#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 -1.81 0.92 -1.23 0.00 -1.26 -5.06 105.19 96.75 2b7t n GLY 2 Ca 0.00 0.87 -0.08 0.00 0.00 0.00 0.00 46.02 46.81 2b7t n GLY 2 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b7t n PRO 3 N 0.00 -1.64 0.00 1.61 -0.04 -1.26 -5.04 135.00 128.64 2b7t n PRO 3 Ca 0.00 -0.46 0.00 0.00 -0.04 0.00 0.00 63.50 63.00 2b7t n PRO 3 Cb 0.00 -0.44 0.00 0.00 -0.04 0.00 0.00 33.50 33.02 2b7t n PRO 3 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2b7t n VAL 4 N -3.16 0.66 -3.87 0.52 0.24 -1.26 -4.90 118.33 106.56 2b7t n VAL 4 Ca 0.04 -0.77 -0.30 0.00 -2.04 0.00 0.00 64.34 61.27 2b7t n VAL 4 Cb 0.16 0.70 -0.15 0.00 -1.47 0.00 0.00 33.84 33.07 2b7t n VAL 4 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2b7t s LEU 5 N -0.66 2.70 0.31 1.34 2.96 -1.26 -4.96 118.68 119.12 2b7t s LEU 5 Ca 0.00 -1.44 0.07 0.00 -0.22 0.00 0.00 54.13 52.54 2b7t s LEU 5 Cb 0.00 -1.10 0.88 0.00 0.50 0.00 0.00 46.19 46.46 2b7t s LEU 5 CO 0.00 -0.32 1.63 -0.65 -1.32 0.00 0.00 176.35 175.69 2b7t h PRO 6 N 7.96 0.16 0.00 0.98 0.11 -1.94 -3.31 132.00 135.97 2b7t h PRO 6 Ca -0.14 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2b7t h PRO 6 Cb 1.05 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2b7t h PRO 6 CO 0.44 0.11 0.00 1.17 -0.21 0.00 0.00 178.00 179.51 2b7t n LYS 7 N -5.24 0.00 -0.03 1.05 0.00 -1.26 -1.52 118.16 111.16 2b7t n LYS 7 Ca 0.26 0.88 -0.17 0.00 0.00 0.00 0.00 58.31 59.28 2b7t n LYS 7 Cb 0.84 -1.35 -0.07 0.00 0.00 0.00 0.00 35.03 34.44 2b7t n LYS 7 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.40 176.43 2b7t h ASN 8 N 0.00 0.89 0.32 3.14 -1.24 -2.00 -1.33 115.58 115.35 2b7t h ASN 8 Ca 0.00 -0.62 0.00 0.00 0.71 0.00 0.00 56.30 56.39 2b7t h ASN 8 Cb 0.00 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.76 2b7t h ASN 8 CO 0.00 1.36 -0.34 0.00 -1.29 0.00 0.00 177.43 177.16 2b7t h ALA 9 N 0.55 -0.72 -0.08 1.57 0.00 -1.76 -1.72 119.26 117.09 2b7t h ALA 9 Ca -0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2b7t h ALA 9 Cb 1.33 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 19.62 2b7t h ALA 9 CO 0.15 -0.94 0.05 -0.07 0.00 0.00 0.00 179.25 178.43 2b7t h LEU 10 N -0.70 0.10 -0.96 0.00 -0.00 -1.12 -1.37 115.31 111.26 2b7t h LEU 10 Ca -0.02 -0.07 0.09 0.00 -0.00 0.00 0.00 57.88 57.89 2b7t h LEU 10 Cb 0.64 -0.03 -0.08 0.00 -0.00 0.00 0.00 40.66 41.20 2b7t h LEU 10 CO -0.08 0.14 0.60 0.00 -0.00 0.00 0.00 178.44 179.10 2b7t h MET 11 N 0.05 0.99 0.18 1.13 -0.00 -1.33 0.14 114.93 116.10 2b7t h MET 11 Ca 0.03 -0.06 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 2b7t h MET 11 Cb 0.06 -0.22 -0.03 0.00 -0.00 0.00 0.00 31.60 31.41 2b7t h MET 11 CO -0.01 0.65 -0.42 0.37 -0.00 0.00 0.00 176.91 177.50 2b7t h GLN 12 N 1.01 -0.64 -0.07 -0.10 4.15 -0.32 -1.40 115.11 117.73 2b7t h GLN 12 Ca 0.45 0.04 -0.17 0.00 0.77 0.00 0.00 58.65 59.75 2b7t h GLN 12 Cb 0.34 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.17 2b7t h GLN 12 CO -0.23 -0.43 -0.68 1.37 -1.93 0.00 0.00 178.83 176.93 2b7t h LEU 13 N -0.67 0.38 -1.07 -2.39 -0.00 -1.11 -1.92 115.31 108.53 2b7t h LEU 13 Ca -0.02 -0.24 -0.02 0.00 -0.00 0.00 0.00 57.88 57.60 2b7t h LEU 13 Cb 0.64 -0.11 -0.03 0.00 -0.00 0.00 0.00 40.66 41.16 2b7t h LEU 13 CO -0.18 0.95 0.33 0.78 -0.00 0.00 0.00 178.44 180.32 2b7t h ASN 14 N 0.23 0.89 0.46 0.17 2.35 -0.72 0.21 115.58 119.17 2b7t h ASN 14 Ca -0.02 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.62 2b7t h ASN 14 Cb 1.23 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 2b7t h ASN 14 CO 0.11 0.76 -0.36 -0.33 -1.65 0.00 0.00 177.43 175.95 2b7t h GLU 15 N 0.98 -0.78 -0.59 0.81 5.08 -1.16 -1.82 114.58 117.10 2b7t h GLU 15 Ca 0.24 0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.71 2b7t h GLU 15 Cb 0.10 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 2b7t h GLU 15 CO -0.03 -0.52 0.31 0.82 -1.00 0.00 0.00 179.01 178.59 2b7t h ILE 16 N -0.81 0.96 -2.57 3.13 2.04 -0.78 -3.38 117.51 116.11 2b7t h ILE 16 Ca -0.05 -0.20 -0.51 0.00 1.00 0.00 0.00 64.86 65.11 2b7t h ILE 16 Cb 0.70 0.32 -0.38 0.00 -0.74 0.00 0.00 36.82 36.72 2b7t h ILE 16 CO -0.01 0.11 -0.78 -0.54 0.00 0.00 0.00 178.15 176.94 2b7t s LYS 17 N -6.11 0.36 -0.26 2.37 1.02 0.68 -5.05 119.74 112.74 2b7t s LYS 17 Ca -0.13 -0.76 -0.06 0.00 0.02 0.00 0.00 55.97 55.05 2b7t s LYS 17 Cb 0.15 -1.10 -0.20 0.00 -0.52 0.00 0.00 37.83 36.16 2b7t s LYS 17 CO 0.75 -1.10 3.04 -0.35 -0.92 0.00 0.00 175.35 176.78 2b7t n PRO 18 N 4.79 1.95 -2.06 -1.68 -0.04 -0.68 -3.96 135.00 133.32 2b7t n PRO 18 Ca 0.02 -1.05 -0.02 0.00 -0.04 0.00 0.00 63.50 62.42 2b7t n PRO 18 Cb 0.41 -2.06 0.02 0.00 -0.04 0.00 0.00 33.50 31.83 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 2.78 -0.42 3.90 0.55 0.00 -1.26 -5.11 105.19 105.64 2b7t n GLY 19 Ca 0.42 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.36 3.75 -0.22 0.99 1.02 -1.25 -4.91 118.68 116.69 2b7t s LEU 20 Ca 0.03 0.90 0.01 0.00 0.02 0.00 0.00 54.13 55.08 2b7t s LEU 20 Cb 0.09 -3.82 0.05 0.00 0.02 0.00 0.00 46.19 42.54 2b7t s LEU 20 CO -0.03 -0.48 -0.07 -1.10 0.02 0.00 0.00 176.35 174.69 2b7t s GLN 21 N -4.42 1.78 -0.13 1.70 1.11 -0.77 -4.93 119.66 114.00 2b7t s GLN 21 Ca 0.47 -0.94 -0.05 0.00 0.01 0.00 0.00 55.36 54.85 2b7t s GLN 21 Cb -0.10 -2.52 -0.04 0.00 -1.01 0.00 0.00 33.01 29.34 2b7t s GLN 21 CO 0.40 -0.53 0.05 0.71 0.01 0.00 0.00 175.29 175.93 2b7t s TYR 22 N 1.39 3.29 0.02 0.91 1.51 -1.26 -0.68 117.35 122.53 2b7t s TYR 22 Ca -0.04 0.20 0.02 0.00 -1.01 0.00 0.00 57.07 56.24 2b7t s TYR 22 Cb -0.18 -1.94 -0.01 0.00 -0.11 0.00 0.00 41.96 39.71 2b7t s TYR 22 CO -0.07 0.38 -0.07 1.41 -1.11 0.00 0.00 175.55 176.09 2b7t s MET 23 N -0.36 0.51 -0.11 -0.62 1.75 0.07 -5.01 119.30 115.54 2b7t s MET 23 Ca 0.09 -0.47 0.01 0.00 -1.25 0.00 0.00 55.69 54.07 2b7t s MET 23 Cb -0.12 -0.40 -0.02 0.00 2.84 0.00 0.00 34.83 37.13 2b7t s MET 23 CO 0.02 0.10 -0.12 -1.17 -0.65 0.00 0.00 175.02 173.19 2b7t s LEU 24 N -0.81 2.80 0.10 4.11 2.96 -1.26 -0.91 118.68 125.66 2b7t s LEU 24 Ca -0.03 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.65 2b7t s LEU 24 Cb -0.06 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2b7t s LEU 24 CO 0.00 0.23 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.42 2b7t s LEU 25 N -0.03 2.46 0.15 -0.68 2.01 0.31 -5.00 118.68 117.91 2b7t s LEU 25 Ca -0.03 -0.92 -0.30 0.00 0.01 0.00 0.00 54.13 52.90 2b7t s LEU 25 Cb -0.14 -0.15 -0.07 0.00 0.01 0.00 0.00 46.19 45.84 2b7t s LEU 25 CO 0.04 -0.39 1.10 -0.94 1.01 0.00 0.00 176.35 177.17 2b7t s SER 26 N -2.77 7.26 -0.18 2.29 1.04 -1.26 -1.71 113.70 118.38 2b7t s SER 26 Ca 0.08 2.04 -0.39 0.00 0.48 0.00 0.00 55.95 58.17 2b7t s SER 26 Cb 0.02 -2.60 -0.15 0.00 0.10 0.00 0.00 66.02 63.39 2b7t s SER 26 CO -0.03 -0.24 1.69 1.67 0.98 0.00 0.00 173.24 177.31 2b7t n GLN 27 N 2.67 1.31 -0.45 4.02 0.00 -1.26 -4.51 117.38 119.16 2b7t n GLN 27 Ca 0.04 0.48 0.00 0.00 -0.00 0.00 0.00 57.00 57.51 2b7t n GLN 27 Cb 0.47 -2.18 0.00 0.00 0.00 0.00 0.00 30.24 28.53 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 4.27 0.00 -4.38 1.69 5.66 0.49 -4.97 114.28 117.04 2b7t n THR 28 Ca 0.24 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.99 2b7t n THR 28 Cb 0.16 0.27 -0.09 0.00 -1.55 0.00 0.00 70.33 69.12 2b7t n THR 28 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 2b7t s GLY 29 N -0.43 2.31 0.87 1.09 0.00 -1.23 -4.75 107.32 105.17 2b7t s GLY 29 Ca 0.00 -2.14 -0.13 0.00 0.00 0.00 0.00 44.72 42.45 2b7t s GLY 29 CO 0.00 -1.98 1.23 2.56 0.00 0.00 0.00 173.10 174.91 2b7t s PRO 30 N -3.77 1.45 0.58 2.90 0.04 -1.25 -4.32 135.00 130.63 2b7t s PRO 30 Ca 0.37 -0.07 0.32 0.00 0.04 0.00 0.00 61.00 61.66 2b7t s PRO 30 Cb 0.05 -1.91 1.36 0.00 0.04 0.00 0.00 34.50 34.04 2b7t s PRO 30 CO 0.20 -1.92 1.66 -0.39 0.04 0.00 0.00 177.00 176.59 2b7t h VAL 31 N -1.29 0.23 -0.01 -0.36 -1.51 -2.01 -1.08 116.25 110.21 2b7t h VAL 31 Ca -0.46 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.01 2b7t h VAL 31 Cb 1.30 0.32 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2b7t h VAL 31 CO 0.56 0.00 -0.27 0.00 -1.23 0.00 0.00 177.57 176.63 2b7t n HIS 32 N -3.70 0.00 -2.74 5.19 -0.00 -1.26 -4.66 115.22 108.06 2b7t n HIS 32 Ca 0.21 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.84 2b7t n HIS 32 Cb 1.20 0.00 0.08 0.00 -0.00 0.00 0.00 29.99 31.27 2b7t n HIS 32 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2b7t n ALA 33 N 0.05 1.47 -1.59 1.59 0.00 -0.60 -5.13 120.51 116.30 2b7t n ALA 33 Ca 0.07 -1.94 -0.45 0.00 0.00 0.00 0.00 53.44 51.12 2b7t n ALA 33 Cb 0.34 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 18.75 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 -0.23 1.96 -3.65 0.00 -0.02 -0.51 -3.92 135.00 128.63 2b7t n PRO 34 Ca 0.04 0.59 -0.39 0.00 -2.02 0.00 0.00 63.50 61.73 2b7t n PRO 34 Cb 0.80 -3.00 -0.12 0.00 -0.02 0.00 0.00 33.50 31.16 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 7.13 4.16 0.20 2.45 1.98 -1.26 -2.62 118.68 130.71 2b7t s LEU 35 Ca 1.00 -0.56 0.07 0.00 -2.89 0.00 0.00 54.13 51.75 2b7t s LEU 35 Cb -0.48 -2.00 -0.04 0.00 0.66 0.00 0.00 46.19 44.32 2b7t s LEU 35 CO 0.41 -0.21 0.06 -0.36 -1.89 0.00 0.00 176.35 174.36 2b7t s PHE 36 N 1.61 2.94 -0.06 5.38 0.40 -0.57 -0.38 117.98 127.30 2b7t s PHE 36 Ca 0.04 -0.12 0.06 0.00 -0.60 0.00 0.00 56.93 56.32 2b7t s PHE 36 Cb -0.17 -1.39 -0.01 0.00 0.51 0.00 0.00 43.02 41.96 2b7t s PHE 36 CO 0.06 0.53 -0.25 0.14 0.70 0.00 0.00 175.22 176.41 2b7t s VAL 37 N -1.89 2.05 -0.08 -0.44 -7.23 -0.69 -1.27 120.40 110.85 2b7t s VAL 37 Ca 0.30 -1.07 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 2b7t s VAL 37 Cb -0.09 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 2b7t s VAL 37 CO 0.21 0.57 -0.14 -0.04 -0.31 0.00 0.00 175.10 175.39 2b7t s MET 38 N -0.18 2.87 -0.12 4.82 -1.94 -0.31 -0.53 119.30 123.91 2b7t s MET 38 Ca -0.03 -0.69 -0.11 0.00 -1.71 0.00 0.00 55.69 53.15 2b7t s MET 38 Cb -0.14 -2.49 -0.05 0.00 2.01 0.00 0.00 34.83 34.17 2b7t s MET 38 CO 0.04 0.46 0.24 -1.54 -0.01 0.00 0.00 175.02 174.20 2b7t s SER 39 N -0.29 6.45 -0.06 3.03 1.04 -0.09 -1.00 113.70 122.78 2b7t s SER 39 Ca 0.02 0.53 0.01 0.00 0.48 0.00 0.00 55.95 57.00 2b7t s SER 39 Cb -0.13 -2.14 0.02 0.00 0.10 0.00 0.00 66.02 63.87 2b7t s SER 39 CO 0.03 0.26 -0.08 0.54 0.98 0.00 0.00 173.24 174.96 2b7t s VAL 40 N -0.34 0.87 -0.21 5.02 0.11 0.23 -0.75 120.40 125.34 2b7t s VAL 40 Ca 0.16 -0.31 -0.07 0.00 -2.93 0.00 0.00 61.98 58.83 2b7t s VAL 40 Cb -0.13 -0.83 -0.04 0.00 -1.53 0.00 0.00 36.38 33.85 2b7t s VAL 40 CO 0.05 0.30 0.06 -0.70 -3.33 0.00 0.00 175.10 171.48 2b7t s GLU 41 N 0.87 3.85 0.00 1.54 -6.30 0.15 -0.45 118.70 118.35 2b7t s GLU 41 Ca -0.11 -0.40 0.00 0.00 -2.50 0.00 0.00 54.97 51.96 2b7t s GLU 41 Cb -0.15 -3.25 0.00 0.00 0.00 0.00 0.00 34.13 30.73 2b7t s GLU 41 CO 0.01 0.10 0.00 1.55 0.02 0.00 0.00 175.26 176.95 2b7t n VAL 42 N 4.04 0.00 -0.36 3.70 3.14 -0.84 -1.84 118.33 126.17 2b7t n VAL 42 Ca -0.16 -0.30 0.00 0.00 -2.96 0.00 0.00 64.34 60.92 2b7t n VAL 42 Cb 0.52 0.82 0.00 0.00 -1.06 0.00 0.00 33.84 34.12 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 -1.05 0.00 0.00 6.55 5.15 -1.26 -4.97 115.26 119.68 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 -0.90 3.33 8.20 0.00 -1.26 -5.15 105.19 109.41 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 0.53 -0.03 1.61 0.00 -1.26 -5.17 119.66 115.34 2b7t s GLN 45 Ca 0.00 0.55 -0.07 0.00 -0.00 0.00 0.00 55.36 55.85 2b7t s GLN 45 Cb 0.00 0.26 -0.04 0.00 0.00 0.00 0.00 33.01 33.22 2b7t s GLN 45 CO 0.00 -0.07 0.23 0.14 0.00 0.00 0.00 175.29 175.59 2b7t s VAL 46 N 0.11 5.36 -0.14 3.63 -7.23 -1.26 -1.99 120.40 118.88 2b7t s VAL 46 Ca -0.01 0.18 0.03 0.00 -1.81 0.00 0.00 61.98 60.36 2b7t s VAL 46 Cb -0.03 -3.53 0.01 0.00 0.56 0.00 0.00 36.38 33.39 2b7t s VAL 46 CO 0.01 0.45 -0.22 -0.36 -0.31 0.00 0.00 175.10 174.67 2b7t s PHE 47 N -1.21 2.66 -0.15 2.82 0.40 0.40 -4.85 117.98 118.05 2b7t s PHE 47 Ca 0.24 -1.33 -0.06 0.00 -0.60 0.00 0.00 56.93 55.18 2b7t s PHE 47 Cb -0.13 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.55 2b7t s PHE 47 CO 0.13 -0.60 0.04 -1.21 0.70 0.00 0.00 175.22 174.28 2b7t s GLU 48 N 0.79 3.69 0.03 0.44 8.01 -1.26 -0.60 118.70 129.79 2b7t s GLU 48 Ca -0.08 -0.37 0.02 0.00 0.01 0.00 0.00 54.97 54.56 2b7t s GLU 48 Cb -0.16 -3.08 -0.02 0.00 -4.31 0.00 0.00 34.13 26.57 2b7t s GLU 48 CO -0.01 0.40 -0.07 0.20 0.01 0.00 0.00 175.26 175.78 2b7t s GLY 49 N -0.01 0.45 -0.15 -1.39 0.00 -0.17 -4.62 107.32 101.43 2b7t s GLY 49 Ca 0.05 -0.62 -0.06 0.00 0.00 0.00 0.00 44.72 44.09 2b7t s GLY 49 CO 0.01 -0.65 0.04 -1.35 0.00 0.00 0.00 173.10 171.16 2b7t s SER 50 N -1.17 5.52 -0.04 1.64 1.04 -1.26 -1.16 113.70 118.27 2b7t s SER 50 Ca -0.06 0.11 -0.02 0.00 0.48 0.00 0.00 55.95 56.46 2b7t s SER 50 Cb -0.08 -1.84 0.02 0.00 0.10 0.00 0.00 66.02 64.22 2b7t s SER 50 CO 0.00 0.25 0.09 -0.83 0.98 0.00 0.00 173.24 173.73 2b7t s GLY 51 N -0.09 -0.03 0.00 7.32 0.00 -0.40 -4.48 107.32 109.65 2b7t s GLY 51 Ca 0.06 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.14 2b7t s GLY 51 CO 0.01 0.50 0.00 -1.05 0.00 0.00 0.00 173.10 172.56 2b7t n PRO 52 N 3.55 0.00 -3.64 2.90 -0.02 -1.26 -1.51 135.00 135.01 2b7t n PRO 52 Ca -0.19 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.25 2b7t n PRO 52 Cb 0.56 -0.91 -0.07 0.00 -0.02 0.00 0.00 33.50 33.06 2b7t n PRO 52 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2b7t s THR 53 N -0.96 0.00 0.57 3.45 -1.32 -1.08 -3.80 115.64 112.51 2b7t s THR 53 Ca 0.00 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.75 2b7t s THR 53 Cb 0.00 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.35 2b7t s THR 53 CO 0.00 0.00 2.07 0.07 -2.21 0.00 0.00 174.62 174.55 2b7t h LYS 54 N 4.94 0.00 -0.28 7.08 2.10 -1.84 -0.41 116.57 128.15 2b7t h LYS 54 Ca -0.28 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.24 2b7t h LYS 54 Cb 1.18 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.50 2b7t h LYS 54 CO 0.16 0.00 -0.35 0.87 -2.00 0.00 0.00 179.45 178.13 2b7t h LYS 55 N 0.00 0.63 -0.10 0.07 1.57 -1.97 -1.24 116.57 115.53 2b7t h LYS 55 Ca 0.12 -0.30 -0.22 0.00 -1.87 0.00 0.00 60.65 58.38 2b7t h LYS 55 Cb 0.60 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.91 2b7t h LYS 55 CO -0.00 0.89 -0.82 -0.22 -0.57 0.00 0.00 179.45 178.73 2b7t h LYS 56 N 0.53 0.63 0.69 3.15 3.64 -1.47 -2.56 116.57 121.18 2b7t h LYS 56 Ca 0.05 -0.55 -0.03 0.00 -1.27 0.00 0.00 60.65 58.85 2b7t h LYS 56 Cb 0.85 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.80 2b7t h LYS 56 CO 0.07 1.17 -0.39 0.00 -2.27 0.00 0.00 179.45 178.03 2b7t h ALA 57 N 0.66 -1.03 -0.97 5.00 0.00 -0.96 0.11 119.26 122.07 2b7t h ALA 57 Ca -0.06 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.73 2b7t h ALA 57 Cb 1.44 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 19.63 2b7t h ALA 57 CO 0.16 -1.09 0.62 1.57 0.00 0.00 0.00 179.25 180.51 2b7t h LYS 58 N -1.01 0.99 0.15 0.00 5.09 -1.38 -1.27 116.57 119.14 2b7t h LYS 58 Ca -0.09 -0.06 0.02 0.00 0.09 0.00 0.00 60.65 60.61 2b7t h LYS 58 Cb 0.81 -0.22 -0.04 0.00 0.10 0.00 0.00 32.23 32.87 2b7t h LYS 58 CO 0.11 0.66 -0.35 1.25 -2.09 0.00 0.00 179.45 179.03 2b7t h LEU 59 N 1.02 -1.01 -0.61 7.07 6.46 -1.21 -1.36 115.31 125.67 2b7t h LEU 59 Ca 0.45 0.11 0.07 0.00 -0.12 0.00 0.00 57.88 58.39 2b7t h LEU 59 Cb 0.36 0.38 -0.06 0.00 -0.73 0.00 0.00 40.66 40.60 2b7t h LEU 59 CO -0.21 -0.44 0.30 -0.74 -0.62 0.00 0.00 178.44 176.73 2b7t h HIS 60 N -0.60 0.53 0.24 1.25 2.76 -0.16 0.23 115.15 119.41 2b7t h HIS 60 Ca 0.02 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 2b7t h HIS 60 Cb 0.62 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.42 2b7t h HIS 60 CO -0.30 0.22 -0.24 0.00 -1.30 0.00 0.00 177.93 176.32 2b7t h ALA 61 N 1.36 -0.94 -0.71 5.26 0.00 -1.19 -2.10 119.26 120.94 2b7t h ALA 61 Ca 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2b7t h ALA 61 Cb 0.26 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 2b7t h ALA 61 CO -0.23 -0.96 0.41 0.00 0.00 0.00 0.00 179.25 178.47 2b7t h ALA 62 N -1.37 0.90 0.35 0.00 0.00 -0.97 0.15 119.26 118.32 2b7t h ALA 62 Ca -0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2b7t h ALA 62 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2b7t h ALA 62 CO -0.03 0.40 -0.35 1.49 0.00 0.00 0.00 179.25 180.76 2b7t h GLU 63 N 0.97 -0.67 -1.01 0.00 4.22 -0.63 -1.82 114.58 115.64 2b7t h GLU 63 Ca 0.25 0.05 0.10 0.00 0.08 0.00 0.00 59.36 59.83 2b7t h GLU 63 Cb 0.00 0.15 -0.08 0.00 0.50 0.00 0.00 28.75 29.33 2b7t h GLU 63 CO -0.04 -0.45 0.64 -0.22 -2.18 0.00 0.00 179.01 176.76 2b7t h LYS 64 N -0.70 1.05 0.50 1.92 3.64 -1.31 -1.60 116.57 120.06 2b7t h LYS 64 Ca -0.04 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2b7t h LYS 64 Cb 0.60 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2b7t h LYS 64 CO -0.04 0.69 -0.49 0.00 -2.27 0.00 0.00 179.45 177.34 2b7t h ALA 65 N 1.50 -1.10 -0.54 5.00 0.00 -0.20 0.26 119.26 124.18 2b7t h ALA 65 Ca 0.47 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 2b7t h ALA 65 Cb 0.35 0.71 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2b7t h ALA 65 CO -0.23 -1.16 0.06 -0.07 0.00 0.00 0.00 179.25 177.85 2b7t h LEU 66 N -0.99 0.88 0.24 0.00 -0.00 -1.38 -1.59 115.31 112.47 2b7t h LEU 66 Ca -0.06 -0.28 0.01 0.00 -0.00 0.00 0.00 57.88 57.55 2b7t h LEU 66 Cb 0.86 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 41.25 2b7t h LEU 66 CO -0.06 0.94 -0.35 -0.09 -0.00 0.00 0.00 178.44 178.87 2b7t h ARG 67 N 0.79 -0.63 -0.30 1.13 2.43 -0.93 0.17 114.38 117.04 2b7t h ARG 67 Ca 0.16 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.42 2b7t h ARG 67 Cb 0.45 0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.10 2b7t h ARG 67 CO 0.02 -0.42 0.01 1.03 -1.51 0.00 0.00 179.97 179.10 2b7t h SER 68 N -0.66 -0.09 -0.77 -3.80 0.87 -0.30 -0.23 113.55 108.58 2b7t h SER 68 Ca 0.00 0.06 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 2b7t h SER 68 Cb 0.63 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.66 2b7t h SER 68 CO -0.13 -0.01 0.51 0.15 -0.53 0.00 0.00 176.83 176.82 2b7t h PHE 69 N 0.10 0.95 0.00 2.24 3.57 -1.06 -1.99 116.94 120.74 2b7t h PHE 69 Ca 0.14 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 2b7t h PHE 69 Cb 0.18 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2b7t h PHE 69 CO -0.21 0.58 -0.42 0.28 -2.23 0.00 0.00 178.31 176.32 2b7t h VAL 70 N 1.01 1.02 0.00 1.41 2.07 -0.39 -3.47 116.25 117.90 2b7t h VAL 70 Ca 0.29 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 66.22 2b7t h VAL 70 Cb -0.07 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 2b7t h VAL 70 CO -0.07 0.41 0.00 0.00 0.02 0.00 0.00 177.57 177.93 2b7t n GLN 71 N -3.64 0.00 -3.96 1.57 10.64 -0.70 -5.09 117.38 116.20 2b7t n GLN 71 Ca -0.01 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.81 2b7t n GLN 71 Cb 0.51 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.78 2b7t n GLN 71 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 2b7t s PHE 72 N 0.00 3.15 -1.29 2.61 0.08 -0.18 -4.88 117.98 117.48 2b7t s PHE 72 Ca 0.00 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 56.89 2b7t s PHE 72 Cb 0.00 -2.13 0.00 0.00 -0.57 0.00 0.00 43.02 40.32 2b7t s PHE 72 CO 0.00 -0.07 0.32 -2.30 -0.10 0.00 0.00 175.22 173.07