#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 5.55 -0.34 1.61 1.04 -1.26 -5.04 113.70 115.26 1x2p s SER 2 Ca 0.00 -2.78 -0.14 0.00 0.48 0.00 0.00 55.95 53.50 1x2p s SER 2 Cb 0.00 -1.93 -0.01 0.00 0.10 0.00 0.00 66.02 64.18 1x2p s SER 2 CO 0.00 -0.42 0.32 -0.44 0.98 0.00 0.00 173.24 173.68 1x2p s SER 3 N 1.05 6.14 0.01 7.02 0.01 -1.26 -4.84 113.70 121.83 1x2p s SER 3 Ca 0.17 -0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.12 1x2p s SER 3 Cb -0.18 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 63.87 1x2p s SER 3 CO -0.04 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 173.91 1x2p n GLY 4 N 5.01 -3.63 3.88 3.44 0.00 -1.26 -4.83 105.19 107.80 1x2p n GLY 4 Ca -0.10 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.22 5.76 -0.53 1.61 0.01 -1.26 -4.54 113.70 114.54 1x2p s SER 5 Ca 0.00 1.24 -0.08 0.00 1.31 0.00 0.00 55.95 58.41 1x2p s SER 5 Cb 0.00 -2.14 0.01 0.00 0.21 0.00 0.00 66.02 64.10 1x2p s SER 5 CO 0.00 -1.15 0.60 -1.20 0.41 0.00 0.00 173.24 171.90 1x2p n SER 6 N -2.90 -7.46 -1.23 2.44 7.64 -1.26 -4.81 113.62 106.05 1x2p n SER 6 Ca 0.06 0.25 0.12 0.00 1.01 0.00 0.00 58.87 60.31 1x2p n SER 6 Cb 0.56 -5.05 -0.03 0.00 -1.01 0.00 0.00 64.21 58.68 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 -0.93 -1.54 3.27 0.23 0.00 -1.26 -4.78 105.19 100.17 1x2p n GLY 7 Ca 0.06 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.32 3.22 -0.48 1.61 2.02 -1.21 -4.82 118.70 117.72 1x2p s GLU 8 Ca 0.00 -0.75 -0.26 0.00 0.02 0.00 0.00 54.97 53.97 1x2p s GLU 8 Cb 0.00 -2.61 0.03 0.00 0.10 0.00 0.00 34.13 31.65 1x2p s GLU 8 CO 0.00 0.04 0.99 -1.21 0.02 0.00 0.00 175.26 175.10 1x2p s GLU 9 N 0.76 3.57 0.21 1.61 0.41 -1.26 -1.30 118.70 122.70 1x2p s GLU 9 Ca -0.06 0.24 0.09 0.00 -0.41 0.00 0.00 54.97 54.83 1x2p s GLU 9 Cb -0.15 -3.93 -0.04 0.00 -1.78 0.00 0.00 34.13 28.22 1x2p s GLU 9 CO 0.01 -1.30 -0.03 -0.06 -0.49 0.00 0.00 175.26 173.38 1x2p s PHE 10 N 4.00 2.72 -0.04 1.61 0.40 0.40 -4.82 117.98 122.24 1x2p s PHE 10 Ca 0.40 -0.20 0.06 0.00 -0.60 0.00 0.00 56.93 56.58 1x2p s PHE 10 Cb -0.09 -1.27 -0.02 0.00 0.51 0.00 0.00 43.02 42.14 1x2p s PHE 10 CO 0.27 0.56 -0.19 0.08 0.70 0.00 0.00 175.22 176.64 1x2p s VAL 11 N -1.96 2.62 -0.17 -0.44 1.01 -1.26 0.19 120.40 120.39 1x2p s VAL 11 Ca 0.28 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 61.07 1x2p s VAL 11 Cb -0.08 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1x2p s VAL 11 CO 0.18 0.58 1.45 0.00 0.00 0.00 0.00 175.10 177.32 1x2p s ALA 12 N -0.68 3.52 -0.62 5.51 0.00 -1.18 -1.38 121.76 126.92 1x2p s ALA 12 Ca 0.11 0.53 0.22 0.00 0.00 0.00 0.00 51.96 52.82 1x2p s ALA 12 Cb -0.10 -3.73 0.90 0.00 0.00 0.00 0.00 23.12 20.19 1x2p s ALA 12 CO -0.00 -1.50 1.67 0.44 0.00 0.00 0.00 175.76 176.38 1x2p n ILE 13 N 5.76 0.81 -3.63 0.00 -5.35 0.49 -1.56 119.36 115.88 1x2p n ILE 13 Ca 0.16 0.18 -0.09 0.00 -0.27 0.00 0.00 62.75 62.73 1x2p n ILE 13 Cb 0.45 -1.05 -0.07 0.00 -1.74 0.00 0.00 39.64 37.23 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 -3.22 -1.98 0.47 -1.28 0.00 -1.23 -4.93 121.76 109.59 1x2p s ALA 14 Ca 0.06 1.81 -0.24 0.00 0.00 0.00 0.00 51.96 53.58 1x2p s ALA 14 Cb 0.10 -1.32 -0.08 0.00 0.00 0.00 0.00 23.12 21.83 1x2p s ALA 14 CO 0.39 -0.24 1.38 -0.40 0.00 0.00 0.00 175.76 176.88 1x2p n ASP 15 N 1.89 2.97 -4.23 0.00 5.75 -1.26 -4.44 116.55 117.23 1x2p n ASP 15 Ca -0.12 1.07 -0.13 0.00 -0.01 0.00 0.00 54.79 55.60 1x2p n ASP 15 Cb 0.56 -1.57 -0.10 0.00 -1.03 0.00 0.00 41.12 38.98 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 -1.22 1.18 -0.23 2.11 5.04 -0.99 -4.91 117.35 118.33 1x2p s TYR 16 Ca 0.64 -0.89 -0.01 0.00 -2.44 0.00 0.00 57.07 54.37 1x2p s TYR 16 Cb -0.45 -0.65 0.07 0.00 0.35 0.00 0.00 41.96 41.28 1x2p s TYR 16 CO 0.55 -0.07 0.02 0.00 -1.34 0.00 0.00 175.55 174.71 1x2p s ALA 17 N -3.51 1.38 -0.06 3.97 0.00 -1.26 -3.84 121.76 118.44 1x2p s ALA 17 Ca 0.19 -1.08 -0.36 0.00 0.00 0.00 0.00 51.96 50.71 1x2p s ALA 17 Cb 0.05 -1.34 -0.13 0.00 0.00 0.00 0.00 23.12 21.69 1x2p s ALA 17 CO 0.01 -1.28 1.74 0.00 0.00 0.00 0.00 175.76 176.23 1x2p n ALA 18 N 4.90 0.58 0.15 0.00 0.00 -1.26 -4.83 120.51 120.04 1x2p n ALA 18 Ca -0.08 0.36 0.07 0.00 0.00 0.00 0.00 53.44 53.78 1x2p n ALA 18 Cb 0.45 -2.37 0.06 0.00 0.00 0.00 0.00 19.45 17.59 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 4.84 0.41 -4.85 0.00 2.02 -1.95 -3.47 112.91 109.91 1x2p h THR 19 Ca -0.47 -1.61 -0.53 0.00 0.77 0.00 0.00 66.41 64.57 1x2p h THR 19 Cb 1.28 2.11 -0.10 0.00 -1.74 0.00 0.00 68.15 69.70 1x2p h THR 19 CO 0.92 0.23 -0.38 0.47 0.37 0.00 0.00 175.52 177.13 1x2p n ASP 20 N -3.07 3.11 -1.66 4.18 8.00 -1.26 -5.03 116.55 120.83 1x2p n ASP 20 Ca 0.01 -2.77 0.07 0.00 0.71 0.00 0.00 54.79 52.81 1x2p n ASP 20 Cb 0.65 0.28 0.35 0.00 -0.02 0.00 0.00 41.12 42.39 1x2p n ASP 20 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1x2p n GLU 21 N -1.01 4.13 0.00 -1.24 0.28 -1.26 -3.84 120.64 117.70 1x2p n GLU 21 Ca -0.17 -2.77 0.01 0.00 -0.16 0.00 0.00 57.16 54.07 1x2p n GLU 21 Cb 0.51 -2.05 -0.00 0.00 1.43 0.00 0.00 31.44 31.33 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 0.77 0.00 -4.06 3.84 -2.24 -1.26 -5.03 114.28 106.30 1x2p n THR 22 Ca 0.25 -0.48 -0.22 0.00 -2.27 0.00 0.00 64.05 61.33 1x2p n THR 22 Cb 1.00 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 70.21 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 -0.70 3.12 -0.02 -0.78 -0.21 -1.25 0.17 119.66 119.99 1x2p s GLN 23 Ca 0.02 -0.93 0.00 0.00 0.02 0.00 0.00 55.36 54.47 1x2p s GLN 23 Cb 0.02 -2.69 -0.04 0.00 1.00 0.00 0.00 33.01 31.30 1x2p s GLN 23 CO 0.06 0.42 0.02 -0.51 -2.12 0.00 0.00 175.29 173.15 1x2p s LEU 24 N -3.86 3.62 -0.11 2.90 1.43 -0.75 -4.79 118.68 117.12 1x2p s LEU 24 Ca 0.33 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 1x2p s LEU 24 Cb -0.08 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 44.08 1x2p s LEU 24 CO 0.26 0.30 -0.11 -0.94 0.23 0.00 0.00 176.35 176.09 1x2p s SER 25 N -1.48 4.24 0.30 2.29 1.04 -1.26 -4.44 113.70 114.40 1x2p s SER 25 Ca 0.19 -0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.40 1x2p s SER 25 Cb -0.12 -1.45 -0.02 0.00 0.10 0.00 0.00 66.02 64.54 1x2p s SER 25 CO 0.10 0.22 0.34 0.72 0.98 0.00 0.00 173.24 175.60 1x2p s PHE 26 N 0.01 1.30 0.02 5.02 -0.12 -1.25 -5.03 117.98 117.93 1x2p s PHE 26 Ca -0.03 -1.41 0.09 0.00 -0.05 0.00 0.00 56.93 55.53 1x2p s PHE 26 Cb -0.14 -0.39 -0.03 0.00 -0.63 0.00 0.00 43.02 41.83 1x2p s PHE 26 CO 0.04 -0.93 -0.26 -1.17 -0.05 0.00 0.00 175.22 172.84 1x2p s LEU 27 N -3.26 2.13 -0.48 -1.99 2.96 -1.26 -2.33 118.68 114.45 1x2p s LEU 27 Ca 0.35 -0.54 -0.44 0.00 -0.22 0.00 0.00 54.13 53.29 1x2p s LEU 27 Cb 0.02 -1.31 -0.18 0.00 0.50 0.00 0.00 46.19 45.21 1x2p s LEU 27 CO 0.21 0.28 2.02 -1.14 -1.32 0.00 0.00 176.35 176.41 1x2p n ARG 28 N 2.04 0.13 0.00 1.98 0.63 -1.26 0.82 116.66 121.00 1x2p n ARG 28 Ca -0.17 0.04 0.00 0.00 -0.92 0.00 0.00 57.85 56.80 1x2p n ARG 28 Cb 0.52 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.83 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 6.62 2.52 3.49 5.14 0.00 -0.60 -4.90 105.19 117.46 1x2p n GLY 29 Ca 0.48 -0.87 -0.56 0.00 0.00 0.00 0.00 46.02 45.07 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 0.10 -2.43 1.61 -0.58 0.24 -4.45 120.64 115.13 1x2p n GLU 30 Ca 0.00 0.04 -0.41 0.00 -0.42 0.00 0.00 57.16 56.36 1x2p n GLU 30 Cb 0.00 -1.46 -0.03 0.00 -0.57 0.00 0.00 31.44 29.38 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 -0.15 3.22 0.12 3.49 3.01 -1.26 -3.11 119.74 125.06 1x2p s LYS 31 Ca 0.86 0.21 -0.05 0.00 -1.01 0.00 0.00 55.97 55.97 1x2p s LYS 31 Cb -1.18 -4.16 -0.05 0.00 -1.01 0.00 0.00 37.83 31.43 1x2p s LYS 31 CO 0.56 -2.06 0.35 0.42 0.51 0.00 0.00 175.35 175.13 1x2p s ILE 32 N 6.14 5.19 -0.17 2.17 -1.09 0.50 -4.88 121.20 129.06 1x2p s ILE 32 Ca 0.47 0.04 -0.01 0.00 -2.23 0.00 0.00 60.65 58.91 1x2p s ILE 32 Cb -0.10 -3.62 -0.01 0.00 -1.58 0.00 0.00 42.46 37.16 1x2p s ILE 32 CO 0.21 0.09 -0.11 -0.22 -1.23 0.00 0.00 174.94 173.68 1x2p s LEU 33 N -2.51 2.69 -0.51 2.97 1.98 -1.26 0.15 118.68 122.18 1x2p s LEU 33 Ca 0.39 -0.40 -0.16 0.00 -2.89 0.00 0.00 54.13 51.07 1x2p s LEU 33 Cb -0.12 -1.64 0.10 0.00 0.66 0.00 0.00 46.19 45.19 1x2p s LEU 33 CO 0.24 0.07 0.46 -0.63 -1.89 0.00 0.00 176.35 174.60 1x2p s ILE 34 N 0.90 5.21 -0.01 6.68 -1.09 -0.42 -2.72 121.20 129.76 1x2p s ILE 34 Ca -0.03 -1.29 -0.03 0.00 -2.23 0.00 0.00 60.65 57.08 1x2p s ILE 34 Cb -0.15 -4.24 -0.02 0.00 -1.58 0.00 0.00 42.46 36.47 1x2p s ILE 34 CO -0.00 -0.74 0.46 -0.07 -1.23 0.00 0.00 174.94 173.36 1x2p h LEU 35 N 8.85 -0.09 -9.44 2.97 -0.00 -1.19 -3.20 115.31 113.22 1x2p h LEU 35 Ca -0.29 0.00 -0.56 0.00 -0.00 0.00 0.00 57.88 57.03 1x2p h LEU 35 Cb 1.10 0.02 -0.13 0.00 -0.00 0.00 0.00 40.66 41.65 1x2p h LEU 35 CO 0.97 -0.01 -0.62 -0.13 -0.00 0.00 0.00 178.44 178.65 1x2p s ARG 36 N -2.11 1.80 -0.13 1.13 0.52 -1.10 -4.92 118.95 114.14 1x2p s ARG 36 Ca -0.01 -1.99 0.17 0.00 -0.52 0.00 0.00 55.73 53.38 1x2p s ARG 36 Cb 0.00 -1.35 -0.25 0.00 0.52 0.00 0.00 34.95 33.88 1x2p s ARG 36 CO 0.04 -0.06 0.29 1.04 0.02 0.00 0.00 175.30 176.63 1x2p n GLN 37 N -0.81 0.67 0.00 3.54 6.02 -1.26 -1.45 117.38 124.08 1x2p n GLN 37 Ca -0.04 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1x2p n GLN 37 Cb 0.66 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 30.33 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 -3.50 114.28 110.81 1x2p n THR 38 Ca -0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 1x2p n THR 38 Cb 1.05 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.56 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 -1.21 -5.09 114.28 118.32 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 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 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 -1.20 0.00 0.27 6.98 0.00 -1.23 -4.93 120.51 120.40 1x2p n ALA 40 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1x2p n ALA 40 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 1x2p n ALA 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1x2p n ASP 41 N 0.00 0.71 -3.91 0.00 8.00 -1.26 -4.54 116.55 115.55 1x2p n ASP 41 Ca 0.00 0.16 -0.25 0.00 0.71 0.00 0.00 54.79 55.41 1x2p n ASP 41 Cb 0.00 0.59 -0.17 0.00 -0.02 0.00 0.00 41.12 41.52 1x2p n ASP 41 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1x2p s TRP 42 N -3.31 1.28 0.32 1.24 0.52 -1.26 -1.59 118.94 116.14 1x2p s TRP 42 Ca 0.01 -0.56 0.09 0.00 0.02 0.00 0.00 56.10 55.66 1x2p s TRP 42 Cb 0.12 -1.07 -0.04 0.00 -1.15 0.00 0.00 33.47 31.32 1x2p s TRP 42 CO 0.79 -0.40 0.09 -1.58 0.02 0.00 0.00 176.95 175.86 1x2p s TRP 43 N 1.45 2.69 -0.27 -1.98 0.51 0.50 -3.33 118.94 118.52 1x2p s TRP 43 Ca -0.01 -0.34 -0.04 0.00 -2.12 0.00 0.00 56.10 53.60 1x2p s TRP 43 Cb -0.13 -1.50 0.02 0.00 -0.81 0.00 0.00 33.47 31.04 1x2p s TRP 43 CO -0.05 0.43 -0.01 -0.46 -0.51 0.00 0.00 176.95 176.36 1x2p s TRP 44 N -2.40 3.10 0.51 -1.98 -0.11 -0.53 0.14 118.94 117.66 1x2p s TRP 44 Ca 0.36 -1.35 0.03 0.00 1.22 0.00 0.00 56.10 56.36 1x2p s TRP 44 Cb -0.03 -2.13 0.03 0.00 -1.50 0.00 0.00 33.47 29.84 1x2p s TRP 44 CO 0.22 -0.67 0.26 0.41 -4.62 0.00 0.00 176.95 172.54 1x2p n GLY 45 N 4.74 3.03 2.70 5.86 0.00 -0.70 -0.60 105.19 120.23 1x2p n GLY 45 Ca -0.16 -2.32 -0.19 0.00 0.00 0.00 0.00 46.02 43.35 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 -4.02 -0.06 0.34 1.61 2.12 -1.10 -2.96 118.70 114.62 1x2p s GLU 46 Ca 0.20 0.40 -0.00 0.00 0.36 0.00 0.00 54.97 55.92 1x2p s GLU 46 Cb -0.02 -0.45 0.07 0.00 0.26 0.00 0.00 34.13 33.99 1x2p s GLU 46 CO 0.13 -0.31 0.46 0.54 -0.54 0.00 0.00 175.26 175.53 1x2p n ARG 47 N 5.22 0.27 -1.67 4.30 5.12 -0.08 -4.40 116.66 125.43 1x2p n ARG 47 Ca -0.05 -1.23 -0.38 0.00 -1.93 0.00 0.00 57.85 54.25 1x2p n ARG 47 Cb 0.50 -0.31 -0.03 0.00 -1.16 0.00 0.00 32.46 31.46 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 -2.97 2.03 0.00 7.54 0.00 -1.26 -1.66 121.76 125.43 1x2p s ALA 48 Ca 0.30 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.38 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 0.20 -3.89 0.00 0.41 0.00 0.00 0.00 175.76 172.48 1x2p n GLY 49 N 5.87 0.07 3.61 0.00 0.00 -1.26 -4.93 105.19 108.55 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 2.39 3.93 0.00 0.00 -1.16 -4.98 105.19 110.72 1x2p n GLY 52 Ca -0.05 -1.55 -0.25 0.00 0.00 0.00 0.00 46.02 44.17 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 -3.49 3.37 -0.00 1.61 2.02 0.13 -1.72 117.35 119.26 1x2p s TYR 53 Ca 0.21 0.45 -0.09 0.00 -0.37 0.00 0.00 57.07 57.27 1x2p s TYR 53 Cb -0.01 -2.28 0.01 0.00 -0.40 0.00 0.00 41.96 39.28 1x2p s TYR 53 CO 0.15 -0.30 0.18 0.96 -1.57 0.00 0.00 175.55 174.97 1x2p s ILE 54 N -2.61 0.08 0.60 2.71 -4.36 0.36 -1.80 121.20 116.18 1x2p s ILE 54 Ca 0.47 -0.62 -0.15 0.00 -0.26 0.00 0.00 60.65 60.09 1x2p s ILE 54 Cb -0.10 -0.47 -0.03 0.00 1.25 0.00 0.00 42.46 43.11 1x2p s ILE 54 CO 0.40 -0.34 1.05 -2.16 0.24 0.00 0.00 174.94 174.13 1x2p s PRO 55 N -1.33 3.31 -1.08 0.37 0.04 -1.26 0.19 135.00 135.23 1x2p s PRO 55 Ca -0.14 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 61.94 1x2p s PRO 55 Cb -0.07 -2.04 0.27 0.00 0.04 0.00 0.00 34.50 32.71 1x2p s PRO 55 CO 0.02 -0.81 1.07 0.00 0.04 0.00 0.00 177.00 177.32 1x2p s ALA 56 N -2.59 4.68 0.00 8.56 0.00 -0.62 -4.23 121.76 127.56 1x2p s ALA 56 Ca 0.62 -3.82 0.00 0.00 0.00 0.00 0.00 51.96 48.76 1x2p s ALA 56 Cb -0.15 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1x2p s ALA 56 CO 0.40 -2.20 0.00 -1.71 0.00 0.00 0.00 175.76 172.25 1x2p n ASN 57 N 2.75 0.00 0.34 0.00 5.15 -1.26 -4.87 115.26 117.36 1x2p n ASN 57 Ca 0.23 0.00 0.21 0.00 -0.60 0.00 0.00 54.58 54.42 1x2p n ASN 57 Cb 0.39 0.00 1.11 0.00 -0.53 0.00 0.00 39.78 40.75 1x2p n ASN 57 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 1x2p h HIS 58 N 0.00 0.00 -3.91 1.20 3.86 -1.93 -3.40 115.15 110.97 1x2p h HIS 58 Ca 0.00 0.00 -0.68 0.00 -1.16 0.00 0.00 60.37 58.53 1x2p h HIS 58 Cb 0.00 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 28.26 1x2p h HIS 58 CO 0.00 0.00 -0.79 0.14 0.86 0.00 0.00 177.93 178.14 1x2p s VAL 59 N -4.12 2.95 -0.30 2.45 -7.23 -1.26 0.18 120.40 113.07 1x2p s VAL 59 Ca -0.05 -1.09 -0.11 0.00 -1.81 0.00 0.00 61.98 58.92 1x2p s VAL 59 Cb 0.12 -2.25 0.18 0.00 0.56 0.00 0.00 36.38 34.98 1x2p s VAL 59 CO 0.37 0.36 0.96 -0.83 -0.31 0.00 0.00 175.10 175.64 1x2p s GLY 60 N -1.41 -0.43 -0.42 2.32 0.00 -0.48 -4.85 107.32 102.05 1x2p s GLY 60 Ca 0.15 2.66 0.01 0.00 0.00 0.00 0.00 44.72 47.54 1x2p s GLY 60 CO 0.06 3.62 0.17 0.54 0.00 0.00 0.00 173.10 177.49 1x2p s LYS 61 N 2.84 1.85 -0.24 2.90 -0.14 -1.26 -4.35 119.74 121.34 1x2p s LYS 61 Ca 0.03 -2.01 0.01 0.00 -1.36 0.00 0.00 55.97 52.64 1x2p s LYS 61 Cb -0.10 -3.42 0.04 0.00 -1.68 0.00 0.00 37.83 32.67 1x2p s LYS 61 CO -0.14 -1.03 -0.12 -1.01 -0.76 0.00 0.00 175.35 172.28 1x2p s HIS 62 N 0.76 3.09 -0.65 3.18 3.76 -1.26 -5.03 115.29 119.13 1x2p s HIS 62 Ca 0.11 -1.95 -0.26 0.00 -0.15 0.00 0.00 55.06 52.81 1x2p s HIS 62 Cb -0.21 -1.96 -0.12 0.00 1.11 0.00 0.00 32.58 31.40 1x2p s HIS 62 CO -0.05 -0.83 2.43 0.45 -0.85 0.00 0.00 174.74 175.89 1x2p n SER 63 N 4.54 1.86 -3.47 1.40 2.88 -1.26 -4.83 113.62 114.75 1x2p n SER 63 Ca -0.16 -0.85 -0.13 0.00 -1.33 0.00 0.00 58.87 56.40 1x2p n SER 63 Cb 0.45 -1.54 -0.03 0.00 -0.75 0.00 0.00 64.21 62.34 1x2p n SER 63 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x2p s GLY 64 N 11.11 -0.56 -0.29 0.46 0.00 -1.26 -5.13 107.32 111.65 1x2p s GLY 64 Ca 1.00 0.89 -0.29 0.00 0.00 0.00 0.00 44.72 46.31 1x2p s GLY 64 CO 0.22 0.45 1.34 2.56 0.00 0.00 0.00 173.10 177.66 1x2p s PRO 65 N -2.83 3.91 0.08 2.90 0.04 -1.26 -4.65 135.00 133.18 1x2p s PRO 65 Ca -0.01 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1x2p s PRO 65 Cb -0.01 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.64 1x2p s PRO 65 CO -0.06 -1.13 0.00 0.43 0.04 0.00 0.00 177.00 176.28 1x2p n SER 66 N 7.70 -0.53 -4.56 6.66 7.64 -1.26 -5.03 113.62 124.25 1x2p n SER 66 Ca 0.15 0.14 -0.33 0.00 1.01 0.00 0.00 58.87 59.85 1x2p n SER 66 Cb 0.46 0.76 -0.04 0.00 -1.01 0.00 0.00 64.21 64.39 1x2p n SER 66 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x2p s SER 67 N -2.25 5.71 0.00 6.43 1.04 -1.26 -5.34 113.70 118.03 1x2p s SER 67 Ca 0.00 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.43 1x2p s SER 67 Cb 0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1x2p s SER 67 CO 0.00 -2.23 0.00 0.61 0.98 0.00 0.00 173.24 172.60