#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2p s SER 2 N 0.00 -0.02 -0.52 1.61 0.15 -1.26 -5.12 113.70 108.54 1x2p s SER 2 Ca 0.00 0.04 -0.17 0.00 0.70 0.00 0.00 55.95 56.52 1x2p s SER 2 Cb 0.00 1.01 0.10 0.00 -1.71 0.00 0.00 66.02 65.42 1x2p s SER 2 CO 0.00 -0.01 0.52 -0.44 1.20 0.00 0.00 173.24 174.51 1x2p s SER 3 N 1.18 6.18 0.00 5.45 0.01 -1.26 -4.58 113.70 120.68 1x2p s SER 3 Ca -0.07 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 55.72 1x2p s SER 3 Cb -0.02 -2.23 0.00 0.00 0.21 0.00 0.00 66.02 63.98 1x2p s SER 3 CO -0.10 -0.84 0.00 0.61 0.41 0.00 0.00 173.24 173.31 1x2p n GLY 4 N 5.23 -2.15 2.99 3.44 0.00 -1.26 -5.10 105.19 108.34 1x2p n GLY 4 Ca -0.12 0.72 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 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 -1.53 -7.31 -1.45 1.61 7.64 -1.26 -4.74 113.62 106.59 1x2p n SER 5 Ca 0.00 0.67 0.00 0.00 1.01 0.00 0.00 58.87 60.55 1x2p n SER 5 Cb 0.00 -4.06 0.00 0.00 -1.01 0.00 0.00 64.21 59.14 1x2p n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x2p n SER 6 N 0.30 -7.22 -3.61 6.43 7.64 -1.26 -5.10 113.62 110.80 1x2p n SER 6 Ca 0.02 0.98 0.01 0.00 1.01 0.00 0.00 58.87 60.89 1x2p n SER 6 Cb 0.37 -3.57 -0.01 0.00 -1.01 0.00 0.00 64.21 59.99 1x2p n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x2p s GLY 7 N -1.20 -0.40 -0.26 0.23 0.00 -1.26 -4.86 107.32 99.56 1x2p s GLY 7 Ca 0.00 0.89 0.03 0.00 0.00 0.00 0.00 44.72 45.64 1x2p s GLY 7 CO 0.00 0.20 -0.09 -0.54 0.00 0.00 0.00 173.10 172.67 1x2p s GLU 8 N -2.39 2.14 -0.13 2.90 0.41 -1.10 -4.93 118.70 115.60 1x2p s GLU 8 Ca 0.13 -1.37 -0.29 0.00 -0.41 0.00 0.00 54.97 53.03 1x2p s GLU 8 Cb 0.04 -2.90 -0.02 0.00 -1.78 0.00 0.00 34.13 29.47 1x2p s GLU 8 CO -0.04 -0.60 1.34 -1.21 -0.49 0.00 0.00 175.26 174.26 1x2p s GLU 9 N 1.10 4.23 0.16 1.61 2.02 -1.26 0.78 118.70 127.35 1x2p s GLU 9 Ca -0.07 1.78 0.05 0.00 0.02 0.00 0.00 54.97 56.74 1x2p s GLU 9 Cb -0.20 -3.79 -0.05 0.00 0.10 0.00 0.00 34.13 30.19 1x2p s GLU 9 CO -0.05 -0.72 -0.09 -0.06 0.02 0.00 0.00 175.26 174.36 1x2p s PHE 10 N 3.50 1.35 -0.00 1.61 0.40 0.17 -4.95 117.98 120.06 1x2p s PHE 10 Ca 0.59 -0.77 0.07 0.00 -0.60 0.00 0.00 56.93 56.22 1x2p s PHE 10 Cb -0.25 -0.69 -0.03 0.00 0.51 0.00 0.00 43.02 42.56 1x2p s PHE 10 CO 0.18 0.09 -0.21 0.08 0.70 0.00 0.00 175.22 176.05 1x2p s VAL 11 N -3.31 2.48 -0.21 -0.44 1.01 -1.26 0.12 120.40 118.79 1x2p s VAL 11 Ca 0.19 -1.09 -0.29 0.00 0.00 0.00 0.00 61.98 60.79 1x2p s VAL 11 Cb 0.03 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 1x2p s VAL 11 CO 0.02 0.49 1.30 0.00 0.00 0.00 0.00 175.10 176.91 1x2p s ALA 12 N -0.75 3.55 -1.63 5.51 0.00 -1.15 -0.83 121.76 126.46 1x2p s ALA 12 Ca 0.12 0.36 0.25 0.00 0.00 0.00 0.00 51.96 52.68 1x2p s ALA 12 Cb -0.10 -3.68 1.33 0.00 0.00 0.00 0.00 23.12 20.67 1x2p s ALA 12 CO 0.01 -1.40 1.83 0.44 0.00 0.00 0.00 175.76 176.64 1x2p n ILE 13 N 5.69 0.15 -3.64 0.00 -5.35 0.51 0.07 119.36 116.78 1x2p n ILE 13 Ca 0.14 0.04 -0.06 0.00 -0.27 0.00 0.00 62.75 62.60 1x2p n ILE 13 Cb 0.45 -0.64 -0.07 0.00 -1.74 0.00 0.00 39.64 37.65 1x2p n ILE 13 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1x2p s ALA 14 N -2.37 -2.10 0.39 -1.28 0.00 -1.22 -4.94 121.76 110.23 1x2p s ALA 14 Ca 0.28 1.88 -0.28 0.00 0.00 0.00 0.00 51.96 53.84 1x2p s ALA 14 Cb 0.17 -1.58 -0.10 0.00 0.00 0.00 0.00 23.12 21.60 1x2p s ALA 14 CO 0.34 -0.22 1.47 0.16 0.00 0.00 0.00 175.76 177.52 1x2p s ASP 15 N 0.36 6.28 0.17 0.00 -4.77 -1.26 -4.18 116.67 113.27 1x2p s ASP 15 Ca 0.02 3.02 0.05 0.00 -3.30 0.00 0.00 52.55 52.34 1x2p s ASP 15 Cb -0.05 -2.67 -0.05 0.00 -1.09 0.00 0.00 42.92 39.07 1x2p s ASP 15 CO -0.10 -0.91 -0.08 -0.47 0.70 0.00 0.00 175.17 174.31 1x2p s TYR 16 N -1.14 1.39 -0.14 2.11 5.04 -0.81 -4.85 117.35 118.96 1x2p s TYR 16 Ca 0.54 -0.78 -0.02 0.00 -2.44 0.00 0.00 57.07 54.38 1x2p s TYR 16 Cb -0.46 -0.73 0.04 0.00 0.35 0.00 0.00 41.96 41.17 1x2p s TYR 16 CO 0.62 0.09 -0.00 0.00 -1.34 0.00 0.00 175.55 174.91 1x2p s ALA 17 N -3.31 1.02 -0.20 3.97 0.00 -1.26 -3.35 121.76 118.63 1x2p s ALA 17 Ca 0.20 -0.50 -0.34 0.00 0.00 0.00 0.00 51.96 51.32 1x2p s ALA 17 Cb 0.03 -0.99 -0.11 0.00 0.00 0.00 0.00 23.12 22.05 1x2p s ALA 17 CO 0.03 -0.77 2.01 0.00 0.00 0.00 0.00 175.76 177.03 1x2p n ALA 18 N 5.04 0.96 0.99 0.00 0.00 -1.26 -4.80 120.51 121.45 1x2p n ALA 18 Ca -0.09 0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1x2p n ALA 18 Cb 0.49 -2.55 0.52 0.00 0.00 0.00 0.00 19.45 17.90 1x2p n ALA 18 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1x2p n THR 19 N 6.06 0.01 -4.28 0.00 -2.24 -1.26 -4.87 114.28 107.71 1x2p n THR 19 Ca 0.29 -0.01 -0.17 0.00 -2.27 0.00 0.00 64.05 61.90 1x2p n THR 19 Cb 0.28 -0.30 -0.09 0.00 -2.10 0.00 0.00 70.33 68.12 1x2p n THR 19 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x2p s ASP 20 N -3.03 1.08 -0.07 3.42 1.11 -1.26 -5.02 116.67 112.89 1x2p s ASP 20 Ca 0.13 -1.54 0.07 0.00 0.18 0.00 0.00 52.55 51.39 1x2p s ASP 20 Cb 0.18 0.42 0.33 0.00 1.07 0.00 0.00 42.92 44.92 1x2p s ASP 20 CO 0.58 -0.91 1.09 -1.84 1.18 0.00 0.00 175.17 175.27 1x2p n GLU 21 N -0.48 2.41 -0.05 8.23 0.28 -1.26 -3.32 120.64 126.45 1x2p n GLU 21 Ca 0.03 -1.29 0.03 0.00 -0.16 0.00 0.00 57.16 55.77 1x2p n GLU 21 Cb 0.65 -1.67 0.04 0.00 1.43 0.00 0.00 31.44 31.89 1x2p n GLU 21 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1x2p n THR 22 N 0.31 1.10 -4.35 3.84 -2.24 -1.26 -5.04 114.28 106.64 1x2p n THR 22 Ca 0.12 -1.21 -0.21 0.00 -2.27 0.00 0.00 64.05 60.48 1x2p n THR 22 Cb 0.55 0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.38 1.33 -0.01 -0.78 -0.21 -1.21 -1.84 119.66 115.56 1x2p s GLN 23 Ca 0.09 -1.49 -0.03 0.00 0.02 0.00 0.00 55.36 53.95 1x2p s GLN 23 Cb 0.08 -1.30 -0.04 0.00 1.00 0.00 0.00 33.01 32.75 1x2p s GLN 23 CO 0.01 0.25 0.18 -0.51 -2.12 0.00 0.00 175.29 173.10 1x2p s LEU 24 N -2.94 4.36 -0.08 2.90 1.43 -0.99 -4.78 118.68 118.58 1x2p s LEU 24 Ca 0.19 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.64 1x2p s LEU 24 Cb -0.04 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.54 1x2p s LEU 24 CO 0.07 0.26 -0.10 -0.94 0.23 0.00 0.00 176.35 175.88 1x2p s SER 25 N -1.94 4.39 0.34 2.29 1.04 -1.26 -4.25 113.70 114.31 1x2p s SER 25 Ca 0.27 -0.12 -0.08 0.00 0.48 0.00 0.00 55.95 56.50 1x2p s SER 25 Cb -0.13 -1.18 0.03 0.00 0.10 0.00 0.00 66.02 64.85 1x2p s SER 25 CO 0.19 0.32 0.58 2.22 0.98 0.00 0.00 173.24 177.53 1x2p n PHE 26 N 2.53 -1.81 -4.61 5.02 1.16 -1.21 -5.01 117.46 113.53 1x2p n PHE 26 Ca -0.18 -1.92 -0.23 0.00 -1.87 0.00 0.00 57.45 53.25 1x2p n PHE 26 Cb 0.53 0.68 -0.14 0.00 -1.61 0.00 0.00 39.48 38.93 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 2.10 -0.48 5.98 2.96 -1.26 -1.93 118.68 126.06 1x2p s LEU 27 Ca 0.20 -0.39 -0.44 0.00 -0.22 0.00 0.00 54.13 53.28 1x2p s LEU 27 Cb -0.03 -0.79 -0.19 0.00 0.50 0.00 0.00 46.19 45.68 1x2p s LEU 27 CO 0.15 0.14 1.77 -1.14 -1.32 0.00 0.00 176.35 175.95 1x2p n ARG 28 N 2.25 0.00 0.00 1.98 0.63 -1.26 0.74 116.66 121.00 1x2p n ARG 28 Ca -0.16 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.77 1x2p n ARG 28 Cb 0.54 -1.44 0.00 0.00 0.45 0.00 0.00 32.46 32.02 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 5.40 3.08 3.29 5.14 0.00 0.11 -4.88 105.19 117.33 1x2p n GLY 29 Ca 0.40 -1.07 -0.52 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 -2.29 1.61 -0.58 0.23 -4.27 120.64 115.33 1x2p n GLU 30 Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 1x2p n GLU 30 Cb 0.00 -1.22 -0.03 0.00 -0.57 0.00 0.00 31.44 29.62 1x2p n GLU 30 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1x2p s LYS 31 N -0.42 2.92 -0.22 3.49 3.01 -1.26 -2.94 119.74 124.32 1x2p s LYS 31 Ca 0.75 0.22 -0.15 0.00 -1.01 0.00 0.00 55.97 55.78 1x2p s LYS 31 Cb -1.07 -4.28 -0.04 0.00 -1.01 0.00 0.00 37.83 31.43 1x2p s LYS 31 CO 0.54 -2.42 0.36 0.42 0.51 0.00 0.00 175.35 174.76 1x2p s ILE 32 N 7.38 5.21 -0.30 2.17 -1.09 0.33 -4.89 121.20 130.01 1x2p s ILE 32 Ca 0.52 0.60 -0.21 0.00 -2.23 0.00 0.00 60.65 59.33 1x2p s ILE 32 Cb -0.10 -3.69 -0.01 0.00 -1.58 0.00 0.00 42.46 37.08 1x2p s ILE 32 CO 0.18 0.24 0.66 -0.22 -1.23 0.00 0.00 174.94 174.58 1x2p s LEU 33 N 1.46 4.13 -1.21 2.97 1.98 -1.26 0.45 118.68 127.20 1x2p s LEU 33 Ca 0.16 0.51 -0.12 0.00 -2.89 0.00 0.00 54.13 51.79 1x2p s LEU 33 Cb -0.15 -2.87 0.19 0.00 0.66 0.00 0.00 46.19 44.02 1x2p s LEU 33 CO 0.08 -0.49 1.49 -0.38 -1.89 0.00 0.00 176.35 175.16 1x2p n ILE 34 N 5.40 4.35 -0.03 6.68 2.08 0.23 -1.81 119.36 136.27 1x2p n ILE 34 Ca -0.00 -4.78 -0.03 0.00 0.56 0.00 0.00 62.75 58.49 1x2p n ILE 34 Cb 0.49 -2.44 -0.02 0.00 -0.75 0.00 0.00 39.64 36.91 1x2p n ILE 34 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1x2p h LEU 35 N 8.83 -0.45 -8.93 1.39 4.07 -1.45 -2.91 115.31 115.87 1x2p h LEU 35 Ca 0.31 0.06 -0.42 0.00 0.08 0.00 0.00 57.88 57.91 1x2p h LEU 35 Cb 0.81 0.18 -0.14 0.00 1.08 0.00 0.00 40.66 42.59 1x2p h LEU 35 CO 1.30 -0.10 -0.69 -0.60 -1.08 0.00 0.00 178.44 177.27 1x2p s ARG 36 N -3.63 1.36 -0.27 1.13 3.52 -0.65 -4.64 118.95 115.77 1x2p s ARG 36 Ca -0.03 -1.65 -0.15 0.00 -0.13 0.00 0.00 55.73 53.77 1x2p s ARG 36 Cb 0.02 -0.91 -0.12 0.00 -1.56 0.00 0.00 34.95 32.38 1x2p s ARG 36 CO 0.15 0.04 -0.31 1.04 -0.81 0.00 0.00 175.30 175.41 1x2p n GLN 37 N -0.42 0.58 0.00 5.12 6.02 -1.26 -0.04 117.38 127.38 1x2p n GLN 37 Ca -0.07 0.29 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 1x2p n GLN 37 Cb 0.62 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 30.37 1x2p n GLN 37 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1x2p n THR 38 N -4.28 0.00 -4.42 5.09 -1.04 -1.26 -3.92 114.28 104.45 1x2p n THR 38 Ca -0.50 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.30 1x2p n THR 38 Cb 0.84 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 69.25 1x2p n THR 38 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1x2p s THR 39 N 0.00 2.09 -1.94 12.58 -4.23 -1.06 -5.01 115.64 118.07 1x2p s THR 39 Ca 0.00 -2.30 0.07 0.00 -1.18 0.00 0.00 61.69 58.29 1x2p s THR 39 Cb 0.00 -2.22 0.22 0.00 1.34 0.00 0.00 72.50 71.84 1x2p s THR 39 CO 0.00 -0.47 1.17 0.00 -0.54 0.00 0.00 174.62 174.78 1x2p n ALA 40 N -0.52 2.49 0.00 3.99 0.00 -1.26 -3.71 120.51 121.49 1x2p n ALA 40 Ca -0.06 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1x2p n ALA 40 Cb 0.61 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1x2p n ALA 40 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1x2p n ASP 41 N 0.21 2.84 -4.21 0.00 -0.08 -1.26 -4.82 116.55 109.23 1x2p n ASP 41 Ca 0.08 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 53.05 1x2p n ASP 41 Cb 0.22 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.51 1x2p n ASP 41 CO 0.00 0.00 0.00 0.26 0.12 0.00 0.00 177.20 177.58 1x2p s TRP 42 N -1.93 2.49 0.27 -0.67 0.52 -1.24 -0.84 118.94 117.53 1x2p s TRP 42 Ca 0.00 -1.00 0.10 0.00 0.02 0.00 0.00 56.10 55.21 1x2p s TRP 42 Cb 0.00 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.61 1x2p s TRP 42 CO 0.00 -0.40 -0.01 -1.58 0.02 0.00 0.00 176.95 174.98 1x2p s TRP 43 N 0.33 2.69 -0.38 -1.98 0.52 0.51 -2.57 118.94 118.06 1x2p s TRP 43 Ca -0.18 -0.23 -0.09 0.00 0.02 0.00 0.00 56.10 55.62 1x2p s TRP 43 Cb -0.18 -1.20 0.05 0.00 -1.15 0.00 0.00 33.47 31.00 1x2p s TRP 43 CO 0.08 0.62 0.20 -0.46 0.02 0.00 0.00 176.95 177.41 1x2p s TRP 44 N -2.33 3.29 0.50 -1.98 -0.11 0.94 0.71 118.94 119.95 1x2p s TRP 44 Ca 0.32 -1.33 0.08 0.00 1.22 0.00 0.00 56.10 56.39 1x2p s TRP 44 Cb -0.06 -2.60 0.03 0.00 -1.50 0.00 0.00 33.47 29.33 1x2p s TRP 44 CO 0.20 -0.75 0.52 0.20 -4.62 0.00 0.00 176.95 172.50 1x2p s GLY 45 N 1.73 2.07 -0.13 5.86 0.00 -0.75 -1.26 107.32 114.85 1x2p s GLY 45 Ca 0.01 -1.75 -0.05 0.00 0.00 0.00 0.00 44.72 42.93 1x2p s GLY 45 CO 0.04 -1.74 0.26 1.85 0.00 0.00 0.00 173.10 173.50 1x2p s GLU 46 N -4.35 0.14 0.44 2.90 2.12 -0.75 -2.78 118.70 116.43 1x2p s GLU 46 Ca 0.49 0.73 0.01 0.00 0.36 0.00 0.00 54.97 56.56 1x2p s GLU 46 Cb -0.04 -0.05 0.09 0.00 0.26 0.00 0.00 34.13 34.38 1x2p s GLU 46 CO 0.30 -0.28 0.61 0.54 -0.54 0.00 0.00 175.26 175.88 1x2p n ARG 47 N 5.33 0.26 -1.55 4.30 5.12 0.35 -4.12 116.66 126.34 1x2p n ARG 47 Ca -0.06 -1.75 -0.39 0.00 -1.93 0.00 0.00 57.85 53.72 1x2p n ARG 47 Cb 0.50 -0.37 -0.04 0.00 -1.16 0.00 0.00 32.46 31.38 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 -2.88 1.01 -0.96 7.54 0.00 -1.26 -0.86 120.51 123.10 1x2p n ALA 48 Ca -0.10 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1x2p n ALA 48 Cb 0.37 -3.03 0.00 0.00 0.00 0.00 0.00 19.45 16.79 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 6.03 0.06 3.59 0.00 0.00 -1.26 -4.94 105.19 108.68 1x2p n GLY 49 Ca 0.38 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.15 1x2p n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2p s GLY 52 N 2.45 1.52 0.19 0.00 0.00 -1.12 -4.99 107.32 105.38 1x2p s GLY 52 Ca 0.08 -1.53 -0.09 0.00 0.00 0.00 0.00 44.72 43.17 1x2p s GLY 52 CO -0.13 -1.00 0.51 -0.19 0.00 0.00 0.00 173.10 172.28 1x2p s TYR 53 N -2.99 3.47 0.06 1.90 2.02 -0.77 -1.82 117.35 119.23 1x2p s TYR 53 Ca 0.30 0.84 0.03 0.00 -0.37 0.00 0.00 57.07 57.87 1x2p s TYR 53 Cb -0.01 -2.22 -0.03 0.00 -0.40 0.00 0.00 41.96 39.31 1x2p s TYR 53 CO 0.21 0.34 -0.09 0.96 -1.57 0.00 0.00 175.55 175.39 1x2p s ILE 54 N -1.71 0.73 0.85 2.71 -4.36 0.22 -2.36 121.20 117.29 1x2p s ILE 54 Ca 0.44 -1.26 -0.12 0.00 -0.26 0.00 0.00 60.65 59.44 1x2p s ILE 54 Cb -0.12 -0.89 0.10 0.00 1.25 0.00 0.00 42.46 42.81 1x2p s ILE 54 CO 0.21 -0.41 1.12 -2.16 0.24 0.00 0.00 174.94 173.94 1x2p s PRO 55 N -1.93 1.63 -0.78 0.37 0.04 -1.26 0.19 135.00 133.25 1x2p s PRO 55 Ca -0.05 0.47 -0.02 0.00 0.04 0.00 0.00 61.00 61.44 1x2p s PRO 55 Cb -0.08 -1.88 0.20 0.00 0.04 0.00 0.00 34.50 32.78 1x2p s PRO 55 CO 0.00 -1.90 0.64 0.00 0.04 0.00 0.00 177.00 175.78 1x2p s ALA 56 N -3.22 3.98 0.00 8.56 0.00 -0.02 -4.42 121.76 126.65 1x2p s ALA 56 Ca 0.62 -3.61 0.00 0.00 0.00 0.00 0.00 51.96 48.97 1x2p s ALA 56 Cb -0.15 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.21 1x2p s ALA 56 CO 0.54 -2.14 0.00 -1.71 0.00 0.00 0.00 175.76 172.45 1x2p n ASN 57 N 2.80 0.00 0.19 0.00 2.85 -1.26 -4.88 115.26 114.96 1x2p n ASN 57 Ca 0.16 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.67 1x2p n ASN 57 Cb 0.38 0.00 0.36 0.00 1.24 0.00 0.00 39.78 41.75 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 -2.91 1.20 3.86 -1.93 -3.43 115.15 111.94 1x2p h HIS 58 Ca 0.00 0.00 -0.65 0.00 -1.16 0.00 0.00 60.37 58.56 1x2p h HIS 58 Cb 0.00 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.40 1x2p h HIS 58 CO 0.00 0.39 -0.52 0.14 0.86 0.00 0.00 177.93 178.80 1x2p s VAL 59 N -3.93 5.18 0.00 2.45 -7.23 -1.26 0.19 120.40 115.80 1x2p s VAL 59 Ca -0.02 -0.24 0.00 0.00 -1.81 0.00 0.00 61.98 59.91 1x2p s VAL 59 Cb 0.13 -3.40 0.00 0.00 0.56 0.00 0.00 36.38 33.67 1x2p s VAL 59 CO 0.71 0.34 0.00 0.61 -0.31 0.00 0.00 175.10 176.45 1x2p n GLY 60 N 1.06 -0.01 0.79 2.32 0.00 -0.01 -4.82 105.19 104.53 1x2p n GLY 60 Ca -0.12 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1x2p n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x2p n LYS 61 N -0.40 0.00 0.07 1.61 4.76 -1.26 -4.66 118.16 118.27 1x2p n LYS 61 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1x2p n LYS 61 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1x2p n LYS 61 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1x2p n HIS 62 N -2.43 -1.13 -1.55 2.13 8.25 -1.26 -5.16 115.22 114.07 1x2p n HIS 62 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 1x2p n HIS 62 Cb 0.00 0.43 0.00 0.00 1.12 0.00 0.00 29.99 31.54 1x2p n HIS 62 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1x2p n SER 63 N -3.09 -8.37 0.00 0.41 7.64 -1.26 -5.09 113.62 103.85 1x2p n SER 63 Ca 0.00 1.35 0.00 0.00 1.01 0.00 0.00 58.87 61.23 1x2p n SER 63 Cb 0.05 -4.72 0.00 0.00 -1.01 0.00 0.00 64.21 58.53 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 -1.27 -0.56 3.82 0.23 0.00 -1.26 -5.15 105.19 101.00 1x2p n GLY 64 Ca 0.00 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 1x2p n GLY 64 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x2p s PRO 65 N -0.92 2.90 0.03 1.61 0.04 -1.26 -5.07 135.00 132.32 1x2p s PRO 65 Ca 0.00 0.94 0.08 0.00 0.04 0.00 0.00 61.00 62.06 1x2p s PRO 65 Cb 0.00 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1x2p s PRO 65 CO 0.00 -1.12 -0.24 -1.12 0.04 0.00 0.00 177.00 174.56 1x2p s SER 66 N -3.80 2.85 -0.23 6.66 0.01 -1.26 -5.12 113.70 112.81 1x2p s SER 66 Ca 0.58 -0.53 -0.08 0.00 1.31 0.00 0.00 55.95 57.24 1x2p s SER 66 Cb -0.14 -0.27 0.10 0.00 0.21 0.00 0.00 66.02 65.92 1x2p s SER 66 CO 0.55 0.24 0.50 -0.55 0.41 0.00 0.00 173.24 174.38 1x2p s SER 67 N -1.03 -0.56 0.00 2.44 0.15 -1.26 -5.35 113.70 108.09 1x2p s SER 67 Ca 0.10 1.19 0.00 0.00 0.70 0.00 0.00 55.95 57.94 1x2p s SER 67 Cb -0.09 1.67 0.00 0.00 -1.71 0.00 0.00 66.02 65.89 1x2p s SER 67 CO 0.01 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.83