#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b7t n GLY 2 N 0.00 -0.60 3.61 -1.23 0.00 -1.26 -4.75 105.19 100.96 2b7t n GLY 2 Ca 0.00 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 2b7t n GLY 2 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b7t s PRO 3 N -0.18 -0.75 0.00 1.61 0.04 -1.26 -4.75 135.00 129.71 2b7t s PRO 3 Ca 0.00 0.13 0.06 0.00 0.04 0.00 0.00 61.00 61.22 2b7t s PRO 3 Cb 0.00 -1.63 0.31 0.00 0.04 0.00 0.00 34.50 33.22 2b7t s PRO 3 CO 0.00 -3.44 0.89 1.33 0.04 0.00 0.00 177.00 175.82 2b7t n VAL 4 N -4.60 0.37 -0.08 -0.36 0.24 -1.26 -0.70 118.33 111.94 2b7t n VAL 4 Ca 0.10 0.09 -0.16 0.00 -2.04 0.00 0.00 64.34 62.34 2b7t n VAL 4 Cb 0.59 -1.00 -0.06 0.00 -1.47 0.00 0.00 33.84 31.90 2b7t n VAL 4 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2b7t n LEU 5 N -1.11 1.46 0.28 1.34 4.32 -1.26 -4.34 117.00 117.69 2b7t n LEU 5 Ca 0.04 0.14 0.12 0.00 -0.02 0.00 0.00 56.01 56.29 2b7t n LEU 5 Cb 0.03 -0.47 0.54 0.00 -1.62 0.00 0.00 43.42 41.90 2b7t n LEU 5 CO 0.04 0.41 1.10 -0.65 -1.22 0.00 0.00 177.39 177.06 2b7t h PRO 6 N -0.46 0.00 -1.29 3.23 0.11 -1.83 -3.12 132.00 128.64 2b7t h PRO 6 Ca -0.39 0.00 0.44 0.00 0.11 0.00 0.00 66.00 66.16 2b7t h PRO 6 Cb 1.38 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.37 2b7t h PRO 6 CO -0.21 0.00 0.84 1.17 -0.21 0.00 0.00 178.00 179.59 2b7t n LYS 7 N -2.87 -0.03 0.12 1.05 4.81 0.12 -1.04 118.16 120.32 2b7t n LYS 7 Ca 0.01 1.11 -0.06 0.00 -0.87 0.00 0.00 58.31 58.51 2b7t n LYS 7 Cb 0.66 -2.23 -0.03 0.00 0.02 0.00 0.00 35.03 33.45 2b7t n LYS 7 CO 0.00 0.00 0.00 -2.95 1.17 0.00 0.00 177.40 175.62 2b7t h ASN 8 N 0.00 -0.38 -0.19 3.14 -1.07 -1.86 0.18 115.58 115.40 2b7t h ASN 8 Ca 0.80 0.02 0.03 0.00 0.07 0.00 0.00 56.30 57.23 2b7t h ASN 8 Cb 2.63 0.12 -0.03 0.00 -2.07 0.00 0.00 38.32 38.97 2b7t h ASN 8 CO -0.38 -0.22 -0.02 0.00 0.07 0.00 0.00 177.43 176.88 2b7t h ALA 9 N -1.64 0.15 -0.14 4.14 0.00 -1.78 -2.08 119.26 117.91 2b7t h ALA 9 Ca -0.03 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2b7t h ALA 9 Cb 0.28 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2b7t h ALA 9 CO 0.02 -0.45 0.08 -0.07 0.00 0.00 0.00 179.25 178.83 2b7t h LEU 10 N 0.03 0.17 -0.65 0.00 -0.00 -1.09 -0.89 115.31 112.88 2b7t h LEU 10 Ca 0.09 -0.06 0.07 0.00 -0.00 0.00 0.00 57.88 57.98 2b7t h LEU 10 Cb 0.12 -0.04 -0.06 0.00 -0.00 0.00 0.00 40.66 40.68 2b7t h LEU 10 CO -0.17 0.18 0.33 0.00 -0.00 0.00 0.00 178.44 178.78 2b7t h MET 11 N 0.15 0.59 -0.09 1.13 -0.00 -0.67 0.19 114.93 116.23 2b7t h MET 11 Ca 0.05 -0.04 0.02 0.00 -0.00 0.00 0.00 59.70 59.73 2b7t h MET 11 Cb 0.04 -0.13 -0.03 0.00 -0.00 0.00 0.00 31.60 31.48 2b7t h MET 11 CO -0.01 0.39 -0.24 0.37 -0.00 0.00 0.00 176.91 177.42 2b7t h GLN 12 N 0.61 -0.23 0.00 -0.10 4.15 -0.45 0.61 115.11 119.70 2b7t h GLN 12 Ca 0.30 0.02 -0.20 0.00 0.77 0.00 0.00 58.65 59.53 2b7t h GLN 12 Cb 0.24 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 2b7t h GLN 12 CO -0.21 -0.16 -0.89 1.37 -1.93 0.00 0.00 178.83 177.01 2b7t h LEU 13 N -0.24 0.33 -1.02 -2.39 -0.00 -1.32 -2.08 115.31 108.59 2b7t h LEU 13 Ca 0.02 -0.27 -0.04 0.00 -0.00 0.00 0.00 57.88 57.59 2b7t h LEU 13 Cb 0.30 -0.10 -0.03 0.00 -0.00 0.00 0.00 40.66 40.82 2b7t h LEU 13 CO -0.21 1.07 0.21 0.78 -0.00 0.00 0.00 178.44 180.29 2b7t h ASN 14 N 0.14 0.84 0.70 0.17 2.35 -0.95 0.20 115.58 119.04 2b7t h ASN 14 Ca -0.05 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.53 2b7t h ASN 14 Cb 1.52 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 39.68 2b7t h ASN 14 CO 0.14 0.78 -0.34 -0.33 -1.65 0.00 0.00 177.43 176.04 2b7t h GLU 15 N 0.89 -0.91 -1.01 0.81 4.39 -0.78 -1.72 114.58 116.26 2b7t h GLU 15 Ca 0.20 0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.98 2b7t h GLU 15 Cb 0.23 0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 2b7t h GLU 15 CO -0.01 -0.60 0.67 0.82 -1.16 0.00 0.00 179.01 178.72 2b7t h ILE 16 N -0.95 1.24 -2.40 3.13 2.04 -1.20 -3.38 117.51 115.99 2b7t h ILE 16 Ca -0.10 -0.46 -0.51 0.00 1.00 0.00 0.00 64.86 64.79 2b7t h ILE 16 Cb 0.73 -0.22 -0.37 0.00 -0.74 0.00 0.00 36.82 36.22 2b7t h ILE 16 CO 0.16 0.25 -0.80 -0.54 0.00 0.00 0.00 178.15 177.22 2b7t s LYS 17 N -6.11 0.56 -0.16 2.37 1.02 0.69 -5.06 119.74 113.04 2b7t s LYS 17 Ca -0.13 -1.15 -0.05 0.00 0.02 0.00 0.00 55.97 54.66 2b7t s LYS 17 Cb 0.18 -1.11 -0.21 0.00 -0.52 0.00 0.00 37.83 36.17 2b7t s LYS 17 CO 0.82 -1.20 3.03 -0.35 -0.92 0.00 0.00 175.35 176.73 2b7t n PRO 18 N 4.16 1.82 -0.76 -1.68 -0.04 -0.65 -3.78 135.00 134.07 2b7t n PRO 18 Ca 0.11 -0.95 -0.04 0.00 -0.04 0.00 0.00 63.50 62.58 2b7t n PRO 18 Cb 0.40 -2.00 -0.04 0.00 -0.04 0.00 0.00 33.50 31.82 2b7t n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b7t n GLY 19 N 2.71 0.32 3.69 0.55 0.00 -1.26 -5.10 105.19 106.10 2b7t n GLY 19 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 2b7t n GLY 19 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b7t s LEU 20 N 0.00 2.44 -0.11 0.99 1.02 -1.25 -4.97 118.68 116.81 2b7t s LEU 20 Ca 0.00 1.79 0.03 0.00 0.02 0.00 0.00 54.13 55.96 2b7t s LEU 20 Cb 0.00 -4.20 0.01 0.00 0.02 0.00 0.00 46.19 42.02 2b7t s LEU 20 CO 0.00 -2.83 -0.19 -1.58 0.02 0.00 0.00 176.35 171.77 2b7t s GLN 21 N -4.78 2.59 -0.11 1.70 -0.44 -0.80 -4.96 119.66 112.87 2b7t s GLN 21 Ca 0.64 -0.71 -0.01 0.00 -2.50 0.00 0.00 55.36 52.78 2b7t s GLN 21 Cb -0.20 -2.07 -0.03 0.00 -1.64 0.00 0.00 33.01 29.07 2b7t s GLN 21 CO 0.58 0.04 -0.05 0.71 0.50 0.00 0.00 175.29 177.07 2b7t s TYR 22 N 0.68 2.99 0.03 1.67 1.51 -1.26 -0.19 117.35 122.79 2b7t s TYR 22 Ca -0.12 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 55.86 2b7t s TYR 22 Cb -0.16 -1.83 -0.02 0.00 -0.11 0.00 0.00 41.96 39.84 2b7t s TYR 22 CO 0.03 0.18 -0.11 1.41 -1.11 0.00 0.00 175.55 175.94 2b7t s MET 23 N -0.30 0.76 -0.19 -0.62 1.75 -0.20 -5.00 119.30 115.51 2b7t s MET 23 Ca 0.05 -0.63 -0.07 0.00 -1.25 0.00 0.00 55.69 53.79 2b7t s MET 23 Cb -0.13 -0.71 -0.04 0.00 2.84 0.00 0.00 34.83 36.79 2b7t s MET 23 CO 0.02 0.18 0.06 -1.17 -0.65 0.00 0.00 175.02 173.46 2b7t s LEU 24 N -0.98 3.74 0.03 4.11 1.98 -1.26 -1.22 118.68 125.08 2b7t s LEU 24 Ca -0.01 0.03 0.06 0.00 -2.89 0.00 0.00 54.13 51.32 2b7t s LEU 24 Cb -0.07 -1.95 -0.02 0.00 0.66 0.00 0.00 46.19 44.81 2b7t s LEU 24 CO 0.01 0.14 -0.17 -0.76 -1.89 0.00 0.00 176.35 173.67 2b7t s LEU 25 N 0.59 2.14 0.11 -0.68 2.01 0.76 -4.97 118.68 118.65 2b7t s LEU 25 Ca 0.03 -0.45 -0.31 0.00 0.01 0.00 0.00 54.13 53.41 2b7t s LEU 25 Cb -0.13 -0.80 -0.08 0.00 0.01 0.00 0.00 46.19 45.19 2b7t s LEU 25 CO 0.01 0.12 1.45 -0.94 1.01 0.00 0.00 176.35 178.00 2b7t s SER 26 N -1.01 6.75 -0.23 2.29 1.04 -1.26 -1.86 113.70 119.41 2b7t s SER 26 Ca 0.05 2.39 -0.39 0.00 0.48 0.00 0.00 55.95 58.48 2b7t s SER 26 Cb -0.08 -2.58 -0.14 0.00 0.10 0.00 0.00 66.02 63.31 2b7t s SER 26 CO 0.01 -0.72 1.80 1.67 0.98 0.00 0.00 173.24 176.98 2b7t n GLN 27 N 4.23 1.43 -2.97 4.02 0.00 -1.26 -4.56 117.38 118.27 2b7t n GLN 27 Ca 0.13 0.52 -0.09 0.00 -0.00 0.00 0.00 57.00 57.56 2b7t n GLN 27 Cb 0.41 -2.26 -0.02 0.00 0.00 0.00 0.00 30.24 28.37 2b7t n GLN 27 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2b7t n THR 28 N 4.82 0.00 0.00 1.69 5.66 0.01 -4.99 114.28 121.48 2b7t n THR 28 Ca 0.26 -1.06 0.00 0.00 -3.05 0.00 0.00 64.05 60.20 2b7t n THR 28 Cb 0.17 0.62 0.00 0.00 -1.55 0.00 0.00 70.33 69.57 2b7t n THR 28 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2b7t n GLY 29 N -0.33 0.94 1.71 1.09 0.00 -1.26 -0.72 105.19 106.63 2b7t n GLY 29 Ca 0.01 -1.93 -0.13 0.00 0.00 0.00 0.00 46.02 43.97 2b7t n GLY 29 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b7t n PRO 30 N 0.00 1.92 0.00 1.61 -0.04 -1.26 -4.91 135.00 132.31 2b7t n PRO 30 Ca 0.00 -1.84 0.00 0.00 -0.04 0.00 0.00 63.50 61.62 2b7t n PRO 30 Cb 0.00 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 2b7t n PRO 30 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2b7t n VAL 31 N -0.42 0.00 1.73 0.52 0.31 -1.26 -4.48 118.33 114.73 2b7t n VAL 31 Ca 0.35 0.00 0.15 0.00 -0.01 0.00 0.00 64.34 64.83 2b7t n VAL 31 Cb 1.18 0.00 0.83 0.00 -0.91 0.00 0.00 33.84 34.94 2b7t n VAL 31 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b7t n HIS 32 N 0.00 0.00 -3.19 3.52 1.44 -1.26 -4.03 115.22 111.69 2b7t n HIS 32 Ca 0.00 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.47 2b7t n HIS 32 Cb 0.00 -0.11 -0.07 0.00 0.12 0.00 0.00 29.99 29.93 2b7t n HIS 32 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b7t n ALA 33 N -1.01 2.39 -1.64 1.59 0.00 -1.26 -5.13 120.51 115.46 2b7t n ALA 33 Ca 0.20 -3.35 -0.53 0.00 0.00 0.00 0.00 53.44 49.76 2b7t n ALA 33 Cb 0.18 -0.81 -0.06 0.00 0.00 0.00 0.00 19.45 18.76 2b7t n ALA 33 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2b7t n PRO 34 N 1.50 1.34 -5.11 0.00 -0.02 -1.26 -4.31 135.00 127.14 2b7t n PRO 34 Ca 0.21 0.49 -0.30 0.00 -2.02 0.00 0.00 63.50 61.88 2b7t n PRO 34 Cb 0.53 -2.17 -0.16 0.00 -0.02 0.00 0.00 33.50 31.67 2b7t n PRO 34 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2b7t s LEU 35 N 1.66 2.01 -0.04 2.45 1.98 0.11 -4.35 118.68 122.49 2b7t s LEU 35 Ca 0.88 -0.47 0.05 0.00 -2.89 0.00 0.00 54.13 51.70 2b7t s LEU 35 Cb -0.94 -1.25 -0.01 0.00 0.66 0.00 0.00 46.19 44.66 2b7t s LEU 35 CO 0.51 0.19 -0.20 -0.36 -1.89 0.00 0.00 176.35 174.61 2b7t s PHE 36 N 0.04 1.93 -0.08 5.38 0.40 -0.40 -0.81 117.98 124.45 2b7t s PHE 36 Ca -0.08 -0.53 0.03 0.00 -0.60 0.00 0.00 56.93 55.75 2b7t s PHE 36 Cb -0.14 -1.28 -0.02 0.00 0.51 0.00 0.00 43.02 42.09 2b7t s PHE 36 CO 0.04 -0.16 -0.17 0.14 0.70 0.00 0.00 175.22 175.77 2b7t s VAL 37 N -0.09 2.78 -0.10 -0.44 -7.23 -0.78 -1.19 120.40 113.35 2b7t s VAL 37 Ca -0.02 -0.80 -0.00 0.00 -1.81 0.00 0.00 61.98 59.35 2b7t s VAL 37 Cb -0.12 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.70 2b7t s VAL 37 CO 0.02 0.56 -0.08 -0.04 -0.31 0.00 0.00 175.10 175.25 2b7t s MET 38 N -0.19 3.05 -0.24 4.82 -1.94 -0.18 -0.17 119.30 124.44 2b7t s MET 38 Ca -0.01 -0.59 -0.09 0.00 -1.71 0.00 0.00 55.69 53.29 2b7t s MET 38 Cb -0.13 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.02 2b7t s MET 38 CO 0.03 0.48 0.13 -1.54 -0.01 0.00 0.00 175.02 174.11 2b7t s SER 39 N -0.31 5.77 -0.12 3.03 1.04 -0.35 -1.13 113.70 121.63 2b7t s SER 39 Ca 0.04 -0.01 0.02 0.00 0.48 0.00 0.00 55.95 56.48 2b7t s SER 39 Cb -0.13 -2.04 -0.01 0.00 0.10 0.00 0.00 66.02 63.95 2b7t s SER 39 CO 0.02 0.02 -0.19 0.54 0.98 0.00 0.00 173.24 174.62 2b7t s VAL 40 N 1.29 2.48 -0.22 5.02 0.11 0.01 -1.03 120.40 128.06 2b7t s VAL 40 Ca 0.06 -0.86 -0.08 0.00 -2.93 0.00 0.00 61.98 58.17 2b7t s VAL 40 Cb -0.14 -2.00 -0.04 0.00 -1.53 0.00 0.00 36.38 32.67 2b7t s VAL 40 CO 0.06 0.54 0.08 -0.70 -3.33 0.00 0.00 175.10 171.75 2b7t s GLU 41 N 0.40 3.82 0.00 1.54 -6.30 0.73 -0.38 118.70 118.52 2b7t s GLU 41 Ca -0.14 -0.41 0.00 0.00 -2.50 0.00 0.00 54.97 51.92 2b7t s GLU 41 Cb -0.17 -3.31 0.00 0.00 0.00 0.00 0.00 34.13 30.65 2b7t s GLU 41 CO 0.07 0.01 0.03 1.55 0.02 0.00 0.00 175.26 176.94 2b7t n VAL 42 N 4.34 0.00 -0.16 3.70 3.14 -0.88 -1.90 118.33 126.57 2b7t n VAL 42 Ca -0.16 -0.47 0.00 0.00 -2.96 0.00 0.00 64.34 60.75 2b7t n VAL 42 Cb 0.52 1.00 0.00 0.00 -1.06 0.00 0.00 33.84 34.30 2b7t n VAL 42 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2b7t n ASN 43 N -0.87 0.00 0.00 6.55 5.15 -1.26 -4.97 115.26 119.86 2b7t n ASN 43 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2b7t n ASN 43 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2b7t n ASN 43 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b7t n GLY 44 N 0.00 -0.80 3.25 8.20 0.00 -1.26 -5.15 105.19 109.43 2b7t n GLY 44 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2b7t n GLY 44 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2b7t s GLN 45 N 0.00 0.45 -0.12 1.61 0.00 -1.26 -5.16 119.66 115.18 2b7t s GLN 45 Ca 0.00 0.42 -0.05 0.00 -0.00 0.00 0.00 55.36 55.72 2b7t s GLN 45 Cb 0.00 0.22 -0.04 0.00 0.00 0.00 0.00 33.01 33.19 2b7t s GLN 45 CO 0.00 -0.07 0.07 0.14 0.00 0.00 0.00 175.29 175.44 2b7t s VAL 46 N 0.00 4.93 -0.16 3.63 -7.23 -1.26 -2.06 120.40 118.25 2b7t s VAL 46 Ca -0.02 -0.01 0.02 0.00 -1.81 0.00 0.00 61.98 60.16 2b7t s VAL 46 Cb -0.03 -3.14 0.01 0.00 0.56 0.00 0.00 36.38 33.79 2b7t s VAL 46 CO 0.01 0.58 -0.20 -0.36 -0.31 0.00 0.00 175.10 174.82 2b7t s PHE 47 N -0.68 2.73 -0.21 2.82 0.40 0.49 -4.84 117.98 118.69 2b7t s PHE 47 Ca 0.12 -1.42 -0.07 0.00 -0.60 0.00 0.00 56.93 54.95 2b7t s PHE 47 Cb -0.12 -1.87 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 2b7t s PHE 47 CO 0.02 -0.67 0.06 -2.00 0.70 0.00 0.00 175.22 173.34 2b7t s GLU 48 N 1.01 3.84 -0.02 0.44 2.12 -1.26 -0.81 118.70 124.02 2b7t s GLU 48 Ca -0.02 -0.40 0.02 0.00 0.36 0.00 0.00 54.97 54.93 2b7t s GLU 48 Cb -0.15 -3.25 -0.00 0.00 0.26 0.00 0.00 34.13 30.99 2b7t s GLU 48 CO -0.06 0.09 -0.08 0.20 -0.54 0.00 0.00 175.26 174.87 2b7t s GLY 49 N 0.86 0.45 -0.14 -1.50 0.00 -0.28 -4.76 107.32 101.95 2b7t s GLY 49 Ca 0.04 -0.32 -0.05 0.00 0.00 0.00 0.00 44.72 44.38 2b7t s GLY 49 CO 0.02 -0.17 0.05 -1.35 0.00 0.00 0.00 173.10 171.66 2b7t s SER 50 N 0.03 5.56 0.01 1.64 1.04 -1.26 -1.01 113.70 119.71 2b7t s SER 50 Ca -0.00 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.58 2b7t s SER 50 Cb -0.06 -1.81 -0.01 0.00 0.10 0.00 0.00 66.02 64.23 2b7t s SER 50 CO -0.00 0.28 -0.02 -0.83 0.98 0.00 0.00 173.24 173.64 2b7t s GLY 51 N -0.25 0.18 0.00 7.32 0.00 -0.33 -4.49 107.32 109.74 2b7t s GLY 51 Ca 0.08 -0.42 0.03 0.00 0.00 0.00 0.00 44.72 44.41 2b7t s GLY 51 CO 0.02 -0.47 0.52 -1.55 0.00 0.00 0.00 173.10 171.62 2b7t n PRO 52 N 2.04 0.26 -3.69 2.90 -0.04 -1.26 -1.27 135.00 133.94 2b7t n PRO 52 Ca -0.20 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.11 2b7t n PRO 52 Cb 0.56 -1.19 -0.08 0.00 -0.04 0.00 0.00 33.50 32.76 2b7t n PRO 52 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2b7t s THR 53 N -2.00 0.04 0.47 0.52 -1.32 -1.26 -4.70 115.64 107.38 2b7t s THR 53 Ca 0.05 -0.31 0.18 0.00 -1.21 0.00 0.00 61.69 60.40 2b7t s THR 53 Cb 0.02 -0.72 0.35 0.00 -1.51 0.00 0.00 72.50 70.64 2b7t s THR 53 CO 0.04 -0.17 1.98 0.07 -2.21 0.00 0.00 174.62 174.33 2b7t h LYS 54 N 3.76 0.25 0.00 7.08 2.10 -1.88 -0.76 116.57 127.13 2b7t h LYS 54 Ca -0.29 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.33 2b7t h LYS 54 Cb 1.17 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 32.44 2b7t h LYS 54 CO 0.38 0.17 -0.10 0.87 -2.00 0.00 0.00 179.45 178.77 2b7t h LYS 55 N 0.26 0.00 0.01 0.07 6.56 -1.97 -1.48 116.57 120.02 2b7t h LYS 55 Ca 0.27 0.00 -0.33 0.00 -1.06 0.00 0.00 60.65 59.53 2b7t h LYS 55 Cb 0.70 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.31 2b7t h LYS 55 CO -0.06 0.10 -1.99 1.17 -2.06 0.00 0.00 179.45 176.61 2b7t n LYS 56 N -3.32 0.66 0.14 3.15 4.81 -0.48 -3.59 118.16 119.54 2b7t n LYS 56 Ca -0.00 0.19 -0.13 0.00 -0.87 0.00 0.00 58.31 57.49 2b7t n LYS 56 Cb 0.31 -1.68 -0.06 0.00 0.02 0.00 0.00 35.03 33.61 2b7t n LYS 56 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2b7t h ALA 57 N 0.85 -0.44 -0.72 3.14 0.00 -0.98 -0.81 119.26 120.30 2b7t h ALA 57 Ca -0.40 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.53 2b7t h ALA 57 Cb 2.08 0.34 -0.07 0.00 0.00 0.00 0.00 17.79 20.15 2b7t h ALA 57 CO 0.06 -0.78 0.39 1.57 0.00 0.00 0.00 179.25 180.48 2b7t h LYS 58 N -0.47 0.67 -0.03 0.00 2.10 -1.46 -0.54 116.57 116.84 2b7t h LYS 58 Ca 0.01 -0.04 0.04 0.00 -2.00 0.00 0.00 60.65 58.65 2b7t h LYS 58 Cb 0.45 -0.15 -0.05 0.00 -0.90 0.00 0.00 32.23 31.58 2b7t h LYS 58 CO -0.08 0.44 -0.30 1.25 -2.00 0.00 0.00 179.45 178.76 2b7t h LEU 59 N 0.69 -0.90 0.02 7.07 5.85 -1.57 -0.23 115.31 126.24 2b7t h LEU 59 Ca 0.34 0.12 0.03 0.00 0.84 0.00 0.00 57.88 59.21 2b7t h LEU 59 Cb 0.29 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 2b7t h LEU 59 CO -0.23 -0.36 -0.21 -0.74 -0.34 0.00 0.00 178.44 176.56 2b7t h HIS 60 N -0.43 -0.57 0.51 1.25 2.76 -0.75 0.26 115.15 118.18 2b7t h HIS 60 Ca 0.07 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2b7t h HIS 60 Cb 0.53 0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.72 2b7t h HIS 60 CO -0.34 -0.30 -0.50 0.00 -1.30 0.00 0.00 177.93 175.49 2b7t h ALA 61 N 0.52 -1.16 -0.06 5.26 0.00 -0.97 -1.93 119.26 120.92 2b7t h ALA 61 Ca 0.06 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2b7t h ALA 61 Cb 0.42 0.73 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2b7t h ALA 61 CO -0.19 -1.19 -0.14 0.00 0.00 0.00 0.00 179.25 177.74 2b7t h ALA 62 N -0.93 -0.10 0.20 0.00 0.00 -0.98 0.18 119.26 117.63 2b7t h ALA 62 Ca -0.06 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2b7t h ALA 62 Cb 0.87 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2b7t h ALA 62 CO -0.06 -0.61 -0.32 1.49 0.00 0.00 0.00 179.25 179.75 2b7t h GLU 63 N -0.20 -0.53 -0.85 0.00 4.22 -0.87 -1.52 114.58 114.82 2b7t h GLU 63 Ca 0.07 0.04 0.09 0.00 0.08 0.00 0.00 59.36 59.63 2b7t h GLU 63 Cb 0.29 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2b7t h GLU 63 CO -0.18 -0.36 0.55 -0.22 -2.18 0.00 0.00 179.01 176.63 2b7t h LYS 64 N -0.55 0.83 0.50 1.92 3.64 -1.37 -1.49 116.57 120.05 2b7t h LYS 64 Ca -0.02 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 2b7t h LYS 64 Cb 0.51 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2b7t h LYS 64 CO -0.11 0.55 -0.51 0.00 -2.27 0.00 0.00 179.45 177.11 2b7t h ALA 65 N 1.56 -1.16 -0.01 5.00 0.00 0.35 0.30 119.26 125.31 2b7t h ALA 65 Ca 0.39 -0.19 -0.22 0.00 0.00 0.00 0.00 54.91 54.89 2b7t h ALA 65 Cb 0.37 0.74 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2b7t h ALA 65 CO -0.15 -1.19 -0.91 1.25 0.00 0.00 0.00 179.25 178.25 2b7t h LEU 66 N -1.01 0.49 0.55 0.00 6.46 -1.33 -1.60 115.31 118.87 2b7t h LEU 66 Ca -0.06 -0.38 -0.02 0.00 -0.12 0.00 0.00 57.88 57.30 2b7t h LEU 66 Cb 0.88 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.64 2b7t h LEU 66 CO -0.07 1.17 -0.50 -0.09 -0.62 0.00 0.00 178.44 178.33 2b7t h ARG 67 N 0.22 -1.00 -0.98 1.25 2.43 -1.18 -0.11 114.38 115.01 2b7t h ARG 67 Ca -0.07 0.07 0.10 0.00 -0.81 0.00 0.00 59.98 59.27 2b7t h ARG 67 Cb 1.53 0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 31.24 2b7t h ARG 67 CO 0.15 -0.67 0.63 1.03 -1.51 0.00 0.00 179.97 179.60 2b7t h SER 68 N -1.04 0.94 -0.70 -3.80 0.87 -0.48 0.11 113.55 109.45 2b7t h SER 68 Ca -0.07 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 2b7t h SER 68 Cb 0.89 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.65 2b7t h SER 68 CO -0.04 0.55 0.37 0.15 -0.53 0.00 0.00 176.83 177.33 2b7t h PHE 69 N 1.03 0.99 -0.09 2.24 3.57 -1.10 -2.40 116.94 121.18 2b7t h PHE 69 Ca 0.46 -0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.77 2b7t h PHE 69 Cb 0.36 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2b7t h PHE 69 CO -0.00 0.71 -0.62 0.28 -2.23 0.00 0.00 178.31 176.44 2b7t h VAL 70 N 1.01 1.38 0.00 1.41 2.07 -0.39 -3.48 116.25 118.24 2b7t h VAL 70 Ca 0.25 -1.99 0.00 0.00 0.82 0.00 0.00 66.70 65.78 2b7t h VAL 70 Cb 0.06 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2b7t h VAL 70 CO -0.04 0.59 0.00 1.67 0.02 0.00 0.00 177.57 179.82 2b7t n GLN 71 N -3.88 0.00 -3.90 1.57 7.27 0.32 -5.04 117.38 113.72 2b7t n GLN 71 Ca -0.03 0.00 -0.09 0.00 0.07 0.00 0.00 57.00 56.95 2b7t n GLN 71 Cb 0.63 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 33.21 2b7t n GLN 71 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 2b7t s PHE 72 N -2.56 0.27 -2.03 3.69 0.08 -1.19 -4.80 117.98 111.44 2b7t s PHE 72 Ca 0.00 -0.66 0.32 0.00 0.12 0.00 0.00 56.93 56.70 2b7t s PHE 72 Cb 0.00 -0.05 1.86 0.00 -0.57 0.00 0.00 43.02 44.26 2b7t s PHE 72 CO 0.00 -0.64 2.20 -0.35 -0.10 0.00 0.00 175.22 176.33