#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 -0.33 -0.05 -5.58 0.01 -1.26 -5.16 113.70 101.32 1qpm s SER 14 Ca 0.00 -0.45 0.02 0.00 1.31 0.00 0.00 55.95 56.83 1qpm s SER 14 Cb 0.00 0.66 0.02 0.00 0.21 0.00 0.00 66.02 66.91 1qpm s SER 14 CO 0.00 -1.19 -0.09 -0.63 0.41 0.00 0.00 173.24 171.74 1qpm s ILE 15 N -3.87 0.84 -0.01 1.44 1.01 -1.26 -5.13 121.20 114.22 1qpm s ILE 15 Ca 0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.43 1qpm s ILE 15 Cb -0.04 -0.80 0.01 0.00 0.01 0.00 0.00 42.46 41.64 1qpm s ILE 15 CO 0.00 0.29 0.01 0.26 0.00 0.00 0.00 174.94 175.51 1qpm s TRP 16 N 0.76 0.01 0.02 3.97 0.52 -1.26 -3.63 118.94 119.31 1qpm s TRP 16 Ca -0.13 0.05 0.00 0.00 0.02 0.00 0.00 56.10 56.04 1qpm s TRP 16 Cb -0.15 -0.08 -0.02 0.00 -1.15 0.00 0.00 33.47 32.07 1qpm s TRP 16 CO 0.02 -0.03 -0.03 0.00 0.02 0.00 0.00 176.95 176.93 1qpm s SER 18 N -1.12 4.89 0.56 0.00 0.15 -1.26 -2.18 113.70 114.75 1qpm s SER 18 Ca -0.12 0.73 0.32 0.00 0.70 0.00 0.00 55.95 57.59 1qpm s SER 18 Cb -0.08 -1.39 1.45 0.00 -1.71 0.00 0.00 66.02 64.30 1qpm s SER 18 CO -0.01 -1.61 1.80 -0.65 1.20 0.00 0.00 173.24 173.97 1qpm h PRO 19 N -0.74 0.00 -0.67 5.44 0.11 -1.93 -1.11 132.00 133.09 1qpm h PRO 19 Ca -0.45 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.67 1qpm h PRO 19 Cb 1.30 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.38 1qpm h PRO 19 CO 0.63 0.00 0.44 1.96 -0.21 0.00 0.00 178.00 180.82 1qpm h GLN 20 N 0.00 0.88 -0.36 1.05 4.20 -1.94 1.24 115.11 120.19 1qpm h GLN 20 Ca 0.42 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.94 1qpm h GLN 20 Cb 1.88 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 29.45 1qpm h GLN 20 CO -0.00 0.58 -0.30 0.93 -0.67 0.00 0.00 178.83 179.37 1qpm h GLU 21 N 0.90 0.83 0.17 1.46 3.07 -1.56 -2.84 114.58 116.62 1qpm h GLU 21 Ca 0.25 -0.42 -0.01 0.00 -0.50 0.00 0.00 59.36 58.68 1qpm h GLU 21 Cb -0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1qpm h GLU 21 CO -0.05 1.05 -0.08 0.82 -1.40 0.00 0.00 179.01 179.34 1qpm h ILE 22 N 0.62 0.92 -0.39 3.13 2.04 -1.32 -2.96 117.51 119.56 1qpm h ILE 22 Ca 0.06 -0.93 0.11 0.00 1.00 0.00 0.00 64.86 65.11 1qpm h ILE 22 Cb 0.87 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 1qpm h ILE 22 CO 0.08 0.20 0.52 0.24 0.00 0.00 0.00 178.15 179.19 1qpm h MET 23 N -0.72 0.00 -0.00 2.37 2.86 0.15 1.28 114.93 120.86 1qpm h MET 23 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1qpm h MET 23 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1qpm h MET 23 CO 0.04 0.00 -0.20 0.00 1.06 0.00 0.00 176.91 177.81 1qpm n ALA 24 N -2.22 2.84 -2.71 6.32 0.00 -1.07 -4.76 120.51 118.91 1qpm n ALA 24 Ca 0.07 -0.21 -0.41 0.00 0.00 0.00 0.00 53.44 52.89 1qpm n ALA 24 Cb 0.68 -1.32 -0.04 0.00 0.00 0.00 0.00 19.45 18.77 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 -2.94 3.24 0.25 0.00 0.00 0.44 -4.94 121.76 117.81 1qpm s ALA 25 Ca 0.15 0.37 -0.06 0.00 0.00 0.00 0.00 51.96 52.41 1qpm s ALA 25 Cb 0.19 -3.17 0.26 0.00 0.00 0.00 0.00 23.12 20.39 1qpm s ALA 25 CO 0.59 -0.17 1.92 0.22 0.00 0.00 0.00 175.76 178.32 1qpm h ASP 26 N 6.76 1.15 -0.26 0.00 1.82 -1.87 -1.27 116.42 122.76 1qpm h ASP 26 Ca -0.41 -0.04 0.08 0.00 -0.39 0.00 0.00 57.03 56.27 1qpm h ASP 26 Cb 1.21 -0.29 -0.01 0.00 0.68 0.00 0.00 39.33 40.92 1qpm h ASP 26 CO 0.75 0.84 0.24 1.23 -1.61 0.00 0.00 179.24 180.69 1qpm h GLY 27 N 1.36 0.00 -6.77 -0.78 0.00 -1.92 -3.23 103.07 91.73 1qpm h GLY 27 Ca 0.36 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 47.09 1qpm h GLY 27 CO -0.08 0.00 -0.73 1.03 0.00 0.00 0.00 176.54 176.76 1qpm n MET 28 N -4.02 1.22 -2.28 4.80 2.81 -0.48 -5.11 117.12 114.06 1qpm n MET 28 Ca 0.03 -3.98 -0.26 0.00 -1.81 0.00 0.00 57.70 51.68 1qpm n MET 28 Cb 0.39 -2.04 0.12 0.00 -0.71 0.00 0.00 33.22 30.98 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 -0.92 1.53 0.00 0.03 0.04 -1.22 -4.34 135.00 130.11 1qpm s PRO 29 Ca 0.29 -0.65 0.00 0.00 0.04 0.00 0.00 61.00 60.68 1qpm s PRO 29 Cb -0.00 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1qpm s PRO 29 CO -0.18 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 175.61 1qpm n GLY 30 N -3.13 0.50 0.97 0.56 0.00 -1.26 -3.98 105.19 98.84 1qpm n GLY 30 Ca 0.13 -1.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.71 -1.43 -0.08 1.61 3.41 -1.26 -4.35 113.62 110.80 1qpm n SER 31 Ca 0.00 -0.64 -0.06 0.00 -0.26 0.00 0.00 58.87 57.90 1qpm n SER 31 Cb 0.00 -0.28 -0.00 0.00 -0.26 0.00 0.00 64.21 63.67 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 -1.90 0.68 -1.00 -3.33 2.07 -1.95 0.10 116.25 110.92 1qpm h VAL 32 Ca -0.11 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1qpm h VAL 32 Cb 0.35 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 1qpm h VAL 32 CO 0.07 0.00 0.65 0.00 0.02 0.00 0.00 177.57 178.32 1qpm h ALA 33 N 1.30 1.33 -0.38 1.67 0.00 -1.95 2.17 119.26 123.40 1qpm h ALA 33 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1qpm h ALA 33 Cb 0.24 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1qpm h ALA 33 CO -0.33 0.54 0.24 0.78 0.00 0.00 0.00 179.25 180.49 1qpm h GLY 34 N 1.26 0.54 0.77 0.00 0.00 -1.44 2.76 103.07 106.96 1qpm h GLY 34 Ca 0.40 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 1qpm h GLY 34 CO -0.13 0.21 0.01 -2.08 0.00 0.00 0.00 176.54 174.55 1qpm h VAL 35 N 0.50 1.21 0.00 4.60 2.07 0.62 -2.70 116.25 122.56 1qpm h VAL 35 Ca 0.14 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 1qpm h VAL 35 Cb -0.03 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1qpm h VAL 35 CO -0.03 0.18 -0.24 -0.74 0.02 0.00 0.00 177.57 176.77 1qpm h HIS 36 N -0.13 0.00 0.12 1.57 2.76 0.41 -2.80 115.15 117.08 1qpm h HIS 36 Ca 0.02 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1qpm h HIS 36 Cb 0.28 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.24 1qpm h HIS 36 CO 0.02 0.24 -0.06 -0.92 -1.30 0.00 0.00 177.93 175.90 1qpm h TYR 37 N 0.00 -0.16 -0.51 5.26 5.03 0.52 0.88 116.97 127.99 1qpm h TYR 37 Ca -0.00 -0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.19 1qpm h TYR 37 Cb 0.47 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.79 1qpm h TYR 37 CO 0.00 -0.10 -0.13 0.07 -1.32 0.00 0.00 178.16 176.68 1qpm h ARG 38 N -0.17 0.98 0.00 1.82 0.11 -1.47 -1.61 114.38 114.04 1qpm h ARG 38 Ca -0.01 -0.37 0.00 0.00 0.10 0.00 0.00 59.98 59.70 1qpm h ARG 38 Cb 0.13 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.16 1qpm h ARG 38 CO 0.02 1.04 0.00 0.00 0.10 0.00 0.00 179.97 181.13 1qpm n ALA 39 N -2.50 1.74 0.01 0.08 0.00 -1.06 -2.46 120.51 116.32 1qpm n ALA 39 Ca 0.01 -0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.22 1qpm n ALA 39 Cb 0.41 -1.23 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 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 0.00 0.51 -0.46 0.00 -1.24 0.21 -3.28 115.58 111.32 1qpm h ASN 40 Ca 0.00 -0.78 -0.14 0.00 0.71 0.00 0.00 56.30 56.09 1qpm h ASN 40 Cb 0.19 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.08 1qpm h ASN 40 CO 0.00 1.23 -0.24 0.58 -1.29 0.00 0.00 177.43 177.71 1qpm h VAL 41 N -0.16 1.27 -4.23 2.57 2.07 -1.50 -3.44 116.25 112.84 1qpm h VAL 41 Ca -0.08 -1.41 -0.48 0.00 0.82 0.00 0.00 66.70 65.55 1qpm h VAL 41 Cb 1.34 1.16 0.03 0.00 -1.52 0.00 0.00 31.29 32.30 1qpm h VAL 41 CO 0.12 0.48 0.38 -1.10 0.02 0.00 0.00 177.57 177.48 1qpm s GLN 42 N -4.63 3.85 -1.12 1.57 -1.52 -1.12 -4.95 119.66 111.74 1qpm s GLN 42 Ca -0.11 0.93 -0.05 0.00 -1.95 0.00 0.00 55.36 54.17 1qpm s GLN 42 Cb 0.12 -2.12 0.10 0.00 -0.22 0.00 0.00 33.01 30.90 1qpm s GLN 42 CO 0.87 -0.36 2.48 0.41 -0.25 0.00 0.00 175.29 178.45 1qpm n GLY 43 N -1.78 5.01 3.78 3.09 0.00 -1.26 -4.87 105.19 109.15 1qpm n GLY 43 Ca 0.07 -2.01 -0.36 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.26 2.87 -0.04 1.61 0.52 -1.26 -4.98 118.94 116.40 1qpm s TRP 44 Ca 0.55 1.56 -0.30 0.00 0.02 0.00 0.00 56.10 57.94 1qpm s TRP 44 Cb 0.23 -3.25 -0.02 0.00 -1.15 0.00 0.00 33.47 29.27 1qpm s TRP 44 CO -0.12 -1.29 1.01 0.99 0.02 0.00 0.00 176.95 177.56 1qpm s THR 45 N -1.73 4.77 0.11 2.01 2.01 -1.26 -5.01 115.64 116.53 1qpm s THR 45 Ca 0.67 2.00 0.05 0.00 0.31 0.00 0.00 61.69 64.72 1qpm s THR 45 Cb -0.24 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 67.95 1qpm s THR 45 CO 0.28 0.09 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.64 1qpm s LYS 46 N 1.44 0.94 -0.10 4.92 1.02 -1.26 -3.15 119.74 123.55 1qpm s LYS 46 Ca 0.51 -1.19 -0.06 0.00 0.02 0.00 0.00 55.97 55.25 1qpm s LYS 46 Cb -0.21 -0.76 0.04 0.00 -0.52 0.00 0.00 37.83 36.38 1qpm s LYS 46 CO 0.24 0.14 0.24 -0.98 -0.92 0.00 0.00 175.35 174.07 1qpm s ARG 47 N -2.64 0.23 0.43 1.68 1.70 -1.15 -4.98 118.95 114.21 1qpm s ARG 47 Ca 0.07 0.44 -0.09 0.00 -0.47 0.00 0.00 55.73 55.68 1qpm s ARG 47 Cb -0.05 -0.02 -0.06 0.00 -0.57 0.00 0.00 34.95 34.26 1qpm s ARG 47 CO 0.02 -0.11 0.78 0.15 -1.08 0.00 0.00 175.30 175.06 1qpm s LYS 48 N 0.80 3.71 0.03 3.89 1.02 -1.26 -2.61 119.74 125.31 1qpm s LYS 48 Ca -0.06 0.40 -0.17 0.00 0.02 0.00 0.00 55.97 56.17 1qpm s LYS 48 Cb -0.07 -2.38 0.03 0.00 -0.52 0.00 0.00 37.83 34.90 1qpm s LYS 48 CO -0.05 -0.10 0.39 0.15 -0.92 0.00 0.00 175.35 174.82 1qpm s LYS 49 N -4.12 0.85 -1.95 1.68 1.02 0.20 -4.87 119.74 112.55 1qpm s LYS 49 Ca 0.50 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.18 1qpm s LYS 49 Cb -0.10 0.38 0.00 0.00 -0.52 0.00 0.00 37.83 37.59 1qpm s LYS 49 CO 0.36 -0.28 0.00 0.39 -0.92 0.00 0.00 175.35 174.90 1qpm n GLU 50 N 0.71 -1.59 -0.69 1.68 1.02 -1.26 -1.30 120.64 119.21 1qpm n GLU 50 Ca -0.19 1.10 0.00 0.00 -0.02 0.00 0.00 57.16 58.04 1qpm n GLU 50 Cb 0.59 -5.63 0.00 0.00 -0.02 0.00 0.00 31.44 26.38 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 -0.71 0.00 1.37 0.62 0.00 -1.26 -3.38 105.19 101.83 1qpm n GLY 51 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1qpm n GLY 51 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1qpm n VAL 52 N -1.58 0.00 -0.13 1.61 0.24 -0.42 -4.67 118.33 113.38 1qpm n VAL 52 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.18 1qpm n VAL 52 Cb 0.28 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.64 1qpm n VAL 52 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1qpm h LYS 53 N 0.00 0.95 0.00 7.34 1.57 -1.86 -3.35 116.57 121.21 1qpm h LYS 53 Ca 0.00 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1qpm h LYS 53 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1qpm h LYS 53 CO 0.00 1.13 0.00 0.41 -0.57 0.00 0.00 179.45 180.42 1qpm n GLY 54 N 0.05 0.01 0.29 3.86 0.00 -1.26 -4.82 105.19 103.31 1qpm n GLY 54 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.97 1qpm n GLY 54 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1qpm h GLY 55 N 0.00 0.82 -5.70 -0.02 0.00 -1.80 -3.46 103.07 92.90 1qpm h GLY 55 Ca 0.00 -0.51 -0.34 0.00 0.00 0.00 0.00 47.33 46.47 1qpm h GLY 55 CO 0.00 0.48 -0.77 0.28 0.00 0.00 0.00 176.54 176.53 1qpm n LYS 56 N -4.24 -6.57 -3.24 4.80 4.76 -1.26 -4.93 118.16 107.48 1qpm n LYS 56 Ca 0.03 0.83 -0.44 0.00 -2.87 0.00 0.00 58.31 55.85 1qpm n LYS 56 Cb 0.27 -5.81 -0.06 0.00 -1.84 0.00 0.00 35.03 27.58 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 -3.38 3.46 0.10 7.82 0.00 -1.21 -4.95 121.76 123.60 1qpm s ALA 57 Ca 0.04 -1.95 0.05 0.00 0.00 0.00 0.00 51.96 50.09 1qpm s ALA 57 Cb -0.02 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1qpm s ALA 57 CO 0.74 -1.95 -0.12 0.08 0.00 0.00 0.00 175.76 174.51 1qpm s VAL 58 N 2.26 1.09 0.06 0.00 1.01 -1.26 0.60 120.40 124.14 1qpm s VAL 58 Ca 0.10 -1.59 0.00 0.00 0.00 0.00 0.00 61.98 60.50 1qpm s VAL 58 Cb -0.22 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1qpm s VAL 58 CO 0.09 -0.45 -0.05 -1.61 0.00 0.00 0.00 175.10 173.08 1qpm s GLU 59 N -2.53 0.61 -0.02 2.72 2.02 -1.07 -4.01 118.70 116.41 1qpm s GLU 59 Ca 0.05 -1.08 0.03 0.00 0.02 0.00 0.00 54.97 53.99 1qpm s GLU 59 Cb -0.05 -0.01 -0.00 0.00 0.10 0.00 0.00 34.13 34.17 1qpm s GLU 59 CO 0.01 -0.05 -0.12 0.71 0.02 0.00 0.00 175.26 175.84 1qpm s TYR 60 N -3.01 1.15 -0.30 1.61 1.51 -0.93 -2.93 117.35 114.46 1qpm s TYR 60 Ca 0.02 -0.28 -0.23 0.00 -1.01 0.00 0.00 57.07 55.57 1qpm s TYR 60 Cb 0.01 -0.79 -0.00 0.00 -0.11 0.00 0.00 41.96 41.07 1qpm s TYR 60 CO -0.05 -0.09 0.75 0.16 -1.11 0.00 0.00 175.55 175.21 1qpm s ASP 61 N 0.03 6.63 0.12 2.29 -4.77 -1.19 -2.94 116.67 116.84 1qpm s ASP 61 Ca -0.01 0.63 0.19 0.00 -3.30 0.00 0.00 52.55 50.06 1qpm s ASP 61 Cb -0.08 -2.39 0.78 0.00 -1.09 0.00 0.00 42.92 40.14 1qpm s ASP 61 CO 0.01 -0.57 1.58 1.33 0.70 0.00 0.00 175.17 178.21 1qpm n VAL 62 N 5.48 0.92 0.33 2.11 0.24 -1.24 -2.44 118.33 123.74 1qpm n VAL 62 Ca 0.03 0.24 0.15 0.00 -2.04 0.00 0.00 64.34 62.71 1qpm n VAL 62 Cb 0.48 -1.07 0.60 0.00 -1.47 0.00 0.00 33.84 32.38 1qpm n VAL 62 CO 0.00 0.00 0.00 -0.03 -2.14 0.00 0.00 176.83 174.66 1qpm h MET 63 N 0.00 0.00 -0.00 7.34 1.85 -1.91 -2.45 114.93 119.76 1qpm h MET 63 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1qpm h MET 63 Cb 0.30 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.33 1qpm h MET 63 CO 0.00 0.00 -0.78 -1.13 -0.40 0.00 0.00 176.91 174.60 1qpm n SER 64 N -2.70 1.15 -4.81 1.39 3.41 -1.02 -4.94 113.62 106.10 1qpm n SER 64 Ca 0.01 -1.07 -0.34 0.00 -0.26 0.00 0.00 58.87 57.21 1qpm n SER 64 Cb 0.27 0.87 -0.05 0.00 -0.26 0.00 0.00 64.21 65.03 1qpm n SER 64 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1qpm s MET 65 N -2.67 4.06 1.02 4.33 -1.94 -0.92 -5.00 119.30 118.18 1qpm s MET 65 Ca 0.10 1.24 -0.17 0.00 -1.71 0.00 0.00 55.69 55.15 1qpm s MET 65 Cb 0.15 -2.18 0.02 0.00 2.01 0.00 0.00 34.83 34.83 1qpm s MET 65 CO 0.72 -0.19 -0.06 -0.35 -0.01 0.00 0.00 175.02 175.12 1qpm n PRO 66 N -0.72 -0.70 -0.37 2.03 -0.04 -1.26 -4.62 135.00 129.31 1qpm n PRO 66 Ca 0.08 -0.18 -0.02 0.00 -0.04 0.00 0.00 63.50 63.34 1qpm n PRO 66 Cb 0.53 -1.62 0.12 0.00 -0.04 0.00 0.00 33.50 32.49 1qpm n PRO 66 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1qpm h THR 67 N -1.63 1.25 -0.09 0.52 2.02 -1.95 -2.89 112.91 110.14 1qpm h THR 67 Ca -0.47 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.25 1qpm h THR 67 Cb 1.32 -0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1qpm h THR 67 CO 0.33 0.25 0.05 0.50 0.37 0.00 0.00 175.52 177.02 1qpm h LYS 68 N 1.35 0.11 0.02 6.66 3.64 -2.00 -2.10 116.57 124.25 1qpm h LYS 68 Ca 0.37 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1qpm h LYS 68 Cb -0.14 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.66 1qpm h LYS 68 CO -0.08 0.07 -0.01 0.93 -2.27 0.00 0.00 179.45 178.09 1qpm h GLU 69 N 0.11 -0.03 -0.99 1.90 3.07 -1.86 -2.71 114.58 114.07 1qpm h GLU 69 Ca 0.04 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1qpm h GLU 69 Cb -0.00 0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 27.87 1qpm h GLU 69 CO -0.02 0.25 0.65 0.07 -1.40 0.00 0.00 179.01 178.55 1qpm h ARG 70 N -0.30 1.31 -0.98 2.33 0.11 -1.52 -0.39 114.38 114.94 1qpm h ARG 70 Ca -0.00 -0.09 0.01 0.00 0.10 0.00 0.00 59.98 60.00 1qpm h ARG 70 Cb 0.29 -0.29 -0.05 0.00 1.11 0.00 0.00 29.97 31.03 1qpm h ARG 70 CO 0.00 0.87 0.63 1.49 0.10 0.00 0.00 179.97 183.07 1qpm h GLU 71 N 1.34 1.30 -0.38 0.08 4.81 -1.35 0.10 114.58 120.49 1qpm h GLU 71 Ca 0.36 -0.09 -0.16 0.00 -0.13 0.00 0.00 59.36 59.34 1qpm h GLU 71 Cb -0.14 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 28.95 1qpm h GLU 71 CO -0.08 0.88 -0.39 0.37 -0.73 0.00 0.00 179.01 179.06 1qpm h GLN 72 N 1.34 0.92 -0.03 1.92 4.15 -1.00 -0.95 115.11 121.47 1qpm h GLN 72 Ca 0.36 -0.49 -0.01 0.00 0.77 0.00 0.00 58.65 59.27 1qpm h GLN 72 Cb -0.13 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.58 1qpm h GLN 72 CO -0.07 1.15 -0.02 0.28 -1.93 0.00 0.00 178.83 178.23 1qpm h VAL 73 N 0.75 1.38 -0.96 2.39 2.07 -0.59 -2.20 116.25 119.09 1qpm h VAL 73 Ca 0.06 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.42 1qpm h VAL 73 Cb 0.99 2.10 -0.05 0.00 -1.52 0.00 0.00 31.29 32.81 1qpm h VAL 73 CO 0.10 0.31 0.60 0.40 0.02 0.00 0.00 177.57 179.00 1qpm h ILE 74 N -0.39 1.26 -1.00 4.57 5.03 -1.04 -2.08 117.51 123.85 1qpm h ILE 74 Ca 0.00 -0.53 0.01 0.00 -0.12 0.00 0.00 64.86 64.23 1qpm h ILE 74 Cb 0.51 -0.12 -0.05 0.00 -3.03 0.00 0.00 36.82 34.13 1qpm h ILE 74 CO 0.01 0.26 0.66 0.00 -0.68 0.00 0.00 178.15 178.40 1qpm h ALA 75 N 1.33 1.27 -0.81 1.87 0.00 -1.08 1.82 119.26 123.67 1qpm h ALA 75 Ca 0.35 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1qpm h ALA 75 Cb -0.09 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 17.26 1qpm h ALA 75 CO -0.07 0.66 0.39 1.25 0.00 0.00 0.00 179.25 181.48 1qpm h HIS 76 N 1.35 1.15 0.00 0.00 -0.00 -0.73 -1.30 115.15 115.63 1qpm h HIS 76 Ca 0.37 -0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.68 1qpm h HIS 76 Cb -0.15 -0.36 0.00 0.00 -0.00 0.00 0.00 27.41 26.90 1qpm h HIS 76 CO -0.00 0.84 -0.43 1.28 -0.00 0.00 0.00 177.93 179.62 1qpm n LEU 77 N -4.35 0.48 0.13 0.26 4.77 -0.79 -3.59 117.00 113.91 1qpm n LEU 77 Ca 0.08 0.18 0.13 0.00 -0.03 0.00 0.00 56.01 56.36 1qpm n LEU 77 Cb 0.13 -0.28 0.36 0.00 -2.33 0.00 0.00 43.42 41.31 1qpm n LEU 77 CO 0.39 0.04 0.87 1.23 -1.33 0.00 0.00 177.39 178.59 1qpm h GLY 78 N 4.84 0.00 -2.19 -0.72 0.00 0.39 -3.14 103.07 102.25 1qpm h GLY 78 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qpm h GLY 78 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 176.54 178.01 1qpm n LEU 79 N -2.45 3.22 -2.53 3.11 -0.00 -0.92 -4.97 117.00 112.47 1qpm n LEU 79 Ca 0.05 -1.63 -0.03 0.00 -0.00 0.00 0.00 56.01 54.40 1qpm n LEU 79 Cb 0.44 -0.58 -0.02 0.00 -0.00 0.00 0.00 43.42 43.26 1qpm n LEU 79 CO 0.31 0.43 -0.46 -1.54 -0.00 0.00 0.00 177.39 176.13 1qpm n SER 80 N 0.30 -4.26 0.00 1.45 3.41 -1.19 -5.14 113.62 108.20 1qpm n SER 80 Ca 0.13 1.44 0.04 0.00 -0.26 0.00 0.00 58.87 60.21 1qpm n SER 80 Cb 0.69 -4.37 0.23 0.00 -0.26 0.00 0.00 64.21 60.50 1qpm n SER 80 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23