#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j6p s TYR 4 N 0.00 0.24 0.42 -2.53 -0.85 -1.26 -4.67 117.35 108.70 2j6p s TYR 4 Ca 0.00 -0.62 0.04 0.00 -0.52 0.00 0.00 57.07 55.97 2j6p s TYR 4 Cb 0.00 0.29 -0.01 0.00 0.38 0.00 0.00 41.96 42.61 2j6p s TYR 4 CO 0.00 -1.02 0.14 0.25 -1.52 0.00 0.00 175.55 173.39 2j6p n THR 5 N -0.39 0.00 -3.69 -3.49 -2.24 -0.85 -4.96 114.28 98.67 2j6p n THR 5 Ca -0.03 -2.39 -0.32 0.00 -2.27 0.00 0.00 64.05 59.05 2j6p n THR 5 Cb 0.61 0.83 -0.05 0.00 -2.10 0.00 0.00 70.33 69.63 2j6p n THR 5 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2j6p s TYR 6 N -3.07 3.49 -0.00 4.78 1.51 -1.26 -0.95 117.35 121.84 2j6p s TYR 6 Ca 0.19 0.56 0.04 0.00 -1.01 0.00 0.00 57.07 56.85 2j6p s TYR 6 Cb 0.01 -2.00 -0.01 0.00 -0.11 0.00 0.00 41.96 39.85 2j6p s TYR 6 CO 0.14 0.47 -0.13 -1.50 -1.11 0.00 0.00 175.55 173.42 2j6p s ILE 7 N -1.60 0.99 0.57 2.71 2.07 -0.48 -4.85 121.20 120.62 2j6p s ILE 7 Ca 0.39 -0.58 -0.05 0.00 -1.41 0.00 0.00 60.65 59.00 2j6p s ILE 7 Cb -0.12 -0.84 0.01 0.00 0.13 0.00 0.00 42.46 41.64 2j6p s ILE 7 CO 0.24 0.25 0.87 -0.54 -1.91 0.00 0.00 174.94 173.84 2j6p s LYS 8 N -0.38 2.92 0.13 3.50 1.02 -1.26 -0.62 119.74 125.05 2j6p s LYS 8 Ca 0.04 -0.09 -0.19 0.00 0.02 0.00 0.00 55.97 55.76 2j6p s LYS 8 Cb -0.05 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.90 2j6p s LYS 8 CO -0.00 -0.65 1.77 -1.35 -0.92 0.00 0.00 175.35 174.20 2j6p h PRO 9 N -0.10 0.35 -0.51 -1.68 0.11 -1.96 -0.26 132.00 127.96 2j6p h PRO 9 Ca -0.45 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.73 2j6p h PRO 9 Cb 1.26 -0.08 -0.10 0.00 0.11 0.00 0.00 31.00 32.19 2j6p h PRO 9 CO 0.60 0.26 -0.22 0.93 -0.21 0.00 0.00 178.00 179.37 2j6p h GLU 10 N 0.34 -0.10 -1.00 1.05 3.07 -1.98 0.25 114.58 116.21 2j6p h GLU 10 Ca 0.10 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.98 2j6p h GLU 10 Cb -0.01 0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 27.87 2j6p h GLU 10 CO -0.02 -0.07 0.66 0.93 -1.40 0.00 0.00 179.01 179.12 2j6p h GLU 11 N -0.10 1.28 -0.12 2.33 5.08 -1.76 -2.36 114.58 118.94 2j6p h GLU 11 Ca 0.24 -0.08 -0.18 0.00 -1.00 0.00 0.00 59.36 58.34 2j6p h GLU 11 Cb 0.47 -0.29 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 2j6p h GLU 11 CO -0.57 0.85 -0.66 1.25 -1.00 0.00 0.00 179.01 178.88 2j6p h LEU 12 N 1.32 0.54 -1.24 1.33 5.85 -0.35 -2.30 115.31 120.47 2j6p h LEU 12 Ca 0.38 -0.33 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 2j6p h LEU 12 Cb -0.09 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 2j6p h LEU 12 CO -0.10 1.06 0.24 -0.37 -0.34 0.00 0.00 178.44 178.93 2j6p h VAL 13 N 0.34 1.19 -0.62 1.05 -1.51 -0.24 -0.80 116.25 115.66 2j6p h VAL 13 Ca -0.02 -0.56 0.09 0.00 -1.23 0.00 0.00 66.70 64.98 2j6p h VAL 13 Cb 1.22 0.52 -0.07 0.00 -2.13 0.00 0.00 31.29 30.83 2j6p h VAL 13 CO 0.12 0.23 0.26 -0.33 -1.23 0.00 0.00 177.57 176.62 2j6p h GLU 14 N 0.77 0.46 -0.31 5.19 4.39 -1.24 0.54 114.58 124.39 2j6p h GLU 14 Ca 0.19 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.83 2j6p h GLU 14 Cb 0.11 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2j6p h GLU 14 CO -0.02 0.30 0.08 1.25 -1.16 0.00 0.00 179.01 179.46 2j6p h LEU 15 N 0.47 0.46 -0.76 1.33 5.85 -1.08 -3.01 115.31 118.58 2j6p h LEU 15 Ca 0.30 -0.23 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 2j6p h LEU 15 Cb 0.34 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2j6p h LEU 15 CO -0.27 0.57 -0.59 -0.07 -0.34 0.00 0.00 178.44 177.74 2j6p h LEU 16 N 0.33 0.10 0.00 2.25 3.38 -0.69 -3.07 115.31 117.62 2j6p h LEU 16 Ca 0.10 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2j6p h LEU 16 Cb 0.29 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2j6p h LEU 16 CO 0.00 0.67 0.00 0.47 0.09 0.00 0.00 178.44 179.67 2j6p n ASP 17 N -3.85 0.00 -4.32 -0.43 8.00 0.19 -4.74 116.55 111.40 2j6p n ASP 17 Ca -0.02 -0.18 -0.34 0.00 0.71 0.00 0.00 54.79 54.96 2j6p n ASP 17 Cb 0.60 -0.25 -0.14 0.00 -0.02 0.00 0.00 41.12 41.30 2j6p n ASP 17 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2j6p s ASN 18 N -2.51 4.11 0.28 -2.24 2.47 -1.16 -5.00 114.94 110.89 2j6p s ASN 18 Ca 0.27 -0.39 -0.03 0.00 0.42 0.00 0.00 52.86 53.13 2j6p s ASN 18 Cb 0.18 -1.67 0.38 0.00 -1.45 0.00 0.00 41.25 38.69 2j6p s ASN 18 CO 0.40 0.05 1.92 -0.65 -3.72 0.00 0.00 177.10 175.10 2j6p h PRO 19 N 7.59 1.10 0.28 0.43 0.11 -1.86 0.62 132.00 140.27 2j6p h PRO 19 Ca -0.37 -0.10 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2j6p h PRO 19 Cb 1.18 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2j6p h PRO 19 CO 0.59 0.78 -0.13 -0.44 -0.21 0.00 0.00 178.00 178.59 2j6p h ASP 20 N 1.12 -0.31 -0.90 -2.05 3.45 -1.94 -1.91 116.42 113.88 2j6p h ASP 20 Ca 0.29 -0.22 0.18 0.00 0.43 0.00 0.00 57.03 57.71 2j6p h ASP 20 Cb -0.04 0.08 -0.11 0.00 -0.56 0.00 0.00 39.33 38.70 2j6p h ASP 20 CO -0.05 0.14 0.47 0.28 -1.57 0.00 0.00 179.24 178.51 2j6p h SER 21 N -0.88 0.54 -0.22 6.45 0.02 -1.80 -2.95 113.55 114.70 2j6p h SER 21 Ca -0.04 0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 2j6p h SER 21 Cb 0.51 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2j6p h SER 21 CO 0.06 0.17 0.00 0.25 -1.14 0.00 0.00 176.83 176.17 2j6p h LEU 22 N 0.59 0.38 -2.45 5.07 5.85 0.47 -1.71 115.31 123.51 2j6p h LEU 22 Ca 0.52 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2j6p h LEU 22 Cb 0.85 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.77 2j6p h LEU 22 CO -0.42 0.60 0.00 1.62 -0.34 0.00 0.00 178.44 179.90 2j6p h VAL 23 N 0.16 0.00 -0.01 1.05 3.04 -1.23 -2.04 116.25 117.21 2j6p h VAL 23 Ca 0.06 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 2j6p h VAL 23 Cb 0.40 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.80 2j6p h VAL 23 CO 0.01 0.00 -0.00 0.29 -1.01 0.00 0.00 177.57 176.86 2j6p n LYS 24 N -3.03 1.50 -5.05 4.17 5.02 -0.68 -4.72 118.16 115.36 2j6p n LYS 24 Ca -0.02 -0.73 -0.28 0.00 -2.02 0.00 0.00 58.31 55.26 2j6p n LYS 24 Cb 0.14 -1.48 -0.15 0.00 -0.02 0.00 0.00 35.03 33.51 2j6p n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j6p s ALA 25 N -2.00 1.90 -0.01 7.82 0.00 -0.77 0.13 121.76 128.82 2j6p s ALA 25 Ca 0.40 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.43 2j6p s ALA 25 Cb 0.21 -0.46 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 2j6p s ALA 25 CO 0.34 0.46 -0.24 0.00 0.00 0.00 0.00 175.76 176.33 2j6p s ALA 26 N -0.58 2.27 -0.21 0.00 0.00 0.36 -4.94 121.76 118.65 2j6p s ALA 26 Ca 0.09 -1.12 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 2j6p s ALA 26 Cb -0.09 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2j6p s ALA 26 CO -0.00 0.54 0.05 0.08 0.00 0.00 0.00 175.76 176.42 2j6p s VAL 27 N -0.67 4.41 -0.32 0.00 1.01 -1.26 -1.00 120.40 122.58 2j6p s VAL 27 Ca 0.11 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 2j6p s VAL 27 Cb -0.10 -3.02 0.02 0.00 0.00 0.00 0.00 36.38 33.29 2j6p s VAL 27 CO -0.00 0.40 0.09 -0.63 0.00 0.00 0.00 175.10 174.96 2j6p s ILE 28 N 1.00 3.87 -0.36 2.22 1.09 0.64 0.33 121.20 129.99 2j6p s ILE 28 Ca 0.03 -0.92 -0.22 0.00 -1.10 0.00 0.00 60.65 58.45 2j6p s ILE 28 Cb -0.14 -3.09 0.01 0.00 -1.06 0.00 0.00 42.46 38.17 2j6p s ILE 28 CO 0.03 -0.05 0.71 -0.62 -0.10 0.00 0.00 174.94 174.91 2j6p s ASP 29 N 1.45 6.49 -0.05 3.58 -1.08 0.12 -1.03 116.67 126.15 2j6p s ASP 29 Ca 0.00 0.25 0.21 0.00 -0.52 0.00 0.00 52.55 52.49 2j6p s ASP 29 Cb -0.18 -2.36 0.69 0.00 -1.46 0.00 0.00 42.92 39.60 2j6p s ASP 29 CO 0.03 -0.66 1.59 0.00 0.52 0.00 0.00 175.17 176.64 2j6p s ARG 31 N -1.37 1.52 0.00 0.00 0.52 -1.26 -2.18 118.95 116.18 2j6p s ARG 31 Ca 0.50 0.39 0.00 0.00 -0.52 0.00 0.00 55.73 56.10 2j6p s ARG 31 Cb 0.29 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.88 2j6p s ARG 31 CO 0.30 -1.96 0.00 -0.40 0.02 0.00 0.00 175.30 173.26 2j6p n ASP 32 N -3.62 0.00 -0.20 0.23 5.75 -1.26 -4.21 116.55 113.25 2j6p n ASP 32 Ca 0.07 0.00 0.13 0.00 -0.01 0.00 0.00 54.79 54.98 2j6p n ASP 32 Cb 0.58 0.00 0.42 0.00 -1.03 0.00 0.00 41.12 41.10 2j6p n ASP 32 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2j6p n SER 33 N -0.23 0.85 -1.01 -1.12 3.41 -1.26 -3.75 113.62 110.52 2j6p n SER 33 Ca 0.00 -0.75 0.10 0.00 -0.26 0.00 0.00 58.87 57.96 2j6p n SER 33 Cb 0.00 0.09 0.21 0.00 -0.26 0.00 0.00 64.21 64.25 2j6p n SER 33 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2j6p n ASP 34 N -0.79 3.30 -0.18 4.04 5.75 -1.26 -4.62 116.55 122.79 2j6p n ASP 34 Ca 0.12 -1.94 -0.07 0.00 -0.01 0.00 0.00 54.79 52.89 2j6p n ASP 34 Cb 0.33 -0.28 0.02 0.00 -1.03 0.00 0.00 41.12 40.16 2j6p n ASP 34 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2j6p h ARG 35 N 3.61 0.71 0.00 0.11 1.12 -1.86 -2.27 114.38 115.81 2j6p h ARG 35 Ca 0.00 -0.08 0.00 0.00 -1.11 0.00 0.00 59.98 58.79 2j6p h ARG 35 Cb 0.87 -0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.69 2j6p h ARG 35 CO 0.00 0.55 0.00 -0.25 -3.11 0.00 0.00 179.97 177.16 2j6p n ASP 36 N -4.65 0.00 -0.26 -3.80 8.00 -1.26 -3.25 116.55 111.33 2j6p n ASP 36 Ca 0.02 -1.36 0.02 0.00 0.71 0.00 0.00 54.79 54.18 2j6p n ASP 36 Cb 0.08 0.00 0.24 0.00 -0.02 0.00 0.00 41.12 41.42 2j6p n ASP 36 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j6p n GLY 38 N -1.41 2.60 3.82 0.00 0.00 -1.20 -4.93 105.19 104.07 2j6p n GLY 38 Ca 0.11 -0.70 -0.05 0.00 0.00 0.00 0.00 46.02 45.38 2j6p n GLY 38 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2j6p s PHE 39 N -2.00 -0.02 -0.05 1.61 -0.12 -0.21 -4.96 117.98 112.23 2j6p s PHE 39 Ca 0.00 -0.43 -0.18 0.00 -0.05 0.00 0.00 56.93 56.27 2j6p s PHE 39 Cb 0.00 0.72 -0.05 0.00 -0.63 0.00 0.00 43.02 43.06 2j6p s PHE 39 CO 0.00 -1.10 0.50 0.42 -0.05 0.00 0.00 175.22 174.99 2j6p s ILE 40 N -2.80 5.05 0.52 -4.49 1.01 -1.26 -1.17 121.20 118.05 2j6p s ILE 40 Ca 0.16 1.04 -0.22 0.00 0.00 0.00 0.00 60.65 61.62 2j6p s ILE 40 Cb -0.03 -3.84 -0.06 0.00 0.01 0.00 0.00 42.46 38.54 2j6p s ILE 40 CO 0.06 0.42 1.33 0.54 0.00 0.00 0.00 174.94 177.29 2j6p s VAL 41 N -0.06 2.28 -0.34 2.92 0.11 -1.26 -1.72 120.40 122.33 2j6p s VAL 41 Ca 0.27 0.21 0.00 0.00 -2.93 0.00 0.00 61.98 59.54 2j6p s VAL 41 Cb -0.17 -3.11 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 2j6p s VAL 41 CO 0.13 0.00 0.00 0.59 -3.33 0.00 0.00 175.10 172.50 2j6p n ASN 42 N -0.81 -5.52 -4.69 3.54 3.02 -1.26 -4.97 115.26 104.57 2j6p n ASN 42 Ca 0.09 0.08 -0.38 0.00 -0.03 0.00 0.00 54.58 54.34 2j6p n ASN 42 Cb 0.45 -3.30 0.05 0.00 -0.61 0.00 0.00 39.78 36.37 2j6p n ASN 42 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2j6p n SER 43 N -0.87 1.95 -4.63 6.41 3.41 -0.70 -4.73 113.62 114.45 2j6p n SER 43 Ca -0.03 0.92 -0.39 0.00 -0.26 0.00 0.00 58.87 59.10 2j6p n SER 43 Cb 0.46 -1.50 -0.08 0.00 -0.26 0.00 0.00 64.21 62.83 2j6p n SER 43 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2j6p s ILE 44 N -1.36 5.13 -0.40 -1.33 1.01 0.15 -4.90 121.20 119.50 2j6p s ILE 44 Ca 0.73 0.77 -0.26 0.00 0.00 0.00 0.00 60.65 61.90 2j6p s ILE 44 Cb -0.43 -3.77 0.02 0.00 0.01 0.00 0.00 42.46 38.29 2j6p s ILE 44 CO 0.48 0.15 0.93 0.20 0.00 0.00 0.00 174.94 176.70 2j6p s ASN 45 N 1.40 6.61 -0.61 3.58 0.01 -1.26 0.15 114.94 124.82 2j6p s ASN 45 Ca 0.19 0.41 0.04 0.00 -0.71 0.00 0.00 52.86 52.80 2j6p s ASN 45 Cb -0.15 -2.46 0.15 0.00 0.41 0.00 0.00 41.25 39.20 2j6p s ASN 45 CO 0.09 -0.93 0.38 -0.04 -1.51 0.00 0.00 177.10 175.09 2j6p s MET 46 N 3.59 2.15 -0.21 -0.60 -1.94 -0.76 -4.97 119.30 116.57 2j6p s MET 46 Ca 0.38 -2.94 -0.28 0.00 -1.71 0.00 0.00 55.69 51.13 2j6p s MET 46 Cb -0.11 -3.25 -0.05 0.00 2.01 0.00 0.00 34.83 33.43 2j6p s MET 46 CO 0.22 -1.21 2.09 -1.25 -0.01 0.00 0.00 175.02 174.86 2j6p s PRO 47 N -0.84 3.31 0.51 2.03 0.04 -1.26 -4.29 135.00 134.50 2j6p s PRO 47 Ca 0.22 1.98 0.24 0.00 0.04 0.00 0.00 61.00 63.47 2j6p s PRO 47 Cb -0.14 -4.30 1.33 0.00 0.04 0.00 0.00 34.50 31.43 2j6p s PRO 47 CO -0.09 -1.89 1.97 1.15 0.04 0.00 0.00 177.00 178.18 2j6p h THR 48 N 6.87 0.73 0.00 1.26 2.02 -1.70 -1.03 112.91 121.06 2j6p h THR 48 Ca -0.40 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.71 2j6p h THR 48 Cb 1.22 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 2j6p h THR 48 CO 0.97 0.02 -0.15 -0.29 0.37 0.00 0.00 175.52 176.44 2j6p h ILE 49 N 0.09 0.80 0.00 3.11 2.10 -1.88 -3.30 117.51 118.43 2j6p h ILE 49 Ca 0.29 -0.57 0.00 0.00 1.08 0.00 0.00 64.86 65.66 2j6p h ILE 49 Cb 1.03 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 38.10 2j6p h ILE 49 CO -0.03 0.15 0.00 -1.54 -1.08 0.00 0.00 178.15 175.65 2j6p n SER 50 N -3.92 0.43 -4.79 2.19 3.41 -0.81 -5.06 113.62 105.07 2j6p n SER 50 Ca -0.02 -1.00 -0.36 0.00 -0.26 0.00 0.00 58.87 57.23 2j6p n SER 50 Cb 0.24 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 2j6p n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2j6p s THR 52 N -1.78 2.06 0.20 0.00 -4.23 -1.26 -5.01 115.64 105.61 2j6p s THR 52 Ca 0.62 -2.07 -0.11 0.00 -1.18 0.00 0.00 61.69 58.94 2j6p s THR 52 Cb -0.20 -2.86 0.16 0.00 1.34 0.00 0.00 72.50 70.94 2j6p s THR 52 CO 0.25 -0.08 1.69 -0.08 -0.54 0.00 0.00 174.62 175.86 2j6p h GLU 53 N 1.88 0.17 0.00 3.99 4.81 -2.00 -0.21 114.58 123.22 2j6p h GLU 53 Ca -0.43 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 58.74 2j6p h GLU 53 Cb 1.24 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 2j6p h GLU 53 CO 0.77 0.11 -0.24 1.49 -0.73 0.00 0.00 179.01 180.41 2j6p h GLU 54 N 0.17 0.00 -0.60 1.92 4.81 -1.98 -1.47 114.58 117.43 2j6p h GLU 54 Ca 0.30 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 2j6p h GLU 54 Cb 0.45 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2j6p h GLU 54 CO -0.44 0.24 0.17 0.52 -0.73 0.00 0.00 179.01 178.77 2j6p h MET 55 N 0.00 0.94 0.00 1.92 2.86 -1.44 0.10 114.93 119.31 2j6p h MET 55 Ca -0.00 -0.21 -0.09 0.00 -2.06 0.00 0.00 59.70 57.34 2j6p h MET 55 Cb 0.59 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 2j6p h MET 55 CO 0.03 0.85 -0.42 1.88 1.06 0.00 0.00 176.91 180.31 2j6p h TYR 56 N 0.86 0.00 -0.36 -0.22 -1.99 -1.03 -1.96 116.97 112.27 2j6p h TYR 56 Ca 0.19 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.82 2j6p h TYR 56 Cb 0.31 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 2j6p h TYR 56 CO 0.02 0.42 -0.17 0.93 -0.00 0.00 0.00 178.16 179.35 2j6p h GLU 57 N 0.00 0.75 -0.26 4.88 5.08 -0.87 -0.22 114.58 123.93 2j6p h GLU 57 Ca -0.00 -0.33 -0.08 0.00 -1.00 0.00 0.00 59.36 57.95 2j6p h GLU 57 Cb 0.82 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 2j6p h GLU 57 CO 0.05 0.94 -0.13 0.87 -1.00 0.00 0.00 179.01 179.74 2j6p h LYS 58 N 0.54 0.55 -0.05 2.33 1.57 -0.70 -1.32 116.57 119.49 2j6p h LYS 58 Ca 0.08 -0.25 0.04 0.00 -1.87 0.00 0.00 60.65 58.65 2j6p h LYS 58 Cb 0.71 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.96 2j6p h LYS 58 CO 0.05 0.81 -0.30 1.25 -0.57 0.00 0.00 179.45 180.69 2j6p h LEU 59 N 0.28 -0.90 -0.54 2.94 6.46 -1.24 0.18 115.31 122.49 2j6p h LEU 59 Ca 0.06 0.13 0.11 0.00 -0.12 0.00 0.00 57.88 58.05 2j6p h LEU 59 Cb 0.65 0.37 -0.10 0.00 -0.73 0.00 0.00 40.66 40.85 2j6p h LEU 59 CO 0.04 -0.36 -0.08 0.00 -0.62 0.00 0.00 178.44 177.43 2j6p h ALA 60 N 0.38 0.43 -0.04 1.25 0.00 -0.76 0.73 119.26 121.25 2j6p h ALA 60 Ca 0.08 0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.19 2j6p h ALA 60 Cb 0.53 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2j6p h ALA 60 CO -0.29 -0.42 -0.04 -0.22 0.00 0.00 0.00 179.25 178.28 2j6p h LYS 61 N 0.04 -0.05 -0.82 0.00 3.64 -1.07 -1.65 116.57 116.66 2j6p h LYS 61 Ca 0.27 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.68 2j6p h LYS 61 Cb 0.42 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 2j6p h LYS 61 CO -0.52 -0.03 0.53 1.15 -2.27 0.00 0.00 179.45 178.31 2j6p h THR 62 N -0.05 1.15 0.00 1.00 2.02 0.48 -2.21 112.91 115.30 2j6p h THR 62 Ca 0.03 -0.36 -0.21 0.00 0.77 0.00 0.00 66.41 66.64 2j6p h THR 62 Cb 0.10 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 2j6p h THR 62 CO -0.07 0.19 -0.99 -0.07 0.37 0.00 0.00 175.52 174.95 2j6p h LEU 63 N 1.05 0.01 0.53 2.58 3.38 -0.79 0.17 115.31 122.23 2j6p h LEU 63 Ca 0.32 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.27 2j6p h LEU 63 Cb -0.02 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2j6p h LEU 63 CO -0.10 0.99 -0.42 0.15 0.09 0.00 0.00 178.44 179.15 2j6p h PHE 64 N 0.00 -1.13 -0.95 1.13 3.57 -1.17 -1.13 116.94 117.26 2j6p h PHE 64 Ca -0.01 -0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.66 2j6p h PHE 64 Cb 1.75 0.42 -0.10 0.00 2.79 0.00 0.00 35.95 40.81 2j6p h PHE 64 CO 0.00 -0.60 0.54 0.93 -2.23 0.00 0.00 178.31 176.96 2j6p h GLU 65 N -0.93 0.70 0.00 1.11 5.08 -1.38 0.31 114.58 119.46 2j6p h GLU 65 Ca -0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2j6p h GLU 65 Cb 0.79 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2j6p h GLU 65 CO 0.00 0.46 0.00 0.39 -1.00 0.00 0.00 179.01 178.86 2j6p n GLU 66 N -4.80 0.95 -1.27 2.33 1.02 0.58 -4.88 120.64 114.56 2j6p n GLU 66 Ca 0.21 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.31 2j6p n GLU 66 Cb 0.51 -1.37 -0.01 0.00 -0.02 0.00 0.00 31.44 30.55 2j6p n GLU 66 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2j6p n LYS 67 N -0.87 -0.26 -2.42 3.49 4.01 0.11 -4.98 118.16 117.24 2j6p n LYS 67 Ca 0.17 0.55 -0.37 0.00 -0.51 0.00 0.00 58.31 58.15 2j6p n LYS 67 Cb 0.08 -4.21 -0.03 0.00 -0.51 0.00 0.00 35.03 30.36 2j6p n LYS 67 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2j6p s LYS 68 N -2.63 4.08 -0.01 1.97 -0.14 -0.46 -4.80 119.74 117.76 2j6p s LYS 68 Ca 0.00 1.66 0.12 0.00 -1.36 0.00 0.00 55.97 56.38 2j6p s LYS 68 Cb 0.00 -2.58 -0.15 0.00 -1.68 0.00 0.00 37.83 33.42 2j6p s LYS 68 CO 0.00 -0.25 0.38 0.39 -0.76 0.00 0.00 175.35 175.12 2j6p n GLU 69 N -0.05 1.93 -4.08 1.68 1.02 0.34 -3.30 120.64 118.18 2j6p n GLU 69 Ca 0.05 -0.05 -0.18 0.00 -0.02 0.00 0.00 57.16 56.96 2j6p n GLU 69 Cb 0.48 -1.15 -0.16 0.00 -0.02 0.00 0.00 31.44 30.60 2j6p n GLU 69 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2j6p s LEU 70 N -3.12 1.42 -0.22 -4.62 1.02 -0.61 -0.78 118.68 111.78 2j6p s LEU 70 Ca 0.00 -0.08 0.01 0.00 0.02 0.00 0.00 54.13 54.08 2j6p s LEU 70 Cb 0.08 -0.32 0.05 0.00 0.02 0.00 0.00 46.19 46.02 2j6p s LEU 70 CO 0.48 -0.04 -0.07 0.00 0.02 0.00 0.00 176.35 176.74 2j6p s ALA 71 N 0.72 1.92 -0.32 4.21 0.00 0.66 -0.49 121.76 128.45 2j6p s ALA 71 Ca -0.08 -1.25 -0.11 0.00 0.00 0.00 0.00 51.96 50.52 2j6p s ALA 71 Cb -0.12 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 2j6p s ALA 71 CO -0.01 -1.04 0.19 0.08 0.00 0.00 0.00 175.76 174.98 2j6p s VAL 72 N 1.42 4.83 -0.18 0.00 1.01 -0.17 -0.04 120.40 127.27 2j6p s VAL 72 Ca -0.04 -0.37 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 2j6p s VAL 72 Cb -0.18 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2j6p s VAL 72 CO -0.07 0.02 0.15 -0.36 0.00 0.00 0.00 175.10 174.84 2j6p s PHE 73 N 1.65 3.44 0.04 5.22 0.40 0.30 -0.26 117.98 128.77 2j6p s PHE 73 Ca 0.05 0.38 -0.03 0.00 -0.60 0.00 0.00 56.93 56.73 2j6p s PHE 73 Cb -0.17 -2.14 -0.02 0.00 0.51 0.00 0.00 43.02 41.19 2j6p s PHE 73 CO 0.08 0.35 0.03 -3.38 0.70 0.00 0.00 175.22 172.99 2j6p s HIS 74 N 0.17 0.33 0.00 0.36 -3.43 -0.20 -0.63 115.29 111.89 2j6p s HIS 74 Ca 0.10 -0.72 0.00 0.00 -0.80 0.00 0.00 55.06 53.64 2j6p s HIS 74 Cb -0.11 -0.24 0.00 0.00 -1.43 0.00 0.00 32.58 30.80 2j6p s HIS 74 CO -0.01 -0.34 0.00 0.00 -2.00 0.00 0.00 174.74 172.39 2j6p h ALA 76 N 1.00 0.14 0.00 0.00 0.00 -1.93 0.26 119.26 118.72 2j6p h ALA 76 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2j6p h ALA 76 Cb 0.00 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2j6p h ALA 76 CO 0.00 0.37 -0.54 1.04 0.00 0.00 0.00 179.25 180.12 2j6p n GLN 77 N -4.52 3.49 -3.64 0.00 6.02 -1.26 -0.40 117.38 117.07 2j6p n GLN 77 Ca -0.21 -0.01 -0.26 0.00 -0.01 0.00 0.00 57.00 56.52 2j6p n GLN 77 Cb 0.57 -0.99 0.06 0.00 1.02 0.00 0.00 30.24 30.90 2j6p n GLN 77 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2j6p n SER 78 N -1.28 -5.92 -0.09 1.08 7.64 -1.26 -3.36 113.62 110.43 2j6p n SER 78 Ca 0.02 -0.58 -0.12 0.00 1.01 0.00 0.00 58.87 59.19 2j6p n SER 78 Cb 0.16 -4.68 -0.08 0.00 -1.01 0.00 0.00 64.21 58.60 2j6p n SER 78 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2j6p n LEU 79 N -4.83 2.95 -0.02 -3.43 4.77 -1.26 -4.65 117.00 110.53 2j6p n LEU 79 Ca 0.01 -0.09 -0.05 0.00 -0.03 0.00 0.00 56.01 55.85 2j6p n LEU 79 Cb 0.55 -0.60 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 2j6p n LEU 79 CO 0.66 0.78 -0.52 0.52 -1.33 0.00 0.00 177.39 177.50 2j6p n VAL 80 N -3.02 0.74 0.11 4.08 0.31 -1.26 -4.77 118.33 114.51 2j6p n VAL 80 Ca -0.31 0.07 -0.23 0.00 -0.01 0.00 0.00 64.34 63.86 2j6p n VAL 80 Cb 0.82 -1.67 -0.15 0.00 -0.91 0.00 0.00 33.84 31.94 2j6p n VAL 80 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2j6p h ARG 81 N -0.25 0.50 -0.34 5.55 3.08 -1.93 -2.67 114.38 118.31 2j6p h ARG 81 Ca -0.11 -0.80 -0.10 0.00 0.07 0.00 0.00 59.98 59.04 2j6p h ARG 81 Cb 0.81 0.29 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 2j6p h ARG 81 CO -0.07 1.38 -0.19 0.00 -1.07 0.00 0.00 179.97 180.02 2j6p h ALA 82 N 0.16 0.48 -0.56 0.04 0.00 -1.88 -0.34 119.26 117.16 2j6p h ALA 82 Ca -0.21 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2j6p h ALA 82 Cb 1.97 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.62 2j6p h ALA 82 CO 0.24 0.42 0.36 -1.35 0.00 0.00 0.00 179.25 178.92 2j6p h PRO 83 N 0.50 0.74 -0.27 0.00 0.11 -1.83 0.15 132.00 131.42 2j6p h PRO 83 Ca 0.07 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.04 2j6p h PRO 83 Cb 0.74 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.68 2j6p h PRO 83 CO 0.06 0.50 -0.18 -0.22 -0.21 0.00 0.00 178.00 177.94 2j6p h LYS 84 N 0.76 0.60 -0.90 1.05 3.64 -1.29 -0.35 116.57 120.08 2j6p h LYS 84 Ca 0.20 -0.28 0.07 0.00 -1.27 0.00 0.00 60.65 59.37 2j6p h LYS 84 Cb -0.07 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.68 2j6p h LYS 84 CO -0.04 0.87 0.56 0.78 -2.27 0.00 0.00 179.45 179.34 2j6p h GLY 85 N 0.32 1.37 1.28 5.01 0.00 0.09 -0.30 103.07 110.85 2j6p h GLY 85 Ca 0.05 -0.40 -0.26 0.00 0.00 0.00 0.00 47.33 46.73 2j6p h GLY 85 CO 0.05 0.25 -1.02 0.00 0.00 0.00 0.00 176.54 175.83 2j6p h ALA 86 N 1.43 0.18 -0.39 3.60 0.00 -0.66 -0.89 119.26 122.55 2j6p h ALA 86 Ca 0.40 -0.70 0.06 0.00 0.00 0.00 0.00 54.91 54.67 2j6p h ALA 86 Cb 0.22 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 2j6p h ALA 86 CO -0.19 0.71 0.06 -0.91 0.00 0.00 0.00 179.25 178.93 2j6p h ASN 87 N 0.37 -0.02 -0.15 0.00 2.35 -0.73 0.57 115.58 117.96 2j6p h ASN 87 Ca -0.12 0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 55.56 2j6p h ASN 87 Cb 1.67 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 40.13 2j6p h ASN 87 CO 0.20 0.02 -0.40 0.03 -1.65 0.00 0.00 177.43 175.62 2j6p h ARG 88 N 0.18 0.69 -0.09 0.81 3.08 -0.78 -1.58 114.38 116.69 2j6p h ARG 88 Ca 0.19 -0.36 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 2j6p h ARG 88 Cb 0.23 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 2j6p h ARG 88 CO -0.26 0.97 0.01 0.35 -1.07 0.00 0.00 179.97 179.97 2j6p h PHE 89 N 0.56 0.17 -0.47 3.04 3.57 -0.86 -1.05 116.94 121.90 2j6p h PHE 89 Ca 0.05 -0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.62 2j6p h PHE 89 Cb 0.94 -0.04 -0.09 0.00 2.79 0.00 0.00 35.95 39.54 2j6p h PHE 89 CO 0.05 0.38 -0.13 0.00 -2.23 0.00 0.00 178.31 176.38 2j6p h ALA 90 N 0.76 0.29 -0.52 2.41 0.00 0.42 0.07 119.26 122.70 2j6p h ALA 90 Ca 0.03 0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2j6p h ALA 90 Cb 0.31 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2j6p h ALA 90 CO 0.00 -0.45 0.31 1.25 0.00 0.00 0.00 179.25 180.36 2j6p h LEU 91 N -0.01 0.50 -1.16 0.00 5.85 -1.24 -0.69 115.31 118.55 2j6p h LEU 91 Ca 0.23 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2j6p h LEU 91 Cb 0.36 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 2j6p h LEU 91 CO -0.49 0.35 0.41 0.00 -0.34 0.00 0.00 178.44 178.37 2j6p h ALA 92 N 1.23 1.36 -0.49 1.25 0.00 -0.42 -1.46 119.26 120.74 2j6p h ALA 92 Ca 0.21 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2j6p h ALA 92 Cb 0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 2j6p h ALA 92 CO -0.10 0.53 0.13 1.96 0.00 0.00 0.00 179.25 181.77 2j6p h GLN 93 N 1.00 0.78 -0.33 0.00 4.20 0.14 -1.64 115.11 119.25 2j6p h GLN 93 Ca 0.26 -0.18 -0.13 0.00 0.06 0.00 0.00 58.65 58.66 2j6p h GLN 93 Cb 0.00 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2j6p h GLN 93 CO -0.04 0.75 -0.31 -0.22 -0.67 0.00 0.00 178.83 178.34 2j6p h LYS 94 N 0.67 0.71 -0.22 1.46 3.11 -0.46 -1.25 116.57 120.59 2j6p h LYS 94 Ca 0.16 -0.32 -0.13 0.00 -2.81 0.00 0.00 60.65 57.54 2j6p h LYS 94 Cb 0.32 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 2j6p h LYS 94 CO 0.00 0.93 -0.43 -0.22 -2.81 0.00 0.00 179.45 176.92 2j6p h LYS 95 N 0.60 0.53 -0.13 1.90 3.64 -1.12 -3.07 116.57 118.92 2j6p h LYS 95 Ca 0.07 -0.28 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2j6p h LYS 95 Cb 0.82 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2j6p h LYS 95 CO 0.07 0.86 0.00 1.28 -2.27 0.00 0.00 179.45 179.39 2j6p n LEU 96 N -4.02 2.06 -3.67 5.20 4.77 -0.63 -4.95 117.00 115.76 2j6p n LEU 96 Ca -0.02 -0.79 -0.24 0.00 -0.03 0.00 0.00 56.01 54.93 2j6p n LEU 96 Cb 0.53 -0.08 0.06 0.00 -2.33 0.00 0.00 43.42 41.60 2j6p n LEU 96 CO 0.45 0.40 0.15 0.61 -1.33 0.00 0.00 177.39 177.67 2j6p n GLY 97 N 1.23 -0.48 3.71 -0.72 0.00 -0.60 -5.05 105.19 103.28 2j6p n GLY 97 Ca 0.17 0.20 -0.23 0.00 0.00 0.00 0.00 46.02 46.16 2j6p n GLY 97 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j6p s TYR 98 N -3.36 2.86 0.00 1.61 4.12 -0.58 -5.01 117.35 117.00 2j6p s TYR 98 Ca 0.45 -0.17 0.00 0.00 0.02 0.00 0.00 57.07 57.37 2j6p s TYR 98 Cb -0.21 -1.30 0.00 0.00 -1.52 0.00 0.00 41.96 38.94 2j6p s TYR 98 CO 0.77 0.57 0.00 1.55 0.02 0.00 0.00 175.55 178.46 2j6p n VAL 99 N -0.86 0.00 -4.28 0.71 3.14 -1.26 -4.43 118.33 111.34 2j6p n VAL 99 Ca -0.07 -0.18 -0.18 0.00 -2.96 0.00 0.00 64.34 60.95 2j6p n VAL 99 Cb 0.58 0.98 -0.13 0.00 -1.06 0.00 0.00 33.84 34.21 2j6p n VAL 99 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 2j6p s LEU 100 N -0.73 2.12 0.74 6.55 2.96 -1.26 -4.04 118.68 125.02 2j6p s LEU 100 Ca 0.00 -0.34 -0.14 0.00 -0.22 0.00 0.00 54.13 53.43 2j6p s LEU 100 Cb 0.00 -0.44 0.04 0.00 0.50 0.00 0.00 46.19 46.30 2j6p s LEU 100 CO 0.00 0.02 1.16 -2.16 -1.32 0.00 0.00 176.35 174.04 2j6p s PRO 101 N -0.82 2.19 0.48 0.98 0.04 -1.21 -4.33 135.00 132.34 2j6p s PRO 101 Ca -0.00 1.55 -0.13 0.00 0.04 0.00 0.00 61.00 62.46 2j6p s PRO 101 Cb -0.06 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 2j6p s PRO 101 CO 0.00 -1.75 0.90 0.00 0.04 0.00 0.00 177.00 176.19 2j6p s ALA 102 N -2.30 3.19 -0.15 8.56 0.00 0.04 -4.79 121.76 126.32 2j6p s ALA 102 Ca 0.69 -0.02 -0.01 0.00 0.00 0.00 0.00 51.96 52.62 2j6p s ALA 102 Cb -0.24 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 2j6p s ALA 102 CO 0.47 -0.20 -0.10 0.08 0.00 0.00 0.00 175.76 176.02 2j6p s VAL 103 N -2.58 3.31 0.09 0.00 1.01 -1.26 -0.25 120.40 120.71 2j6p s VAL 103 Ca 0.55 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 62.04 2j6p s VAL 103 Cb -0.10 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 2j6p s VAL 103 CO 0.34 0.51 -0.18 -0.31 0.00 0.00 0.00 175.10 175.45 2j6p s TYR 104 N 0.48 1.54 -0.09 5.22 2.02 0.95 -2.00 117.35 125.46 2j6p s TYR 104 Ca -0.07 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.21 2j6p s TYR 104 Cb -0.15 -0.85 -0.02 0.00 -0.40 0.00 0.00 41.96 40.54 2j6p s TYR 104 CO 0.04 0.14 -0.14 0.08 -1.57 0.00 0.00 175.55 174.09 2j6p s VAL 105 N -1.21 2.98 -0.28 0.71 1.01 -0.13 -0.54 120.40 122.95 2j6p s VAL 105 Ca 0.03 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.00 2j6p s VAL 105 Cb -0.10 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2j6p s VAL 105 CO 0.03 0.55 1.05 -0.22 0.00 0.00 0.00 175.10 176.52 2j6p s LEU 106 N -0.11 4.01 0.17 3.92 2.96 0.20 -1.38 118.68 128.44 2j6p s LEU 106 Ca -0.02 1.17 -0.32 0.00 -0.22 0.00 0.00 54.13 54.75 2j6p s LEU 106 Cb -0.14 -3.52 -0.11 0.00 0.50 0.00 0.00 46.19 42.92 2j6p s LEU 106 CO 0.04 -0.78 1.74 -0.60 -1.32 0.00 0.00 176.35 175.42 2j6p s ARG 107 N 3.43 4.14 0.00 1.98 3.00 0.20 -1.39 118.95 130.32 2j6p s ARG 107 Ca 0.44 2.56 0.00 0.00 -1.00 0.00 0.00 55.73 57.73 2j6p s ARG 107 Cb -0.13 -3.29 0.00 0.00 0.00 0.00 0.00 34.95 31.53 2j6p s ARG 107 CO 0.11 -0.77 0.00 0.41 0.00 0.00 0.00 175.30 175.06 2j6p n GLY 108 N 4.04 2.34 7.00 8.12 0.00 -1.25 -4.70 105.19 120.75 2j6p n GLY 108 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2j6p n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j6p n GLY 109 N -2.00 0.80 0.25 -0.02 0.00 -0.49 -2.19 105.19 101.55 2j6p n GLY 109 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 46.02 45.22 2j6p n GLY 109 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2j6p h TRP 110 N 0.00 0.41 -0.25 1.61 2.91 0.13 -2.47 115.95 118.29 2j6p h TRP 110 Ca 0.00 -0.05 0.06 0.00 1.13 0.00 0.00 58.89 60.03 2j6p h TRP 110 Cb 0.00 -0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 28.48 2j6p h TRP 110 CO 0.00 0.48 -0.11 1.49 -1.03 0.00 0.00 178.44 179.26 2j6p h GLU 111 N 0.37 -0.08 -0.19 2.65 4.81 -0.76 -1.44 114.58 119.95 2j6p h GLU 111 Ca 0.07 0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.13 2j6p h GLU 111 Cb 0.39 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 2j6p h GLU 111 CO 0.02 -0.05 -0.62 0.00 -0.73 0.00 0.00 179.01 177.63 2j6p h ALA 112 N 1.13 0.54 0.03 2.92 0.00 -1.24 0.44 119.26 123.08 2j6p h ALA 112 Ca 0.13 -0.55 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2j6p h ALA 112 Cb 0.28 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2j6p h ALA 112 CO -0.30 0.70 -0.09 0.35 0.00 0.00 0.00 179.25 179.91 2j6p h PHE 113 N 0.49 -0.23 -0.23 0.00 3.57 -1.23 0.18 116.94 119.49 2j6p h PHE 113 Ca -0.01 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.36 2j6p h PHE 113 Cb 1.21 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 2j6p h PHE 113 CO 0.06 -0.14 -0.42 -0.92 -2.23 0.00 0.00 178.31 174.66 2j6p h TYR 114 N -0.18 0.66 -0.73 0.41 3.20 -1.22 -0.02 116.97 119.09 2j6p h TYR 114 Ca 0.02 -0.19 -0.04 0.00 3.14 0.00 0.00 58.73 61.66 2j6p h TYR 114 Cb 0.20 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 2j6p h TYR 114 CO -0.14 0.88 0.29 1.25 -1.64 0.00 0.00 178.16 178.79 2j6p h HIS 115 N 0.45 1.11 -0.03 -3.82 2.76 -0.54 0.23 115.15 115.30 2j6p h HIS 115 Ca 0.04 -0.09 -0.22 0.00 -2.20 0.00 0.00 60.37 57.90 2j6p h HIS 115 Cb 0.92 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2j6p h HIS 115 CO 0.04 0.85 -0.89 1.98 -1.30 0.00 0.00 177.93 178.61 2j6p h MET 116 N 1.04 0.48 0.00 5.26 1.85 -0.34 -3.39 114.93 119.83 2j6p h MET 116 Ca 0.24 -0.47 0.00 0.00 -0.61 0.00 0.00 59.70 58.86 2j6p h MET 116 Cb 0.22 0.12 0.00 0.00 0.43 0.00 0.00 31.60 32.37 2j6p h MET 116 CO -0.02 1.12 0.00 0.66 -0.40 0.00 0.00 176.91 178.27 2j6p n TYR 117 N -3.80 0.00 -0.11 1.39 4.02 -0.05 -4.67 117.16 113.94 2j6p n TYR 117 Ca -0.07 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.84 2j6p n TYR 117 Cb 0.80 0.00 0.31 0.00 -0.02 0.00 0.00 39.34 40.43 2j6p n TYR 117 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2j6p h GLY 118 N 0.00 0.83 0.00 2.72 0.00 -0.68 0.20 103.07 106.14 2j6p h GLY 118 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2j6p h GLY 118 CO 0.00 0.33 -1.68 2.09 0.00 0.00 0.00 176.54 177.28 2j6p n ASP 119 N -4.41 1.29 0.14 0.19 5.68 -1.26 -4.14 116.55 114.04 2j6p n ASP 119 Ca 0.05 -0.05 0.01 0.00 -0.50 0.00 0.00 54.79 54.30 2j6p n ASP 119 Cb 0.08 1.69 0.17 0.00 -1.14 0.00 0.00 41.12 41.92 2j6p n ASP 119 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 2j6p h VAL 120 N 0.00 1.23 -2.14 2.12 2.07 -1.82 -3.40 116.25 114.31 2j6p h VAL 120 Ca 0.00 -2.12 -0.56 0.00 0.82 0.00 0.00 66.70 64.84 2j6p h VAL 120 Cb 0.71 2.20 -0.41 0.00 -1.52 0.00 0.00 31.29 32.28 2j6p h VAL 120 CO 0.00 0.57 -0.86 0.54 0.02 0.00 0.00 177.57 177.84 2j6p n ARG 121 N -3.58 2.06 0.05 1.57 5.12 0.70 -4.88 116.66 117.70 2j6p n ARG 121 Ca -0.00 -4.15 0.10 0.00 -1.93 0.00 0.00 57.85 51.87 2j6p n ARG 121 Cb 0.64 -1.93 0.42 0.00 -1.16 0.00 0.00 32.46 30.43 2j6p n ARG 121 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2j6p n PRO 122 N 0.41 0.09 0.30 5.56 -0.04 -1.26 -0.33 135.00 139.73 2j6p n PRO 122 Ca 0.27 0.27 0.18 0.00 -0.04 0.00 0.00 63.50 64.19 2j6p n PRO 122 Cb 0.49 -1.66 0.90 0.00 -0.04 0.00 0.00 33.50 33.19 2j6p n PRO 122 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2j6p h ASP 123 N 0.00 0.00 0.40 3.54 2.03 -1.92 -1.64 116.42 118.82 2j6p h ASP 123 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2j6p h ASP 123 Cb 0.37 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.87 2j6p h ASP 123 CO 0.00 0.04 -0.38 0.18 -1.03 0.00 0.00 179.24 178.05 2j6p n LEU 124 N -3.27 0.70 -4.41 0.15 4.77 0.55 -4.86 117.00 110.63 2j6p n LEU 124 Ca -0.02 -0.10 -0.37 0.00 -0.03 0.00 0.00 56.01 55.50 2j6p n LEU 124 Cb 0.20 -0.20 -0.12 0.00 -2.33 0.00 0.00 43.42 40.96 2j6p n LEU 124 CO 0.25 0.15 -0.26 -0.04 -1.33 0.00 0.00 177.39 176.16 2j6p s MET 125 N -2.78 3.39 0.15 3.23 -1.94 -1.08 -4.54 119.30 115.73 2j6p s MET 125 Ca 0.17 -0.66 0.06 0.00 -1.71 0.00 0.00 55.69 53.55 2j6p s MET 125 Cb 0.18 -3.39 -0.04 0.00 2.01 0.00 0.00 34.83 33.60 2j6p s MET 125 CO 0.62 -0.33 0.02 0.71 -0.01 0.00 0.00 175.02 176.03 2j6p s TYR 126 N 1.57 2.94 0.22 -0.03 1.51 -0.31 -0.57 117.35 122.68 2j6p s TYR 126 Ca 0.05 -0.08 -0.00 0.00 -1.01 0.00 0.00 57.07 56.02 2j6p s TYR 126 Cb -0.16 -1.45 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 2j6p s TYR 126 CO 0.04 0.50 0.16 0.14 -1.11 0.00 0.00 175.55 175.28 2j6p s VAL 127 N -1.59 0.00 -0.00 0.71 -7.23 -0.83 -1.05 120.40 110.41 2j6p s VAL 127 Ca 0.27 -1.98 0.08 0.00 -1.81 0.00 0.00 61.98 58.55 2j6p s VAL 127 Cb -0.10 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 2j6p s VAL 127 CO 0.19 0.00 -0.26 -0.54 -0.31 0.00 0.00 175.10 174.19 2j6p s LYS 128 N -4.05 2.04 0.02 4.82 1.02 -1.26 -1.38 119.74 120.94 2j6p s LYS 128 Ca 0.39 -0.97 -0.02 0.00 0.02 0.00 0.00 55.97 55.39 2j6p s LYS 128 Cb 0.06 -2.04 -0.02 0.00 -0.52 0.00 0.00 37.83 35.32 2j6p s LYS 128 CO 0.14 0.55 0.01 -1.17 -0.92 0.00 0.00 175.35 173.96 2j6p s LEU 129 N -0.79 2.09 0.00 3.17 1.98 -0.97 -4.85 118.68 119.31 2j6p s LEU 129 Ca 0.11 -0.43 0.00 0.00 -2.89 0.00 0.00 54.13 50.91 2j6p s LEU 129 Cb -0.10 0.22 0.00 0.00 0.66 0.00 0.00 46.19 46.97 2j6p s LEU 129 CO -0.00 -0.31 0.00 0.61 -1.89 0.00 0.00 176.35 174.76 2j6p n GLY 130 N 1.58 0.30 0.20 7.98 0.00 -1.26 -1.06 105.19 112.92 2j6p n GLY 130 Ca -0.24 -2.06 0.14 0.00 0.00 0.00 0.00 46.02 43.86 2j6p n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2j6p h PRO 131 N 0.00 0.00 -0.01 1.61 0.13 -2.01 -1.68 132.00 130.03 2j6p h PRO 131 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2j6p h PRO 131 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2j6p h PRO 131 CO 0.00 0.00 -0.11 0.39 -0.23 0.00 0.00 178.00 178.05 2j6p n GLU 132 N -2.80 1.29 -3.54 0.86 1.02 -1.26 -5.03 120.64 111.17 2j6p n GLU 132 Ca 0.03 -1.01 -0.21 0.00 -0.02 0.00 0.00 57.16 55.95 2j6p n GLU 132 Cb 0.41 -1.20 0.02 0.00 -0.02 0.00 0.00 31.44 30.65 2j6p n GLU 132 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2j6p n GLN 133 N 0.32 -1.34 -3.18 3.49 1.13 -0.64 -4.94 117.38 112.23 2j6p n GLN 133 Ca 0.06 0.83 -0.31 0.00 -1.94 0.00 0.00 57.00 55.65 2j6p n GLN 133 Cb 0.29 -4.04 -0.04 0.00 0.11 0.00 0.00 30.24 26.56 2j6p n GLN 133 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2j6p s LYS 134 N -4.86 3.78 0.39 -1.09 1.02 -0.22 -4.47 119.74 114.29 2j6p s LYS 134 Ca 0.21 0.32 -0.27 0.00 0.02 0.00 0.00 55.97 56.24 2j6p s LYS 134 Cb -0.07 -2.54 -0.11 0.00 -0.52 0.00 0.00 37.83 34.59 2j6p s LYS 134 CO 0.84 0.16 1.46 1.28 -0.92 0.00 0.00 175.35 178.16 2j6p n LEU 135 N -0.75 4.71 -3.63 3.17 4.32 -1.26 -2.28 117.00 121.28 2j6p n LEU 135 Ca 0.01 1.21 -0.14 0.00 -0.02 0.00 0.00 56.01 57.06 2j6p n LEU 135 Cb 0.53 -1.60 -0.07 0.00 -1.62 0.00 0.00 43.42 40.66 2j6p n LEU 135 CO 0.46 0.03 0.40 -0.51 -1.22 0.00 0.00 177.39 176.55 2j6p s ILE 136 N -1.13 0.00 0.47 -0.08 2.07 -0.48 -4.95 121.20 117.10 2j6p s ILE 136 Ca 0.55 -0.00 -0.21 0.00 -1.41 0.00 0.00 60.65 59.58 2j6p s ILE 136 Cb -0.48 -0.97 -0.09 0.00 0.13 0.00 0.00 42.46 41.05 2j6p s ILE 136 CO 0.63 -0.00 1.03 -0.94 -1.91 0.00 0.00 174.94 173.75 2j6p s SER 137 N 0.28 6.44 0.49 4.50 1.04 -1.26 -1.96 113.70 123.24 2j6p s SER 137 Ca -0.01 1.92 0.20 0.00 0.48 0.00 0.00 55.95 58.54 2j6p s SER 137 Cb -0.05 -2.56 1.25 0.00 0.10 0.00 0.00 66.02 64.76 2j6p s SER 137 CO 0.01 -0.71 2.07 -0.33 0.98 0.00 0.00 173.24 175.26 2j6p h GLU 138 N 1.71 0.00 0.23 4.02 5.08 -0.73 -1.80 114.58 123.09 2j6p h GLU 138 Ca -0.49 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2j6p h GLU 138 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2j6p h GLU 138 CO 0.60 0.12 -0.15 1.49 -1.00 0.00 0.00 179.01 180.06 2j6p h GLU 139 N 0.00 -0.36 0.00 2.33 4.81 -1.56 0.55 114.58 120.35 2j6p h GLU 139 Ca -0.00 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2j6p h GLU 139 Cb 0.24 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2j6p h GLU 139 CO 0.02 -0.24 -0.01 -0.44 -0.73 0.00 0.00 179.01 177.60 2j6p h ASP 140 N -0.37 0.00 0.00 1.04 3.32 -1.78 -1.32 116.42 117.31 2j6p h ASP 140 Ca -0.02 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 2j6p h ASP 140 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2j6p h ASP 140 CO 0.01 0.01 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.37 2j6p h LEU 141 N 0.00 0.08 -0.93 1.55 4.07 -0.58 -1.18 115.31 118.33 2j6p h LEU 141 Ca -0.00 -0.80 0.16 0.00 0.08 0.00 0.00 57.88 57.31 2j6p h LEU 141 Cb 0.07 -0.03 -0.10 0.00 1.08 0.00 0.00 40.66 41.69 2j6p h LEU 141 CO 0.00 0.88 0.54 0.78 -1.08 0.00 0.00 178.44 179.55 2j6p h ASN 142 N -0.70 0.70 -0.21 -0.43 2.35 -0.53 -1.48 115.58 115.28 2j6p h ASN 142 Ca -0.01 0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2j6p h ASN 142 Cb 0.89 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.21 2j6p h ASN 142 CO 0.02 0.30 0.10 0.28 -1.65 0.00 0.00 177.43 176.48 2j6p h SER 143 N 0.75 0.28 -0.77 5.81 0.02 -1.19 -1.04 113.55 117.41 2j6p h SER 143 Ca 0.51 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.31 2j6p h SER 143 Cb 0.70 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.13 2j6p h SER 143 CO -0.35 0.33 0.38 0.00 -1.14 0.00 0.00 176.83 176.05 2j6p h ALA 144 N 0.96 1.20 -0.14 3.77 0.00 -0.99 -1.87 119.26 122.20 2j6p h ALA 144 Ca 0.07 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 2j6p h ALA 144 Cb 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2j6p h ALA 144 CO -0.01 0.61 -0.59 0.28 0.00 0.00 0.00 179.25 179.54 2j6p h VAL 145 N 1.10 1.34 -0.42 0.00 2.07 -1.04 -3.18 116.25 116.13 2j6p h VAL 145 Ca 0.27 -1.89 -0.08 0.00 0.82 0.00 0.00 66.70 65.82 2j6p h VAL 145 Cb 0.10 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2j6p h VAL 145 CO -0.04 0.58 -0.03 0.44 0.02 0.00 0.00 177.57 178.54 2j6p h ASP 146 N 0.34 0.75 0.00 0.57 3.32 -0.99 -3.51 116.42 116.90 2j6p h ASP 146 Ca -0.00 -0.33 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2j6p h ASP 146 Cb 1.13 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.48 2j6p h ASP 146 CO 0.11 0.90 0.00 1.41 -1.72 0.00 0.00 179.24 179.93