#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 1.51 -0.06 1.61 0.01 -1.26 -5.16 113.70 110.36 1x2p s SER 2 Ca 0.00 -1.23 0.02 0.00 1.31 0.00 0.00 55.95 56.05 1x2p s SER 2 Cb 0.00 0.07 -0.03 0.00 0.21 0.00 0.00 66.02 66.27 1x2p s SER 2 CO 0.00 -0.57 -0.09 -0.55 0.41 0.00 0.00 173.24 172.45 1x2p s SER 3 N -3.26 4.48 -0.22 2.44 0.15 -1.26 -5.10 113.70 110.93 1x2p s SER 3 Ca 0.28 -0.07 -0.33 0.00 0.70 0.00 0.00 55.95 56.53 1x2p s SER 3 Cb 0.06 -1.08 0.15 0.00 -1.71 0.00 0.00 66.02 63.45 1x2p s SER 3 CO 0.08 0.35 1.24 -0.83 1.20 0.00 0.00 173.24 175.28 1x2p s GLY 4 N -0.82 -0.18 0.18 9.45 0.00 -1.26 -5.10 107.32 109.59 1x2p s GLY 4 Ca 0.12 2.01 0.00 0.00 0.00 0.00 0.00 44.72 46.86 1x2p s GLY 4 CO 0.01 0.76 0.00 -1.26 0.00 0.00 0.00 173.10 172.61 1x2p n SER 5 N 0.18 0.21 -3.94 1.64 2.88 -1.26 -5.14 113.62 108.19 1x2p n SER 5 Ca -0.00 0.29 -0.09 0.00 -1.33 0.00 0.00 58.87 57.74 1x2p n SER 5 Cb 0.58 0.12 -0.09 0.00 -0.75 0.00 0.00 64.21 64.07 1x2p n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x2p s SER 6 N -5.13 0.23 0.00 -3.46 1.04 -1.26 -5.14 113.70 99.98 1x2p s SER 6 Ca 0.00 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1x2p s SER 6 Cb 0.00 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1x2p s SER 6 CO 0.00 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.23 1x2p n GLY 7 N 0.37 0.85 3.04 7.32 0.00 -1.26 -4.96 105.19 110.55 1x2p n GLY 7 Ca -0.17 -2.03 -0.31 0.00 0.00 0.00 0.00 46.02 43.52 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 -1.33 2.39 -0.49 1.61 8.01 -1.19 -4.95 118.70 122.75 1x2p s GLU 8 Ca 0.00 -0.79 -0.28 0.00 0.01 0.00 0.00 54.97 53.91 1x2p s GLU 8 Cb 0.00 -2.40 0.02 0.00 -4.31 0.00 0.00 34.13 27.44 1x2p s GLU 8 CO 0.00 -0.32 1.34 -1.21 0.01 0.00 0.00 175.26 175.08 1x2p s GLU 9 N 1.37 3.51 0.30 1.61 2.02 -1.26 -1.91 118.70 124.34 1x2p s GLU 9 Ca 0.02 0.65 0.09 0.00 0.02 0.00 0.00 54.97 55.75 1x2p s GLU 9 Cb -0.15 -4.03 -0.04 0.00 0.10 0.00 0.00 34.13 30.01 1x2p s GLU 9 CO -0.10 -1.66 0.06 -0.06 0.02 0.00 0.00 175.26 173.53 1x2p s PHE 10 N 5.40 2.72 -0.03 1.61 0.40 0.32 -4.90 117.98 123.50 1x2p s PHE 10 Ca 0.54 -0.28 0.06 0.00 -0.60 0.00 0.00 56.93 56.66 1x2p s PHE 10 Cb -0.11 -1.38 -0.01 0.00 0.51 0.00 0.00 43.02 42.02 1x2p s PHE 10 CO 0.30 0.51 -0.22 0.08 0.70 0.00 0.00 175.22 176.58 1x2p s VAL 11 N -2.36 1.79 -0.16 -0.44 1.01 -1.21 0.19 120.40 119.22 1x2p s VAL 11 Ca 0.34 -0.95 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 1x2p s VAL 11 Cb -0.05 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1x2p s VAL 11 CO 0.21 0.51 1.50 0.00 0.00 0.00 0.00 175.10 177.32 1x2p s ALA 12 N -0.35 3.50 -0.48 5.51 0.00 -1.18 -2.14 121.76 126.62 1x2p s ALA 12 Ca 0.04 0.58 0.22 0.00 0.00 0.00 0.00 51.96 52.79 1x2p s ALA 12 Cb -0.10 -3.75 0.96 0.00 0.00 0.00 0.00 23.12 20.23 1x2p s ALA 12 CO 0.01 -1.55 1.65 0.44 0.00 0.00 0.00 175.76 176.32 1x2p n ILE 13 N 5.81 0.93 -3.59 0.00 -5.35 0.49 -1.83 119.36 115.84 1x2p n ILE 13 Ca 0.17 0.36 -0.12 0.00 -0.27 0.00 0.00 62.75 62.88 1x2p n ILE 13 Cb 0.44 -1.29 -0.06 0.00 -1.74 0.00 0.00 39.64 36.99 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 -3.33 -1.89 0.29 -1.28 0.00 -1.23 -4.94 121.76 109.36 1x2p s ALA 14 Ca 0.03 1.67 -0.29 0.00 0.00 0.00 0.00 51.96 53.36 1x2p s ALA 14 Cb 0.08 -0.84 -0.10 0.00 0.00 0.00 0.00 23.12 22.26 1x2p s ALA 14 CO 0.32 -0.30 1.44 -0.51 0.00 0.00 0.00 175.76 176.71 1x2p s ASP 15 N -0.57 6.61 0.21 0.00 1.01 -1.26 -4.33 116.67 118.34 1x2p s ASP 15 Ca -0.02 2.75 0.09 0.00 0.71 0.00 0.00 52.55 56.08 1x2p s ASP 15 Cb -0.02 -2.64 -0.05 0.00 1.01 0.00 0.00 42.92 41.23 1x2p s ASP 15 CO 0.01 -0.71 -0.17 -0.47 0.21 0.00 0.00 175.17 174.04 1x2p s TYR 16 N -0.38 1.89 -0.21 4.23 5.04 -1.08 -4.90 117.35 121.94 1x2p s TYR 16 Ca 0.57 -0.48 0.01 0.00 -2.44 0.00 0.00 57.07 54.72 1x2p s TYR 16 Cb -0.43 -0.88 0.05 0.00 0.35 0.00 0.00 41.96 41.05 1x2p s TYR 16 CO 0.48 0.44 -0.08 0.00 -1.34 0.00 0.00 175.55 175.05 1x2p s ALA 17 N -2.58 1.96 -0.21 3.97 0.00 -1.26 -3.92 121.76 119.72 1x2p s ALA 17 Ca 0.22 -1.24 -0.33 0.00 0.00 0.00 0.00 51.96 50.61 1x2p s ALA 17 Cb -0.03 -1.33 -0.10 0.00 0.00 0.00 0.00 23.12 21.65 1x2p s ALA 17 CO 0.09 -0.97 2.06 0.00 0.00 0.00 0.00 175.76 176.94 1x2p n ALA 18 N 4.69 1.13 0.25 0.00 0.00 -1.26 -4.79 120.51 120.52 1x2p n ALA 18 Ca -0.13 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1x2p n ALA 18 Cb 0.46 -2.61 0.19 0.00 0.00 0.00 0.00 19.45 17.49 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 6.40 0.52 -4.58 0.00 -2.24 -1.26 -4.96 114.28 108.16 1x2p n THR 19 Ca 0.30 -0.76 -0.28 0.00 -2.27 0.00 0.00 64.05 61.05 1x2p n THR 19 Cb 0.30 0.95 -0.08 0.00 -2.10 0.00 0.00 70.33 69.41 1x2p n THR 19 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1x2p s ASP 20 N -1.36 3.16 0.00 3.42 2.15 -1.26 -5.04 116.67 117.74 1x2p s ASP 20 Ca 0.35 -1.70 0.23 0.00 0.43 0.00 0.00 52.55 51.86 1x2p s ASP 20 Cb 0.20 0.56 0.44 0.00 -0.30 0.00 0.00 42.92 43.82 1x2p s ASP 20 CO 0.28 -0.94 1.40 -1.84 -0.17 0.00 0.00 175.17 173.90 1x2p n GLU 21 N -1.02 2.51 -2.60 4.34 0.28 -1.26 -4.34 120.64 118.55 1x2p n GLU 21 Ca -0.09 -2.32 -0.14 0.00 -0.16 0.00 0.00 57.16 54.45 1x2p n GLU 21 Cb 0.65 -1.51 0.02 0.00 1.43 0.00 0.00 31.44 32.04 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 1.48 1.44 -4.06 3.84 -2.24 -1.26 -5.08 114.28 108.40 1x2p n THR 22 Ca 0.20 -3.60 -0.10 0.00 -2.27 0.00 0.00 64.05 58.27 1x2p n THR 22 Cb 0.60 0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.87 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 -3.30 1.19 0.02 -0.78 -0.21 -1.26 -3.48 119.66 111.86 1x2p s GLN 23 Ca 0.34 -1.35 0.06 0.00 0.02 0.00 0.00 55.36 54.43 1x2p s GLN 23 Cb 0.43 0.34 -0.03 0.00 1.00 0.00 0.00 33.01 34.75 1x2p s GLN 23 CO -0.03 -0.42 -0.15 -0.51 -2.12 0.00 0.00 175.29 172.06 1x2p s LEU 24 N -3.04 2.75 -0.15 2.90 1.43 -0.90 -4.73 118.68 116.94 1x2p s LEU 24 Ca 0.25 -0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 1x2p s LEU 24 Cb 0.04 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 1x2p s LEU 24 CO 0.05 0.27 -0.09 -0.94 0.23 0.00 0.00 176.35 175.86 1x2p s SER 25 N -1.37 4.29 0.34 2.29 1.04 -1.26 -4.55 113.70 114.48 1x2p s SER 25 Ca 0.15 -0.27 0.08 0.00 0.48 0.00 0.00 55.95 56.39 1x2p s SER 25 Cb -0.11 -1.68 -0.03 0.00 0.10 0.00 0.00 66.02 64.31 1x2p s SER 25 CO 0.05 0.15 0.28 0.72 0.98 0.00 0.00 173.24 175.42 1x2p s PHE 26 N 0.44 1.79 0.05 5.02 -0.12 -1.25 -5.02 117.98 118.89 1x2p s PHE 26 Ca -0.07 -1.66 0.08 0.00 -0.05 0.00 0.00 56.93 55.22 1x2p s PHE 26 Cb -0.15 -0.75 -0.03 0.00 -0.63 0.00 0.00 43.02 41.46 1x2p s PHE 26 CO 0.04 -0.85 -0.21 -1.17 -0.05 0.00 0.00 175.22 172.97 1x2p s LEU 27 N -3.40 2.17 -0.43 -1.99 2.96 -1.26 -2.63 118.68 114.10 1x2p s LEU 27 Ca 0.40 -0.53 -0.42 0.00 -0.22 0.00 0.00 54.13 53.36 1x2p s LEU 27 Cb 0.02 -1.00 -0.17 0.00 0.50 0.00 0.00 46.19 45.54 1x2p s LEU 27 CO 0.28 0.17 2.00 -1.14 -1.32 0.00 0.00 176.35 176.34 1x2p n ARG 28 N 1.82 0.41 0.00 1.98 0.63 -1.26 0.11 116.66 120.35 1x2p n ARG 28 Ca -0.17 0.13 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 1x2p n ARG 28 Cb 0.53 -1.81 0.00 0.00 0.45 0.00 0.00 32.46 31.64 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 6.21 1.14 3.60 5.14 0.00 -0.76 -4.91 105.19 115.61 1x2p n GLY 29 Ca 0.44 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.04 1.33 -2.38 1.61 1.02 0.30 -4.58 120.64 117.89 1x2p n GLU 30 Ca 0.00 0.48 -0.41 0.00 -0.02 0.00 0.00 57.16 57.21 1x2p n GLU 30 Cb 0.00 -2.13 -0.03 0.00 -0.02 0.00 0.00 31.44 29.26 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 0.45 3.11 0.01 3.49 -0.14 -1.26 -3.08 119.74 122.32 1x2p s LYS 31 Ca 0.82 0.20 -0.14 0.00 -1.36 0.00 0.00 55.97 55.48 1x2p s LYS 31 Cb -0.89 -4.20 -0.06 0.00 -1.68 0.00 0.00 37.83 31.00 1x2p s LYS 31 CO 0.46 -2.20 0.41 0.42 -0.76 0.00 0.00 175.35 173.68 1x2p s ILE 32 N 6.57 5.03 -0.24 2.17 -1.09 0.49 -4.85 121.20 129.28 1x2p s ILE 32 Ca 0.48 0.82 -0.08 0.00 -2.23 0.00 0.00 60.65 59.65 1x2p s ILE 32 Cb -0.10 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 37.04 1x2p s ILE 32 CO 0.20 0.56 0.08 -0.22 -1.23 0.00 0.00 174.94 174.32 1x2p s LEU 33 N -1.14 3.54 -0.48 2.97 1.98 -1.26 0.12 118.68 124.40 1x2p s LEU 33 Ca 0.25 -0.15 -0.17 0.00 -2.89 0.00 0.00 54.13 51.17 1x2p s LEU 33 Cb -0.17 -1.94 0.07 0.00 0.66 0.00 0.00 46.19 44.81 1x2p s LEU 33 CO 0.14 -0.00 0.46 -0.63 -1.89 0.00 0.00 176.35 174.43 1x2p s ILE 34 N 1.44 5.13 -0.01 6.68 -1.09 -0.80 -2.70 121.20 129.84 1x2p s ILE 34 Ca 0.06 -0.87 -0.01 0.00 -2.23 0.00 0.00 60.65 57.59 1x2p s ILE 34 Cb -0.15 -4.17 -0.01 0.00 -1.58 0.00 0.00 42.46 36.55 1x2p s ILE 34 CO 0.04 -0.64 0.25 -0.07 -1.23 0.00 0.00 174.94 173.29 1x2p h LEU 35 N 9.04 -0.04 -9.35 2.97 -0.00 -1.17 -3.15 115.31 113.61 1x2p h LEU 35 Ca -0.28 0.00 -0.55 0.00 -0.00 0.00 0.00 57.88 57.05 1x2p h LEU 35 Cb 1.11 0.01 -0.14 0.00 -0.00 0.00 0.00 40.66 41.64 1x2p h LEU 35 CO 0.90 0.03 -0.64 -0.13 -0.00 0.00 0.00 178.44 178.60 1x2p s ARG 36 N -1.63 1.73 -0.20 1.13 1.81 -1.08 -4.93 118.95 115.78 1x2p s ARG 36 Ca -0.01 -1.93 0.18 0.00 -1.72 0.00 0.00 55.73 52.26 1x2p s ARG 36 Cb 0.00 -1.33 -0.25 0.00 -0.45 0.00 0.00 34.95 32.93 1x2p s ARG 36 CO 0.02 -0.01 0.07 1.04 -0.68 0.00 0.00 175.30 175.74 1x2p n GLN 37 N -0.74 0.69 0.00 3.54 6.02 -1.26 -1.10 117.38 124.52 1x2p n GLN 37 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 1x2p n GLN 37 Cb 0.65 -1.52 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 -2.76 0.00 0.00 5.09 -1.04 -1.26 -3.52 114.28 110.79 1x2p n THR 38 Ca -0.33 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 1x2p n THR 38 Cb 1.16 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.67 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 0.00 12.58 -2.24 -1.24 -5.09 114.28 118.30 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 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 67.84 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 -1.06 0.00 0.01 6.98 0.00 -1.23 -4.95 120.51 120.26 1x2p n ALA 40 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1x2p n ALA 40 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 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 0.35 -3.47 0.00 3.32 -1.90 -3.42 116.42 111.29 1x2p h ASP 41 Ca 0.00 -0.71 -0.65 0.00 0.02 0.00 0.00 57.03 55.70 1x2p h ASP 41 Cb 0.00 -0.11 -0.23 0.00 0.22 0.00 0.00 39.33 39.20 1x2p h ASP 41 CO 0.00 1.63 -0.66 0.26 -1.72 0.00 0.00 179.24 178.75 1x2p s TRP 42 N -2.58 3.04 0.29 4.55 0.52 -1.26 0.18 118.94 123.69 1x2p s TRP 42 Ca -0.16 -0.50 0.09 0.00 0.02 0.00 0.00 56.10 55.55 1x2p s TRP 42 Cb 0.07 -2.12 -0.04 0.00 -1.15 0.00 0.00 33.47 30.22 1x2p s TRP 42 CO 0.80 -0.30 0.04 -1.58 0.02 0.00 0.00 176.95 175.93 1x2p s TRP 43 N 1.19 2.69 -0.26 -1.98 0.52 0.50 -3.61 118.94 117.98 1x2p s TRP 43 Ca 0.03 -0.29 -0.04 0.00 0.02 0.00 0.00 56.10 55.82 1x2p s TRP 43 Cb -0.14 -1.35 0.01 0.00 -1.15 0.00 0.00 33.47 30.84 1x2p s TRP 43 CO 0.02 0.53 -0.00 -0.46 0.02 0.00 0.00 176.95 177.05 1x2p s TRP 44 N -2.37 3.09 0.12 -1.98 -0.11 -0.26 0.12 118.94 117.55 1x2p s TRP 44 Ca 0.33 -1.23 0.01 0.00 1.22 0.00 0.00 56.10 56.43 1x2p s TRP 44 Cb -0.05 -2.14 0.01 0.00 -1.50 0.00 0.00 33.47 29.79 1x2p s TRP 44 CO 0.21 -0.64 0.07 0.41 -4.62 0.00 0.00 176.95 172.37 1x2p n GLY 45 N 4.77 3.26 3.08 5.86 0.00 -0.58 -0.59 105.19 120.99 1x2p n GLY 45 Ca -0.16 -2.21 -0.12 0.00 0.00 0.00 0.00 46.02 43.53 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 0.20 0.31 1.61 2.12 -1.10 -3.23 118.70 116.12 1x2p s GLU 46 Ca 0.05 0.82 -0.00 0.00 0.36 0.00 0.00 54.97 56.20 1x2p s GLU 46 Cb -0.00 0.06 0.06 0.00 0.26 0.00 0.00 34.13 34.51 1x2p s GLU 46 CO 0.03 -0.27 0.42 0.54 -0.54 0.00 0.00 175.26 175.45 1x2p n ARG 47 N 5.30 0.32 -1.67 4.30 5.12 -0.21 -4.41 116.66 125.41 1x2p n ARG 47 Ca -0.08 -1.15 -0.38 0.00 -1.93 0.00 0.00 57.85 54.30 1x2p n ARG 47 Cb 0.50 -0.28 -0.03 0.00 -1.16 0.00 0.00 32.46 31.49 1x2p n ARG 47 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1x2p s ALA 48 N -2.92 2.04 0.00 7.54 0.00 -1.26 -1.64 121.76 125.52 1x2p s ALA 48 Ca 0.28 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1x2p s ALA 48 Cb -0.02 -4.26 0.00 0.00 0.00 0.00 0.00 23.12 18.85 1x2p s ALA 48 CO 0.19 -3.88 0.00 0.41 0.00 0.00 0.00 175.76 172.48 1x2p n GLY 49 N 5.87 0.08 3.63 0.00 0.00 -1.26 -4.93 105.19 108.56 1x2p n GLY 49 Ca 0.32 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.10 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 2.40 3.97 0.00 0.00 -1.20 -4.98 105.19 110.74 1x2p n GLY 52 Ca -0.05 -1.55 -0.23 0.00 0.00 0.00 0.00 46.02 44.19 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 -3.52 2.20 -0.12 1.61 2.02 -1.23 -1.53 117.35 116.78 1x2p s TYR 53 Ca 0.21 -0.06 -0.26 0.00 -0.37 0.00 0.00 57.07 56.58 1x2p s TYR 53 Cb -0.01 -2.99 0.06 0.00 -0.40 0.00 0.00 41.96 38.63 1x2p s TYR 53 CO 0.15 -1.43 0.63 0.96 -1.57 0.00 0.00 175.55 174.29 1x2p s ILE 54 N -3.06 0.01 0.69 2.71 -4.36 0.32 -2.13 121.20 115.38 1x2p s ILE 54 Ca 0.63 -0.05 -0.11 0.00 -0.26 0.00 0.00 60.65 60.85 1x2p s ILE 54 Cb -0.08 -0.92 0.00 0.00 1.25 0.00 0.00 42.46 42.72 1x2p s ILE 54 CO 0.43 -0.03 1.06 -2.16 0.24 0.00 0.00 174.94 174.48 1x2p s PRO 55 N -0.62 2.97 -1.01 0.37 0.04 -1.26 0.19 135.00 135.68 1x2p s PRO 55 Ca -0.07 0.96 -0.07 0.00 0.04 0.00 0.00 61.00 61.86 1x2p s PRO 55 Cb -0.02 -1.99 0.25 0.00 0.04 0.00 0.00 34.50 32.78 1x2p s PRO 55 CO 0.06 -1.07 0.96 0.00 0.04 0.00 0.00 177.00 176.99 1x2p s ALA 56 N -3.02 4.51 0.00 8.56 0.00 0.48 -4.30 121.76 127.99 1x2p s ALA 56 Ca 0.58 -3.78 0.00 0.00 0.00 0.00 0.00 51.96 48.76 1x2p s ALA 56 Cb -0.14 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1x2p s ALA 56 CO 0.54 -2.19 0.00 -1.71 0.00 0.00 0.00 175.76 172.40 1x2p n ASN 57 N 2.73 0.00 0.27 0.00 2.85 -1.26 -4.90 115.26 114.95 1x2p n ASN 57 Ca 0.22 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.79 1x2p n ASN 57 Cb 0.39 0.00 0.72 0.00 1.24 0.00 0.00 39.78 42.13 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 -2.94 1.20 3.86 -1.93 -3.42 115.15 111.91 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 -0.11 0.00 1.06 0.00 0.00 27.41 28.36 1x2p h HIS 58 CO 0.00 0.06 -0.65 0.14 0.86 0.00 0.00 177.93 178.34 1x2p s VAL 59 N -4.67 3.82 -1.78 2.45 -7.23 -1.26 0.19 120.40 111.91 1x2p s VAL 59 Ca -0.04 -1.33 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 1x2p s VAL 59 Cb 0.15 -2.91 0.00 0.00 0.56 0.00 0.00 36.38 34.19 1x2p s VAL 59 CO 0.62 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.95 1x2p n GLY 60 N -0.02 -0.66 3.77 2.32 0.00 -0.91 -4.84 105.19 104.85 1x2p n GLY 60 Ca -0.10 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 1x2p n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x2p s LYS 61 N -0.71 3.96 -0.90 1.61 -0.14 -1.26 -3.30 119.74 118.99 1x2p s LYS 61 Ca 0.00 -0.19 -0.15 0.00 -1.36 0.00 0.00 55.97 54.27 1x2p s LYS 61 Cb 0.00 -3.35 0.20 0.00 -1.68 0.00 0.00 37.83 33.00 1x2p s LYS 61 CO 0.00 0.45 0.93 -1.58 -0.76 0.00 0.00 175.35 174.38 1x2p s HIS 62 N -0.06 3.61 -0.23 3.18 5.65 -1.26 -5.01 115.29 121.18 1x2p s HIS 62 Ca 0.10 -1.89 -0.07 0.00 0.25 0.00 0.00 55.06 53.45 1x2p s HIS 62 Cb -0.11 -3.97 -0.03 0.00 -1.18 0.00 0.00 32.58 27.28 1x2p s HIS 62 CO -0.00 -1.15 0.07 0.45 -0.65 0.00 0.00 174.74 173.46 1x2p s SER 63 N 2.54 5.33 0.52 9.88 0.15 -1.26 -5.08 113.70 125.78 1x2p s SER 63 Ca 0.24 -0.10 -0.22 0.00 0.70 0.00 0.00 55.95 56.57 1x2p s SER 63 Cb -0.08 -1.94 -0.05 0.00 -1.71 0.00 0.00 66.02 62.23 1x2p s SER 63 CO -0.09 0.04 1.30 -0.83 1.20 0.00 0.00 173.24 174.86 1x2p s GLY 64 N 1.20 2.85 0.31 9.45 0.00 -1.26 -4.97 107.32 114.91 1x2p s GLY 64 Ca 0.05 1.22 -0.28 0.00 0.00 0.00 0.00 44.72 45.71 1x2p s GLY 64 CO 0.03 1.72 1.07 2.56 0.00 0.00 0.00 173.10 178.48 1x2p s PRO 65 N -2.86 4.51 0.09 2.90 0.04 -1.26 -4.32 135.00 134.09 1x2p s PRO 65 Ca 0.70 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1x2p s PRO 65 Cb -0.37 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.18 1x2p s PRO 65 CO 0.44 0.12 0.00 0.43 0.04 0.00 0.00 177.00 178.03 1x2p n SER 66 N 0.82 -8.97 0.00 6.66 7.64 -1.26 -4.23 113.62 114.27 1x2p n SER 66 Ca 0.01 1.69 0.00 0.00 1.01 0.00 0.00 58.87 61.57 1x2p n SER 66 Cb 0.46 -5.05 0.00 0.00 -1.01 0.00 0.00 64.21 58.62 1x2p n SER 66 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x2p n SER 67 N 1.91 0.00 0.00 6.43 7.64 -1.26 -5.26 113.62 123.08 1x2p n SER 67 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1x2p n SER 67 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1x2p n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64