#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 -0.15 0.39 1.20 -0.85 -1.26 -4.71 117.35 111.96 2j6p s TYR 4 Ca 0.00 0.01 0.04 0.00 -0.52 0.00 0.00 57.07 56.60 2j6p s TYR 4 Cb 0.00 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.85 2j6p s TYR 4 CO 0.00 -0.42 0.07 0.95 -1.52 0.00 0.00 175.55 174.64 2j6p s THR 5 N -2.73 1.03 0.07 -3.49 -4.23 -1.15 -4.94 115.64 100.19 2j6p s THR 5 Ca 0.10 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.54 2j6p s THR 5 Cb 0.01 -2.57 -0.05 0.00 1.34 0.00 0.00 72.50 71.23 2j6p s THR 5 CO -0.04 0.00 0.36 -0.31 -0.54 0.00 0.00 174.62 174.09 2j6p s TYR 6 N -3.17 3.56 -0.02 3.99 1.51 -1.26 -1.22 117.35 120.73 2j6p s TYR 6 Ca 0.28 0.68 0.08 0.00 -1.01 0.00 0.00 57.07 57.09 2j6p s TYR 6 Cb 0.06 -2.08 -0.02 0.00 -0.11 0.00 0.00 41.96 39.81 2j6p s TYR 6 CO 0.14 0.53 -0.25 -1.50 -1.11 0.00 0.00 175.55 173.35 2j6p s ILE 7 N -1.42 2.09 0.64 2.71 2.07 -0.26 -4.88 121.20 122.16 2j6p s ILE 7 Ca 0.33 -1.09 -0.11 0.00 -1.41 0.00 0.00 60.65 58.36 2j6p s ILE 7 Cb -0.13 -1.72 -0.03 0.00 0.13 0.00 0.00 42.46 40.71 2j6p s ILE 7 CO 0.19 0.58 1.04 -0.54 -1.91 0.00 0.00 174.94 174.29 2j6p s LYS 8 N -0.59 3.43 0.23 3.50 1.02 -1.26 -0.44 119.74 125.62 2j6p s LYS 8 Ca 0.09 0.82 -0.07 0.00 0.02 0.00 0.00 55.97 56.84 2j6p s LYS 8 Cb -0.10 -2.06 0.34 0.00 -0.52 0.00 0.00 37.83 35.49 2j6p s LYS 8 CO -0.01 -0.71 1.78 -1.35 -0.92 0.00 0.00 175.35 174.14 2j6p h PRO 9 N -0.37 0.58 -0.67 -1.68 0.11 -1.96 -1.21 132.00 126.80 2j6p h PRO 9 Ca -0.44 -0.03 0.13 0.00 0.11 0.00 0.00 66.00 65.77 2j6p h PRO 9 Cb 1.20 -0.13 -0.10 0.00 0.11 0.00 0.00 31.00 32.08 2j6p h PRO 9 CO 0.60 0.38 0.15 0.93 -0.21 0.00 0.00 178.00 179.86 2j6p h GLU 10 N 0.60 0.26 -0.39 1.05 3.07 -1.99 0.14 114.58 117.31 2j6p h GLU 10 Ca 0.35 -0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 59.09 2j6p h GLU 10 Cb 0.38 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 2j6p h GLU 10 CO -0.27 0.17 -0.16 0.93 -1.40 0.00 0.00 179.01 178.27 2j6p h GLU 11 N 0.27 0.80 -0.11 2.33 5.08 -1.82 -1.93 114.58 119.20 2j6p h GLU 11 Ca 0.36 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2j6p h GLU 11 Cb 0.58 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2j6p h GLU 11 CO -0.46 0.96 0.05 1.25 -1.00 0.00 0.00 179.01 179.82 2j6p h LEU 12 N 0.61 0.14 -0.79 1.33 5.85 -0.98 -1.23 115.31 120.23 2j6p h LEU 12 Ca 0.09 -0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.79 2j6p h LEU 12 Cb 0.71 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 2j6p h LEU 12 CO 0.05 0.23 0.42 0.58 -0.34 0.00 0.00 178.44 179.38 2j6p h VAL 13 N 0.05 0.84 -0.92 1.05 2.07 -0.62 -1.45 116.25 117.26 2j6p h VAL 13 Ca 0.04 -0.23 0.07 0.00 0.82 0.00 0.00 66.70 67.39 2j6p h VAL 13 Cb 0.12 0.10 -0.07 0.00 -1.52 0.00 0.00 31.29 29.93 2j6p h VAL 13 CO -0.00 0.12 0.58 -0.08 0.02 0.00 0.00 177.57 178.21 2j6p h GLU 14 N 0.68 1.01 0.33 1.57 4.81 -1.02 -0.75 114.58 121.20 2j6p h GLU 14 Ca 0.40 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 2j6p h GLU 14 Cb 0.44 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2j6p h GLU 14 CO -0.28 0.67 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.44 2j6p h LEU 15 N 1.04 -0.37 -1.96 1.64 3.38 -0.44 -2.89 115.31 115.71 2j6p h LEU 15 Ca 0.41 -0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.43 2j6p h LEU 15 Cb 0.20 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2j6p h LEU 15 CO -0.18 -0.15 0.33 -0.07 0.09 0.00 0.00 178.44 178.46 2j6p h LEU 16 N -0.58 0.04 0.00 1.67 3.38 -0.87 -2.96 115.31 115.99 2j6p h LEU 16 Ca -0.05 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 2j6p h LEU 16 Cb 0.43 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2j6p h LEU 16 CO 0.07 0.02 -0.88 0.44 0.09 0.00 0.00 178.44 178.19 2j6p h ASP 17 N 0.04 0.00 -3.60 -0.43 3.32 -1.03 -3.43 116.42 111.29 2j6p h ASP 17 Ca 0.22 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.63 2j6p h ASP 17 Cb 0.83 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.24 2j6p h ASP 17 CO -0.01 0.74 0.22 0.21 -1.72 0.00 0.00 179.24 178.67 2j6p s ASN 18 N -6.46 6.37 0.54 6.45 3.84 -1.10 -4.96 114.94 119.63 2j6p s ASN 18 Ca 0.01 -0.17 0.30 0.00 0.21 0.00 0.00 52.86 53.21 2j6p s ASN 18 Cb 0.09 -2.35 1.55 0.00 -0.55 0.00 0.00 41.25 39.99 2j6p s ASN 18 CO 0.79 -0.80 2.09 1.55 -2.79 0.00 0.00 177.10 177.94 2j6p h PRO 19 N 8.84 0.00 0.53 0.43 0.13 -1.83 0.47 132.00 140.57 2j6p h PRO 19 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 2j6p h PRO 19 Cb 1.09 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.23 2j6p h PRO 19 CO 0.91 0.09 -0.25 0.22 -0.23 0.00 0.00 178.00 178.74 2j6p h ASP 20 N 0.00 -0.60 -1.00 1.44 1.82 -1.93 -2.99 116.42 113.17 2j6p h ASP 20 Ca -0.00 -0.04 0.14 0.00 -0.39 0.00 0.00 57.03 56.74 2j6p h ASP 20 Cb 0.33 0.16 -0.15 0.00 0.68 0.00 0.00 39.33 40.34 2j6p h ASP 20 CO 0.01 -0.21 -0.42 -1.20 -1.61 0.00 0.00 179.24 175.81 2j6p n SER 21 N -5.27 -0.71 -0.33 2.28 7.64 -1.04 -2.14 113.62 114.05 2j6p n SER 21 Ca -0.10 1.75 0.11 0.00 1.01 0.00 0.00 58.87 61.64 2j6p n SER 21 Cb 0.31 -0.37 0.29 0.00 -1.01 0.00 0.00 64.21 63.42 2j6p n SER 21 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2j6p h LEU 22 N 0.00 0.67 -1.12 -3.43 5.85 -0.75 0.41 115.31 116.94 2j6p h LEU 22 Ca 0.32 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 59.09 2j6p h LEU 22 Cb 0.57 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2j6p h LEU 22 CO -0.98 0.24 -0.21 -0.37 -0.34 0.00 0.00 178.44 176.78 2j6p h VAL 23 N 0.70 0.51 -0.01 1.05 -1.51 -1.28 -2.50 116.25 113.21 2j6p h VAL 23 Ca 0.54 -1.08 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 2j6p h VAL 23 Cb 0.82 1.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.73 2j6p h VAL 23 CO -0.38 0.20 -0.04 0.29 -1.23 0.00 0.00 177.57 176.40 2j6p n LYS 24 N -3.36 1.47 -4.42 5.19 5.02 0.06 -4.70 118.16 117.41 2j6p n LYS 24 Ca 0.00 -0.82 -0.31 0.00 -2.02 0.00 0.00 58.31 55.16 2j6p n LYS 24 Cb 0.42 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.85 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 -2.09 2.97 -0.02 7.82 0.00 -0.73 -0.91 121.76 128.80 2j6p s ALA 25 Ca 0.36 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 51.28 2j6p s ALA 25 Cb 0.21 -1.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.28 2j6p s ALA 25 CO 0.37 0.62 -0.17 0.00 0.00 0.00 0.00 175.76 176.58 2j6p s ALA 26 N -1.05 1.40 -0.30 0.00 0.00 -0.54 -4.96 121.76 116.31 2j6p s ALA 26 Ca 0.18 -0.71 -0.08 0.00 0.00 0.00 0.00 51.96 51.36 2j6p s ALA 26 Cb -0.11 -0.38 0.00 0.00 0.00 0.00 0.00 23.12 22.63 2j6p s ALA 26 CO 0.09 0.33 0.11 0.08 0.00 0.00 0.00 175.76 176.37 2j6p s VAL 27 N -0.31 4.25 -0.45 0.00 1.01 -1.26 -0.58 120.40 123.07 2j6p s VAL 27 Ca 0.05 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.30 2j6p s VAL 27 Cb -0.07 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.18 2j6p s VAL 27 CO -0.00 0.08 0.40 -0.63 0.00 0.00 0.00 175.10 174.95 2j6p s ILE 28 N 1.55 5.18 -0.34 2.22 1.09 0.71 -0.29 121.20 131.33 2j6p s ILE 28 Ca 0.04 -0.76 -0.22 0.00 -1.10 0.00 0.00 60.65 58.61 2j6p s ILE 28 Cb -0.17 -4.07 0.00 0.00 -1.06 0.00 0.00 42.46 37.16 2j6p s ILE 28 CO 0.04 -0.50 0.71 -0.62 -0.10 0.00 0.00 174.94 174.47 2j6p s ASP 29 N 2.20 6.52 -0.17 3.58 -1.08 0.69 -1.33 116.67 127.09 2j6p s ASP 29 Ca 0.07 0.35 0.16 0.00 -0.52 0.00 0.00 52.55 52.61 2j6p s ASP 29 Cb -0.21 -2.36 0.75 0.00 -1.46 0.00 0.00 42.92 39.63 2j6p s ASP 29 CO 0.09 -0.62 1.66 0.00 0.52 0.00 0.00 175.17 176.82 2j6p s ARG 31 N -2.26 1.79 0.00 0.00 0.52 -1.26 -2.52 118.95 115.21 2j6p s ARG 31 Ca 0.52 0.04 0.00 0.00 -0.52 0.00 0.00 55.73 55.76 2j6p s ARG 31 Cb 0.36 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.89 2j6p s ARG 31 CO 0.20 -1.71 0.00 -0.40 0.02 0.00 0.00 175.30 173.42 2j6p n ASP 32 N -3.38 0.00 0.09 0.23 5.75 -1.26 -4.16 116.55 113.83 2j6p n ASP 32 Ca 0.09 0.00 0.13 0.00 -0.01 0.00 0.00 54.79 55.00 2j6p n ASP 32 Cb 0.61 0.00 0.31 0.00 -1.03 0.00 0.00 41.12 41.01 2j6p n ASP 32 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2j6p h SER 33 N 0.00 0.00 -0.59 -1.12 4.64 -2.04 -3.18 113.55 111.25 2j6p h SER 33 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2j6p h SER 33 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2j6p h SER 33 CO 0.00 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.10 2j6p n ASP 34 N -2.25 3.67 -0.23 4.97 5.75 -1.26 -4.58 116.55 122.62 2j6p n ASP 34 Ca 0.05 -1.99 0.03 0.00 -0.01 0.00 0.00 54.79 52.86 2j6p n ASP 34 Cb 0.44 -0.39 0.27 0.00 -1.03 0.00 0.00 41.12 40.41 2j6p n ASP 34 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 2j6p h ARG 35 N 4.27 0.93 -0.03 0.11 0.11 -1.84 -3.13 114.38 114.80 2j6p h ARG 35 Ca 0.00 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 60.02 2j6p h ARG 35 Cb 0.96 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.83 2j6p h ARG 35 CO 0.00 0.61 0.00 -0.25 0.10 0.00 0.00 179.97 180.43 2j6p n ASP 36 N -4.45 0.20 0.16 0.08 8.00 -1.26 -3.21 116.55 116.07 2j6p n ASP 36 Ca 0.10 -1.64 0.15 0.00 0.71 0.00 0.00 54.79 54.11 2j6p n ASP 36 Cb 0.13 -0.02 0.72 0.00 -0.02 0.00 0.00 41.12 41.93 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 -1.52 3.55 3.62 0.00 0.00 -1.20 -4.97 105.19 104.67 2j6p n GLY 38 Ca 0.02 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 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 0.17 0.01 1.61 -0.12 -0.58 -4.97 117.98 112.09 2j6p s PHE 39 Ca 0.00 -0.55 -0.24 0.00 -0.05 0.00 0.00 56.93 56.09 2j6p s PHE 39 Cb 0.00 0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 42.65 2j6p s PHE 39 CO 0.00 -1.01 0.74 0.42 -0.05 0.00 0.00 175.22 175.31 2j6p s ILE 40 N -3.97 4.84 0.48 -4.49 1.01 -1.26 -1.52 121.20 116.29 2j6p s ILE 40 Ca 0.18 1.55 -0.24 0.00 0.00 0.00 0.00 60.65 62.14 2j6p s ILE 40 Cb -0.02 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.30 2j6p s ILE 40 CO 0.06 0.33 1.32 0.54 0.00 0.00 0.00 174.94 177.19 2j6p s VAL 41 N 0.20 2.41 -0.27 2.92 0.11 -1.26 -1.60 120.40 122.90 2j6p s VAL 41 Ca 0.38 0.33 0.00 0.00 -2.93 0.00 0.00 61.98 59.76 2j6p s VAL 41 Cb -0.19 -3.18 0.00 0.00 -1.53 0.00 0.00 36.38 31.47 2j6p s VAL 41 CO 0.21 0.02 0.00 0.59 -3.33 0.00 0.00 175.10 172.59 2j6p n ASN 42 N -0.48 -5.28 -4.74 3.54 3.02 -1.26 -4.98 115.26 105.08 2j6p n ASN 42 Ca 0.07 0.06 -0.38 0.00 -0.03 0.00 0.00 54.58 54.31 2j6p n ASN 42 Cb 0.45 -3.00 0.05 0.00 -0.61 0.00 0.00 39.78 36.67 2j6p n ASN 42 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2j6p s SER 43 N -2.13 4.94 -0.18 6.41 1.04 -0.63 -4.68 113.70 118.47 2j6p s SER 43 Ca 0.00 2.68 -0.07 0.00 0.48 0.00 0.00 55.95 59.04 2j6p s SER 43 Cb 0.00 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2j6p s SER 43 CO 0.00 -1.78 0.05 -0.63 0.98 0.00 0.00 173.24 171.86 2j6p s ILE 44 N -1.36 4.67 -0.13 -1.02 1.01 0.61 -4.87 121.20 120.11 2j6p s ILE 44 Ca 0.77 -0.07 -0.15 0.00 0.00 0.00 0.00 60.65 61.20 2j6p s ILE 44 Cb -0.39 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 2j6p s ILE 44 CO 0.43 0.46 0.34 0.20 0.00 0.00 0.00 174.94 176.37 2j6p s ASN 45 N 0.41 6.53 -0.41 3.58 0.01 -1.26 -0.22 114.94 123.57 2j6p s ASN 45 Ca 0.02 0.62 0.03 0.00 -0.71 0.00 0.00 52.86 52.82 2j6p s ASN 45 Cb -0.13 -2.21 0.16 0.00 0.41 0.00 0.00 41.25 39.48 2j6p s ASN 45 CO 0.01 0.11 0.31 -0.04 -1.51 0.00 0.00 177.10 175.97 2j6p s MET 46 N 0.32 0.89 -0.00 -0.60 -1.94 -0.18 -4.93 119.30 112.85 2j6p s MET 46 Ca 0.19 -1.95 -0.30 0.00 -1.71 0.00 0.00 55.69 51.93 2j6p s MET 46 Cb -0.14 -1.51 -0.08 0.00 2.01 0.00 0.00 34.83 35.11 2j6p s MET 46 CO 0.06 -1.33 1.93 -1.25 -0.01 0.00 0.00 175.02 174.43 2j6p s PRO 47 N 0.28 4.06 0.42 2.03 0.04 -1.26 -4.29 135.00 136.29 2j6p s PRO 47 Ca 0.28 2.48 0.15 0.00 0.04 0.00 0.00 61.00 63.95 2j6p s PRO 47 Cb -0.05 -4.15 1.04 0.00 0.04 0.00 0.00 34.50 31.38 2j6p s PRO 47 CO -0.13 -1.04 1.92 1.15 0.04 0.00 0.00 177.00 178.94 2j6p h THR 48 N 5.76 0.80 0.00 1.26 2.02 -1.76 -0.64 112.91 120.35 2j6p h THR 48 Ca -0.47 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.52 2j6p h THR 48 Cb 1.23 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2j6p h THR 48 CO 0.95 0.08 -0.21 -0.29 0.37 0.00 0.00 175.52 176.42 2j6p h ILE 49 N 0.43 0.57 0.00 3.11 2.10 -1.88 -3.34 117.51 118.50 2j6p h ILE 49 Ca 0.37 -0.99 0.00 0.00 1.08 0.00 0.00 64.86 65.32 2j6p h ILE 49 Cb 0.83 1.66 0.00 0.00 -1.09 0.00 0.00 36.82 38.22 2j6p h ILE 49 CO -0.12 0.20 0.00 -1.54 -1.08 0.00 0.00 178.15 175.61 2j6p n SER 50 N -3.46 0.35 -4.77 2.19 3.41 -0.83 -5.07 113.62 105.45 2j6p n SER 50 Ca -0.00 -0.80 -0.35 0.00 -0.26 0.00 0.00 58.87 57.45 2j6p n SER 50 Cb 0.38 0.12 0.01 0.00 -0.26 0.00 0.00 64.21 64.46 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 -1.73 1.40 0.16 0.00 -4.23 -1.26 -5.01 115.64 104.97 2j6p s THR 52 Ca 0.73 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 59.09 2j6p s THR 52 Cb -0.25 -2.45 0.04 0.00 1.34 0.00 0.00 72.50 71.18 2j6p s THR 52 CO 0.28 0.00 1.75 -0.08 -0.54 0.00 0.00 174.62 176.03 2j6p h GLU 53 N 1.52 0.29 0.00 3.99 4.81 -2.00 -0.61 114.58 122.59 2j6p h GLU 53 Ca -0.44 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2j6p h GLU 53 Cb 1.29 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 2j6p h GLU 53 CO 0.76 0.20 -0.11 1.49 -0.73 0.00 0.00 179.01 180.61 2j6p h GLU 54 N 0.30 0.00 -0.29 1.92 4.81 -1.99 -1.92 114.58 117.41 2j6p h GLU 54 Ca 0.18 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.29 2j6p h GLU 54 Cb 0.16 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2j6p h GLU 54 CO -0.18 0.11 -0.33 0.52 -0.73 0.00 0.00 179.01 178.39 2j6p h MET 55 N 0.00 0.63 -0.24 1.92 2.86 -1.50 0.19 114.93 118.79 2j6p h MET 55 Ca -0.00 -0.29 -0.15 0.00 -2.06 0.00 0.00 59.70 57.20 2j6p h MET 55 Cb 0.23 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2j6p h MET 55 CO 0.01 0.88 -0.47 1.88 1.06 0.00 0.00 176.91 180.27 2j6p h TYR 56 N 0.53 0.77 -0.76 -0.22 -1.99 -1.27 -0.77 116.97 113.27 2j6p h TYR 56 Ca 0.06 -0.25 -0.05 0.00 2.00 0.00 0.00 58.73 60.49 2j6p h TYR 56 Cb 0.83 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 2j6p h TYR 56 CO 0.04 0.98 0.27 0.93 -0.00 0.00 0.00 178.16 180.38 2j6p h GLU 57 N 0.51 1.15 -0.25 4.88 5.08 -1.02 0.00 114.58 124.92 2j6p h GLU 57 Ca 0.03 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 58.00 2j6p h GLU 57 Cb 1.01 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2j6p h GLU 57 CO 0.09 0.95 -0.50 0.87 -1.00 0.00 0.00 179.01 179.43 2j6p h LYS 58 N 1.11 0.69 -0.56 2.33 1.57 -0.82 -2.55 116.57 118.35 2j6p h LYS 58 Ca 0.25 -0.41 -0.04 0.00 -1.87 0.00 0.00 60.65 58.58 2j6p h LYS 58 Cb 0.25 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 2j6p h LYS 58 CO -0.02 1.03 0.20 1.25 -0.57 0.00 0.00 179.45 181.34 2j6p h LEU 59 N 0.55 0.80 -0.48 2.94 6.46 -0.81 -0.11 115.31 124.66 2j6p h LEU 59 Ca 0.02 -0.19 0.03 0.00 -0.12 0.00 0.00 57.88 57.62 2j6p h LEU 59 Cb 1.05 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.74 2j6p h LEU 59 CO 0.10 0.78 0.28 0.00 -0.62 0.00 0.00 178.44 178.98 2j6p h ALA 60 N 1.06 0.61 -0.22 1.25 0.00 -0.86 -0.66 119.26 120.44 2j6p h ALA 60 Ca 0.18 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2j6p h ALA 60 Cb 0.24 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2j6p h ALA 60 CO -0.01 -0.04 0.01 -0.22 0.00 0.00 0.00 179.25 178.99 2j6p h LYS 61 N 0.55 0.38 -0.24 0.00 3.64 -1.46 -1.34 116.57 118.10 2j6p h LYS 61 Ca 0.20 -0.12 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2j6p h LYS 61 Cb 0.04 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 2j6p h LYS 61 CO -0.10 0.56 0.02 1.15 -2.27 0.00 0.00 179.45 178.81 2j6p h THR 62 N 0.16 0.85 -0.22 1.00 2.02 -0.71 0.71 112.91 116.72 2j6p h THR 62 Ca 0.06 -0.04 -0.13 0.00 0.77 0.00 0.00 66.41 67.08 2j6p h THR 62 Cb 0.38 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 2j6p h THR 62 CO 0.01 0.02 -0.40 -0.07 0.37 0.00 0.00 175.52 175.45 2j6p h LEU 63 N 0.10 0.54 0.23 2.58 3.38 -1.12 0.16 115.31 121.18 2j6p h LEU 63 Ca 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2j6p h LEU 63 Cb 0.13 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2j6p h LEU 63 CO -0.17 0.88 -0.13 0.15 0.09 0.00 0.00 178.44 179.26 2j6p h PHE 64 N 0.42 -0.34 0.00 1.13 3.57 -1.01 0.02 116.94 120.73 2j6p h PHE 64 Ca 0.04 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 2j6p h PHE 64 Cb 0.89 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 2j6p h PHE 64 CO 0.03 -0.21 -0.03 0.93 -2.23 0.00 0.00 178.31 176.81 2j6p h GLU 65 N -0.34 0.00 -0.01 1.11 5.08 -0.47 0.36 114.58 120.31 2j6p h GLU 65 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2j6p h GLU 65 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2j6p h GLU 65 CO 0.03 0.03 -0.05 0.39 -1.00 0.00 0.00 179.01 178.41 2j6p n GLU 66 N -3.44 1.24 -2.50 2.33 1.02 0.53 -4.91 120.64 114.92 2j6p n GLU 66 Ca -0.02 -0.56 -0.11 0.00 -0.02 0.00 0.00 57.16 56.44 2j6p n GLU 66 Cb 0.13 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.08 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 -0.39 -1.99 -2.35 3.49 5.02 0.13 -4.99 118.16 117.08 2j6p n LYS 67 Ca 0.19 0.50 -0.38 0.00 -2.02 0.00 0.00 58.31 56.59 2j6p n LYS 67 Cb 0.28 -4.52 -0.03 0.00 -0.02 0.00 0.00 35.03 30.75 2j6p n LYS 67 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2j6p s LYS 68 N -4.93 4.14 -0.05 1.97 -0.14 -0.07 -4.75 119.74 115.91 2j6p s LYS 68 Ca 0.10 1.80 0.13 0.00 -1.36 0.00 0.00 55.97 56.64 2j6p s LYS 68 Cb -0.05 -2.72 -0.19 0.00 -1.68 0.00 0.00 37.83 33.19 2j6p s LYS 68 CO 0.13 -0.23 0.21 0.39 -0.76 0.00 0.00 175.35 175.09 2j6p n GLU 69 N 0.20 0.92 -4.45 1.68 1.02 -0.09 -3.06 120.64 116.86 2j6p n GLU 69 Ca 0.04 -0.08 -0.20 0.00 -0.02 0.00 0.00 57.16 56.89 2j6p n GLU 69 Cb 0.47 -1.32 -0.15 0.00 -0.02 0.00 0.00 31.44 30.42 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 -4.25 1.96 -0.15 -4.62 1.02 -0.87 -1.44 118.68 110.34 2j6p s LEU 70 Ca -0.05 -0.19 -0.01 0.00 0.02 0.00 0.00 54.13 53.90 2j6p s LEU 70 Cb 0.07 -0.55 0.04 0.00 0.02 0.00 0.00 46.19 45.77 2j6p s LEU 70 CO 0.54 0.12 -0.05 0.00 0.02 0.00 0.00 176.35 176.98 2j6p s ALA 71 N -0.14 1.37 -0.30 4.21 0.00 0.28 -1.46 121.76 125.71 2j6p s ALA 71 Ca 0.02 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 2j6p s ALA 71 Cb -0.05 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 22.00 2j6p s ALA 71 CO -0.00 -0.73 0.11 0.08 0.00 0.00 0.00 175.76 175.21 2j6p s VAL 72 N 1.68 4.20 -0.14 0.00 1.01 0.26 -0.14 120.40 127.26 2j6p s VAL 72 Ca 0.02 -0.61 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 2j6p s VAL 72 Cb -0.15 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 2j6p s VAL 72 CO -0.08 0.07 0.30 -0.36 0.00 0.00 0.00 175.10 175.03 2j6p s PHE 73 N 1.54 3.50 0.10 5.22 0.40 0.87 -0.20 117.98 129.40 2j6p s PHE 73 Ca 0.03 0.65 -0.02 0.00 -0.60 0.00 0.00 56.93 56.98 2j6p s PHE 73 Cb -0.17 -2.32 -0.03 0.00 0.51 0.00 0.00 43.02 41.00 2j6p s PHE 73 CO 0.04 0.31 0.05 -3.38 0.70 0.00 0.00 175.22 172.94 2j6p s HIS 74 N 0.23 0.62 0.00 0.36 -3.43 -0.44 -1.06 115.29 111.56 2j6p s HIS 74 Ca 0.18 -1.07 0.00 0.00 -0.80 0.00 0.00 55.06 53.37 2j6p s HIS 74 Cb -0.13 -0.37 0.00 0.00 -1.43 0.00 0.00 32.58 30.65 2j6p s HIS 74 CO 0.05 -0.48 0.00 0.00 -2.00 0.00 0.00 174.74 172.31 2j6p h ALA 76 N 1.00 0.08 -0.00 0.00 0.00 -1.94 -1.04 119.26 117.37 2j6p h ALA 76 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2j6p h ALA 76 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2j6p h ALA 76 CO 0.00 0.33 -0.60 1.04 0.00 0.00 0.00 179.25 180.02 2j6p n GLN 77 N -4.59 2.63 -3.54 0.00 6.02 -1.26 -1.75 117.38 114.90 2j6p n GLN 77 Ca -0.14 -0.03 -0.25 0.00 -0.01 0.00 0.00 57.00 56.56 2j6p n GLN 77 Cb 0.40 -1.12 0.05 0.00 1.02 0.00 0.00 30.24 30.59 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 -1.26 -5.73 -0.06 1.08 7.64 -1.26 -3.57 113.62 110.47 2j6p n SER 78 Ca 0.03 -0.54 -0.07 0.00 1.01 0.00 0.00 58.87 59.30 2j6p n SER 78 Cb 0.21 -4.56 -0.07 0.00 -1.01 0.00 0.00 64.21 58.78 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 -4.62 1.26 0.02 -3.43 4.77 -1.26 -4.64 117.00 109.10 2j6p n LEU 79 Ca -0.01 -0.03 -0.01 0.00 -0.03 0.00 0.00 56.01 55.93 2j6p n LEU 79 Cb 0.56 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2j6p n LEU 79 CO 0.63 0.45 -0.10 0.52 -1.33 0.00 0.00 177.39 177.56 2j6p n VAL 80 N -2.59 1.02 0.12 4.08 0.31 -1.26 -4.77 118.33 115.25 2j6p n VAL 80 Ca -0.19 0.31 -0.20 0.00 -0.01 0.00 0.00 64.34 64.24 2j6p n VAL 80 Cb 0.79 -1.59 -0.15 0.00 -0.91 0.00 0.00 33.84 31.98 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 -0.14 0.40 0.04 5.55 3.08 -1.92 -1.23 114.38 120.16 2j6p h ARG 81 Ca 0.00 -0.69 -0.00 0.00 0.07 0.00 0.00 59.98 59.36 2j6p h ARG 81 Cb 0.14 0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2j6p h ARG 81 CO 0.00 1.33 -0.02 0.00 -1.07 0.00 0.00 179.97 180.21 2j6p h ALA 82 N 0.37 -0.05 -0.27 0.04 0.00 -1.88 -0.21 119.26 117.25 2j6p h ALA 82 Ca -0.20 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 2j6p h ALA 82 Cb 2.07 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.87 2j6p h ALA 82 CO 0.24 -0.36 -0.03 -1.00 0.00 0.00 0.00 179.25 178.10 2j6p h PRO 83 N -0.39 0.42 -0.37 0.00 0.13 -1.82 0.14 132.00 130.10 2j6p h PRO 83 Ca -0.01 -0.09 0.01 0.00 -0.87 0.00 0.00 66.00 65.05 2j6p h PRO 83 Cb 0.36 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.41 2j6p h PRO 83 CO 0.01 0.48 0.23 0.87 -0.23 0.00 0.00 178.00 179.36 2j6p h LYS 84 N 0.41 0.46 -0.80 0.86 1.57 -1.11 -0.18 116.57 117.77 2j6p h LYS 84 Ca 0.09 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.91 2j6p h LYS 84 Cb 0.32 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.46 2j6p h LYS 84 CO 0.01 0.31 0.48 0.78 -0.57 0.00 0.00 179.45 180.46 2j6p h GLY 85 N 0.48 1.21 1.40 3.86 0.00 -0.47 -0.43 103.07 109.12 2j6p h GLY 85 Ca 0.14 -0.34 -0.17 0.00 0.00 0.00 0.00 47.33 46.96 2j6p h GLY 85 CO -0.05 0.21 -0.59 0.00 0.00 0.00 0.00 176.54 176.11 2j6p h ALA 86 N 1.40 0.61 -0.08 3.60 0.00 -0.80 0.50 119.26 124.49 2j6p h ALA 86 Ca 0.36 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2j6p h ALA 86 Cb 0.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2j6p h ALA 86 CO -0.19 0.70 0.05 -0.91 0.00 0.00 0.00 179.25 178.89 2j6p h ASN 87 N 0.47 0.09 -1.01 0.00 2.35 -0.40 -0.52 115.58 116.57 2j6p h ASN 87 Ca 0.00 -0.04 0.03 0.00 -0.55 0.00 0.00 56.30 55.74 2j6p h ASN 87 Cb 1.15 -0.02 -0.06 0.00 0.05 0.00 0.00 38.32 39.44 2j6p h ASN 87 CO 0.11 0.11 0.66 0.03 -1.65 0.00 0.00 177.43 176.70 2j6p h ARG 88 N 0.07 1.27 -0.24 0.81 3.08 -0.86 -2.12 114.38 116.39 2j6p h ARG 88 Ca 0.03 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 2j6p h ARG 88 Cb 0.03 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 2j6p h ARG 88 CO -0.01 0.84 -0.07 0.35 -1.07 0.00 0.00 179.97 180.01 2j6p h PHE 89 N 1.30 0.53 -0.72 3.04 3.57 -0.72 -0.46 116.94 123.49 2j6p h PHE 89 Ca 0.39 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 2j6p h PHE 89 Cb -0.05 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 2j6p h PHE 89 CO -0.00 0.70 0.41 0.00 -2.23 0.00 0.00 178.31 177.19 2j6p h ALA 90 N 0.75 0.92 -0.25 2.41 0.00 -0.98 0.19 119.26 122.29 2j6p h ALA 90 Ca 0.06 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 2j6p h ALA 90 Cb 0.54 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2j6p h ALA 90 CO 0.03 0.42 -0.57 -0.07 0.00 0.00 0.00 179.25 179.05 2j6p h LEU 91 N 0.99 0.90 -0.39 0.00 4.07 -1.33 -1.18 115.31 118.36 2j6p h LEU 91 Ca 0.26 -0.49 0.06 0.00 0.08 0.00 0.00 57.88 57.79 2j6p h LEU 91 Cb 0.01 -0.26 -0.06 0.00 1.08 0.00 0.00 40.66 41.43 2j6p h LEU 91 CO -0.04 1.27 0.05 0.00 -1.08 0.00 0.00 178.44 178.64 2j6p h ALA 92 N 0.74 0.40 -0.42 1.53 0.00 -0.70 -1.49 119.26 119.33 2j6p h ALA 92 Ca 0.01 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2j6p h ALA 92 Cb 1.17 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2j6p h ALA 92 CO 0.12 -0.35 0.26 1.96 0.00 0.00 0.00 179.25 181.24 2j6p h GLN 93 N 0.16 0.52 -0.43 0.00 4.20 -0.36 -1.61 115.11 117.59 2j6p h GLN 93 Ca 0.19 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 2j6p h GLN 93 Cb 0.25 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 2j6p h GLN 93 CO -0.28 0.34 0.18 -0.22 -0.67 0.00 0.00 178.83 178.19 2j6p h LYS 94 N 0.53 0.64 -0.61 1.46 3.64 -1.21 0.38 116.57 121.40 2j6p h LYS 94 Ca 0.16 -0.11 0.11 0.00 -1.27 0.00 0.00 60.65 59.54 2j6p h LYS 94 Cb -0.03 -0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 31.60 2j6p h LYS 94 CO -0.05 0.58 0.17 -0.22 -2.27 0.00 0.00 179.45 177.65 2j6p h LYS 95 N 0.56 0.30 0.00 1.90 3.64 -0.91 -2.35 116.57 119.71 2j6p h LYS 95 Ca 0.15 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2j6p h LYS 95 Cb 0.17 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2j6p h LYS 95 CO -0.01 0.20 0.00 1.28 -2.27 0.00 0.00 179.45 178.65 2j6p n LEU 96 N -5.08 0.71 -0.02 5.20 4.77 -0.64 -4.93 117.00 117.01 2j6p n LEU 96 Ca 0.09 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.65 2j6p n LEU 96 Cb 0.32 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 2j6p n LEU 96 CO 0.19 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.66 2j6p n GLY 97 N 1.20 0.82 3.73 -0.72 0.00 -0.09 -5.09 105.19 105.06 2j6p n GLY 97 Ca 0.05 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 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 -2.04 3.06 0.00 1.61 4.12 -0.07 -4.97 117.35 119.05 2j6p s TYR 98 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.07 57.08 2j6p s TYR 98 Cb 0.00 -1.53 0.00 0.00 -1.52 0.00 0.00 41.96 38.91 2j6p s TYR 98 CO 0.00 0.50 0.19 1.33 0.02 0.00 0.00 175.55 177.59 2j6p n VAL 99 N 0.27 0.00 -4.63 0.71 0.24 -1.26 -4.11 118.33 109.54 2j6p n VAL 99 Ca -0.10 -0.28 -0.26 0.00 -2.04 0.00 0.00 64.34 61.67 2j6p n VAL 99 Cb 0.53 1.30 -0.14 0.00 -1.47 0.00 0.00 33.84 34.06 2j6p n VAL 99 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2j6p s LEU 100 N -0.36 2.17 0.72 1.34 2.01 -1.26 -3.78 118.68 119.52 2j6p s LEU 100 Ca 0.00 -0.53 -0.14 0.00 0.01 0.00 0.00 54.13 53.47 2j6p s LEU 100 Cb 0.00 -0.97 0.03 0.00 0.01 0.00 0.00 46.19 45.26 2j6p s LEU 100 CO 0.00 0.16 1.14 -2.16 1.01 0.00 0.00 176.35 176.50 2j6p s PRO 101 N -1.20 2.37 0.60 1.29 0.04 -1.17 -4.36 135.00 132.56 2j6p s PRO 101 Ca 0.07 1.48 -0.16 0.00 0.04 0.00 0.00 61.00 62.43 2j6p s PRO 101 Cb -0.09 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 2j6p s PRO 101 CO 0.02 -1.60 1.06 0.00 0.04 0.00 0.00 177.00 176.52 2j6p s ALA 102 N -2.35 2.72 -0.16 8.56 0.00 -0.52 -4.80 121.76 125.21 2j6p s ALA 102 Ca 0.68 0.42 -0.01 0.00 0.00 0.00 0.00 51.96 53.05 2j6p s ALA 102 Cb -0.23 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 2j6p s ALA 102 CO 0.46 -0.84 -0.10 0.08 0.00 0.00 0.00 175.76 175.36 2j6p s VAL 103 N -2.42 3.16 0.19 0.00 1.01 -1.26 -0.56 120.40 120.52 2j6p s VAL 103 Ca 0.64 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 62.10 2j6p s VAL 103 Cb -0.17 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 2j6p s VAL 103 CO 0.37 0.49 -0.17 -0.31 0.00 0.00 0.00 175.10 175.48 2j6p s TYR 104 N 0.72 1.81 -0.20 5.22 2.02 0.80 -2.94 117.35 124.78 2j6p s TYR 104 Ca -0.05 -0.49 -0.04 0.00 -0.37 0.00 0.00 57.07 56.12 2j6p s TYR 104 Cb -0.15 -0.87 -0.02 0.00 -0.40 0.00 0.00 41.96 40.52 2j6p s TYR 104 CO 0.02 0.37 -0.02 0.08 -1.57 0.00 0.00 175.55 174.42 2j6p s VAL 105 N -2.40 3.73 -0.45 0.71 1.01 -0.36 -0.09 120.40 122.55 2j6p s VAL 105 Ca 0.19 -0.39 -0.27 0.00 0.00 0.00 0.00 61.98 61.51 2j6p s VAL 105 Cb -0.04 -2.68 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 2j6p s VAL 105 CO 0.07 0.44 2.21 -0.22 0.00 0.00 0.00 175.10 177.60 2j6p s LEU 106 N 1.03 3.40 -0.19 3.92 2.96 -0.22 -1.10 118.68 128.48 2j6p s LEU 106 Ca 0.01 1.09 -0.39 0.00 -0.22 0.00 0.00 54.13 54.62 2j6p s LEU 106 Cb -0.14 -2.78 -0.16 0.00 0.50 0.00 0.00 46.19 43.61 2j6p s LEU 106 CO 0.01 -2.51 1.64 -1.14 -1.32 0.00 0.00 176.35 173.02 2j6p n ARG 107 N 8.95 1.13 0.00 1.98 0.63 0.41 -1.32 116.66 128.45 2j6p n ARG 107 Ca 0.31 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 2j6p n ARG 107 Cb 0.52 -2.08 0.00 0.00 0.45 0.00 0.00 32.46 31.35 2j6p n ARG 107 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2j6p n GLY 108 N 3.75 2.67 7.00 5.14 0.00 -1.23 -4.58 105.19 117.94 2j6p n GLY 108 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.99 0.37 -0.02 0.00 -0.43 -1.75 105.19 99.36 2j6p n GLY 109 Ca 0.00 -1.39 0.05 0.00 0.00 0.00 0.00 46.02 44.68 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 1.16 -0.18 1.61 2.91 -0.98 -1.91 115.95 118.57 2j6p h TRP 110 Ca 0.00 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.04 2j6p h TRP 110 Cb 0.00 -0.38 -0.01 0.00 -0.51 0.00 0.00 29.16 28.27 2j6p h TRP 110 CO 0.00 0.54 0.09 0.93 -1.03 0.00 0.00 178.44 178.96 2j6p h GLU 111 N 1.08 0.26 -0.65 2.65 5.08 -1.41 0.14 114.58 121.73 2j6p h GLU 111 Ca 0.46 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.73 2j6p h GLU 111 Cb 0.32 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2j6p h GLU 111 CO -0.21 0.30 0.19 0.00 -1.00 0.00 0.00 179.01 178.29 2j6p h ALA 112 N 0.95 1.12 0.24 3.43 0.00 -1.16 -0.80 119.26 123.04 2j6p h ALA 112 Ca 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2j6p h ALA 112 Cb 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2j6p h ALA 112 CO -0.01 0.60 -0.12 0.35 0.00 0.00 0.00 179.25 180.08 2j6p h PHE 113 N 0.96 -0.30 -0.30 0.00 3.57 -0.55 -0.59 116.94 119.73 2j6p h PHE 113 Ca 0.21 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 2j6p h PHE 113 Cb 0.29 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 2j6p h PHE 113 CO 0.02 -0.18 -0.27 -0.92 -2.23 0.00 0.00 178.31 174.73 2j6p h TYR 114 N -0.33 0.68 -0.17 0.41 3.20 -0.76 -0.66 116.97 119.34 2j6p h TYR 114 Ca -0.03 -0.16 0.02 0.00 3.14 0.00 0.00 58.73 61.70 2j6p h TYR 114 Cb 0.25 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2j6p h TYR 114 CO -0.06 0.81 0.05 1.25 -1.64 0.00 0.00 178.16 178.56 2j6p h HIS 115 N 0.52 0.08 -0.64 -3.82 2.76 -0.84 0.56 115.15 113.78 2j6p h HIS 115 Ca 0.07 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.18 2j6p h HIS 115 Cb 0.73 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.66 2j6p h HIS 115 CO 0.03 0.04 0.12 1.98 -1.30 0.00 0.00 177.93 178.79 2j6p h MET 116 N 0.12 1.03 0.00 5.26 1.85 -0.97 -3.39 114.93 118.83 2j6p h MET 116 Ca 0.08 -0.26 0.00 0.00 -0.61 0.00 0.00 59.70 58.91 2j6p h MET 116 Cb 0.06 -0.13 0.00 0.00 0.43 0.00 0.00 31.60 31.96 2j6p h MET 116 CO -0.09 0.94 0.00 0.66 -0.40 0.00 0.00 176.91 178.02 2j6p n TYR 117 N -4.23 0.00 -0.27 1.39 4.02 -0.27 -4.78 117.16 113.03 2j6p n TYR 117 Ca 0.04 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.04 2j6p n TYR 117 Cb 0.27 0.00 0.36 0.00 -0.02 0.00 0.00 39.34 39.95 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 1.22 0.42 2.72 0.00 -0.03 0.22 103.07 107.61 2j6p h GLY 118 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2j6p h GLY 118 CO 0.00 0.11 -1.04 2.09 0.00 0.00 0.00 176.54 177.71 2j6p n ASP 119 N -4.56 0.66 -0.00 0.19 5.68 -1.26 -4.11 116.55 113.15 2j6p n ASP 119 Ca 0.17 -0.43 0.05 0.00 -0.50 0.00 0.00 54.79 54.08 2j6p n ASP 119 Cb 0.43 0.89 -0.07 0.00 -1.14 0.00 0.00 41.12 41.24 2j6p n ASP 119 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 2j6p n VAL 120 N -1.79 0.00 -3.18 2.12 0.24 -1.08 -4.79 118.33 109.86 2j6p n VAL 120 Ca 0.02 -0.25 -0.20 0.00 -2.04 0.00 0.00 64.34 61.87 2j6p n VAL 120 Cb 0.40 0.65 -0.04 0.00 -1.47 0.00 0.00 33.84 33.39 2j6p n VAL 120 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2j6p n ARG 121 N -1.53 1.14 0.00 7.34 5.12 0.74 -4.91 116.66 124.56 2j6p n ARG 121 Ca 0.00 -3.50 0.07 0.00 -1.93 0.00 0.00 57.85 52.49 2j6p n ARG 121 Cb 0.21 -1.67 0.35 0.00 -1.16 0.00 0.00 32.46 30.20 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 0.48 0.21 0.23 5.56 -0.04 -1.26 -2.10 135.00 138.07 2j6p n PRO 122 Ca 0.25 0.15 0.14 0.00 -0.04 0.00 0.00 63.50 64.00 2j6p n PRO 122 Cb 0.61 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.99 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 0.94 3.54 2.03 -1.92 -1.82 116.42 119.19 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 0.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 2j6p h ASP 123 CO 0.00 0.00 -0.36 0.18 -1.03 0.00 0.00 179.24 178.03 2j6p n LEU 124 N -2.96 0.56 -4.30 0.15 4.77 -0.89 -4.87 117.00 109.46 2j6p n LEU 124 Ca 0.03 0.30 -0.35 0.00 -0.03 0.00 0.00 56.01 55.95 2j6p n LEU 124 Cb 0.41 -0.28 -0.14 0.00 -2.33 0.00 0.00 43.42 41.08 2j6p n LEU 124 CO 0.30 -0.03 -0.37 -0.04 -1.33 0.00 0.00 177.39 175.92 2j6p s MET 125 N -3.09 3.23 0.13 3.23 -1.94 -1.13 -4.29 119.30 115.44 2j6p s MET 125 Ca 0.10 -0.73 0.08 0.00 -1.71 0.00 0.00 55.69 53.43 2j6p s MET 125 Cb 0.15 -3.08 -0.04 0.00 2.01 0.00 0.00 34.83 33.87 2j6p s MET 125 CO 0.66 -0.28 -0.12 0.71 -0.01 0.00 0.00 175.02 175.97 2j6p s TYR 126 N 1.46 2.66 0.22 -0.03 1.51 -0.57 0.38 117.35 122.96 2j6p s TYR 126 Ca 0.04 -0.20 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 2j6p s TYR 126 Cb -0.15 -1.37 -0.05 0.00 -0.11 0.00 0.00 41.96 40.28 2j6p s TYR 126 CO -0.02 0.44 0.10 0.14 -1.11 0.00 0.00 175.55 175.09 2j6p s VAL 127 N -1.31 0.31 0.03 0.71 -7.23 -0.54 -1.53 120.40 110.85 2j6p s VAL 127 Ca 0.21 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.46 2j6p s VAL 127 Cb -0.10 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.31 2j6p s VAL 127 CO 0.13 -0.08 -0.18 -0.54 -0.31 0.00 0.00 175.10 174.12 2j6p s LYS 128 N -4.07 2.09 -0.04 4.82 1.02 -1.26 -2.57 119.74 119.73 2j6p s LYS 128 Ca 0.36 -0.96 -0.15 0.00 0.02 0.00 0.00 55.97 55.24 2j6p s LYS 128 Cb 0.07 -2.19 0.03 0.00 -0.52 0.00 0.00 37.83 35.22 2j6p s LYS 128 CO 0.11 0.55 0.33 -1.17 -0.92 0.00 0.00 175.35 174.24 2j6p s LEU 129 N -1.37 0.78 0.00 3.17 2.96 -0.41 -4.83 118.68 118.97 2j6p s LEU 129 Ca 0.14 0.22 0.00 0.00 -0.22 0.00 0.00 54.13 54.27 2j6p s LEU 129 Cb -0.10 1.29 0.00 0.00 0.50 0.00 0.00 46.19 47.87 2j6p s LEU 129 CO 0.05 -0.39 0.00 0.61 -1.32 0.00 0.00 176.35 175.30 2j6p n GLY 130 N 1.57 1.06 0.26 7.98 0.00 -1.26 -0.88 105.19 113.92 2j6p n GLY 130 Ca -0.20 -2.01 0.12 0.00 0.00 0.00 0.00 46.02 43.93 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 -0.40 1.61 0.13 -2.01 0.20 132.00 131.53 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 0.11 0.00 0.39 -0.23 0.00 0.00 178.00 178.27 2j6p n GLU 132 N -3.80 2.46 -3.58 0.86 1.02 -1.26 -4.98 120.64 111.36 2j6p n GLU 132 Ca -0.02 -2.21 -0.27 0.00 -0.02 0.00 0.00 57.16 54.65 2j6p n GLU 132 Cb 0.21 -1.51 0.04 0.00 -0.02 0.00 0.00 31.44 30.16 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 1.40 -1.37 -3.23 3.49 1.13 0.70 -4.94 117.38 114.56 2j6p n GLN 133 Ca 0.19 0.61 -0.35 0.00 -1.94 0.00 0.00 57.00 55.51 2j6p n GLN 133 Cb 0.58 -4.35 -0.06 0.00 0.11 0.00 0.00 30.24 26.52 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 -5.48 4.07 0.35 -1.09 1.02 -0.06 -4.44 119.74 114.11 2j6p s LYS 134 Ca 0.41 0.64 -0.28 0.00 0.02 0.00 0.00 55.97 56.76 2j6p s LYS 134 Cb -0.13 -2.81 -0.12 0.00 -0.52 0.00 0.00 37.83 34.25 2j6p s LYS 134 CO 0.84 0.38 1.45 -0.11 -0.92 0.00 0.00 175.35 177.00 2j6p n LEU 135 N 0.51 4.34 -3.64 3.17 7.94 -1.26 -1.29 117.00 126.77 2j6p n LEU 135 Ca -0.02 1.21 -0.07 0.00 -1.11 0.00 0.00 56.01 56.02 2j6p n LEU 135 Cb 0.52 -1.57 -0.07 0.00 0.53 0.00 0.00 43.42 42.82 2j6p n LEU 135 CO 0.43 -0.03 0.75 -0.51 -1.11 0.00 0.00 177.39 176.92 2j6p s ILE 136 N -0.88 0.00 0.63 1.96 2.07 -1.06 -4.97 121.20 118.94 2j6p s ILE 136 Ca 0.56 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 59.67 2j6p s ILE 136 Cb -0.51 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.05 2j6p s ILE 136 CO 0.60 0.00 1.04 -0.94 -1.91 0.00 0.00 174.94 173.73 2j6p s SER 137 N 0.53 5.88 0.48 4.50 1.04 -1.26 -1.46 113.70 123.41 2j6p s SER 137 Ca 0.00 1.59 0.27 0.00 0.48 0.00 0.00 55.95 58.29 2j6p s SER 137 Cb -0.05 -2.50 1.01 0.00 0.10 0.00 0.00 66.02 64.59 2j6p s SER 137 CO -0.09 -1.10 1.86 -0.33 0.98 0.00 0.00 173.24 174.55 2j6p h GLU 138 N -0.14 0.00 0.27 4.02 5.08 0.30 -2.38 114.58 121.74 2j6p h GLU 138 Ca -0.45 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 2j6p h GLU 138 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2j6p h GLU 138 CO 0.59 0.13 -0.13 1.49 -1.00 0.00 0.00 179.01 180.09 2j6p h GLU 139 N 0.00 -0.36 -0.92 2.33 4.81 -1.59 -1.06 114.58 117.80 2j6p h GLU 139 Ca -0.00 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.33 2j6p h GLU 139 Cb 0.70 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 30.10 2j6p h GLU 139 CO 0.02 -0.19 0.59 -0.44 -0.73 0.00 0.00 179.01 178.26 2j6p h ASP 140 N -0.44 0.88 -0.19 1.04 5.19 -1.74 -2.10 116.42 119.06 2j6p h ASP 140 Ca -0.04 0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.35 2j6p h ASP 140 Cb 0.33 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2j6p h ASP 140 CO 0.06 0.54 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.64 2j6p h LEU 141 N 0.98 0.35 -0.47 1.55 4.07 -1.33 0.04 115.31 120.51 2j6p h LEU 141 Ca 0.41 -0.33 0.08 0.00 0.08 0.00 0.00 57.88 58.12 2j6p h LEU 141 Cb 0.30 -0.09 -0.06 0.00 1.08 0.00 0.00 40.66 41.88 2j6p h LEU 141 CO -0.17 0.59 0.09 0.78 -1.08 0.00 0.00 178.44 178.66 2j6p h ASN 142 N 0.10 0.00 -0.04 -0.43 2.35 -0.92 -0.92 115.58 115.72 2j6p h ASN 142 Ca 0.05 0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2j6p h ASN 142 Cb 0.42 0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 2j6p h ASN 142 CO 0.01 0.03 0.01 0.28 -1.65 0.00 0.00 177.43 176.12 2j6p h SER 143 N 0.23 0.01 -0.67 5.81 0.02 -1.02 -0.62 113.55 117.31 2j6p h SER 143 Ca 0.23 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 61.25 2j6p h SER 143 Cb 0.30 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 2j6p h SER 143 CO -0.30 0.01 0.36 0.00 -1.14 0.00 0.00 176.83 175.76 2j6p h ALA 144 N 1.03 0.90 -0.24 3.77 0.00 -0.82 0.11 119.26 124.01 2j6p h ALA 144 Ca 0.02 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2j6p h ALA 144 Cb 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2j6p h ALA 144 CO -0.02 0.02 0.06 0.28 0.00 0.00 0.00 179.25 179.59 2j6p h VAL 145 N 0.65 1.21 -0.28 0.00 2.07 -0.66 -2.78 116.25 116.46 2j6p h VAL 145 Ca 0.31 -0.67 0.06 0.00 0.82 0.00 0.00 66.70 67.22 2j6p h VAL 145 Cb 0.23 1.19 -0.08 0.00 -1.52 0.00 0.00 31.29 31.11 2j6p h VAL 145 CO -0.20 0.21 -0.39 0.44 0.02 0.00 0.00 177.57 177.66 2j6p h ASP 146 N 0.22 -1.25 0.00 0.57 3.32 -0.90 -3.51 116.42 114.86 2j6p h ASP 146 Ca 0.08 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2j6p h ASP 146 Cb 0.27 0.54 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2j6p h ASP 146 CO -0.00 -0.37 0.00 1.41 -1.72 0.00 0.00 179.24 178.56