#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 6.56 -0.26 1.61 1.04 -1.26 -5.06 113.70 116.33 1x2p s SER 2 Ca 0.00 0.85 -0.13 0.00 0.48 0.00 0.00 55.95 57.16 1x2p s SER 2 Cb 0.00 -2.20 -0.04 0.00 0.10 0.00 0.00 66.02 63.88 1x2p s SER 2 CO 0.00 -0.12 0.27 -0.55 0.98 0.00 0.00 173.24 173.82 1x2p s SER 3 N -2.64 6.16 0.00 7.02 0.15 -1.26 -4.86 113.70 118.27 1x2p s SER 3 Ca 0.46 0.17 0.00 0.00 0.70 0.00 0.00 55.95 57.28 1x2p s SER 3 Cb -0.11 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.04 1x2p s SER 3 CO 0.24 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 175.22 1x2p n GLY 4 N 4.67 1.69 3.55 9.45 0.00 -1.26 -5.13 105.19 118.16 1x2p n GLY 4 Ca -0.12 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 1x2p n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x2p s SER 5 N 0.00 4.32 -0.29 1.61 0.15 -1.26 -5.10 113.70 113.14 1x2p s SER 5 Ca 0.00 -0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.41 1x2p s SER 5 Cb 0.00 -0.89 0.19 0.00 -1.71 0.00 0.00 66.02 63.61 1x2p s SER 5 CO 0.00 0.26 0.55 -0.55 1.20 0.00 0.00 173.24 174.70 1x2p s SER 6 N -1.56 -1.18 0.00 5.45 0.15 -1.26 -5.15 113.70 110.15 1x2p s SER 6 Ca 0.17 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.08 1x2p s SER 6 Cb -0.11 1.88 0.00 0.00 -1.71 0.00 0.00 66.02 66.08 1x2p s SER 6 CO 0.08 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1x2p n GLY 7 N 5.41 1.56 3.14 9.45 0.00 -1.26 -4.87 105.19 118.62 1x2p n GLY 7 Ca 0.03 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.00 2.96 -0.19 1.61 2.02 -1.14 -4.91 118.70 117.07 1x2p s GLU 8 Ca 0.00 -0.83 -0.26 0.00 0.02 0.00 0.00 54.97 53.90 1x2p s GLU 8 Cb 0.00 -2.48 -0.01 0.00 0.10 0.00 0.00 34.13 31.74 1x2p s GLU 8 CO 0.00 -0.13 0.88 -1.21 0.02 0.00 0.00 175.26 174.83 1x2p s GLU 9 N 1.09 4.28 0.25 1.61 2.02 -1.26 0.18 118.70 126.88 1x2p s GLU 9 Ca -0.00 1.10 0.03 0.00 0.02 0.00 0.00 54.97 56.11 1x2p s GLU 9 Cb -0.14 -3.59 -0.05 0.00 0.10 0.00 0.00 34.13 30.44 1x2p s GLU 9 CO -0.08 -0.41 0.04 -0.06 0.02 0.00 0.00 175.26 174.77 1x2p s PHE 10 N 2.42 1.59 -0.03 1.61 0.40 0.33 -4.95 117.98 119.36 1x2p s PHE 10 Ca 0.40 -1.01 0.06 0.00 -0.60 0.00 0.00 56.93 55.77 1x2p s PHE 10 Cb -0.16 -0.95 -0.01 0.00 0.51 0.00 0.00 43.02 42.41 1x2p s PHE 10 CO 0.11 -0.13 -0.20 0.08 0.70 0.00 0.00 175.22 175.78 1x2p s VAL 11 N -3.52 1.60 -0.16 -0.44 1.01 -1.26 0.11 120.40 117.74 1x2p s VAL 11 Ca 0.32 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.16 1x2p s VAL 11 Cb 0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 1x2p s VAL 11 CO 0.11 0.45 1.41 0.00 0.00 0.00 0.00 175.10 177.07 1x2p s ALA 12 N -0.31 3.57 -0.46 5.51 0.00 -1.15 -2.03 121.76 126.89 1x2p s ALA 12 Ca 0.04 0.54 0.24 0.00 0.00 0.00 0.00 51.96 52.78 1x2p s ALA 12 Cb -0.09 -3.70 1.00 0.00 0.00 0.00 0.00 23.12 20.32 1x2p s ALA 12 CO 0.00 -1.39 1.73 0.44 0.00 0.00 0.00 175.76 176.54 1x2p n ILE 13 N 5.62 0.81 -3.64 0.00 -5.35 0.33 -0.91 119.36 116.23 1x2p n ILE 13 Ca 0.15 0.22 -0.10 0.00 -0.27 0.00 0.00 62.75 62.75 1x2p n ILE 13 Cb 0.45 -1.16 -0.07 0.00 -1.74 0.00 0.00 39.64 37.12 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 -1.92 0.36 -1.28 0.00 -1.23 -4.94 121.76 109.42 1x2p s ALA 14 Ca 0.04 1.95 -0.27 0.00 0.00 0.00 0.00 51.96 53.68 1x2p s ALA 14 Cb 0.09 -1.37 -0.12 0.00 0.00 0.00 0.00 23.12 21.73 1x2p s ALA 14 CO 0.40 -0.28 1.25 -0.40 0.00 0.00 0.00 175.76 176.74 1x2p n ASP 15 N 2.48 2.55 -4.21 0.00 5.75 -1.26 -4.42 116.55 117.44 1x2p n ASP 15 Ca -0.13 1.18 -0.14 0.00 -0.01 0.00 0.00 54.79 55.68 1x2p n ASP 15 Cb 0.56 -1.47 -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 1.16 -0.16 2.11 5.04 -0.75 -4.88 117.35 118.74 1x2p s TYR 16 Ca 0.57 -0.71 -0.01 0.00 -2.44 0.00 0.00 57.07 54.47 1x2p s TYR 16 Cb -0.56 -0.61 0.05 0.00 0.35 0.00 0.00 41.96 41.18 1x2p s TYR 16 CO 0.61 0.03 -0.01 0.00 -1.34 0.00 0.00 175.55 174.84 1x2p s ALA 17 N -2.89 1.18 -0.15 3.97 0.00 -1.26 -3.39 121.76 119.21 1x2p s ALA 17 Ca 0.11 -0.67 -0.36 0.00 0.00 0.00 0.00 51.96 51.04 1x2p s ALA 17 Cb -0.00 -1.08 -0.13 0.00 0.00 0.00 0.00 23.12 21.91 1x2p s ALA 17 CO 0.00 -0.88 1.86 0.00 0.00 0.00 0.00 175.76 176.73 1x2p n ALA 18 N 4.98 0.58 0.55 0.00 0.00 -1.26 -4.81 120.51 120.55 1x2p n ALA 18 Ca -0.10 0.30 0.13 0.00 0.00 0.00 0.00 53.44 53.77 1x2p n ALA 18 Cb 0.48 -2.43 0.35 0.00 0.00 0.00 0.00 19.45 17.85 1x2p n ALA 18 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1x2p h THR 19 N 5.46 0.00 -2.28 0.00 1.35 -1.95 -3.46 112.91 112.03 1x2p h THR 19 Ca -0.48 -0.57 -0.59 0.00 -0.55 0.00 0.00 66.41 64.23 1x2p h THR 19 Cb 1.29 1.54 -0.13 0.00 -1.73 0.00 0.00 68.15 69.11 1x2p h THR 19 CO 0.96 0.00 -0.51 -1.81 -0.25 0.00 0.00 175.52 173.91 1x2p s ASP 20 N -4.80 3.04 -0.13 5.36 1.01 -1.26 -5.03 116.67 114.87 1x2p s ASP 20 Ca 0.10 -1.70 0.12 0.00 0.71 0.00 0.00 52.55 51.78 1x2p s ASP 20 Cb 0.11 0.55 0.56 0.00 1.01 0.00 0.00 42.92 45.15 1x2p s ASP 20 CO 0.62 -0.94 1.39 -1.84 0.21 0.00 0.00 175.17 174.61 1x2p n GLU 21 N -0.98 3.40 -0.64 8.23 0.28 -1.26 -3.85 120.64 125.82 1x2p n GLU 21 Ca -0.08 -2.17 0.06 0.00 -0.16 0.00 0.00 57.16 54.81 1x2p n GLU 21 Cb 0.65 -1.89 0.15 0.00 1.43 0.00 0.00 31.44 31.78 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 0.61 1.58 -4.31 3.84 -2.24 -1.26 -5.05 114.28 107.45 1x2p n THR 22 Ca 0.19 -2.39 -0.16 0.00 -2.27 0.00 0.00 64.05 59.42 1x2p n THR 22 Cb 0.81 0.04 -0.10 0.00 -2.10 0.00 0.00 70.33 68.97 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 -2.34 1.37 -0.06 -0.78 -0.21 -1.25 -3.07 119.66 113.32 1x2p s GLN 23 Ca 0.33 -1.73 0.02 0.00 0.02 0.00 0.00 55.36 54.00 1x2p s GLN 23 Cb 0.33 -0.27 -0.03 0.00 1.00 0.00 0.00 33.01 34.04 1x2p s GLN 23 CO -0.06 -0.27 -0.12 -0.51 -2.12 0.00 0.00 175.29 172.21 1x2p s LEU 24 N -3.29 2.88 -0.15 2.90 1.43 -0.94 -4.78 118.68 116.73 1x2p s LEU 24 Ca 0.36 -0.14 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1x2p s LEU 24 Cb 0.08 -1.60 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 1x2p s LEU 24 CO 0.12 0.34 -0.06 -0.44 0.23 0.00 0.00 176.35 176.54 1x2p s SER 25 N -0.69 4.61 0.26 2.29 0.01 -1.26 -4.40 113.70 114.51 1x2p s SER 25 Ca 0.10 -0.17 0.01 0.00 1.31 0.00 0.00 55.95 57.20 1x2p s SER 25 Cb -0.11 -1.72 -0.03 0.00 0.21 0.00 0.00 66.02 64.37 1x2p s SER 25 CO 0.01 0.18 0.22 0.72 0.41 0.00 0.00 173.24 174.78 1x2p s PHE 26 N 0.31 1.31 0.00 2.43 -0.12 -1.22 -5.01 117.98 115.69 1x2p s PHE 26 Ca -0.05 -1.44 0.07 0.00 -0.05 0.00 0.00 56.93 55.46 1x2p s PHE 26 Cb -0.14 -0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 41.68 1x2p s PHE 26 CO 0.04 -0.77 -0.21 -1.17 -0.05 0.00 0.00 175.22 173.06 1x2p s LEU 27 N -3.23 2.39 -0.32 -1.99 2.96 -1.26 -1.81 118.68 115.42 1x2p s LEU 27 Ca 0.38 -0.41 -0.42 0.00 -0.22 0.00 0.00 54.13 53.46 1x2p s LEU 27 Cb 0.05 -1.43 -0.19 0.00 0.50 0.00 0.00 46.19 45.11 1x2p s LEU 27 CO 0.18 0.30 1.35 -1.14 -1.32 0.00 0.00 176.35 175.72 1x2p n ARG 28 N 2.05 0.00 0.00 1.98 0.63 -1.26 0.11 116.66 120.17 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 0.52 -1.42 0.00 0.00 0.45 0.00 0.00 32.46 32.01 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 3.03 2.72 3.53 5.14 0.00 -0.09 -4.89 105.19 114.63 1x2p n GLY 29 Ca 0.26 -0.32 -0.53 0.00 0.00 0.00 0.00 46.02 45.43 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 0.54 -2.40 1.61 1.02 0.29 -4.44 120.64 117.26 1x2p n GLU 30 Ca 0.00 0.19 -0.40 0.00 -0.02 0.00 0.00 57.16 56.93 1x2p n GLU 30 Cb 0.00 -1.66 -0.03 0.00 -0.02 0.00 0.00 31.44 29.73 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 -0.13 3.03 -0.08 3.49 3.01 -1.26 -2.91 119.74 124.88 1x2p s LYS 31 Ca 0.81 0.00 -0.15 0.00 -1.01 0.00 0.00 55.97 55.63 1x2p s LYS 31 Cb -1.05 -4.25 -0.05 0.00 -1.01 0.00 0.00 37.83 31.47 1x2p s LYS 31 CO 0.53 -2.32 0.38 0.42 0.51 0.00 0.00 175.35 174.87 1x2p s ILE 32 N 6.72 5.17 -0.30 2.17 -1.09 0.29 -4.85 121.20 129.31 1x2p s ILE 32 Ca 0.44 0.76 -0.14 0.00 -2.23 0.00 0.00 60.65 59.48 1x2p s ILE 32 Cb -0.09 -3.70 -0.03 0.00 -1.58 0.00 0.00 42.46 37.06 1x2p s ILE 32 CO 0.16 0.46 0.32 -0.22 -1.23 0.00 0.00 174.94 174.44 1x2p s LEU 33 N -0.22 4.22 -1.20 2.97 1.98 -1.26 0.12 118.68 125.29 1x2p s LEU 33 Ca 0.22 -0.02 -0.12 0.00 -2.89 0.00 0.00 54.13 51.32 1x2p s LEU 33 Cb -0.15 -2.31 0.20 0.00 0.66 0.00 0.00 46.19 44.58 1x2p s LEU 33 CO 0.10 -0.22 1.43 -0.38 -1.89 0.00 0.00 176.35 175.39 1x2p n ILE 34 N 5.15 4.36 -0.02 6.68 2.08 0.49 -1.88 119.36 136.23 1x2p n ILE 34 Ca -0.10 -4.85 -0.02 0.00 0.56 0.00 0.00 62.75 58.33 1x2p n ILE 34 Cb 0.50 -2.46 -0.02 0.00 -0.75 0.00 0.00 39.64 36.92 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 8.77 -0.32 -8.69 1.39 4.07 -1.40 -3.00 115.31 116.13 1x2p h LEU 35 Ca 0.30 0.04 -0.37 0.00 0.08 0.00 0.00 57.88 57.93 1x2p h LEU 35 Cb 0.83 0.13 -0.15 0.00 1.08 0.00 0.00 40.66 42.55 1x2p h LEU 35 CO 1.25 -0.07 -0.73 -0.13 -1.08 0.00 0.00 178.44 177.69 1x2p s ARG 36 N -3.44 1.11 -0.22 1.13 0.52 -0.76 -4.66 118.95 112.63 1x2p s ARG 36 Ca -0.02 -1.43 -0.19 0.00 -0.52 0.00 0.00 55.73 53.56 1x2p s ARG 36 Cb 0.01 -0.79 -0.17 0.00 0.52 0.00 0.00 34.95 34.53 1x2p s ARG 36 CO 0.10 0.12 0.04 1.04 0.02 0.00 0.00 175.30 176.63 1x2p n GLN 37 N -0.07 0.57 0.00 3.54 6.02 -1.26 0.34 117.38 126.52 1x2p n GLN 37 Ca -0.11 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 1x2p n GLN 37 Cb 0.60 -1.68 0.00 0.00 1.02 0.00 0.00 30.24 30.18 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 -4.39 0.00 -4.37 5.09 -1.04 -1.26 -3.91 114.28 104.39 1x2p n THR 38 Ca -0.37 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.45 1x2p n THR 38 Cb 0.72 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 69.13 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 1.56 -1.94 12.58 -4.23 -1.07 -5.02 115.64 117.52 1x2p s THR 39 Ca 0.00 -2.14 0.09 0.00 -1.18 0.00 0.00 61.69 58.46 1x2p s THR 39 Cb 0.00 -2.24 0.28 0.00 1.34 0.00 0.00 72.50 71.88 1x2p s THR 39 CO 0.00 -0.45 1.22 0.00 -0.54 0.00 0.00 174.62 174.85 1x2p n ALA 40 N -0.45 2.48 0.00 3.99 0.00 -1.26 -3.81 120.51 121.46 1x2p n ALA 40 Ca -0.07 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1x2p n ALA 40 Cb 0.62 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.09 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 0.40 2.93 -4.21 0.00 8.00 -1.26 -4.84 116.55 117.56 1x2p n ASP 41 Ca 0.10 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.30 1x2p n ASP 41 Cb 0.28 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.94 2.35 0.28 1.24 0.52 -1.25 -1.21 118.94 118.92 1x2p s TRP 42 Ca 0.00 -0.83 0.10 0.00 0.02 0.00 0.00 56.10 55.39 1x2p s TRP 42 Cb 0.00 -1.56 -0.04 0.00 -1.15 0.00 0.00 33.47 30.71 1x2p s TRP 42 CO 0.00 -0.31 -0.02 -1.58 0.02 0.00 0.00 176.95 175.06 1x2p s TRP 43 N 0.14 2.64 -0.36 -1.98 0.52 0.50 -2.59 118.94 117.81 1x2p s TRP 43 Ca -0.11 -0.26 -0.08 0.00 0.02 0.00 0.00 56.10 55.67 1x2p s TRP 43 Cb -0.16 -1.21 0.04 0.00 -1.15 0.00 0.00 33.47 31.00 1x2p s TRP 43 CO 0.06 0.61 0.16 -0.46 0.02 0.00 0.00 176.95 177.34 1x2p s TRP 44 N -2.36 3.27 0.41 -1.98 -0.11 0.15 0.12 118.94 118.44 1x2p s TRP 44 Ca 0.32 -1.32 0.08 0.00 1.22 0.00 0.00 56.10 56.40 1x2p s TRP 44 Cb -0.06 -2.43 -0.02 0.00 -1.50 0.00 0.00 33.47 29.46 1x2p s TRP 44 CO 0.19 -0.72 0.35 0.20 -4.62 0.00 0.00 176.95 172.35 1x2p s GLY 45 N 1.54 2.14 -0.07 5.86 0.00 -0.56 -1.16 107.32 115.08 1x2p s GLY 45 Ca 0.00 -1.90 -0.01 0.00 0.00 0.00 0.00 44.72 42.81 1x2p s GLY 45 CO 0.04 -1.71 0.00 1.85 0.00 0.00 0.00 173.10 173.28 1x2p s GLU 46 N -4.10 0.56 0.23 2.90 2.12 -0.79 -2.44 118.70 117.19 1x2p s GLU 46 Ca 0.47 0.12 -0.01 0.00 0.36 0.00 0.00 54.97 55.91 1x2p s GLU 46 Cb -0.03 -0.92 0.05 0.00 0.26 0.00 0.00 34.13 33.49 1x2p s GLU 46 CO 0.27 -0.29 0.31 0.54 -0.54 0.00 0.00 175.26 175.55 1x2p n ARG 47 N 5.09 0.31 -1.74 4.30 5.12 -0.53 -4.23 116.66 124.98 1x2p n ARG 47 Ca -0.08 -0.79 -0.39 0.00 -1.93 0.00 0.00 57.85 54.66 1x2p n ARG 47 Cb 0.50 -0.22 -0.03 0.00 -1.16 0.00 0.00 32.46 31.55 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 -3.01 2.15 0.00 7.54 0.00 -1.26 -1.82 121.76 125.36 1x2p s ALA 48 Ca 0.20 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1x2p s ALA 48 Cb -0.01 -4.23 0.00 0.00 0.00 0.00 0.00 23.12 18.88 1x2p s ALA 48 CO 0.14 -3.74 0.00 0.41 0.00 0.00 0.00 175.76 172.57 1x2p n GLY 49 N 5.80 0.07 3.64 0.00 0.00 -1.26 -4.93 105.19 108.51 1x2p n GLY 49 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.08 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 3.96 0.00 0.00 -1.02 -4.98 105.19 110.88 1x2p n GLY 52 Ca -0.05 -1.55 -0.22 0.00 0.00 0.00 0.00 46.02 44.20 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 3.31 -0.00 1.61 2.02 -1.18 -1.49 117.35 118.13 1x2p s TYR 53 Ca 0.21 0.18 -0.10 0.00 -0.37 0.00 0.00 57.07 56.99 1x2p s TYR 53 Cb -0.01 -2.08 0.01 0.00 -0.40 0.00 0.00 41.96 39.48 1x2p s TYR 53 CO 0.15 -0.10 0.21 0.96 -1.57 0.00 0.00 175.55 175.20 1x2p s ILE 54 N -2.38 0.08 0.60 2.71 -4.36 0.31 -2.22 121.20 115.94 1x2p s ILE 54 Ca 0.44 -0.62 -0.15 0.00 -0.26 0.00 0.00 60.65 60.06 1x2p s ILE 54 Cb -0.10 -0.54 -0.03 0.00 1.25 0.00 0.00 42.46 43.04 1x2p s ILE 54 CO 0.36 -0.34 1.05 -2.16 0.24 0.00 0.00 174.94 174.08 1x2p s PRO 55 N -1.45 3.32 -1.10 0.37 0.04 -1.26 0.19 135.00 135.10 1x2p s PRO 55 Ca -0.14 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 61.95 1x2p s PRO 55 Cb -0.06 -2.04 0.27 0.00 0.04 0.00 0.00 34.50 32.72 1x2p s PRO 55 CO 0.02 -0.81 1.09 0.00 0.04 0.00 0.00 177.00 177.35 1x2p s ALA 56 N -2.59 4.72 0.00 8.56 0.00 -0.35 -4.17 121.76 127.92 1x2p s ALA 56 Ca 0.62 -3.85 0.00 0.00 0.00 0.00 0.00 51.96 48.73 1x2p s ALA 56 Cb -0.15 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.46 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 2.66 0.00 0.23 0.00 5.15 -1.26 -4.89 115.26 117.16 1x2p n ASN 57 Ca 0.24 0.00 0.08 0.00 -0.60 0.00 0.00 54.58 54.30 1x2p n ASN 57 Cb 0.39 0.00 0.57 0.00 -0.53 0.00 0.00 39.78 40.21 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 -2.58 1.20 3.86 -1.93 -3.43 115.15 112.26 1x2p h HIS 58 Ca 0.00 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 1x2p h HIS 58 Cb 0.00 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.38 1x2p h HIS 58 CO 0.00 0.20 -0.62 0.14 0.86 0.00 0.00 177.93 178.51 1x2p s VAL 59 N -4.29 3.90 0.00 2.45 -7.23 -1.26 0.12 120.40 114.09 1x2p s VAL 59 Ca -0.03 -1.48 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1x2p s VAL 59 Cb 0.14 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 34.06 1x2p s VAL 59 CO 0.65 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 1x2p n GLY 60 N -0.51 1.69 0.31 2.32 0.00 -0.86 -4.84 105.19 103.30 1x2p n GLY 60 Ca -0.08 -1.72 -0.19 0.00 0.00 0.00 0.00 46.02 44.03 1x2p n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x2p n LYS 61 N -1.79 0.45 -1.18 1.61 3.00 -1.26 -4.21 118.16 114.78 1x2p n LYS 61 Ca 0.00 0.19 -0.31 0.00 -0.00 0.00 0.00 58.31 58.20 1x2p n LYS 61 Cb 0.00 -1.27 0.11 0.00 0.00 0.00 0.00 35.03 33.87 1x2p n LYS 61 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1x2p s HIS 62 N -2.50 2.43 0.19 5.64 3.76 -1.26 -4.90 115.29 118.66 1x2p s HIS 62 Ca -0.29 1.55 0.00 0.00 -0.15 0.00 0.00 55.06 56.17 1x2p s HIS 62 Cb 0.09 -3.09 0.00 0.00 1.11 0.00 0.00 32.58 30.69 1x2p s HIS 62 CO 0.37 -1.99 0.00 0.45 -0.85 0.00 0.00 174.74 172.72 1x2p n SER 63 N -3.66 -1.71 0.00 1.40 2.88 -1.26 -5.06 113.62 106.21 1x2p n SER 63 Ca 0.09 0.53 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 1x2p n SER 63 Cb 0.53 1.82 0.00 0.00 -0.75 0.00 0.00 64.21 65.81 1x2p n SER 63 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x2p n GLY 64 N -1.27 1.83 3.80 0.46 0.00 -1.26 -5.10 105.19 103.66 1x2p n GLY 64 Ca 0.00 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.49 1.97 -0.18 1.61 0.04 -1.26 -5.02 135.00 130.67 1x2p s PRO 65 Ca 0.00 0.59 -0.18 0.00 0.04 0.00 0.00 61.00 61.46 1x2p s PRO 65 Cb 0.00 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1x2p s PRO 65 CO 0.00 -1.69 0.48 -1.12 0.04 0.00 0.00 177.00 174.71 1x2p s SER 66 N -3.92 6.55 0.19 6.66 0.01 -1.26 -4.89 113.70 117.04 1x2p s SER 66 Ca 0.61 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.53 1x2p s SER 66 Cb -0.14 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.81 1x2p s SER 66 CO 0.54 -0.11 0.00 -1.20 0.41 0.00 0.00 173.24 172.88 1x2p n SER 67 N 4.47 0.30 0.00 2.44 7.64 -1.26 -5.35 113.62 121.86 1x2p n SER 67 Ca -0.06 0.30 0.10 0.00 1.01 0.00 0.00 58.87 60.22 1x2p n SER 67 Cb 0.51 0.09 0.60 0.00 -1.01 0.00 0.00 64.21 64.40 1x2p n SER 67 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64