.63 1x2p h PRO 65 Ca 0.00 -0.66 -0.00 0.00 -0.87 0.00 0.00 66.00 64.47 1x2p h PRO 65 Cb 0.00 0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.30 1x2p h PRO 65 CO 0.00 1.25 -0.96 0.43 -0.23 0.00 0.00 178.00 178.50 1x2p n SER 66 N -3.86 -7.97 -4.41 1.44 7.64 -1.26 -4.90 113.62 100.30 1x2p n SER 66 Ca -0.09 1.31 -0.35 0.00 1.01 0.00 0.00 58.87 60.75 1x2p n SER 66 Cb 0.82 -5.16 0.09 0.00 -1.01 0.00 0.00 64.21 58.95 1x2p n SER 66 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1x2p n SER 67 N 0.65 -1.96 0.00 6.43 2.88 -1.26 -5.27 113.62 115.09 1x2p n SER 67 Ca 0.01 0.46 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 1x2p n SER 67 Cb 0.07 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.36 1x2p n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42