#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e6p s SER 2 N 0.00 1.71 0.99 1.61 0.01 -1.26 -5.14 113.70 111.62 2e6p s SER 2 Ca 0.00 -0.18 -0.15 0.00 1.31 0.00 0.00 55.95 56.93 2e6p s SER 2 Cb 0.00 -0.37 0.01 0.00 0.21 0.00 0.00 66.02 65.87 2e6p s SER 2 CO 0.00 -0.24 0.06 -0.24 0.41 0.00 0.00 173.24 173.23 2e6p n SER 3 N 5.19 -2.83 -2.99 2.44 2.88 -1.26 -5.01 113.62 112.03 2e6p n SER 3 Ca -0.06 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2e6p n SER 3 Cb 0.50 -1.06 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 2e6p n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2e6p n GLY 4 N 2.00 0.91 3.56 0.46 0.00 -1.26 -4.89 105.19 105.97 2e6p n GLY 4 Ca 0.04 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 2e6p n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e6p s SER 5 N -1.00 5.81 0.17 1.61 0.01 -1.26 -4.90 113.70 114.14 2e6p s SER 5 Ca 0.00 -0.60 -0.23 0.00 1.31 0.00 0.00 55.95 56.43 2e6p s SER 5 Cb 0.00 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.74 2e6p s SER 5 CO 0.00 -2.09 0.67 -0.44 0.41 0.00 0.00 173.24 171.79 2e6p s SER 6 N 6.11 -0.46 0.70 2.44 0.01 -1.26 -5.15 113.70 116.08 2e6p s SER 6 Ca 0.54 -0.16 -0.17 0.00 1.31 0.00 0.00 55.95 57.47 2e6p s SER 6 Cb -0.07 0.61 -0.07 0.00 0.21 0.00 0.00 66.02 66.71 2e6p s SER 6 CO 0.06 -1.02 0.36 0.61 0.41 0.00 0.00 173.24 173.65 2e6p n GLY 7 N -0.39 -1.95 0.07 3.44 0.00 -1.26 -4.92 105.19 100.18 2e6p n GLY 7 Ca -0.13 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.40 2e6p n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e6p h PRO 8 N -0.30 0.05 -3.06 1.61 0.13 -1.99 -3.45 132.00 124.99 2e6p h PRO 8 Ca -0.45 -0.03 -0.19 0.00 -0.87 0.00 0.00 66.00 64.46 2e6p h PRO 8 Cb 1.36 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.20 2e6p h PRO 8 CO 0.42 0.52 -0.49 0.54 -0.23 0.00 0.00 178.00 178.76 2e6p s VAL 9 N -4.27 -0.03 -0.05 1.56 0.11 -1.26 -4.78 120.40 111.67 2e6p s VAL 9 Ca -0.16 0.13 0.02 0.00 -2.93 0.00 0.00 61.98 59.04 2e6p s VAL 9 Cb 0.02 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.52 2e6p s VAL 9 CO 0.69 0.05 -0.10 -1.38 -3.33 0.00 0.00 175.10 171.03 2e6p s HIS 10 N 1.07 1.19 0.05 1.54 -3.43 -1.26 -4.14 115.29 110.32 2e6p s HIS 10 Ca -0.08 -0.39 -0.31 0.00 -0.80 0.00 0.00 55.06 53.49 2e6p s HIS 10 Cb -0.09 -0.89 -0.06 0.00 -1.43 0.00 0.00 32.58 30.11 2e6p s HIS 10 CO -0.07 -0.21 1.23 0.42 -2.00 0.00 0.00 174.74 174.11 2e6p s ILE 11 N 0.56 3.97 -0.08 -5.38 1.01 -1.26 -2.03 121.20 117.99 2e6p s ILE 11 Ca -0.11 1.40 0.15 0.00 0.00 0.00 0.00 60.65 62.09 2e6p s ILE 11 Cb -0.14 -3.90 -0.17 0.00 0.01 0.00 0.00 42.46 38.27 2e6p s ILE 11 CO 0.02 0.09 0.81 -0.07 0.00 0.00 0.00 174.94 175.79 2e6p h LEU 12 N 7.02 0.00 -7.00 2.97 3.38 -1.81 -3.46 115.31 116.41 2e6p h LEU 12 Ca -0.41 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.60 2e6p h LEU 12 Cb 1.21 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.73 2e6p h LEU 12 CO 0.83 0.75 0.14 -0.55 0.09 0.00 0.00 178.44 179.70 2e6p s SER 13 N -5.97 -0.79 0.90 -0.43 0.15 -1.25 -4.53 113.70 101.77 2e6p s SER 13 Ca -0.03 1.32 0.00 0.00 0.70 0.00 0.00 55.95 57.94 2e6p s SER 13 Cb 0.08 1.33 0.00 0.00 -1.71 0.00 0.00 66.02 65.72 2e6p s SER 13 CO 0.81 -0.21 0.00 -0.81 1.20 0.00 0.00 173.24 174.23 2e6p n PRO 14 N 3.80 -0.82 -0.03 5.44 -0.04 -1.26 -0.24 135.00 141.85 2e6p n PRO 14 Ca -0.18 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.24 2e6p n PRO 14 Cb 0.58 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 34.00 2e6p n PRO 14 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2e6p n GLN 15 N -1.36 1.94 0.00 0.54 6.02 -1.26 -4.91 117.38 118.36 2e6p n GLN 15 Ca 0.00 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 2e6p n GLN 15 Cb 0.00 -1.13 0.00 0.00 1.02 0.00 0.00 30.24 30.13 2e6p n GLN 15 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2e6p n ASP 16 N -2.39 0.00 -3.61 1.08 2.03 -1.26 -5.05 116.55 107.35 2e6p n ASP 16 Ca -0.10 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.07 2e6p n ASP 16 Cb 0.65 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.98 2e6p n ASP 16 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2e6p s LYS 17 N -0.91 0.88 0.49 -0.67 2.47 -1.26 -4.29 119.74 116.46 2e6p s LYS 17 Ca 0.00 0.83 0.04 0.00 -1.56 0.00 0.00 55.97 55.28 2e6p s LYS 17 Cb 0.00 0.43 -0.01 0.00 -1.46 0.00 0.00 37.83 36.78 2e6p s LYS 17 CO 0.00 -0.15 0.13 0.14 0.16 0.00 0.00 175.35 175.63 2e6p s VAL 18 N 0.03 1.56 -0.04 4.02 -7.23 -1.21 -5.03 120.40 112.50 2e6p s VAL 18 Ca -0.02 -1.83 -0.02 0.00 -1.81 0.00 0.00 61.98 58.29 2e6p s VAL 18 Cb -0.04 -2.39 0.02 0.00 0.56 0.00 0.00 36.38 34.53 2e6p s VAL 18 CO 0.03 0.00 0.09 -0.55 -0.31 0.00 0.00 175.10 174.36 2e6p s SER 19 N -3.96 -0.07 0.04 4.85 0.15 -1.26 -2.62 113.70 110.84 2e6p s SER 19 Ca 0.22 0.18 -0.06 0.00 0.70 0.00 0.00 55.95 56.99 2e6p s SER 19 Cb 0.02 0.13 -0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2e6p s SER 19 CO 0.12 -0.08 0.12 -0.76 1.20 0.00 0.00 173.24 173.84 2e6p s LEU 20 N 0.56 1.72 -0.01 3.45 1.43 0.12 -4.94 118.68 121.01 2e6p s LEU 20 Ca -0.04 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 2e6p s LEU 20 Cb -0.06 0.68 -0.00 0.00 0.03 0.00 0.00 46.19 46.83 2e6p s LEU 20 CO -0.02 -0.52 -0.04 -0.89 0.23 0.00 0.00 176.35 175.10 2e6p s THR 21 N -2.65 0.33 0.14 5.49 2.01 -1.26 -2.26 115.64 117.44 2e6p s THR 21 Ca -0.05 -0.16 -0.07 0.00 0.31 0.00 0.00 61.69 61.72 2e6p s THR 21 Cb -0.01 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.19 2e6p s THR 21 CO -0.05 0.10 0.22 -0.36 -0.69 0.00 0.00 174.62 173.84 2e6p s PHE 22 N 0.02 0.44 0.08 4.92 0.40 0.06 -4.95 117.98 118.95 2e6p s PHE 22 Ca 0.00 -0.82 0.02 0.00 -0.60 0.00 0.00 56.93 55.53 2e6p s PHE 22 Cb -0.03 -0.14 -0.04 0.00 0.51 0.00 0.00 43.02 43.32 2e6p s PHE 22 CO -0.00 -0.64 0.15 0.99 0.70 0.00 0.00 175.22 176.42 2e6p s THR 23 N -3.96 4.94 0.38 0.64 2.01 -1.26 -1.08 115.64 117.31 2e6p s THR 23 Ca 0.16 -0.62 -0.26 0.00 0.31 0.00 0.00 61.69 61.27 2e6p s THR 23 Cb 0.04 -3.41 -0.11 0.00 0.01 0.00 0.00 72.50 69.03 2e6p s THR 23 CO -0.02 0.10 1.20 0.41 -0.69 0.00 0.00 174.62 175.62 2e6p n THR 24 N 0.28 2.27 -2.79 -0.82 -1.04 -1.21 -3.01 114.28 107.95 2e6p n THR 24 Ca -0.07 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.05 61.35 2e6p n THR 24 Cb 0.52 -1.43 0.05 0.00 -1.82 0.00 0.00 70.33 67.64 2e6p n THR 24 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2e6p n SER 25 N 0.58 -2.39 -3.74 8.00 7.64 -0.88 -4.82 113.62 118.02 2e6p n SER 25 Ca 0.07 -0.31 -0.16 0.00 1.01 0.00 0.00 58.87 59.47 2e6p n SER 25 Cb 0.37 -2.89 -0.09 0.00 -1.01 0.00 0.00 64.21 60.59 2e6p n SER 25 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2e6p s GLU 26 N -4.86 1.51 -0.24 1.43 2.02 -1.16 -4.84 118.70 112.55 2e6p s GLU 26 Ca 0.05 -1.84 -0.13 0.00 0.02 0.00 0.00 54.97 53.07 2e6p s GLU 26 Cb -0.02 0.30 -0.04 0.00 0.10 0.00 0.00 34.13 34.47 2e6p s GLU 26 CO 0.38 -0.53 0.27 0.50 0.02 0.00 0.00 175.26 175.90 2e6p s ARG 27 N -3.77 4.08 -0.16 1.61 3.52 -1.26 -1.27 118.95 121.70 2e6p s ARG 27 Ca 0.40 -0.07 0.00 0.00 -0.13 0.00 0.00 55.73 55.93 2e6p s ARG 27 Cb 0.04 -3.57 0.03 0.00 -1.56 0.00 0.00 34.95 29.89 2e6p s ARG 27 CO 0.20 -0.05 -0.12 0.08 -0.81 0.00 0.00 175.30 174.60 2e6p s VAL 28 N 1.38 1.51 -0.08 7.11 1.01 -0.85 -4.97 120.40 125.51 2e6p s VAL 28 Ca 0.12 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.41 2e6p s VAL 28 Cb -0.15 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.77 2e6p s VAL 28 CO 0.07 0.35 -0.08 0.54 0.00 0.00 0.00 175.10 175.98 2e6p s VAL 29 N 1.49 0.94 0.06 2.92 0.11 -1.26 -0.60 120.40 124.07 2e6p s VAL 29 Ca 0.03 -0.31 -0.01 0.00 -2.93 0.00 0.00 61.98 58.77 2e6p s VAL 29 Cb -0.14 -0.93 0.01 0.00 -1.53 0.00 0.00 36.38 33.80 2e6p s VAL 29 CO -0.10 0.33 0.09 0.18 -3.33 0.00 0.00 175.10 172.27 2e6p n LEU 30 N 4.37 0.00 -3.66 2.54 4.77 -0.80 -4.94 117.00 119.28 2e6p n LEU 30 Ca -0.18 -0.13 -0.09 0.00 -0.03 0.00 0.00 56.01 55.58 2e6p n LEU 30 Cb 0.51 -0.06 -0.09 0.00 -2.33 0.00 0.00 43.42 41.45 2e6p n LEU 30 CO 0.21 -0.55 0.23 -0.89 -1.33 0.00 0.00 177.39 175.05 2e6p s THR 31 N -0.59 -0.01 -0.06 -5.08 2.01 -1.26 -4.25 115.64 106.39 2e6p s THR 31 Ca 0.05 0.04 -0.03 0.00 0.31 0.00 0.00 61.69 62.05 2e6p s THR 31 Cb -0.00 -0.84 0.03 0.00 0.01 0.00 0.00 72.50 71.70 2e6p s THR 31 CO 0.04 0.01 0.14 0.00 -0.69 0.00 0.00 174.62 174.12 2e6p s GLU 33 N 0.77 2.41 0.27 0.00 2.12 0.67 -1.02 118.70 123.92 2e6p s GLU 33 Ca -0.06 -1.10 0.01 0.00 0.36 0.00 0.00 54.97 54.19 2e6p s GLU 33 Cb -0.08 -2.36 -0.05 0.00 0.26 0.00 0.00 34.13 31.90 2e6p s GLU 33 CO -0.04 0.46 0.12 -0.51 -0.54 0.00 0.00 175.26 174.74 2e6p s LEU 34 N -2.94 1.60 0.00 2.70 1.43 -0.96 -2.77 118.68 117.74 2e6p s LEU 34 Ca 0.27 -1.43 0.22 0.00 -1.03 0.00 0.00 54.13 52.17 2e6p s LEU 34 Cb -0.09 0.10 0.05 0.00 0.03 0.00 0.00 46.19 46.28 2e6p s LEU 34 CO 0.19 -0.78 1.12 -0.24 0.23 0.00 0.00 176.35 176.86 2e6p n SER 35 N -0.57 2.30 -4.23 2.29 2.88 -0.86 -4.73 113.62 110.70 2e6p n SER 35 Ca 0.00 -1.65 -0.30 0.00 -1.33 0.00 0.00 58.87 55.59 2e6p n SER 35 Cb 0.66 0.33 -0.16 0.00 -0.75 0.00 0.00 64.21 64.28 2e6p n SER 35 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2e6p s ARG 36 N -2.27 2.45 0.18 -1.46 0.52 -1.26 -4.90 118.95 112.20 2e6p s ARG 36 Ca 0.21 -0.83 -0.14 0.00 -0.52 0.00 0.00 55.73 54.44 2e6p s ARG 36 Cb 0.18 -2.04 -0.07 0.00 0.52 0.00 0.00 34.95 33.53 2e6p s ARG 36 CO 0.47 0.32 0.58 0.08 0.02 0.00 0.00 175.30 176.77 2e6p s VAL 37 N -0.04 4.83 -1.29 3.52 1.01 -1.26 -4.15 120.40 123.02 2e6p s VAL 37 Ca -0.06 0.82 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 2e6p s VAL 37 Cb -0.14 -3.72 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 2e6p s VAL 37 CO 0.04 0.17 0.68 -0.67 0.00 0.00 0.00 175.10 175.32 2e6p n ASP 38 N 0.58 -1.70 -4.56 3.32 -0.08 -1.21 -4.92 116.55 107.98 2e6p n ASP 38 Ca -0.04 -0.86 -0.33 0.00 -1.51 0.00 0.00 54.79 52.05 2e6p n ASP 38 Cb 0.52 -3.92 -0.12 0.00 2.34 0.00 0.00 41.12 39.94 2e6p n ASP 38 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 2e6p s PHE 39 N -3.67 2.88 0.76 -0.67 5.36 -1.26 -5.09 117.98 116.28 2e6p s PHE 39 Ca 0.07 -0.02 -0.11 0.00 -0.96 0.00 0.00 56.93 55.90 2e6p s PHE 39 Cb -0.02 -1.68 0.05 0.00 -0.34 0.00 0.00 43.02 41.03 2e6p s PHE 39 CO 0.82 0.31 1.10 -1.25 -1.46 0.00 0.00 175.22 174.73 2e6p s PRO 40 N -0.85 2.33 -0.10 10.12 0.04 -1.26 -5.07 135.00 140.21 2e6p s PRO 40 Ca 0.13 1.21 -0.32 0.00 0.04 0.00 0.00 61.00 62.06 2e6p s PRO 40 Cb -0.11 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.65 2e6p s PRO 40 CO 0.02 -1.59 1.05 0.00 0.04 0.00 0.00 177.00 176.52 2e6p s ALA 41 N -2.81 -1.95 -0.05 8.56 0.00 -1.26 -4.60 121.76 119.65 2e6p s ALA 41 Ca 0.62 1.29 -0.01 0.00 0.00 0.00 0.00 51.96 53.87 2e6p s ALA 41 Cb -0.18 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.12 2e6p s ALA 41 CO 0.54 -0.65 0.01 0.99 0.00 0.00 0.00 175.76 176.65 2e6p s THR 42 N -2.77 0.23 0.48 0.00 2.01 -0.72 -5.01 115.64 109.86 2e6p s THR 42 Ca 0.07 0.15 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 2e6p s THR 42 Cb -0.01 -0.37 -0.09 0.00 0.01 0.00 0.00 72.50 72.04 2e6p s THR 42 CO -0.07 0.20 0.99 0.26 -0.69 0.00 0.00 174.62 175.32 2e6p s TRP 43 N 1.59 3.23 0.05 4.92 0.52 -1.26 -1.70 118.94 126.29 2e6p s TRP 43 Ca -0.02 1.56 -0.03 0.00 0.02 0.00 0.00 56.10 57.64 2e6p s TRP 43 Cb -0.13 -2.91 -0.02 0.00 -1.15 0.00 0.00 33.47 29.26 2e6p s TRP 43 CO -0.03 -0.44 0.04 0.71 0.02 0.00 0.00 176.95 177.25 2e6p s TYR 44 N -2.24 0.35 -0.03 -1.98 1.51 0.92 -2.53 117.35 113.35 2e6p s TYR 44 Ca 0.63 -0.79 0.02 0.00 -1.01 0.00 0.00 57.07 55.91 2e6p s TYR 44 Cb -0.12 -0.25 0.01 0.00 -0.11 0.00 0.00 41.96 41.49 2e6p s TYR 44 CO 0.21 -0.39 -0.07 0.21 -1.11 0.00 0.00 175.55 174.40 2e6p s LYS 45 N -3.35 0.88 -0.13 -0.62 2.20 0.12 -0.91 119.74 117.93 2e6p s LYS 45 Ca 0.01 -0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.41 2e6p s LYS 45 Cb 0.03 -0.84 0.00 0.00 -1.51 0.00 0.00 37.83 35.52 2e6p s LYS 45 CO -0.08 0.03 0.00 -0.25 -0.36 0.00 0.00 175.35 174.69 2e6p n ASP 46 N 3.57 -0.84 -0.05 1.43 8.00 -0.74 0.22 116.55 128.14 2e6p n ASP 46 Ca -0.21 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.54 2e6p n ASP 46 Cb 0.53 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 2e6p n ASP 46 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2e6p n GLY 47 N -0.28 1.07 2.90 0.44 0.00 -1.26 -5.08 105.19 102.98 2e6p n GLY 47 Ca -0.02 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.38 2e6p n GLY 47 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2e6p s GLN 48 N -2.69 0.08 0.49 1.61 -2.07 0.61 -5.14 119.66 112.55 2e6p s GLN 48 Ca 0.00 0.57 -0.20 0.00 -1.82 0.00 0.00 55.36 53.91 2e6p s GLN 48 Cb 0.00 -0.20 -0.11 0.00 -1.09 0.00 0.00 33.01 31.62 2e6p s GLN 48 CO 0.00 -0.27 0.52 1.17 -1.32 0.00 0.00 175.29 175.39 2e6p n LYS 49 N 5.09 0.55 -3.96 9.60 0.00 -1.26 0.16 118.16 128.35 2e6p n LYS 49 Ca -0.10 0.21 -0.34 0.00 0.00 0.00 0.00 58.31 58.09 2e6p n LYS 49 Cb 0.50 -1.59 -0.06 0.00 0.00 0.00 0.00 35.03 33.88 2e6p n LYS 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2e6p s VAL 50 N -1.61 5.24 -0.46 3.15 -7.23 -1.05 -4.72 120.40 113.72 2e6p s VAL 50 Ca 0.65 -0.18 -0.13 0.00 -1.81 0.00 0.00 61.98 60.51 2e6p s VAL 50 Cb -0.52 -3.41 0.08 0.00 0.56 0.00 0.00 36.38 33.09 2e6p s VAL 50 CO 0.57 0.37 0.35 -1.83 -0.31 0.00 0.00 175.10 174.26 2e6p s GLU 51 N -1.75 2.83 -0.01 4.82 -1.05 -1.26 -4.91 118.70 117.37 2e6p s GLU 51 Ca 0.24 -1.43 -0.36 0.00 -0.15 0.00 0.00 54.97 53.28 2e6p s GLU 51 Cb -0.12 -4.02 -0.14 0.00 -0.44 0.00 0.00 34.13 29.41 2e6p s GLU 51 CO 0.15 -1.03 1.64 0.39 0.95 0.00 0.00 175.26 177.37 2e6p n GLU 52 N 5.10 1.75 -2.96 -4.83 4.71 -1.26 -4.77 120.64 118.37 2e6p n GLU 52 Ca -0.12 0.64 -0.07 0.00 -0.01 0.00 0.00 57.16 57.60 2e6p n GLU 52 Cb 0.43 -2.38 0.00 0.00 -1.01 0.00 0.00 31.44 28.48 2e6p n GLU 52 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2e6p n SER 53 N 4.50 -1.26 0.06 1.62 2.88 -0.49 -4.94 113.62 115.99 2e6p n SER 53 Ca 0.21 -2.14 0.18 0.00 -1.33 0.00 0.00 58.87 55.79 2e6p n SER 53 Cb 0.24 2.18 0.68 0.00 -0.75 0.00 0.00 64.21 66.56 2e6p n SER 53 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2e6p h GLU 54 N 0.00 0.00 -0.00 -1.46 4.11 -2.02 0.37 114.58 115.58 2e6p h GLU 54 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.23 2e6p h GLU 54 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 2e6p h GLU 54 CO 0.27 0.00 -0.42 1.28 0.07 0.00 0.00 179.01 180.20 2e6p n LEU 55 N -4.39 0.79 -3.70 3.06 4.77 -1.26 -4.70 117.00 111.57 2e6p n LEU 55 Ca 0.07 -0.16 -0.29 0.00 -0.03 0.00 0.00 56.01 55.60 2e6p n LEU 55 Cb 0.49 -0.18 -0.16 0.00 -2.33 0.00 0.00 43.42 41.25 2e6p n LEU 55 CO 0.36 0.17 -0.34 -0.22 -1.33 0.00 0.00 177.39 176.02 2e6p s LEU 56 N -2.78 1.51 -0.19 2.23 0.20 0.13 -4.34 118.68 115.45 2e6p s LEU 56 Ca 0.17 -1.25 -0.07 0.00 0.69 0.00 0.00 54.13 53.67 2e6p s LEU 56 Cb 0.18 -0.66 -0.04 0.00 -0.43 0.00 0.00 46.19 45.24 2e6p s LEU 56 CO 0.63 -0.38 0.04 -0.69 -0.29 0.00 0.00 176.35 175.66 2e6p s VAL 57 N 1.80 4.50 -0.21 1.68 1.01 -0.60 -1.39 120.40 127.19 2e6p s VAL 57 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.90 2e6p s VAL 57 Cb -0.17 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.21 2e6p s VAL 57 CO -0.21 0.45 -0.14 -0.69 0.00 0.00 0.00 175.10 174.51 2e6p s VAL 58 N 0.58 2.39 -0.07 2.92 1.01 -1.26 -0.05 120.40 125.91 2e6p s VAL 58 Ca 0.02 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 60.94 2e6p s VAL 58 Cb -0.13 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 2e6p s VAL 58 CO 0.02 0.38 0.17 -0.54 0.00 0.00 0.00 175.10 175.13 2e6p s LYS 59 N 1.29 3.46 -0.25 2.72 -0.14 -1.09 -5.03 119.74 120.70 2e6p s LYS 59 Ca 0.02 -0.17 -0.01 0.00 -1.36 0.00 0.00 55.97 54.45 2e6p s LYS 59 Cb -0.15 -3.15 0.08 0.00 -1.68 0.00 0.00 37.83 32.93 2e6p s LYS 59 CO -0.09 0.73 0.03 1.41 -0.76 0.00 0.00 175.35 176.67 2e6p s MET 60 N -1.39 0.98 -0.29 1.68 -2.45 -1.26 -3.26 119.30 113.31 2e6p s MET 60 Ca 0.20 -0.88 0.01 0.00 -1.25 0.00 0.00 55.69 53.78 2e6p s MET 60 Cb -0.12 -2.26 0.09 0.00 1.25 0.00 0.00 34.83 33.78 2e6p s MET 60 CO 0.10 -0.76 0.03 -0.51 1.05 0.00 0.00 175.02 174.93 2e6p s ASP 61 N 1.60 4.21 0.17 1.11 1.11 -0.07 -5.02 116.67 119.78 2e6p s ASP 61 Ca 0.02 -1.65 0.00 0.00 0.18 0.00 0.00 52.55 51.10 2e6p s ASP 61 Cb -0.18 -1.23 0.00 0.00 1.07 0.00 0.00 42.92 42.59 2e6p s ASP 61 CO -0.13 -0.34 0.00 0.61 1.18 0.00 0.00 175.17 176.48 2e6p n GLY 62 N 4.59 2.29 1.87 0.21 0.00 -1.26 0.70 105.19 113.58 2e6p n GLY 62 Ca -0.03 0.31 -0.15 0.00 0.00 0.00 0.00 46.02 46.15 2e6p n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e6p n ARG 63 N 14.00 1.72 -3.70 1.61 1.74 -1.26 -3.33 116.66 127.44 2e6p n ARG 63 Ca 0.00 -1.36 -0.16 0.00 -0.77 0.00 0.00 57.85 55.56 2e6p n ARG 63 Cb 0.00 -1.56 -0.15 0.00 -1.02 0.00 0.00 32.46 29.73 2e6p n ARG 63 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2e6p s LYS 64 N -1.49 0.05 -0.08 5.56 1.02 0.22 -2.26 119.74 122.75 2e6p s LYS 64 Ca 0.28 0.48 -0.03 0.00 0.02 0.00 0.00 55.97 56.73 2e6p s LYS 64 Cb 0.22 -0.24 0.04 0.00 -0.52 0.00 0.00 37.83 37.32 2e6p s LYS 64 CO -0.02 -0.25 0.05 -1.01 -0.92 0.00 0.00 175.35 173.21 2e6p s HIS 65 N 1.84 0.26 0.28 3.18 3.76 -0.19 -0.89 115.29 123.53 2e6p s HIS 65 Ca -0.02 -0.02 0.02 0.00 -0.15 0.00 0.00 55.06 54.89 2e6p s HIS 65 Cb -0.12 -0.62 -0.05 0.00 1.11 0.00 0.00 32.58 32.90 2e6p s HIS 65 CO -0.06 -0.31 0.10 -0.98 -0.85 0.00 0.00 174.74 172.63 2e6p s ARG 66 N 2.11 1.50 -0.17 1.40 1.70 -1.20 -2.15 118.95 122.13 2e6p s ARG 66 Ca 0.04 -1.82 0.00 0.00 -0.47 0.00 0.00 55.73 53.48 2e6p s ARG 66 Cb -0.13 -0.39 0.04 0.00 -0.57 0.00 0.00 34.95 33.90 2e6p s ARG 66 CO -0.05 -0.29 -0.09 -1.17 -1.08 0.00 0.00 175.30 172.61 2e6p s LEU 67 N -3.37 1.87 0.10 -1.89 0.20 -1.26 -2.69 118.68 111.64 2e6p s LEU 67 Ca 0.37 -0.69 -0.05 0.00 0.69 0.00 0.00 54.13 54.45 2e6p s LEU 67 Cb 0.08 -1.09 -0.05 0.00 -0.43 0.00 0.00 46.19 44.69 2e6p s LEU 67 CO 0.14 -0.14 0.33 -0.63 -0.29 0.00 0.00 176.35 175.77 2e6p s ILE 68 N 1.51 5.22 -0.07 6.68 1.01 0.92 -1.91 121.20 134.56 2e6p s ILE 68 Ca 0.01 0.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.68 2e6p s ILE 68 Cb -0.15 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 38.74 2e6p s ILE 68 CO -0.09 0.14 0.02 -0.76 0.00 0.00 0.00 174.94 174.25 2e6p s LEU 69 N -2.39 0.52 0.21 2.97 1.43 0.23 -1.55 118.68 120.09 2e6p s LEU 69 Ca 0.37 -0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.34 2e6p s LEU 69 Cb -0.13 -0.38 0.17 0.00 0.03 0.00 0.00 46.19 45.88 2e6p s LEU 69 CO 0.23 -0.22 1.57 1.55 0.23 0.00 0.00 176.35 179.71 2e6p h PRO 70 N 8.35 0.62 -3.79 1.29 0.13 -1.83 -2.27 132.00 134.49 2e6p h PRO 70 Ca -0.18 -0.32 -0.53 0.00 -0.87 0.00 0.00 66.00 64.10 2e6p h PRO 70 Cb 1.12 0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.87 2e6p h PRO 70 CO 0.24 0.92 -0.77 -2.00 -0.23 0.00 0.00 178.00 176.16 2e6p s GLU 71 N -4.24 0.93 -0.78 0.86 2.12 -1.25 -4.31 118.70 112.04 2e6p s GLU 71 Ca -0.08 -0.49 -0.24 0.00 0.36 0.00 0.00 54.97 54.52 2e6p s GLU 71 Cb 0.12 -2.09 0.06 0.00 0.26 0.00 0.00 34.13 32.48 2e6p s GLU 71 CO 0.83 -0.58 1.18 0.00 -0.54 0.00 0.00 175.26 176.16 2e6p s ALA 72 N 1.75 2.93 0.31 6.30 0.00 -0.40 -4.87 121.76 127.78 2e6p s ALA 72 Ca -0.01 -1.83 -0.07 0.00 0.00 0.00 0.00 51.96 50.06 2e6p s ALA 72 Cb -0.17 -4.14 -0.06 0.00 0.00 0.00 0.00 23.12 18.75 2e6p s ALA 72 CO -0.07 -3.13 0.60 0.15 0.00 0.00 0.00 175.76 173.30 2e6p s LYS 73 N 4.72 3.68 0.51 0.00 1.02 -1.26 -2.06 119.74 126.34 2e6p s LYS 73 Ca 0.32 0.13 0.26 0.00 0.02 0.00 0.00 55.97 56.70 2e6p s LYS 73 Cb -0.09 -2.59 1.44 0.00 -0.52 0.00 0.00 37.83 36.07 2e6p s LYS 73 CO 0.07 0.17 1.78 0.28 -0.92 0.00 0.00 175.35 176.73 2e6p h VAL 74 N 1.35 0.00 0.00 3.17 2.07 -1.95 0.47 116.25 121.35 2e6p h VAL 74 Ca -0.47 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 2e6p h VAL 74 Cb 1.19 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2e6p h VAL 74 CO 0.66 0.00 -0.60 1.56 0.02 0.00 0.00 177.57 179.21 2e6p h GLN 75 N 0.00 0.00 0.00 1.57 4.20 -1.92 -3.22 115.11 115.74 2e6p h GLN 75 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2e6p h GLN 75 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2e6p h GLN 75 CO 0.00 0.24 0.00 -0.25 -0.67 0.00 0.00 178.83 178.15 2e6p n ASP 76 N -3.04 0.68 -4.56 1.46 9.92 0.16 -4.71 116.55 116.47 2e6p n ASP 76 Ca 0.00 0.59 -0.39 0.00 -0.53 0.00 0.00 54.79 54.46 2e6p n ASP 76 Cb 0.66 -0.76 -0.03 0.00 -0.64 0.00 0.00 41.12 40.35 2e6p n ASP 76 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2e6p s SER 77 N -4.28 5.30 0.00 -2.24 1.04 -1.20 -4.82 113.70 107.50 2e6p s SER 77 Ca 0.10 0.65 0.00 0.00 0.48 0.00 0.00 55.95 57.18 2e6p s SER 77 Cb 0.12 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2e6p s SER 77 CO 0.54 -2.30 0.00 0.61 0.98 0.00 0.00 173.24 173.07 2e6p n GLY 78 N 5.68 1.98 3.43 7.32 0.00 -0.20 -4.89 105.19 118.50 2e6p n GLY 78 Ca 0.23 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 2e6p n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e6p s GLU 79 N 1.25 3.52 0.06 1.61 2.12 -1.26 -1.27 118.70 124.74 2e6p s GLU 79 Ca 0.00 -0.60 0.03 0.00 0.36 0.00 0.00 54.97 54.76 2e6p s GLU 79 Cb 0.00 -2.78 -0.04 0.00 0.26 0.00 0.00 34.13 31.57 2e6p s GLU 79 CO 0.00 0.21 0.05 -0.06 -0.54 0.00 0.00 175.26 174.92 2e6p s PHE 80 N 0.41 3.14 -0.03 5.30 0.40 -0.34 -1.79 117.98 125.08 2e6p s PHE 80 Ca -0.07 0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.32 2e6p s PHE 80 Cb -0.15 -1.62 0.02 0.00 0.51 0.00 0.00 43.02 41.78 2e6p s PHE 80 CO 0.04 0.51 0.06 -2.00 0.70 0.00 0.00 175.22 174.53 2e6p s GLU 81 N -2.21 0.01 -1.07 0.44 2.12 -0.09 -1.01 118.70 116.90 2e6p s GLU 81 Ca 0.27 0.19 -0.07 0.00 0.36 0.00 0.00 54.97 55.72 2e6p s GLU 81 Cb -0.12 -0.16 0.27 0.00 0.26 0.00 0.00 34.13 34.38 2e6p s GLU 81 CO 0.19 -0.12 1.06 0.00 -0.54 0.00 0.00 175.26 175.85 2e6p s ARG 83 N -1.41 3.80 0.20 0.00 3.52 -0.69 -3.80 118.95 120.57 2e6p s ARG 83 Ca 0.30 2.40 -0.18 0.00 -0.13 0.00 0.00 55.73 58.12 2e6p s ARG 83 Cb -0.08 -2.72 0.03 0.00 -1.56 0.00 0.00 34.95 30.61 2e6p s ARG 83 CO -0.08 -0.72 0.55 -0.08 -0.81 0.00 0.00 175.30 174.16 2e6p s THR 84 N -1.20 0.02 -0.83 4.11 -1.32 -1.01 -1.76 115.64 113.65 2e6p s THR 84 Ca 0.59 -0.77 -0.27 0.00 -1.21 0.00 0.00 61.69 60.04 2e6p s THR 84 Cb -0.43 -1.61 -0.24 0.00 -1.51 0.00 0.00 72.50 68.72 2e6p s THR 84 CO 0.56 -0.09 1.95 1.21 -2.21 0.00 0.00 174.62 176.04 2e6p n GLU 85 N -0.36 0.46 0.00 7.08 4.07 -1.26 -3.32 120.64 127.31 2e6p n GLU 85 Ca -0.10 -1.70 0.00 0.00 -0.06 0.00 0.00 57.16 55.30 2e6p n GLU 85 Cb 0.62 -3.50 0.00 0.00 -0.06 0.00 0.00 31.44 28.50 2e6p n GLU 85 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2e6p n GLY 86 N 5.69 0.09 3.02 8.31 0.00 -1.26 -4.27 105.19 116.77 2e6p n GLY 86 Ca 0.44 0.12 -0.19 0.00 0.00 0.00 0.00 46.02 46.39 2e6p n GLY 86 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2e6p n VAL 87 N 0.00 0.00 -3.90 1.61 0.24 -1.21 -5.05 118.33 110.02 2e6p n VAL 87 Ca 0.00 -2.26 -0.11 0.00 -2.04 0.00 0.00 64.34 59.93 2e6p n VAL 87 Cb 0.00 1.07 -0.10 0.00 -1.47 0.00 0.00 33.84 33.34 2e6p n VAL 87 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2e6p s SER 88 N -3.21 0.08 0.35 -1.34 0.01 -1.26 -2.41 113.70 105.92 2e6p s SER 88 Ca 0.34 -0.28 0.07 0.00 1.31 0.00 0.00 55.95 57.39 2e6p s SER 88 Cb 0.02 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.41 2e6p s SER 88 CO 0.24 -0.34 0.42 0.00 0.41 0.00 0.00 173.24 173.96 2e6p s ALA 89 N -1.37 4.13 -0.03 1.44 0.00 -1.25 -4.91 121.76 119.77 2e6p s ALA 89 Ca -0.15 -1.57 0.02 0.00 0.00 0.00 0.00 51.96 50.26 2e6p s ALA 89 Cb -0.08 -1.47 0.01 0.00 0.00 0.00 0.00 23.12 21.58 2e6p s ALA 89 CO 0.01 -0.06 -0.07 -0.06 0.00 0.00 0.00 175.76 175.59 2e6p s PHE 90 N -2.25 0.78 -0.02 0.00 0.40 -1.26 -3.14 117.98 112.49 2e6p s PHE 90 Ca 0.45 -0.20 0.02 0.00 -0.60 0.00 0.00 56.93 56.60 2e6p s PHE 90 Cb -0.08 -0.61 -0.00 0.00 0.51 0.00 0.00 43.02 42.84 2e6p s PHE 90 CO 0.30 -0.12 -0.08 -0.06 0.70 0.00 0.00 175.22 175.96 2e6p s PHE 91 N 0.43 0.80 -0.32 0.36 0.08 -0.18 -3.35 117.98 115.79 2e6p s PHE 91 Ca -0.06 -0.17 -0.06 0.00 0.12 0.00 0.00 56.93 56.75 2e6p s PHE 91 Cb -0.10 -0.55 0.03 0.00 -0.57 0.00 0.00 43.02 41.83 2e6p s PHE 91 CO 0.00 -0.06 0.09 0.20 -0.10 0.00 0.00 175.22 175.35 2e6p s GLY 92 N 0.05 1.82 -0.11 4.36 0.00 -1.08 -1.19 107.32 111.16 2e6p s GLY 92 Ca -0.01 -1.64 0.02 0.00 0.00 0.00 0.00 44.72 43.10 2e6p s GLY 92 CO -0.00 0.72 -0.17 0.14 0.00 0.00 0.00 173.10 173.79 2e6p s VAL 93 N 1.43 2.67 -0.13 1.40 1.01 -0.39 0.11 120.40 126.49 2e6p s VAL 93 Ca -0.00 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 2e6p s VAL 93 Cb -0.19 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.14 2e6p s VAL 93 CO 0.02 0.54 -0.11 -0.89 0.00 0.00 0.00 175.10 174.67 2e6p s THR 94 N 0.27 1.30 -0.45 3.92 2.01 -0.96 -1.04 115.64 120.69 2e6p s THR 94 Ca -0.12 -0.48 -0.12 0.00 0.31 0.00 0.00 61.69 61.28 2e6p s THR 94 Cb -0.16 -1.27 0.08 0.00 0.01 0.00 0.00 72.50 71.16 2e6p s THR 94 CO 0.06 0.40 0.34 -0.69 -0.69 0.00 0.00 174.62 174.04 2e6p s VAL 95 N 1.59 4.68 -0.36 3.82 1.01 -1.26 -0.76 120.40 129.13 2e6p s VAL 95 Ca 0.05 -1.31 -0.14 0.00 0.00 0.00 0.00 61.98 60.57 2e6p s VAL 95 Cb -0.13 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 2e6p s VAL 95 CO -0.09 -0.58 0.31 -1.10 0.00 0.00 0.00 175.10 173.63 2e6p s GLN 96 N 1.51 3.43 0.32 2.72 -0.21 -0.24 -4.64 119.66 122.55 2e6p s GLN 96 Ca 0.04 -0.61 -0.29 0.00 0.02 0.00 0.00 55.36 54.51 2e6p s GLN 96 Cb -0.24 -3.84 -0.12 0.00 1.00 0.00 0.00 33.01 29.81 2e6p s GLN 96 CO 0.04 -0.54 1.48 -0.40 -2.12 0.00 0.00 175.29 173.74 2e6p n ASP 97 N 5.26 3.49 -3.54 5.90 5.68 -1.26 -3.30 116.55 128.78 2e6p n ASP 97 Ca -0.11 1.19 -0.30 0.00 -0.50 0.00 0.00 54.79 55.07 2e6p n ASP 97 Cb 0.49 -1.56 0.25 0.00 -1.14 0.00 0.00 41.12 39.16 2e6p n ASP 97 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 2e6p n PRO 98 N 1.26 -3.13 -3.75 0.11 -0.04 -1.26 -4.90 135.00 123.28 2e6p n PRO 98 Ca 0.06 -1.72 -0.12 0.00 -0.04 0.00 0.00 63.50 61.67 2e6p n PRO 98 Cb 0.37 -1.62 -0.12 0.00 -0.04 0.00 0.00 33.50 32.09 2e6p n PRO 98 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2e6p s SER 99 N -4.40 -0.28 0.00 3.54 1.04 -1.26 -5.08 113.70 107.26 2e6p s SER 99 Ca 0.70 0.53 0.00 0.00 0.48 0.00 0.00 55.95 57.66 2e6p s SER 99 Cb -0.07 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2e6p s SER 99 CO 0.54 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.24 2e6p n GLY 100 N 3.64 0.59 3.69 7.32 0.00 -1.26 -4.94 105.19 114.23 2e6p n GLY 100 Ca -0.19 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 2e6p n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2e6p s PRO 101 N -2.01 4.27 -0.30 1.61 0.04 -1.26 -4.98 135.00 132.37 2e6p s PRO 101 Ca 0.00 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 62.90 2e6p s PRO 101 Cb 0.00 -3.56 0.18 0.00 0.04 0.00 0.00 34.50 31.16 2e6p s PRO 101 CO 0.00 -0.59 1.14 -1.54 0.04 0.00 0.00 177.00 176.05 2e6p s SER 102 N 1.92 -0.27 -0.74 6.66 1.04 -1.26 -5.11 113.70 115.94 2e6p s SER 102 Ca 0.65 0.41 -0.02 0.00 0.48 0.00 0.00 55.95 57.48 2e6p s SER 102 Cb -0.33 1.15 0.19 0.00 0.10 0.00 0.00 66.02 67.13 2e6p s SER 102 CO 0.27 -0.06 0.58 -0.94 0.98 0.00 0.00 173.24 174.07 2e6p s SER 103 N 1.38 5.49 0.00 7.02 1.04 -1.26 -5.14 113.70 122.23 2e6p s SER 103 Ca -0.07 -3.31 0.15 0.00 0.48 0.00 0.00 55.95 53.20 2e6p s SER 103 Cb -0.03 -1.85 0.87 0.00 0.10 0.00 0.00 66.02 65.11 2e6p s SER 103 CO -0.13 -0.26 1.29 0.61 0.98 0.00 0.00 173.24 175.73