#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qpm s SER 14 N 0.00 5.30 -0.05 -5.58 0.01 -1.26 -5.08 113.70 107.04 1qpm s SER 14 Ca 0.00 1.08 0.02 0.00 1.31 0.00 0.00 55.95 58.36 1qpm s SER 14 Cb 0.00 -1.82 0.01 0.00 0.21 0.00 0.00 66.02 64.42 1qpm s SER 14 CO 0.00 -1.43 -0.11 -0.63 0.41 0.00 0.00 173.24 171.48 1qpm s ILE 15 N -3.39 0.99 -0.03 1.44 1.01 -1.26 -5.13 121.20 114.83 1qpm s ILE 15 Ca 0.59 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.82 1qpm s ILE 15 Cb -0.11 -0.91 0.03 0.00 0.01 0.00 0.00 42.46 41.48 1qpm s ILE 15 CO 0.51 0.32 0.05 0.26 0.00 0.00 0.00 174.94 176.07 1qpm s TRP 16 N 0.57 -0.00 0.05 3.97 0.52 -1.26 -3.98 118.94 118.80 1qpm s TRP 16 Ca -0.11 0.17 0.03 0.00 0.02 0.00 0.00 56.10 56.21 1qpm s TRP 16 Cb -0.14 -0.20 -0.02 0.00 -1.15 0.00 0.00 33.47 31.96 1qpm s TRP 16 CO 0.02 -0.09 -0.09 0.00 0.02 0.00 0.00 176.95 176.81 1qpm s SER 18 N -1.61 4.85 0.50 0.00 1.04 -1.26 -0.14 113.70 117.08 1qpm s SER 18 Ca -0.09 1.45 0.21 0.00 0.48 0.00 0.00 55.95 58.00 1qpm s SER 18 Cb -0.10 -2.24 1.31 0.00 0.10 0.00 0.00 66.02 65.09 1qpm s SER 18 CO 0.01 -1.76 2.09 1.55 0.98 0.00 0.00 173.24 176.10 1qpm h PRO 19 N -0.94 0.00 -0.81 4.02 0.13 -1.96 -2.25 132.00 130.18 1qpm h PRO 19 Ca -0.46 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1qpm h PRO 19 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 1qpm h PRO 19 CO 0.58 0.10 0.54 1.96 -0.23 0.00 0.00 178.00 180.95 1qpm h GLN 20 N 0.00 1.06 -0.94 0.86 4.20 -1.93 1.34 115.11 119.69 1qpm h GLN 20 Ca -0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1qpm h GLN 20 Cb 0.21 -0.24 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 1qpm h GLN 20 CO 0.01 0.70 0.59 0.93 -0.67 0.00 0.00 178.83 180.40 1qpm h GLU 21 N 1.09 1.26 -0.15 1.46 5.08 -1.77 -2.31 114.58 119.23 1qpm h GLU 21 Ca 0.30 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 1qpm h GLU 21 Cb -0.11 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 28.87 1qpm h GLU 21 CO -0.07 0.86 -0.13 0.82 -1.00 0.00 0.00 179.01 179.49 1qpm h ILE 22 N 1.29 1.34 -0.71 3.13 2.04 -0.86 -2.81 117.51 120.92 1qpm h ILE 22 Ca 0.34 -1.27 0.21 0.00 1.00 0.00 0.00 64.86 65.14 1qpm h ILE 22 Cb -0.10 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1qpm h ILE 22 CO -0.07 0.37 0.79 0.24 0.00 0.00 0.00 178.15 179.48 1qpm h MET 23 N -0.01 0.00 0.00 2.37 2.86 0.22 2.16 114.93 122.53 1qpm h MET 23 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1qpm h MET 23 Cb 0.65 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.31 1qpm h MET 23 CO 0.03 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.00 1qpm n ALA 24 N -2.31 2.39 -2.64 6.32 0.00 -1.05 -4.71 120.51 118.51 1qpm n ALA 24 Ca 0.15 -0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.05 1qpm n ALA 24 Cb 1.03 -1.48 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 1qpm n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qpm s ALA 25 N -2.82 3.60 0.24 0.00 0.00 0.73 -4.91 121.76 118.60 1qpm s ALA 25 Ca 0.20 -0.18 -0.06 0.00 0.00 0.00 0.00 51.96 51.92 1qpm s ALA 25 Cb 0.19 -3.37 0.23 0.00 0.00 0.00 0.00 23.12 20.18 1qpm s ALA 25 CO 0.50 -1.09 1.88 -0.44 0.00 0.00 0.00 175.76 176.61 1qpm h ASP 26 N 7.83 1.14 0.00 0.00 3.32 -1.84 0.41 116.42 127.28 1qpm h ASP 26 Ca -0.23 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1qpm h ASP 26 Cb 1.09 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1qpm h ASP 26 CO 0.91 0.88 0.25 1.23 -1.72 0.00 0.00 179.24 180.78 1qpm h GLY 27 N 1.30 0.00 -6.66 2.75 0.00 -1.91 -3.03 103.07 95.52 1qpm h GLY 27 Ca 0.34 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 47.06 1qpm h GLY 27 CO -0.06 0.00 -0.78 1.03 0.00 0.00 0.00 176.54 176.73 1qpm n MET 28 N -2.37 1.06 -1.88 4.80 2.81 0.13 -5.12 117.12 116.56 1qpm n MET 28 Ca -0.01 -3.84 -0.29 0.00 -1.81 0.00 0.00 57.70 51.74 1qpm n MET 28 Cb 0.28 -1.96 0.10 0.00 -0.71 0.00 0.00 33.22 30.93 1qpm n MET 28 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1qpm s PRO 29 N -0.81 1.82 0.00 0.03 0.04 -1.15 -4.61 135.00 130.32 1qpm s PRO 29 Ca 0.30 0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.42 1qpm s PRO 29 Cb 0.01 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1qpm s PRO 29 CO -0.17 -1.69 0.00 0.41 0.04 0.00 0.00 177.00 175.58 1qpm n GLY 30 N -3.29 2.36 0.00 0.56 0.00 -1.26 -4.26 105.19 99.29 1qpm n GLY 30 Ca 0.08 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.22 1qpm n GLY 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1qpm n SER 31 N 0.00 -0.57 -0.10 1.61 3.41 -1.26 -4.47 113.62 112.24 1qpm n SER 31 Ca 0.00 -0.34 -0.06 0.00 -0.26 0.00 0.00 58.87 58.21 1qpm n SER 31 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1qpm n SER 31 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1qpm h VAL 32 N -1.08 0.81 -0.92 -3.33 2.07 -1.96 -0.92 116.25 110.92 1qpm h VAL 32 Ca 0.00 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1qpm h VAL 32 Cb 0.00 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1qpm h VAL 32 CO 0.00 0.03 0.61 0.00 0.02 0.00 0.00 177.57 178.23 1qpm h ALA 33 N 1.26 1.35 -0.91 1.67 0.00 -1.89 -1.96 119.26 118.78 1qpm h ALA 33 Ca 0.16 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1qpm h ALA 33 Cb 0.19 -0.37 -0.06 0.00 0.00 0.00 0.00 17.79 17.55 1qpm h ALA 33 CO -0.23 0.60 0.58 0.78 0.00 0.00 0.00 179.25 180.99 1qpm h GLY 34 N 1.24 1.36 1.00 0.00 0.00 -1.45 -0.26 103.07 104.95 1qpm h GLY 34 Ca 0.34 -0.43 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 1qpm h GLY 34 CO -0.08 0.33 0.26 -2.08 0.00 0.00 0.00 176.54 174.98 1qpm h VAL 35 N 1.09 1.23 -0.10 4.60 2.07 -0.68 -1.67 116.25 122.79 1qpm h VAL 35 Ca 0.38 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1qpm h VAL 35 Cb 0.09 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1qpm h VAL 35 CO -0.15 0.28 0.03 0.45 0.02 0.00 0.00 177.57 178.21 1qpm h HIS 36 N 0.88 0.13 -0.05 1.57 3.86 -0.70 -2.40 115.15 118.44 1qpm h HIS 36 Ca 0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.43 1qpm h HIS 36 Cb 0.19 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 28.61 1qpm h HIS 36 CO 0.01 0.11 0.02 -0.92 0.86 0.00 0.00 177.93 178.02 1qpm h TYR 37 N 0.14 0.04 -0.77 2.45 5.03 -0.12 0.95 116.97 124.69 1qpm h TYR 37 Ca 0.04 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.32 1qpm h TYR 37 Cb 0.04 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 38.28 1qpm h TYR 37 CO 0.00 0.02 0.35 0.00 -1.32 0.00 0.00 178.16 177.22 1qpm h ARG 38 N 0.05 1.12 -0.02 1.82 3.08 -1.40 -1.42 114.38 117.62 1qpm h ARG 38 Ca 0.02 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.89 1qpm h ARG 38 Cb 0.01 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1qpm h ARG 38 CO -0.02 0.89 0.00 0.00 -1.07 0.00 0.00 179.97 179.77 1qpm n ALA 39 N -2.40 2.64 -0.03 0.04 0.00 -0.91 -3.61 120.51 116.24 1qpm n ALA 39 Ca 0.07 -0.26 -0.14 0.00 0.00 0.00 0.00 53.44 53.11 1qpm n ALA 39 Cb 0.15 -1.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.13 1qpm n ALA 39 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1qpm h ASN 40 N 0.64 0.19 -0.22 0.00 -1.24 0.21 -3.28 115.58 111.87 1qpm h ASN 40 Ca 0.00 -0.63 -0.10 0.00 0.71 0.00 0.00 56.30 56.29 1qpm h ASN 40 Cb 0.14 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 39.13 1qpm h ASN 40 CO 0.00 0.79 -0.24 0.58 -1.29 0.00 0.00 177.43 177.27 1qpm h VAL 41 N -0.39 1.32 -4.22 2.57 2.07 -1.63 -3.44 116.25 112.52 1qpm h VAL 41 Ca -0.01 -1.41 -0.49 0.00 0.82 0.00 0.00 66.70 65.61 1qpm h VAL 41 Cb 0.77 1.73 0.04 0.00 -1.52 0.00 0.00 31.29 32.31 1qpm h VAL 41 CO 0.03 0.44 0.37 -1.10 0.02 0.00 0.00 177.57 177.33 1qpm s GLN 42 N -4.30 3.74 -0.97 1.57 -1.52 -1.24 -5.00 119.66 111.95 1qpm s GLN 42 Ca -0.13 0.79 -0.01 0.00 -1.95 0.00 0.00 55.36 54.06 1qpm s GLN 42 Cb 0.07 -2.13 0.29 0.00 -0.22 0.00 0.00 33.01 31.02 1qpm s GLN 42 CO 0.80 -0.41 1.30 0.41 -0.25 0.00 0.00 175.29 177.14 1qpm n GLY 43 N -2.19 5.09 3.73 3.09 0.00 -1.26 -4.80 105.19 108.85 1qpm n GLY 43 Ca 0.06 -2.70 -0.32 0.00 0.00 0.00 0.00 46.02 43.06 1qpm n GLY 43 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qpm s TRP 44 N -2.72 2.18 -0.25 1.61 0.52 -1.26 -4.94 118.94 114.08 1qpm s TRP 44 Ca 0.33 1.63 -0.29 0.00 0.02 0.00 0.00 56.10 57.79 1qpm s TRP 44 Cb 0.07 -3.28 0.01 0.00 -1.15 0.00 0.00 33.47 29.13 1qpm s TRP 44 CO 0.08 -2.28 1.07 0.99 0.02 0.00 0.00 176.95 176.83 1qpm s THR 45 N -2.44 4.60 0.17 2.01 2.01 -1.26 -5.01 115.64 115.72 1qpm s THR 45 Ca 0.68 1.91 0.06 0.00 0.31 0.00 0.00 61.69 64.64 1qpm s THR 45 Cb -0.23 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 67.92 1qpm s THR 45 CO 0.50 -0.26 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.51 1qpm s LYS 46 N 3.36 1.19 -0.11 4.92 1.02 -1.26 -3.22 119.74 125.64 1qpm s LYS 46 Ca 0.45 -1.52 -0.03 0.00 0.02 0.00 0.00 55.97 54.90 1qpm s LYS 46 Cb -0.15 -0.87 0.04 0.00 -0.52 0.00 0.00 37.83 36.33 1qpm s LYS 46 CO 0.09 0.13 0.06 -0.98 -0.92 0.00 0.00 175.35 173.74 1qpm s ARG 47 N -3.68 0.13 0.57 1.68 1.70 -1.19 -5.04 118.95 113.12 1qpm s ARG 47 Ca 0.19 0.09 -0.10 0.00 -0.47 0.00 0.00 55.73 55.45 1qpm s ARG 47 Cb 0.01 -1.24 -0.04 0.00 -0.57 0.00 0.00 34.95 33.11 1qpm s ARG 47 CO 0.04 -0.49 0.95 -1.59 -1.08 0.00 0.00 175.30 173.13 1qpm s LYS 48 N 2.10 3.61 -0.21 3.89 -2.85 -1.26 -3.12 119.74 121.90 1qpm s LYS 48 Ca 0.03 0.60 -0.15 0.00 -1.00 0.00 0.00 55.97 55.45 1qpm s LYS 48 Cb -0.14 -2.18 0.06 0.00 -2.06 0.00 0.00 37.83 33.51 1qpm s LYS 48 CO -0.06 -0.43 0.53 0.21 0.10 0.00 0.00 175.35 175.70 1qpm s LYS 49 N -4.94 0.56 -1.14 1.78 2.20 -0.75 -4.89 119.74 112.56 1qpm s LYS 49 Ca 0.53 0.88 -0.05 0.00 -0.36 0.00 0.00 55.97 56.97 1qpm s LYS 49 Cb -0.11 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.36 1qpm s LYS 49 CO 0.49 -0.12 0.66 0.39 -0.36 0.00 0.00 175.35 176.41 1qpm n GLU 50 N 3.72 -4.82 -2.96 4.03 1.02 -1.26 -3.29 120.64 117.08 1qpm n GLU 50 Ca -0.19 0.68 -0.02 0.00 -0.02 0.00 0.00 57.16 57.62 1qpm n GLU 50 Cb 0.57 -5.13 -0.01 0.00 -0.02 0.00 0.00 31.44 26.84 1qpm n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qpm n GLY 51 N -1.49 -1.36 3.46 0.62 0.00 -1.26 -4.74 105.19 100.43 1qpm n GLY 51 Ca -0.05 0.48 -0.36 0.00 0.00 0.00 0.00 46.02 46.09 1qpm n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qpm s VAL 52 N -0.17 4.29 -0.61 1.61 -7.23 -1.26 -4.84 120.40 112.18 1qpm s VAL 52 Ca -0.08 -0.18 0.07 0.00 -1.81 0.00 0.00 61.98 59.98 1qpm s VAL 52 Cb 0.01 -2.99 -0.00 0.00 0.56 0.00 0.00 36.38 33.95 1qpm s VAL 52 CO 0.21 0.36 0.51 0.29 -0.31 0.00 0.00 175.10 176.16 1qpm n LYS 53 N 4.68 2.33 0.00 4.82 5.02 -1.26 -4.82 118.16 128.94 1qpm n LYS 53 Ca -0.16 -0.49 0.00 0.00 -2.02 0.00 0.00 58.31 55.64 1qpm n LYS 53 Cb 0.52 -0.98 0.00 0.00 -0.02 0.00 0.00 35.03 34.55 1qpm n LYS 53 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qpm n GLY 54 N 0.76 0.00 0.00 0.72 0.00 -1.26 -5.12 105.19 100.29 1qpm n GLY 54 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1qpm n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qpm n GLY 55 N 0.00 1.54 7.00 -0.02 0.00 -1.26 -4.82 105.19 107.64 1qpm n GLY 55 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1qpm n GLY 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qpm n LYS 56 N 0.00 0.00 -3.84 1.61 4.76 -1.26 -4.29 118.16 115.14 1qpm n LYS 56 Ca 0.00 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.08 1qpm n LYS 56 Cb 0.00 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.06 1qpm n LYS 56 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1qpm s ALA 57 N -1.60 2.91 0.03 7.82 0.00 -1.21 -5.07 121.76 124.64 1qpm s ALA 57 Ca 0.00 -1.72 0.04 0.00 0.00 0.00 0.00 51.96 50.28 1qpm s ALA 57 Cb 0.00 -2.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1qpm s ALA 57 CO 0.00 -1.25 -0.12 0.54 0.00 0.00 0.00 175.76 174.93 1qpm s VAL 58 N 1.33 0.92 0.04 0.00 0.11 -1.26 -1.81 120.40 119.72 1qpm s VAL 58 Ca -0.03 -0.87 0.06 0.00 -2.93 0.00 0.00 61.98 58.21 1qpm s VAL 58 Cb -0.19 -0.84 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 1qpm s VAL 58 CO 0.00 -0.02 -0.17 -0.70 -3.33 0.00 0.00 175.10 170.89 1qpm s GLU 59 N -1.00 1.15 -0.01 1.54 2.56 -1.18 -4.10 118.70 117.65 1qpm s GLU 59 Ca 0.00 -0.82 0.08 0.00 0.00 0.00 0.00 54.97 54.23 1qpm s GLU 59 Cb -0.07 -1.20 -0.02 0.00 2.00 0.00 0.00 34.13 34.84 1qpm s GLU 59 CO 0.01 0.30 -0.25 0.71 -0.56 0.00 0.00 175.26 175.47 1qpm s TYR 60 N -0.80 2.36 -0.23 5.30 2.02 0.80 -3.19 117.35 123.61 1qpm s TYR 60 Ca 0.04 -0.41 -0.11 0.00 -0.37 0.00 0.00 57.07 56.22 1qpm s TYR 60 Cb -0.08 -1.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.94 1qpm s TYR 60 CO 0.01 0.01 0.19 0.16 -1.57 0.00 0.00 175.55 174.36 1qpm s ASP 61 N -0.75 6.16 0.54 2.29 -4.77 -1.20 -0.71 116.67 118.23 1qpm s ASP 61 Ca 0.11 0.17 0.36 0.00 -3.30 0.00 0.00 52.55 49.89 1qpm s ASP 61 Cb -0.10 -2.12 1.80 0.00 -1.09 0.00 0.00 42.92 41.41 1qpm s ASP 61 CO -0.00 0.05 2.09 0.58 0.70 0.00 0.00 175.17 178.59 1qpm h VAL 62 N 5.00 0.00 0.00 2.11 2.07 -1.94 -2.57 116.25 120.92 1qpm h VAL 62 Ca -0.38 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1qpm h VAL 62 Cb 1.17 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1qpm h VAL 62 CO 0.67 0.00 0.00 0.23 0.02 0.00 0.00 177.57 178.49 1qpm n MET 63 N -2.87 0.79 -0.03 1.57 2.81 -1.26 -3.27 117.12 114.85 1qpm n MET 63 Ca -0.01 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.89 1qpm n MET 63 Cb 0.14 -1.08 -0.11 0.00 -0.71 0.00 0.00 33.22 31.47 1qpm n MET 63 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1qpm n SER 64 N -0.58 1.75 -4.85 7.83 3.41 -0.97 -5.00 113.62 115.22 1qpm n SER 64 Ca 0.03 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.33 1qpm n SER 64 Cb 0.01 1.32 0.02 0.00 -0.26 0.00 0.00 64.21 65.30 1qpm n SER 64 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qpm s MET 65 N -2.72 3.40 1.10 4.33 0.23 -1.20 -4.90 119.30 119.54 1qpm s MET 65 Ca -0.06 0.84 -0.14 0.00 -1.03 0.00 0.00 55.69 55.31 1qpm s MET 65 Cb 0.07 -2.05 0.24 0.00 -1.53 0.00 0.00 34.83 31.56 1qpm s MET 65 CO 0.57 -0.73 1.07 -1.25 -2.03 0.00 0.00 175.02 172.65 1qpm s PRO 66 N -5.03 -0.39 0.24 3.16 0.04 -1.26 -4.71 135.00 127.04 1qpm s PRO 66 Ca 0.56 0.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.04 1qpm s PRO 66 Cb -0.12 -1.64 0.24 0.00 0.04 0.00 0.00 34.50 33.02 1qpm s PRO 66 CO 0.52 -3.28 1.90 1.79 0.04 0.00 0.00 177.00 177.97 1qpm h THR 67 N -2.29 1.26 -0.16 1.26 1.35 -1.98 -1.66 112.91 110.68 1qpm h THR 67 Ca -0.56 -0.55 0.03 0.00 -0.55 0.00 0.00 66.41 64.78 1qpm h THR 67 Cb 1.33 -0.10 -0.03 0.00 -1.73 0.00 0.00 68.15 67.62 1qpm h THR 67 CO 0.52 0.27 -0.03 0.50 -0.25 0.00 0.00 175.52 176.53 1qpm h LYS 68 N 1.32 0.01 -0.39 4.72 3.64 -2.00 -0.94 116.57 122.91 1qpm h LYS 68 Ca 0.34 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.61 1qpm h LYS 68 Cb -0.07 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1qpm h LYS 68 CO -0.07 0.01 -0.22 0.93 -2.27 0.00 0.00 179.45 177.83 1qpm h GLU 69 N 0.01 0.78 -0.99 1.90 3.07 -1.88 -2.86 114.58 114.61 1qpm h GLU 69 Ca 0.08 -0.31 0.02 0.00 -0.50 0.00 0.00 59.36 58.65 1qpm h GLU 69 Cb 0.12 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 27.94 1qpm h GLU 69 CO -0.16 0.93 0.65 0.00 -1.40 0.00 0.00 179.01 179.03 1qpm h ARG 70 N 0.68 1.26 -0.99 2.33 3.08 -0.71 -0.82 114.38 119.21 1qpm h ARG 70 Ca 0.09 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1qpm h ARG 70 Cb 0.73 -0.28 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 1qpm h ARG 70 CO 0.06 0.84 0.64 0.93 -1.07 0.00 0.00 179.97 181.36 1qpm h GLU 71 N 1.30 1.31 -0.65 0.04 5.08 -0.97 0.40 114.58 121.09 1qpm h GLU 71 Ca 0.38 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.57 1qpm h GLU 71 Cb -0.08 -0.29 -0.03 0.00 0.50 0.00 0.00 28.75 28.85 1qpm h GLU 71 CO -0.10 0.88 0.10 1.96 -1.00 0.00 0.00 179.01 180.85 1qpm h GLN 72 N 1.34 1.08 0.01 2.33 1.08 -1.08 0.35 115.11 120.22 1qpm h GLN 72 Ca 0.36 -0.29 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1qpm h GLN 72 Cb -0.13 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.18 1qpm h GLN 72 CO -0.07 1.00 -0.00 0.28 -0.95 0.00 0.00 178.83 179.08 1qpm h VAL 73 N 1.01 1.39 -0.93 -0.54 2.07 -0.22 -2.67 116.25 116.36 1qpm h VAL 73 Ca 0.20 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1qpm h VAL 73 Cb 0.44 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.37 1qpm h VAL 73 CO 0.01 0.31 0.53 0.40 0.02 0.00 0.00 177.57 178.84 1qpm h ILE 74 N -0.52 1.26 -0.48 4.57 5.03 -0.16 -2.29 117.51 124.92 1qpm h ILE 74 Ca -0.00 -0.61 0.06 0.00 -0.12 0.00 0.00 64.86 64.19 1qpm h ILE 74 Cb 0.51 -0.02 -0.05 0.00 -3.03 0.00 0.00 36.82 34.23 1qpm h ILE 74 CO 0.00 0.28 0.17 0.00 -0.68 0.00 0.00 178.15 177.93 1qpm h ALA 75 N 1.30 0.58 -0.66 1.87 0.00 -0.25 0.93 119.26 123.03 1qpm h ALA 75 Ca 0.33 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1qpm h ALA 75 Cb -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1qpm h ALA 75 CO -0.06 -0.21 0.27 1.25 0.00 0.00 0.00 179.25 180.50 1qpm h HIS 76 N 0.35 0.99 -0.55 0.00 -0.00 -1.10 -1.86 115.15 112.99 1qpm h HIS 76 Ca 0.23 -0.07 -0.10 0.00 -0.00 0.00 0.00 60.37 60.42 1qpm h HIS 76 Cb 0.23 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 1qpm h HIS 76 CO -0.16 0.77 -0.06 -0.07 -0.00 0.00 0.00 177.93 178.42 1qpm h LEU 77 N 0.92 0.98 -1.01 0.26 3.38 -0.73 -1.98 115.31 117.14 1qpm h LEU 77 Ca 0.22 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1qpm h LEU 77 Cb 0.20 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1qpm h LEU 77 CO -0.02 1.06 0.67 1.23 0.09 0.00 0.00 178.44 181.47 1qpm h GLY 78 N 0.97 1.43 -0.05 0.83 0.00 0.14 -0.86 103.07 105.54 1qpm h GLY 78 Ca 0.15 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1qpm h GLY 78 CO 0.04 0.49 -0.03 1.47 0.00 0.00 0.00 176.54 178.52 1qpm n LEU 79 N -4.40 1.11 -0.48 3.11 -0.00 -0.75 -3.37 117.00 112.22 1qpm n LEU 79 Ca 0.12 -0.36 0.12 0.00 -0.00 0.00 0.00 56.01 55.90 1qpm n LEU 79 Cb 0.03 -0.02 0.47 0.00 -0.00 0.00 0.00 43.42 43.90 1qpm n LEU 79 CO 0.36 0.19 0.83 -1.20 -0.00 0.00 0.00 177.39 177.57 1qpm n SER 80 N -0.18 1.49 0.00 1.45 7.64 -0.33 -5.09 113.62 118.59 1qpm n SER 80 Ca 0.19 -1.58 0.00 0.00 1.01 0.00 0.00 58.87 58.50 1qpm n SER 80 Cb 0.30 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 1qpm n SER 80 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10