#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 -8.45 -1.40 1.61 7.64 -1.26 -4.98 113.62 106.79 1x2p n SER 2 Ca 0.00 1.78 0.17 0.00 1.01 0.00 0.00 58.87 61.83 1x2p n SER 2 Cb 0.00 -5.19 -0.07 0.00 -1.01 0.00 0.00 64.21 57.94 1x2p n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x2p n SER 3 N -3.27 -7.89 0.00 6.43 7.64 -1.26 -4.98 113.62 110.29 1x2p n SER 3 Ca -0.04 1.14 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1x2p n SER 3 Cb 0.57 -4.65 0.00 0.00 -1.01 0.00 0.00 64.21 59.13 1x2p n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2p n GLY 4 N -4.22 1.58 3.08 0.23 0.00 -1.26 -4.98 105.19 99.61 1x2p n GLY 4 Ca -0.06 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 1x2p n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x2p s SER 5 N -4.00 2.92 0.03 1.61 0.01 -1.26 -4.92 113.70 108.09 1x2p s SER 5 Ca 0.00 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1x2p s SER 5 Cb 0.00 -1.34 0.00 0.00 0.21 0.00 0.00 66.02 64.89 1x2p s SER 5 CO 0.00 -0.02 0.00 -1.20 0.41 0.00 0.00 173.24 172.43 1x2p n SER 6 N 4.65 -0.09 -0.18 2.44 7.64 -1.26 -5.17 113.62 121.64 1x2p n SER 6 Ca -0.19 0.05 0.02 0.00 1.01 0.00 0.00 58.87 59.76 1x2p n SER 6 Cb 0.50 0.20 -0.01 0.00 -1.01 0.00 0.00 64.21 63.89 1x2p n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x2p n GLY 7 N 0.84 -2.21 3.19 0.23 0.00 -1.26 -4.87 105.19 101.11 1x2p n GLY 7 Ca 0.00 -1.44 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 1x2p n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x2p s GLU 8 N -2.42 2.60 -0.01 1.61 2.02 -1.10 -4.89 118.70 116.51 1x2p s GLU 8 Ca 0.00 -1.15 -0.30 0.00 0.02 0.00 0.00 54.97 53.54 1x2p s GLU 8 Cb 0.00 -3.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.07 1x2p s GLU 8 CO 0.00 -0.54 1.12 -2.00 0.02 0.00 0.00 175.26 173.86 1x2p s GLU 9 N 1.29 4.44 0.14 1.61 -6.30 -1.26 0.13 118.70 118.75 1x2p s GLU 9 Ca -0.03 1.61 0.00 0.00 -2.50 0.00 0.00 54.97 54.05 1x2p s GLU 9 Cb -0.19 -3.46 -0.04 0.00 0.00 0.00 0.00 34.13 30.44 1x2p s GLU 9 CO -0.02 -0.26 0.02 -0.06 0.02 0.00 0.00 175.26 174.96 1x2p s PHE 10 N 1.49 0.98 -0.02 5.30 0.40 0.45 -4.93 117.98 121.64 1x2p s PHE 10 Ca 0.55 -1.11 0.07 0.00 -0.60 0.00 0.00 56.93 55.83 1x2p s PHE 10 Cb -0.25 -0.56 -0.02 0.00 0.51 0.00 0.00 43.02 42.71 1x2p s PHE 10 CO 0.25 -0.36 -0.22 0.08 0.70 0.00 0.00 175.22 175.68 1x2p s VAL 11 N -3.85 1.73 -0.16 -0.44 1.01 -1.26 0.16 120.40 117.60 1x2p s VAL 11 Ca 0.22 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.97 1x2p s VAL 11 Cb 0.07 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1x2p s VAL 11 CO 0.01 0.49 1.46 0.00 0.00 0.00 0.00 175.10 177.06 1x2p s ALA 12 N -0.51 3.53 0.26 5.51 0.00 -1.16 0.14 121.76 129.53 1x2p s ALA 12 Ca 0.08 0.56 0.37 0.00 0.00 0.00 0.00 51.96 52.97 1x2p s ALA 12 Cb -0.08 -3.72 1.68 0.00 0.00 0.00 0.00 23.12 20.99 1x2p s ALA 12 CO -0.01 -1.47 2.10 -0.84 0.00 0.00 0.00 175.76 175.54 1x2p h ILE 13 N 5.71 0.00 -1.89 0.00 3.07 0.57 -1.62 117.51 123.34 1x2p h ILE 13 Ca -0.32 -0.36 -0.02 0.00 1.55 0.00 0.00 64.86 65.71 1x2p h ILE 13 Cb 1.13 1.36 -0.21 0.00 -0.27 0.00 0.00 36.82 38.83 1x2p h ILE 13 CO 0.98 0.00 0.25 0.00 -1.05 0.00 0.00 178.15 178.33 1x2p s ALA 14 N -3.81 -1.82 0.36 0.16 0.00 -1.24 -4.92 121.76 110.50 1x2p s ALA 14 Ca -0.01 1.63 -0.27 0.00 0.00 0.00 0.00 51.96 53.30 1x2p s ALA 14 Cb 0.10 -0.60 -0.12 0.00 0.00 0.00 0.00 23.12 22.50 1x2p s ALA 14 CO 0.50 -0.34 1.28 -0.40 0.00 0.00 0.00 175.76 176.81 1x2p n ASP 15 N 1.54 2.71 -4.24 0.00 5.75 -1.26 -4.34 116.55 116.71 1x2p n ASP 15 Ca -0.16 1.19 -0.14 0.00 -0.01 0.00 0.00 54.79 55.67 1x2p n ASP 15 Cb 0.56 -1.49 -0.10 0.00 -1.03 0.00 0.00 41.12 39.07 1x2p n ASP 15 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 1x2p s TYR 16 N -1.12 1.21 -0.12 2.11 5.04 -0.96 -4.90 117.35 118.61 1x2p s TYR 16 Ca 0.56 -0.77 -0.03 0.00 -2.44 0.00 0.00 57.07 54.40 1x2p s TYR 16 Cb -0.56 -0.63 0.04 0.00 0.35 0.00 0.00 41.96 41.17 1x2p s TYR 16 CO 0.61 0.05 0.04 0.00 -1.34 0.00 0.00 175.55 174.91 1x2p s ALA 17 N -3.30 0.66 0.15 3.97 0.00 -1.26 -3.67 121.76 118.31 1x2p s ALA 17 Ca 0.15 -0.27 -0.34 0.00 0.00 0.00 0.00 51.96 51.50 1x2p s ALA 17 Cb 0.02 -0.90 -0.15 0.00 0.00 0.00 0.00 23.12 22.10 1x2p s ALA 17 CO -0.00 -0.80 1.48 0.00 0.00 0.00 0.00 175.76 176.44 1x2p n ALA 18 N 5.17 0.58 0.26 0.00 0.00 -1.26 -4.86 120.51 120.40 1x2p n ALA 18 Ca -0.07 0.47 0.11 0.00 0.00 0.00 0.00 53.44 53.95 1x2p n ALA 18 Cb 0.49 -2.25 -0.01 0.00 0.00 0.00 0.00 19.45 17.67 1x2p n ALA 18 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1x2p n THR 19 N 2.96 0.34 -4.52 0.00 -1.04 -1.26 -4.95 114.28 105.81 1x2p n THR 19 Ca 0.17 -0.42 -0.25 0.00 -2.04 0.00 0.00 64.05 61.51 1x2p n THR 19 Cb 0.26 -0.08 -0.09 0.00 -1.82 0.00 0.00 70.33 68.60 1x2p n THR 19 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1x2p s ASP 20 N -4.66 2.83 -0.01 8.00 1.01 -1.26 -5.02 116.67 117.56 1x2p s ASP 20 Ca -0.00 -1.56 0.06 0.00 0.71 0.00 0.00 52.55 51.76 1x2p s ASP 20 Cb 0.12 0.27 0.20 0.00 1.01 0.00 0.00 42.92 44.53 1x2p s ASP 20 CO 0.81 -0.79 1.10 1.21 0.21 0.00 0.00 175.17 177.71 1x2p n GLU 21 N -0.87 1.63 -2.40 8.23 2.13 -1.26 -3.77 120.64 124.32 1x2p n GLU 21 Ca -0.06 -0.80 -0.22 0.00 0.66 0.00 0.00 57.16 56.74 1x2p n GLU 21 Cb 0.66 -1.28 0.01 0.00 0.27 0.00 0.00 31.44 31.10 1x2p n GLU 21 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1x2p n THR 22 N 0.14 2.15 -3.58 6.31 -2.24 -1.26 -5.04 114.28 110.76 1x2p n THR 22 Ca 0.07 -4.33 -0.12 0.00 -2.27 0.00 0.00 64.05 57.40 1x2p n THR 22 Cb 0.25 -0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 67.65 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 -3.52 1.07 0.01 -0.78 -0.21 -1.25 -3.88 119.66 111.10 1x2p s GLN 23 Ca 0.44 -0.46 -0.00 0.00 0.02 0.00 0.00 55.36 55.37 1x2p s GLN 23 Cb 0.40 0.48 -0.04 0.00 1.00 0.00 0.00 33.01 34.86 1x2p s GLN 23 CO -0.08 -0.41 0.10 -0.51 -2.12 0.00 0.00 175.29 172.26 1x2p s LEU 24 N -2.39 3.95 -0.12 2.90 1.43 -1.10 -4.84 118.68 118.51 1x2p s LEU 24 Ca -0.01 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1x2p s LEU 24 Cb 0.00 -2.35 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 1x2p s LEU 24 CO -0.07 0.26 -0.14 -0.94 0.23 0.00 0.00 176.35 175.69 1x2p s SER 25 N -1.85 3.95 0.31 2.29 1.04 -1.26 -4.40 113.70 113.78 1x2p s SER 25 Ca 0.24 -0.33 0.06 0.00 0.48 0.00 0.00 55.95 56.41 1x2p s SER 25 Cb -0.12 -1.49 -0.02 0.00 0.10 0.00 0.00 66.02 64.49 1x2p s SER 25 CO 0.16 0.19 0.29 2.22 0.98 0.00 0.00 173.24 177.08 1x2p n PHE 26 N 3.36 -0.84 -4.55 5.02 1.16 -1.24 -5.02 117.46 115.35 1x2p n PHE 26 Ca -0.18 -2.53 -0.24 0.00 -1.87 0.00 0.00 57.45 52.63 1x2p n PHE 26 Cb 0.53 0.31 -0.14 0.00 -1.61 0.00 0.00 39.48 38.57 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 2.16 -0.31 5.98 2.96 -1.26 -2.27 118.68 125.93 1x2p s LEU 27 Ca 0.35 -0.49 -0.43 0.00 -0.22 0.00 0.00 54.13 53.34 1x2p s LEU 27 Cb 0.01 -0.84 -0.19 0.00 0.50 0.00 0.00 46.19 45.67 1x2p s LEU 27 CO 0.25 0.12 1.37 -1.14 -1.32 0.00 0.00 176.35 175.63 1x2p n ARG 28 N 1.91 0.00 0.00 1.98 0.63 -1.26 0.90 116.66 120.82 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 -1.45 0.00 0.00 0.45 0.00 0.00 32.46 31.99 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 3.01 2.62 3.56 5.14 0.00 -0.61 -4.90 105.19 114.01 1x2p n GLY 29 Ca 0.26 -0.25 -0.53 0.00 0.00 0.00 0.00 46.02 45.51 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 0.86 -2.40 1.61 1.02 0.26 -4.55 120.64 117.44 1x2p n GLU 30 Ca 0.00 0.31 -0.41 0.00 -0.02 0.00 0.00 57.16 57.04 1x2p n GLU 30 Cb 0.00 -1.86 -0.03 0.00 -0.02 0.00 0.00 31.44 29.53 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 0.10 3.19 -0.11 3.49 -0.14 -1.26 -2.98 119.74 122.04 1x2p s LYS 31 Ca 0.82 0.26 -0.10 0.00 -1.36 0.00 0.00 55.97 55.59 1x2p s LYS 31 Cb -0.99 -4.17 -0.05 0.00 -1.68 0.00 0.00 37.83 30.94 1x2p s LYS 31 CO 0.51 -2.09 0.22 0.42 -0.76 0.00 0.00 175.35 173.65 1x2p s ILE 32 N 6.30 5.36 -0.17 2.17 -1.09 0.43 -4.88 121.20 129.32 1x2p s ILE 32 Ca 0.49 0.40 -0.09 0.00 -2.23 0.00 0.00 60.65 59.22 1x2p s ILE 32 Cb -0.10 -3.51 -0.05 0.00 -1.58 0.00 0.00 42.46 37.22 1x2p s ILE 32 CO 0.21 0.56 0.14 -0.22 -1.23 0.00 0.00 174.94 174.40 1x2p s LEU 33 N -0.67 4.28 -0.99 2.97 1.98 -1.26 0.17 118.68 125.15 1x2p s LEU 33 Ca 0.16 0.33 -0.05 0.00 -2.89 0.00 0.00 54.13 51.68 1x2p s LEU 33 Cb -0.13 -2.09 0.25 0.00 0.66 0.00 0.00 46.19 44.87 1x2p s LEU 33 CO 0.05 0.26 0.93 -0.38 -1.89 0.00 0.00 176.35 175.33 1x2p n ILE 34 N 2.96 3.68 -0.01 6.68 2.08 0.36 -2.69 119.36 132.42 1x2p n ILE 34 Ca -0.17 -5.24 -0.04 0.00 0.56 0.00 0.00 62.75 57.85 1x2p n ILE 34 Cb 0.53 -2.45 -0.03 0.00 -0.75 0.00 0.00 39.64 36.94 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 6.21 -0.51 -8.91 1.39 4.07 -1.39 -2.90 115.31 113.27 1x2p h LEU 35 Ca 0.17 0.06 -0.37 0.00 0.08 0.00 0.00 57.88 57.82 1x2p h LEU 35 Cb 0.83 0.20 -0.14 0.00 1.08 0.00 0.00 40.66 42.62 1x2p h LEU 35 CO 0.93 -0.14 -0.59 -0.60 -1.08 0.00 0.00 178.44 176.97 1x2p s ARG 36 N -3.78 1.49 -0.25 1.13 3.52 -0.71 -4.72 118.95 115.65 1x2p s ARG 36 Ca -0.04 -1.83 0.05 0.00 -0.13 0.00 0.00 55.73 53.78 1x2p s ARG 36 Cb 0.02 -0.15 -0.19 0.00 -1.56 0.00 0.00 34.95 33.08 1x2p s ARG 36 CO 0.18 -0.38 -0.16 1.04 -0.81 0.00 0.00 175.30 175.17 1x2p n GLN 37 N -0.51 0.66 0.00 5.12 6.02 -1.26 -0.29 117.38 127.12 1x2p n GLN 37 Ca 0.01 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 1x2p n GLN 37 Cb 0.66 -1.53 0.00 0.00 1.02 0.00 0.00 30.24 30.39 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 -3.17 0.00 0.00 5.09 -1.04 -1.26 -3.94 114.28 109.95 1x2p n THR 38 Ca -0.43 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.58 1x2p n THR 38 Cb 1.02 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.53 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 0.00 0.07 12.58 -2.24 -1.24 -5.11 114.28 118.34 1x2p n THR 39 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1x2p n THR 39 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 -3.00 0.00 0.06 6.98 0.00 -1.25 -4.94 120.51 118.36 1x2p n ALA 40 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1x2p n ALA 40 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 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 0.43 -3.37 0.00 3.32 -1.91 -3.43 116.42 111.46 1x2p h ASP 41 Ca 0.00 -0.29 -0.64 0.00 0.02 0.00 0.00 57.03 56.12 1x2p h ASP 41 Cb 0.00 -0.13 -0.22 0.00 0.22 0.00 0.00 39.33 39.20 1x2p h ASP 41 CO 0.00 1.03 -0.66 0.26 -1.72 0.00 0.00 179.24 178.15 1x2p s TRP 42 N -3.56 3.04 0.15 4.55 0.52 -1.26 0.82 118.94 123.20 1x2p s TRP 42 Ca -0.05 -0.38 0.09 0.00 0.02 0.00 0.00 56.10 55.78 1x2p s TRP 42 Cb 0.10 -2.03 -0.04 0.00 -1.15 0.00 0.00 33.47 30.35 1x2p s TRP 42 CO 0.83 -0.14 -0.12 -1.58 0.02 0.00 0.00 176.95 175.96 1x2p s TRP 43 N 0.71 2.61 -0.47 -1.98 0.52 0.46 -3.61 118.94 117.18 1x2p s TRP 43 Ca -0.01 -0.23 -0.15 0.00 0.02 0.00 0.00 56.10 55.73 1x2p s TRP 43 Cb -0.14 -1.32 0.08 0.00 -1.15 0.00 0.00 33.47 30.94 1x2p s TRP 43 CO 0.02 0.47 0.40 -0.46 0.02 0.00 0.00 176.95 177.40 1x2p s TRP 44 N -1.49 3.25 0.16 -1.98 -0.11 0.61 0.19 118.94 119.56 1x2p s TRP 44 Ca 0.23 -0.97 0.03 0.00 1.22 0.00 0.00 56.10 56.60 1x2p s TRP 44 Cb -0.10 -3.20 0.03 0.00 -1.50 0.00 0.00 33.47 28.70 1x2p s TRP 44 CO 0.14 -0.81 0.21 0.41 -4.62 0.00 0.00 176.95 172.28 1x2p n GLY 45 N 5.20 2.02 3.35 5.86 0.00 -0.58 -1.09 105.19 119.94 1x2p n GLY 45 Ca -0.12 -2.16 -0.07 0.00 0.00 0.00 0.00 46.02 43.66 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 -2.72 0.38 0.45 1.61 2.12 -1.09 -3.20 118.70 116.25 1x2p s GLU 46 Ca 0.16 1.11 -0.00 0.00 0.36 0.00 0.00 54.97 56.60 1x2p s GLU 46 Cb -0.01 0.43 0.09 0.00 0.26 0.00 0.00 34.13 34.89 1x2p s GLU 46 CO 0.10 -0.24 0.61 0.54 -0.54 0.00 0.00 175.26 175.74 1x2p n ARG 47 N 5.34 0.16 -1.56 4.30 5.12 -0.05 -4.24 116.66 125.72 1x2p n ARG 47 Ca -0.10 -1.66 -0.39 0.00 -1.93 0.00 0.00 57.85 53.78 1x2p n ARG 47 Cb 0.50 -0.41 -0.03 0.00 -1.16 0.00 0.00 32.46 31.35 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 -2.95 1.12 -0.93 7.54 0.00 -1.26 -1.11 120.51 122.92 1x2p n ALA 48 Ca -0.10 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.65 1x2p n ALA 48 Cb 0.36 -3.09 0.00 0.00 0.00 0.00 0.00 19.45 16.72 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 3.62 0.00 0.00 -1.26 -4.93 105.19 108.65 1x2p n GLY 49 Ca 0.35 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.14 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 2.42 3.90 0.00 0.00 -1.19 -4.97 105.19 110.70 1x2p n GLY 52 Ca -0.05 -1.56 -0.31 0.00 0.00 0.00 0.00 46.02 44.10 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 -3.48 3.47 0.07 1.61 2.02 -1.25 -1.53 117.35 118.25 1x2p s TYR 53 Ca 0.21 0.55 0.04 0.00 -0.37 0.00 0.00 57.07 57.50 1x2p s TYR 53 Cb -0.01 -2.01 -0.03 0.00 -0.40 0.00 0.00 41.96 39.52 1x2p s TYR 53 CO 0.15 0.40 -0.11 0.96 -1.57 0.00 0.00 175.55 175.38 1x2p s ILE 54 N -1.73 0.85 0.92 2.71 -4.36 0.49 -2.72 121.20 117.37 1x2p s ILE 54 Ca 0.41 -1.35 -0.13 0.00 -0.26 0.00 0.00 60.65 59.32 1x2p s ILE 54 Cb -0.12 -1.02 0.15 0.00 1.25 0.00 0.00 42.46 42.72 1x2p s ILE 54 CO 0.25 -0.40 1.14 -2.16 0.24 0.00 0.00 174.94 174.02 1x2p s PRO 55 N -2.07 1.04 -0.68 0.37 0.04 -1.26 0.17 135.00 132.61 1x2p s PRO 55 Ca -0.02 0.25 -0.00 0.00 0.04 0.00 0.00 61.00 61.26 1x2p s PRO 55 Cb -0.07 -1.83 0.17 0.00 0.04 0.00 0.00 34.50 32.80 1x2p s PRO 55 CO 0.01 -2.26 0.49 0.00 0.04 0.00 0.00 177.00 175.28 1x2p s ALA 56 N -3.30 3.71 0.00 8.56 0.00 0.24 -4.48 121.76 126.50 1x2p s ALA 56 Ca 0.64 -3.48 0.00 0.00 0.00 0.00 0.00 51.96 49.12 1x2p s ALA 56 Cb -0.14 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.44 1x2p s ALA 56 CO 0.53 -2.10 0.00 0.09 0.00 0.00 0.00 175.76 174.28 1x2p n ASN 57 N 2.94 0.00 0.23 0.00 4.13 -1.26 -4.93 115.26 116.37 1x2p n ASN 57 Ca 0.12 0.00 0.08 0.00 1.68 0.00 0.00 54.58 56.46 1x2p n ASN 57 Cb 0.36 0.00 0.57 0.00 -1.54 0.00 0.00 39.78 39.18 1x2p n ASN 57 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 1x2p h HIS 58 N 0.00 0.00 -2.92 3.10 3.86 -1.94 -3.43 115.15 113.82 1x2p h HIS 58 Ca 0.00 0.00 -0.61 0.00 -1.16 0.00 0.00 60.37 58.60 1x2p h HIS 58 Cb 0.00 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.41 1x2p h HIS 58 CO 0.00 0.19 -0.54 0.14 0.86 0.00 0.00 177.93 178.58 1x2p s VAL 59 N -4.34 4.96 0.00 2.45 -7.23 -1.26 0.11 120.40 115.09 1x2p s VAL 59 Ca -0.03 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.48 1x2p s VAL 59 Cb 0.14 -3.45 0.00 0.00 0.56 0.00 0.00 36.38 33.64 1x2p s VAL 59 CO 0.65 0.07 0.00 0.61 -0.31 0.00 0.00 175.10 176.12 1x2p n GLY 60 N 0.13 3.07 3.39 2.32 0.00 0.12 -4.78 105.19 109.45 1x2p n GLY 60 Ca -0.07 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.52 0.28 -3.63 1.61 4.76 -1.26 -4.04 118.16 115.36 1x2p n LYS 61 Ca 0.00 0.10 -0.12 0.00 -2.87 0.00 0.00 58.31 55.42 1x2p n LYS 61 Cb 0.00 -1.22 -0.07 0.00 -1.84 0.00 0.00 35.03 31.90 1x2p n LYS 61 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1x2p s HIS 62 N -1.41 -0.71 0.21 2.13 2.46 -1.26 -4.96 115.29 111.76 1x2p s HIS 62 Ca 0.62 1.71 -0.30 0.00 0.47 0.00 0.00 55.06 57.56 1x2p s HIS 62 Cb -0.70 0.30 -0.08 0.00 -0.13 0.00 0.00 32.58 31.97 1x2p s HIS 62 CO 0.59 -0.34 1.06 0.45 -2.47 0.00 0.00 174.74 174.04 1x2p s SER 63 N 0.37 7.34 0.14 9.88 0.15 -1.26 -5.02 113.70 125.31 1x2p s SER 63 Ca 0.01 2.09 -0.24 0.00 0.70 0.00 0.00 55.95 58.51 1x2p s SER 63 Cb -0.05 -2.61 0.07 0.00 -1.71 0.00 0.00 66.02 61.72 1x2p s SER 63 CO -0.02 -0.13 0.68 -0.83 1.20 0.00 0.00 173.24 174.15 1x2p s GLY 64 N -0.47 -0.52 -0.06 9.45 0.00 -1.26 -5.08 107.32 109.37 1x2p s GLY 64 Ca 0.47 0.51 -0.13 0.00 0.00 0.00 0.00 44.72 45.57 1x2p s GLY 64 CO 0.36 0.17 0.51 -0.56 0.00 0.00 0.00 173.10 173.58 1x2p h PRO 65 N 2.00 -0.27 -2.89 2.90 0.13 -2.04 -3.50 132.00 128.34 1x2p h PRO 65 Ca -0.30 0.02 0.16 0.00 -0.87 0.00 0.00 66.00 65.01 1x2p h PRO 65 Cb 1.29 0.06 -0.09 0.00 0.13 0.00 0.00 31.00 32.39 1x2p h PRO 65 CO 0.35 -0.03 -0.92 0.43 -0.23 0.00 0.00 178.00 177.59 1x2p n SER 66 N -4.95 -6.48 -1.39 1.44 7.64 -1.26 -5.03 113.62 103.59 1x2p n SER 66 Ca -0.05 1.32 0.00 0.00 1.01 0.00 0.00 58.87 61.15 1x2p n SER 66 Cb 0.18 -3.93 0.00 0.00 -1.01 0.00 0.00 64.21 59.45 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 -3.23 -7.63 0.00 6.43 2.88 -1.26 -5.33 113.62 105.49 1x2p n SER 67 Ca -0.04 1.07 0.00 0.00 -1.33 0.00 0.00 58.87 58.56 1x2p n SER 67 Cb 0.48 -3.93 0.00 0.00 -0.75 0.00 0.00 64.21 60.01 1x2p n SER 67 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42