#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p70 h GLN 2 N 0.00 0.48 -0.03 4.33 4.20 -1.81 -1.94 115.11 120.34 2p70 h GLN 2 Ca 0.00 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2p70 h GLN 2 Cb 0.00 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 2p70 h GLN 2 CO 0.00 0.32 0.01 0.93 -0.67 0.00 0.00 178.83 179.42 2p70 h GLU 3 N 0.49 0.05 -0.04 1.46 3.07 -1.98 0.35 114.58 117.99 2p70 h GLU 3 Ca 0.61 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.50 2p70 h GLU 3 Cb 1.18 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 29.03 2p70 h GLU 3 CO -0.50 0.17 -0.22 0.28 -1.40 0.00 0.00 179.01 177.33 2p70 h VAL 4 N -0.09 0.48 -0.44 3.13 2.07 -1.88 -2.38 116.25 117.15 2p70 h VAL 4 Ca 0.01 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.56 2p70 h VAL 4 Cb 0.14 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2p70 h VAL 4 CO -0.00 0.00 0.29 0.24 0.02 0.00 0.00 177.57 178.12 2p70 h MET 5 N -0.33 0.47 0.40 1.57 2.86 -1.25 0.14 114.93 118.79 2p70 h MET 5 Ca 0.07 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2p70 h MET 5 Cb 0.43 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2p70 h MET 5 CO -0.23 0.31 -0.19 -0.22 1.06 0.00 0.00 176.91 177.64 2p70 h LYS 6 N 0.48 -0.52 -0.86 1.72 3.64 -0.80 -0.80 116.57 119.43 2p70 h LYS 6 Ca 0.18 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2p70 h LYS 6 Cb 0.10 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 2p70 h LYS 6 CO -0.04 -0.30 0.57 -0.97 -2.27 0.00 0.00 179.45 176.43 2p70 h ASN 7 N -0.62 0.96 -0.52 4.20 -0.00 -0.88 -1.47 115.58 117.26 2p70 h ASN 7 Ca -0.06 -0.02 0.01 0.00 -0.00 0.00 0.00 56.30 56.23 2p70 h ASN 7 Cb 0.46 -0.23 -0.03 0.00 -0.00 0.00 0.00 38.32 38.52 2p70 h ASN 7 CO 0.09 0.68 0.34 -0.07 -0.00 0.00 0.00 177.43 178.47 2p70 h LEU 8 N 1.13 0.58 -0.40 0.34 4.07 -0.45 0.89 115.31 121.46 2p70 h LEU 8 Ca 0.33 -0.01 -0.18 0.00 0.08 0.00 0.00 57.88 58.10 2p70 h LEU 8 Cb -0.06 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.53 2p70 h LEU 8 CO -0.08 0.42 -0.61 0.77 -1.08 0.00 0.00 178.44 177.86 2p70 h SER 9 N 0.69 0.72 -0.82 -0.43 4.64 -0.79 0.57 113.55 118.12 2p70 h SER 9 Ca 0.19 -0.41 -0.04 0.00 -0.47 0.00 0.00 61.79 61.07 2p70 h SER 9 Cb -0.07 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 61.78 2p70 h SER 9 CO -0.05 1.16 0.37 -0.07 -0.87 0.00 0.00 176.83 177.37 2p70 h LEU 10 N 0.47 1.10 -0.13 5.97 3.38 -1.12 -0.92 115.31 124.07 2p70 h LEU 10 Ca -0.00 -0.15 -0.20 0.00 0.09 0.00 0.00 57.88 57.62 2p70 h LEU 10 Cb 1.18 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 2p70 h LEU 10 CO 0.12 0.95 -0.93 0.78 0.09 0.00 0.00 178.44 179.44 2p70 h ASN 11 N 1.18 0.00 -0.49 -0.43 2.35 -0.17 -2.91 115.58 115.12 2p70 h ASN 11 Ca 0.28 -0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.97 2p70 h ASN 11 Cb 0.16 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2p70 h ASN 11 CO -0.03 0.94 0.10 0.15 -1.65 0.00 0.00 177.43 176.93 2p70 h PHE 12 N 0.00 0.89 0.00 1.19 3.57 0.45 -3.05 116.94 119.99 2p70 h PHE 12 Ca -0.01 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2p70 h PHE 12 Cb 1.65 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 40.14 2p70 h PHE 12 CO 0.00 0.76 0.00 0.78 -2.23 0.00 0.00 178.31 177.62 2p70 h GLY 13 N 0.98 0.00 0.35 2.40 0.00 -1.12 -3.39 103.07 102.30 2p70 h GLY 13 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.61 2p70 h GLY 13 CO 0.00 0.00 0.28 0.50 0.00 0.00 0.00 176.54 177.33 2p70 h LYS 14 N 0.00 0.46 -0.42 4.80 1.79 -1.40 -1.35 116.57 120.45 2p70 h LYS 14 Ca 0.00 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2p70 h LYS 14 Cb 0.54 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 2p70 h LYS 14 CO 0.00 0.30 0.00 0.00 -1.08 0.00 0.00 179.45 178.67 2p70 n ALA 15 N -2.46 2.60 -0.12 3.86 0.00 -1.26 -4.32 120.51 118.80 2p70 n ALA 15 Ca 0.11 -0.42 -0.05 0.00 0.00 0.00 0.00 53.44 53.08 2p70 n ALA 15 Cb 0.31 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.78 2p70 n ALA 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2p70 h LEU 16 N 1.20 -0.30 -0.81 0.00 5.85 -1.54 -2.19 115.31 117.52 2p70 h LEU 16 Ca 0.00 0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.99 2p70 h LEU 16 Cb 0.48 0.22 -0.10 0.00 0.37 0.00 0.00 40.66 41.63 2p70 h LEU 16 CO 0.04 -0.10 0.35 0.44 -0.34 0.00 0.00 178.44 178.83 2p70 h ASP 17 N 0.04 0.34 -0.04 1.25 3.45 -1.82 -1.33 116.42 118.30 2p70 h ASP 17 Ca 0.20 0.12 -0.04 0.00 0.43 0.00 0.00 57.03 57.73 2p70 h ASP 17 Cb 0.30 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 2p70 h ASP 17 CO -0.39 0.10 -0.08 -0.08 -1.57 0.00 0.00 179.24 177.23 2p70 h GLU 18 N 0.47 0.28 -0.09 3.56 4.81 -1.73 -2.58 114.58 119.30 2p70 h GLU 18 Ca 0.46 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.54 2p70 h GLU 18 Cb 0.74 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2p70 h GLU 18 CO -0.43 0.37 -0.38 0.00 -0.73 0.00 0.00 179.01 177.84 2p70 s LYS 20 N -4.20 3.63 0.00 0.00 1.02 -0.97 0.32 119.74 119.55 2p70 s LYS 20 Ca -0.04 0.39 0.00 0.00 0.02 0.00 0.00 55.97 56.34 2p70 s LYS 20 Cb 0.14 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 35.12 2p70 s LYS 20 CO 0.76 -0.21 0.00 1.63 -0.92 0.00 0.00 175.35 176.61 2p70 n LYS 21 N -2.02 0.00 0.01 1.68 5.02 -1.26 -4.41 118.16 117.17 2p70 n LYS 21 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2p70 n LYS 21 Cb 0.55 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.58 2p70 n LYS 21 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2p70 n GLU 22 N 0.00 0.01 0.00 1.97 2.13 -1.17 -3.80 120.64 119.78 2p70 n GLU 22 Ca 0.00 0.39 0.00 0.00 0.66 0.00 0.00 57.16 58.21 2p70 n GLU 22 Cb 0.00 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.06 2p70 n GLU 22 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2p70 n MET 23 N -1.41 3.25 -0.40 5.31 2.81 0.15 -5.01 117.12 121.82 2p70 n MET 23 Ca -0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2p70 n MET 23 Cb 0.13 -0.60 0.00 0.00 -0.71 0.00 0.00 33.22 32.05 2p70 n MET 23 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2p70 n THR 24 N -0.48 0.00 -2.35 2.03 -1.04 -1.25 -5.03 114.28 106.16 2p70 n THR 24 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 2p70 n THR 24 Cb 0.04 -0.19 -0.02 0.00 -1.82 0.00 0.00 70.33 68.34 2p70 n THR 24 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2p70 s LEU 25 N 0.00 3.70 0.00 -4.42 1.43 -1.26 -5.01 118.68 113.12 2p70 s LEU 25 Ca 0.00 1.87 -0.06 0.00 -1.03 0.00 0.00 54.13 54.91 2p70 s LEU 25 Cb 0.00 -4.55 0.15 0.00 0.03 0.00 0.00 46.19 41.82 2p70 s LEU 25 CO 0.00 -0.92 0.95 0.35 0.23 0.00 0.00 176.35 176.96 2p70 n THR 26 N -1.40 0.00 0.71 5.49 -2.24 -1.26 -4.92 114.28 110.66 2p70 n THR 26 Ca 0.09 -1.10 0.13 0.00 -2.27 0.00 0.00 64.05 60.90 2p70 n THR 26 Cb 0.53 -1.24 0.48 0.00 -2.10 0.00 0.00 70.33 67.99 2p70 n THR 26 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2p70 n ASP 27 N -3.27 0.46 0.25 3.42 8.00 -1.26 -3.35 116.55 120.81 2p70 n ASP 27 Ca 0.14 0.56 0.08 0.00 0.71 0.00 0.00 54.79 56.27 2p70 n ASP 27 Cb 0.49 -0.68 0.62 0.00 -0.02 0.00 0.00 41.12 41.54 2p70 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2p70 h ALA 28 N 2.64 1.97 -0.00 2.24 0.00 -2.00 -2.40 119.26 121.71 2p70 h ALA 28 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2p70 h ALA 28 Cb 0.57 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2p70 h ALA 28 CO 0.00 0.03 -0.59 -0.84 0.00 0.00 0.00 179.25 177.84 2p70 h ILE 29 N 0.01 1.43 0.00 0.00 3.07 -1.95 -2.29 117.51 117.78 2p70 h ILE 29 Ca 0.00 -2.04 -0.16 0.00 1.55 0.00 0.00 64.86 64.21 2p70 h ILE 29 Cb 0.03 2.10 -0.02 0.00 -0.27 0.00 0.00 36.82 38.66 2p70 h ILE 29 CO 0.00 0.58 -0.76 0.78 -1.05 0.00 0.00 178.15 177.71 2p70 h ASN 30 N 0.00 0.00 0.04 2.16 2.35 -1.63 -0.68 115.58 117.82 2p70 h ASN 30 Ca -0.01 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.53 2p70 h ASN 30 Cb 1.05 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.43 2p70 h ASN 30 CO 0.08 0.76 -0.81 -0.08 -1.65 0.00 0.00 177.43 175.73 2p70 h GLU 31 N 0.00 0.63 -0.57 0.81 4.81 -1.43 0.11 114.58 118.93 2p70 h GLU 31 Ca -0.01 -0.54 -0.07 0.00 -0.13 0.00 0.00 59.36 58.61 2p70 h GLU 31 Cb 1.39 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.87 2p70 h GLU 31 CO 0.10 1.16 0.09 -0.44 -0.73 0.00 0.00 179.01 179.19 2p70 h ASP 32 N 0.42 0.91 -0.44 1.04 3.32 -1.04 -2.11 116.42 118.52 2p70 h ASP 32 Ca -0.06 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 56.70 2p70 h ASP 32 Cb 1.42 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 2p70 h ASP 32 CO 0.15 0.94 0.13 -0.26 -1.72 0.00 0.00 179.24 178.49 2p70 h PHE 33 N 0.84 0.70 -0.94 4.55 0.04 -1.02 -0.97 116.94 120.14 2p70 h PHE 33 Ca 0.17 -0.07 0.06 0.00 2.80 0.00 0.00 57.97 60.93 2p70 h PHE 33 Cb 0.42 -0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.31 2p70 h PHE 33 CO 0.03 0.64 0.61 -0.92 -0.60 0.00 0.00 178.31 178.07 2p70 h TYR 34 N 0.56 1.11 -0.01 -0.55 3.20 -0.57 -2.72 116.97 117.99 2p70 h TYR 34 Ca 0.14 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.04 2p70 h TYR 34 Cb 0.27 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.17 2p70 h TYR 34 CO 0.01 0.60 -0.11 0.09 -1.64 0.00 0.00 178.16 177.11 2p70 n ASN 35 N -4.48 1.25 -0.16 -2.11 3.02 -0.81 -4.72 115.26 107.25 2p70 n ASN 35 Ca 0.14 -1.20 -0.03 0.00 -0.03 0.00 0.00 54.58 53.45 2p70 n ASN 35 Cb 0.17 0.05 0.03 0.00 -0.61 0.00 0.00 39.78 39.42 2p70 n ASN 35 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2p70 h PHE 36 N 1.78 -0.33 -0.02 3.10 3.57 -0.84 -0.56 116.94 123.64 2p70 h PHE 36 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 2p70 h PHE 36 Cb 0.49 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.46 2p70 h PHE 36 CO 0.00 -0.24 0.00 0.91 -2.23 0.00 0.00 178.31 176.75 2p70 n TRP 37 N -5.37 0.02 -1.75 0.41 7.02 -1.26 -4.87 117.44 111.63 2p70 n TRP 37 Ca 0.05 -0.01 -0.42 0.00 -1.02 0.00 0.00 57.50 56.10 2p70 n TRP 37 Cb 0.28 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.15 2p70 n TRP 37 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2p70 s LYS 38 N -1.98 4.11 0.21 -0.99 1.02 -0.22 -4.85 119.74 117.05 2p70 s LYS 38 Ca 0.40 2.60 -0.31 0.00 0.02 0.00 0.00 55.97 58.69 2p70 s LYS 38 Cb 0.20 -3.03 -0.10 0.00 -0.52 0.00 0.00 37.83 34.38 2p70 s LYS 38 CO 0.33 -0.68 1.48 -2.00 -0.92 0.00 0.00 175.35 173.56 2p70 s GLU 39 N 0.02 4.25 0.00 1.68 2.56 -1.26 -1.39 118.70 124.57 2p70 s GLU 39 Ca 0.67 2.30 0.00 0.00 0.00 0.00 0.00 54.97 57.94 2p70 s GLU 39 Cb -0.49 -3.14 0.00 0.00 2.00 0.00 0.00 34.13 32.51 2p70 s GLU 39 CO 0.43 -0.49 0.00 0.41 -0.56 0.00 0.00 175.26 175.06 2p70 n GLY 40 N 2.85 0.43 3.77 -1.50 0.00 -1.26 -5.00 105.19 104.49 2p70 n GLY 40 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2p70 n GLY 40 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2p70 s TYR 41 N -2.28 3.32 -0.10 1.61 5.04 -0.49 -5.02 117.35 119.44 2p70 s TYR 41 Ca 0.00 1.65 0.01 0.00 -2.44 0.00 0.00 57.07 56.29 2p70 s TYR 41 Cb 0.00 -3.21 0.02 0.00 0.35 0.00 0.00 41.96 39.12 2p70 s TYR 41 CO 0.00 -0.72 -0.11 -1.21 -1.34 0.00 0.00 175.55 172.18 2p70 s GLU 42 N -2.17 1.72 -0.14 4.97 2.02 -1.26 -4.99 118.70 118.85 2p70 s GLU 42 Ca 0.54 -0.37 -0.24 0.00 0.02 0.00 0.00 54.97 54.93 2p70 s GLU 42 Cb -0.26 -1.59 -0.02 0.00 0.10 0.00 0.00 34.13 32.35 2p70 s GLU 42 CO 0.33 -0.14 0.75 0.42 0.02 0.00 0.00 175.26 176.64 2p70 s ILE 43 N 1.24 4.96 -0.42 -1.63 1.01 -1.26 -4.91 121.20 120.20 2p70 s ILE 43 Ca -0.03 1.47 0.06 0.00 0.00 0.00 0.00 60.65 62.15 2p70 s ILE 43 Cb -0.14 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 2p70 s ILE 43 CO -0.04 0.11 0.37 0.29 0.00 0.00 0.00 174.94 175.68 2p70 n LYS 44 N 4.74 3.76 -3.59 2.79 5.02 -1.26 -4.97 118.16 124.64 2p70 n LYS 44 Ca 0.01 -0.23 -0.38 0.00 -2.02 0.00 0.00 58.31 55.70 2p70 n LYS 44 Cb 0.50 -0.87 -0.11 0.00 -0.02 0.00 0.00 35.03 34.53 2p70 n LYS 44 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2p70 s ASN 45 N -1.31 5.99 0.33 4.39 0.01 -1.26 -4.94 114.94 118.15 2p70 s ASN 45 Ca 0.04 -0.04 0.10 0.00 -0.71 0.00 0.00 52.86 52.25 2p70 s ASN 45 Cb 0.05 -2.11 0.99 0.00 0.41 0.00 0.00 41.25 40.59 2p70 s ASN 45 CO 0.20 -0.06 1.61 -0.09 -1.51 0.00 0.00 177.10 177.25 2p70 h ARG 46 N 8.37 0.11 0.00 -0.60 2.43 -1.95 -1.37 114.38 121.38 2p70 h ARG 46 Ca -0.35 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2p70 h ARG 46 Cb 1.19 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 2p70 h ARG 46 CO 0.55 0.07 0.00 0.93 -1.51 0.00 0.00 179.97 180.02 2p70 h GLU 47 N 0.11 0.00 -0.00 0.20 5.08 -1.94 -1.45 114.58 116.58 2p70 h GLU 47 Ca 0.69 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.82 2p70 h GLU 47 Cb 1.61 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.86 2p70 h GLU 47 CO -0.75 0.00 -0.97 1.15 -1.00 0.00 0.00 179.01 177.44 2p70 h THR 48 N 0.00 1.36 -0.10 1.13 2.02 -1.64 -1.07 112.91 114.61 2p70 h THR 48 Ca 0.00 -2.38 -0.00 0.00 0.77 0.00 0.00 66.41 64.80 2p70 h THR 48 Cb 0.47 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 69.28 2p70 h THR 48 CO 0.00 0.72 0.06 1.23 0.37 0.00 0.00 175.52 177.90 2p70 h GLY 49 N 1.00 0.15 -0.36 2.16 0.00 -1.32 -1.18 103.07 103.52 2p70 h GLY 49 Ca -0.09 -0.06 0.22 0.00 0.00 0.00 0.00 47.33 47.39 2p70 h GLY 49 CO 0.17 0.06 0.24 0.00 0.00 0.00 0.00 176.54 177.01 2p70 h ALA 51 N 1.74 0.47 0.13 0.00 0.00 -0.67 -1.80 119.26 119.13 2p70 h ALA 51 Ca 0.53 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2p70 h ALA 51 Cb 1.03 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2p70 h ALA 51 CO -0.62 0.50 -0.15 0.82 0.00 0.00 0.00 179.25 179.80 2p70 h ILE 52 N 0.55 0.66 -0.67 0.00 1.08 -1.06 0.30 117.51 118.36 2p70 h ILE 52 Ca 0.06 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.66 2p70 h ILE 52 Cb 0.87 0.66 -0.09 0.00 -3.07 0.00 0.00 36.82 35.18 2p70 h ILE 52 CO 0.07 0.00 0.19 -0.03 -0.69 0.00 0.00 178.15 177.69 2p70 h MET 53 N -0.32 0.31 -0.60 2.37 4.05 -1.29 0.10 114.93 119.55 2p70 h MET 53 Ca 0.01 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 2p70 h MET 53 Cb 0.31 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.02 2p70 h MET 53 CO -0.06 0.21 0.28 0.00 0.23 0.00 0.00 176.91 177.57 2p70 h LEU 55 N 0.85 0.37 -1.16 0.00 3.38 0.34 -2.39 115.31 116.70 2p70 h LEU 55 Ca 0.21 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2p70 h LEU 55 Cb 0.11 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2p70 h LEU 55 CO -0.03 0.87 0.50 0.28 0.09 0.00 0.00 178.44 180.16 2p70 h SER 56 N -0.12 0.94 0.43 -0.43 0.02 -0.63 -2.67 113.55 111.08 2p70 h SER 56 Ca 0.00 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2p70 h SER 56 Cb 0.82 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2p70 h SER 56 CO 0.05 0.70 -0.20 0.74 -1.14 0.00 0.00 176.83 176.98 2p70 h THR 57 N 1.09 0.54 -1.21 -2.27 2.02 -0.98 -1.00 112.91 111.11 2p70 h THR 57 Ca 0.29 -0.36 0.34 0.00 0.77 0.00 0.00 66.41 67.45 2p70 h THR 57 Cb -0.08 0.71 -0.07 0.00 -1.74 0.00 0.00 68.15 66.97 2p70 h THR 57 CO -0.06 0.06 0.83 0.11 0.37 0.00 0.00 175.52 176.84 2p70 h LYS 58 N -0.80 0.12 -0.14 6.66 1.79 -1.43 0.52 116.57 123.28 2p70 h LYS 58 Ca -0.06 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2p70 h LYS 58 Cb 0.54 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2p70 h LYS 58 CO 0.10 0.08 0.00 1.28 -1.08 0.00 0.00 179.45 179.83 2p70 n LEU 59 N -4.35 1.17 -2.52 2.94 4.77 -0.87 -4.94 117.00 113.20 2p70 n LEU 59 Ca 0.28 -0.52 -0.21 0.00 -0.03 0.00 0.00 56.01 55.53 2p70 n LEU 59 Cb 1.20 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 42.20 2p70 n LEU 59 CO 0.34 0.26 -0.21 0.59 -1.33 0.00 0.00 177.39 177.04 2p70 n ASN 60 N 0.03 -6.00 -0.71 -1.43 3.02 0.18 -4.90 115.26 105.45 2p70 n ASN 60 Ca 0.14 -0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.72 2p70 n ASN 60 Cb 0.23 -4.96 0.05 0.00 -0.61 0.00 0.00 39.78 34.49 2p70 n ASN 60 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2p70 n MET 61 N -3.23 1.75 -4.05 3.52 2.81 -0.43 -4.66 117.12 112.83 2p70 n MET 61 Ca -0.22 -1.44 -0.17 0.00 -1.81 0.00 0.00 57.70 54.05 2p70 n MET 61 Cb 0.68 -1.44 -0.16 0.00 -0.71 0.00 0.00 33.22 31.58 2p70 n MET 61 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2p70 s LEU 62 N -2.15 1.44 0.89 4.03 1.43 -1.24 -0.75 118.68 122.32 2p70 s LEU 62 Ca 0.22 -0.07 -0.11 0.00 -1.03 0.00 0.00 54.13 53.14 2p70 s LEU 62 Cb 0.18 -0.29 0.18 0.00 0.03 0.00 0.00 46.19 46.29 2p70 s LEU 62 CO 0.41 -0.05 1.22 1.51 0.23 0.00 0.00 176.35 179.68 2p70 s ASP 63 N 0.69 3.48 0.00 2.29 3.84 -0.68 -4.70 116.67 121.60 2p70 s ASP 63 Ca -0.08 0.06 0.00 0.00 -0.00 0.00 0.00 52.55 52.53 2p70 s ASP 63 Cb -0.11 -0.20 0.00 0.00 -1.38 0.00 0.00 42.92 41.23 2p70 s ASP 63 CO -0.01 -2.48 0.69 -2.65 -0.00 0.00 0.00 175.17 170.73 2p70 n PRO 64 N -3.48 0.85 0.00 2.11 -0.02 -1.26 -1.38 135.00 131.81 2p70 n PRO 64 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2p70 n PRO 64 Cb 0.60 -1.16 0.00 0.00 -0.02 0.00 0.00 33.50 32.92 2p70 n PRO 64 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2p70 n GLU 65 N -0.28 -0.41 0.00 -0.52 2.13 -1.26 -4.99 120.64 115.31 2p70 n GLU 65 Ca 0.00 -0.30 0.00 0.00 0.66 0.00 0.00 57.16 57.52 2p70 n GLU 65 Cb 0.08 -0.79 0.00 0.00 0.27 0.00 0.00 31.44 31.00 2p70 n GLU 65 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2p70 n GLY 66 N 0.03 0.66 3.89 8.31 0.00 -0.48 -4.99 105.19 112.60 2p70 n GLY 66 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2p70 n GLY 66 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2p70 s ASN 67 N -2.61 6.39 0.20 1.61 0.01 -1.26 -4.76 114.94 114.51 2p70 s ASN 67 Ca 0.00 1.10 -0.30 0.00 -0.71 0.00 0.00 52.86 52.95 2p70 s ASN 67 Cb 0.00 -2.32 -0.08 0.00 0.41 0.00 0.00 41.25 39.26 2p70 s ASN 67 CO 0.00 -0.53 1.02 -0.22 -1.51 0.00 0.00 177.10 175.86 2p70 s LEU 68 N -4.37 4.55 -0.41 0.60 2.96 -1.26 -1.68 118.68 119.07 2p70 s LEU 68 Ca 0.50 2.01 -0.24 0.00 -0.22 0.00 0.00 54.13 56.19 2p70 s LEU 68 Cb -0.10 -3.61 0.02 0.00 0.50 0.00 0.00 46.19 43.00 2p70 s LEU 68 CO 0.39 -0.07 0.85 -2.28 -1.32 0.00 0.00 176.35 173.93 2p70 s HIS 69 N -0.60 3.03 0.05 5.38 5.65 0.07 -4.89 115.29 123.99 2p70 s HIS 69 Ca 0.46 0.48 -0.19 0.00 0.25 0.00 0.00 55.06 56.06 2p70 s HIS 69 Cb -0.28 -3.65 -0.13 0.00 -1.18 0.00 0.00 32.58 27.34 2p70 s HIS 69 CO 0.34 -0.90 1.36 0.45 -0.65 0.00 0.00 174.74 175.34 2p70 h HIS 70 N 8.73 0.55 -0.73 3.88 -0.00 -1.94 -1.68 115.15 123.95 2p70 h HIS 70 Ca -0.24 -0.17 0.07 0.00 -0.00 0.00 0.00 60.37 60.03 2p70 h HIS 70 Cb 1.08 -0.11 -0.06 0.00 -0.00 0.00 0.00 27.41 28.32 2p70 h HIS 70 CO 0.82 0.83 0.42 0.78 -0.00 0.00 0.00 177.93 180.78 2p70 h GLY 71 N 0.11 1.09 1.65 2.45 0.00 -1.98 -1.20 103.07 105.19 2p70 h GLY 71 Ca 0.03 -0.29 -0.17 0.00 0.00 0.00 0.00 47.33 46.89 2p70 h GLY 71 CO 0.05 0.17 -0.70 3.43 0.00 0.00 0.00 176.54 179.48 2p70 h ASN 72 N 0.75 0.41 -0.54 0.19 2.35 -1.78 -2.08 115.58 114.88 2p70 h ASN 72 Ca 0.33 -0.26 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 2p70 h ASN 72 Cb 0.22 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2p70 h ASN 72 CO -0.19 0.99 0.12 0.00 -1.65 0.00 0.00 177.43 176.69 2p70 h ALA 73 N 1.01 1.11 -0.10 -0.83 0.00 -0.73 -1.59 119.26 118.13 2p70 h ALA 73 Ca -0.02 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.68 2p70 h ALA 73 Cb 1.27 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2p70 h ALA 73 CO 0.12 0.59 -0.08 1.98 0.00 0.00 0.00 179.25 181.86 2p70 h MET 74 N 0.88 -0.09 -0.35 0.00 1.85 -1.16 -0.84 114.93 115.23 2p70 h MET 74 Ca 0.19 0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.35 2p70 h MET 74 Cb 0.35 0.02 -0.07 0.00 0.43 0.00 0.00 31.60 32.34 2p70 h MET 74 CO 0.00 -0.06 -0.09 1.49 -0.40 0.00 0.00 176.91 177.85 2p70 h GLU 75 N -0.09 -0.00 -0.39 0.39 4.57 -1.30 0.96 114.58 118.71 2p70 h GLU 75 Ca 0.07 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.27 2p70 h GLU 75 Cb 0.19 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.75 2p70 h GLU 75 CO -0.15 -0.00 0.22 0.35 -1.18 0.00 0.00 179.01 178.24 2p70 h PHE 76 N -0.00 0.40 -0.39 0.92 3.57 -1.13 -0.85 116.94 119.46 2p70 h PHE 76 Ca 0.17 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.72 2p70 h PHE 76 Cb 0.26 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 2p70 h PHE 76 CO -0.32 0.23 0.18 0.00 -2.23 0.00 0.00 178.31 176.17 2p70 h ALA 77 N 1.18 0.48 -0.23 2.41 0.00 -0.86 -2.20 119.26 120.04 2p70 h ALA 77 Ca 0.16 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 2p70 h ALA 77 Cb 0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2p70 h ALA 77 CO -0.09 -0.19 -0.32 0.87 0.00 0.00 0.00 179.25 179.52 2p70 h LYS 78 N 0.37 0.49 0.00 0.00 1.57 -0.74 -0.65 116.57 117.60 2p70 h LYS 78 Ca 0.17 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2p70 h LYS 78 Cb 0.10 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2p70 h LYS 78 CO -0.14 0.75 -0.05 -0.22 -0.57 0.00 0.00 179.45 179.22 2p70 h LYS 79 N 0.42 0.00 -0.38 3.15 3.64 -0.53 -3.02 116.57 119.84 2p70 h LYS 79 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2p70 h LYS 79 Cb 0.77 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2p70 h LYS 79 CO 0.06 0.05 0.00 0.72 -2.27 0.00 0.00 179.45 178.01 2p70 n HIS 80 N -4.36 0.51 0.00 1.91 8.25 -0.99 -4.98 115.22 115.56 2p70 n HIS 80 Ca -0.03 -0.41 0.00 0.00 -0.26 0.00 0.00 57.72 57.02 2p70 n HIS 80 Cb 0.14 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.23 2p70 n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2p70 n GLY 81 N 0.84 1.01 3.74 -1.41 0.00 -1.02 -4.62 105.19 103.72 2p70 n GLY 81 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2p70 n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p70 s ALA 82 N -2.00 3.46 1.02 4.61 0.00 -0.29 -4.97 121.76 123.60 2p70 s ALA 82 Ca 0.00 1.01 -0.08 0.00 0.00 0.00 0.00 51.96 52.89 2p70 s ALA 82 Cb 0.00 -3.43 0.11 0.00 0.00 0.00 0.00 23.12 19.79 2p70 s ALA 82 CO 0.00 -0.42 0.58 -0.40 0.00 0.00 0.00 175.76 175.52 2p70 n ASP 83 N 2.41 -0.24 0.07 0.00 5.75 -1.26 -4.09 116.55 119.19 2p70 n ASP 83 Ca 0.04 -1.14 -0.13 0.00 -0.01 0.00 0.00 54.79 53.56 2p70 n ASP 83 Cb 0.44 -0.46 -0.08 0.00 -1.03 0.00 0.00 41.12 39.99 2p70 n ASP 83 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 2p70 h GLU 84 N 0.00 -0.12 -0.59 0.11 4.57 -1.99 -1.17 114.58 115.39 2p70 h GLU 84 Ca -0.19 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 2p70 h GLU 84 Cb 0.54 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 2p70 h GLU 84 CO 0.13 0.07 0.39 1.15 -1.18 0.00 0.00 179.01 179.57 2p70 h THR 85 N -0.29 1.16 -0.62 0.32 2.02 -1.99 -0.53 112.91 112.98 2p70 h THR 85 Ca -0.01 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 2p70 h THR 85 Cb 0.25 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 2p70 h THR 85 CO 0.02 0.15 0.13 -0.03 0.37 0.00 0.00 175.52 176.16 2p70 h MET 86 N 0.80 1.00 -0.36 6.66 1.85 -1.90 -2.50 114.93 120.49 2p70 h MET 86 Ca 0.22 -0.25 -0.02 0.00 -0.61 0.00 0.00 59.70 59.03 2p70 h MET 86 Cb -0.08 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 31.81 2p70 h MET 86 CO -0.05 0.92 0.14 0.00 -0.40 0.00 0.00 176.91 177.53 2p70 h ALA 87 N 1.04 0.47 -0.44 0.39 0.00 -0.97 -1.74 119.26 118.01 2p70 h ALA 87 Ca 0.19 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2p70 h ALA 87 Cb 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2p70 h ALA 87 CO 0.01 0.07 0.06 0.37 0.00 0.00 0.00 179.25 179.76 2p70 h GLN 88 N 0.44 0.74 -0.47 0.00 5.75 -1.10 -1.41 115.11 119.06 2p70 h GLN 88 Ca 0.12 -0.21 0.09 0.00 -0.15 0.00 0.00 58.65 58.51 2p70 h GLN 88 Cb 0.19 -0.08 -0.10 0.00 1.07 0.00 0.00 27.48 28.56 2p70 h GLN 88 CO -0.01 0.77 -0.27 1.96 -2.65 0.00 0.00 178.83 178.64 2p70 h GLN 89 N 0.60 -0.16 -0.68 1.69 4.20 -1.07 0.23 115.11 119.93 2p70 h GLN 89 Ca 0.13 0.01 0.15 0.00 0.06 0.00 0.00 58.65 59.00 2p70 h GLN 89 Cb 0.40 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 28.10 2p70 h GLN 89 CO 0.01 -0.11 0.01 -0.07 -0.67 0.00 0.00 178.83 178.00 2p70 h LEU 90 N -0.17 -0.29 -0.27 1.46 3.38 -1.01 -2.66 115.31 115.76 2p70 h LEU 90 Ca 0.21 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2p70 h LEU 90 Cb 0.50 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2p70 h LEU 90 CO -0.56 -0.14 0.17 0.40 0.09 0.00 0.00 178.44 178.40 2p70 h ILE 91 N 0.12 1.06 0.00 1.22 2.04 -0.61 -1.74 117.51 119.60 2p70 h ILE 91 Ca 0.36 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 66.07 2p70 h ILE 91 Cb 0.60 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2p70 h ILE 91 CO -0.58 0.06 -0.17 0.44 0.00 0.00 0.00 178.15 177.91 2p70 h ASP 92 N 0.35 0.00 0.11 1.72 3.45 -0.70 -1.13 116.42 120.22 2p70 h ASP 92 Ca 0.10 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.55 2p70 h ASP 92 Cb -0.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.74 2p70 h ASP 92 CO -0.03 0.17 -0.05 0.40 -1.57 0.00 0.00 179.24 178.16 2p70 h ILE 93 N 0.00 1.03 -0.29 0.35 2.04 -1.36 -0.23 117.51 119.06 2p70 h ILE 93 Ca -0.00 -1.29 0.02 0.00 1.00 0.00 0.00 64.86 64.59 2p70 h ILE 93 Cb 0.30 1.75 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 2p70 h ILE 93 CO 0.02 0.28 0.14 0.58 0.00 0.00 0.00 178.15 179.17 2p70 h VAL 94 N -0.82 0.99 0.24 1.67 2.07 -1.02 0.59 116.25 119.97 2p70 h VAL 94 Ca -0.02 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2p70 h VAL 94 Cb 0.56 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2p70 h VAL 94 CO 0.02 0.06 -0.12 -0.74 0.02 0.00 0.00 177.57 176.81 2p70 h HIS 95 N 0.30 -0.30 -0.72 1.57 -0.00 -1.22 0.16 115.15 114.94 2p70 h HIS 95 Ca 0.12 -0.01 0.16 0.00 -0.00 0.00 0.00 60.37 60.64 2p70 h HIS 95 Cb 0.04 0.10 -0.12 0.00 -0.00 0.00 0.00 27.41 27.42 2p70 h HIS 95 CO -0.10 -0.18 0.01 0.78 -0.00 0.00 0.00 177.93 178.44 2p70 h GLY 96 N -0.33 0.81 1.59 5.26 0.00 -0.68 -1.87 103.07 107.87 2p70 h GLY 96 Ca -0.03 0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 2p70 h GLY 96 CO 0.05 -0.26 -0.15 0.00 0.00 0.00 0.00 176.54 176.18 2p70 h GLU 98 N 0.45 0.78 -0.12 0.00 5.08 0.01 -1.86 114.58 118.91 2p70 h GLU 98 Ca 0.08 -0.05 -0.23 0.00 -1.00 0.00 0.00 59.36 58.17 2p70 h GLU 98 Cb 0.53 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.61 2p70 h GLU 98 CO 0.03 0.51 -0.81 0.87 -1.00 0.00 0.00 179.01 178.62 2p70 h LYS 99 N 0.80 0.76 0.00 2.33 1.57 -1.05 -3.31 116.57 117.68 2p70 h LYS 99 Ca 0.38 -0.66 -0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2p70 h LYS 99 Cb 0.32 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 2p70 h LYS 99 CO -0.23 1.26 -0.06 0.66 -0.57 0.00 0.00 179.45 180.51 2p70 h SER 100 N 0.48 0.00 -3.37 0.86 4.64 -1.24 -3.45 113.55 111.47 2p70 h SER 100 Ca -0.07 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.70 2p70 h SER 100 Cb 1.45 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.49 2p70 h SER 100 CO 0.17 0.06 0.16 0.42 -0.87 0.00 0.00 176.83 176.77 2p70 s THR 101 N -3.54 5.00 0.18 2.95 -4.23 -0.71 -4.98 115.64 110.32 2p70 s THR 101 Ca 0.02 1.59 -0.33 0.00 -1.18 0.00 0.00 61.69 61.79 2p70 s THR 101 Cb 0.08 -4.11 -0.15 0.00 1.34 0.00 0.00 72.50 69.66 2p70 s THR 101 CO 0.60 0.22 1.23 -2.65 -0.54 0.00 0.00 174.62 173.48 2p70 n PRO 102 N 3.87 1.36 -1.16 3.99 -0.02 -1.26 -4.92 135.00 136.86 2p70 n PRO 102 Ca 0.01 0.48 -0.33 0.00 -2.02 0.00 0.00 63.50 61.64 2p70 n PRO 102 Cb 0.51 -2.03 0.12 0.00 -0.02 0.00 0.00 33.50 32.08 2p70 n PRO 102 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2p70 s ALA 103 N -0.09 1.89 -0.28 3.55 0.00 -1.26 -4.94 121.76 120.63 2p70 s ALA 103 Ca 0.73 0.79 -0.21 0.00 0.00 0.00 0.00 51.96 53.28 2p70 s ALA 103 Cb -0.81 -3.47 0.11 0.00 0.00 0.00 0.00 23.12 18.95 2p70 s ALA 103 CO 0.51 -2.21 0.89 1.21 0.00 0.00 0.00 175.76 176.16 2p70 s ASN 104 N -2.25 -0.62 0.37 0.00 3.04 -1.26 -5.01 114.94 109.20 2p70 s ASN 104 Ca 0.72 1.09 0.12 0.00 0.04 0.00 0.00 52.86 54.83 2p70 s ASN 104 Cb -0.27 1.18 0.71 0.00 -1.54 0.00 0.00 41.25 41.33 2p70 s ASN 104 CO 0.50 -0.18 1.83 0.44 -3.04 0.00 0.00 177.10 176.65 2p70 h ASP 105 N 5.46 0.04 -2.33 -4.21 3.45 -2.02 -3.39 116.42 113.41 2p70 h ASP 105 Ca -0.29 -0.01 -0.61 0.00 0.43 0.00 0.00 57.03 56.55 2p70 h ASP 105 Cb 1.19 -0.01 -0.12 0.00 -0.56 0.00 0.00 39.33 39.83 2p70 h ASP 105 CO 0.13 0.39 0.86 -0.62 -1.57 0.00 0.00 179.24 178.44 2p70 s ASP 106 N -6.93 6.27 0.36 6.45 -1.08 -1.26 -4.85 116.67 115.63 2p70 s ASP 106 Ca -0.03 -1.02 0.05 0.00 -0.52 0.00 0.00 52.55 51.02 2p70 s ASP 106 Cb 0.14 -2.48 0.71 0.00 -1.46 0.00 0.00 42.92 39.83 2p70 s ASP 106 CO 0.73 -1.52 1.98 0.11 0.52 0.00 0.00 175.17 176.98 2p70 h LYS 107 N 9.64 0.76 -0.16 4.34 1.79 -1.95 -1.07 116.57 129.93 2p70 h LYS 107 Ca -0.16 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.25 2p70 h LYS 107 Cb 1.05 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 31.52 2p70 h LYS 107 CO 1.23 0.51 0.08 0.00 -1.08 0.00 0.00 179.45 180.19 2p70 h ILE 109 N 0.15 1.27 -0.58 0.00 2.04 -1.74 -1.04 117.51 117.61 2p70 h ILE 109 Ca 0.06 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 2p70 h ILE 109 Cb 0.10 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 2p70 h ILE 109 CO -0.01 0.51 0.32 -0.25 0.00 0.00 0.00 178.15 178.71 2p70 h TRP 110 N 0.76 0.77 -0.33 1.37 7.01 -0.86 -2.46 115.95 122.21 2p70 h TRP 110 Ca 0.07 -0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.93 2p70 h TRP 110 Cb 0.92 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 27.72 2p70 h TRP 110 CO 0.06 0.54 -0.36 1.15 -2.79 0.00 0.00 178.44 177.03 2p70 h THR 111 N 0.80 1.28 -0.76 2.65 2.02 -0.16 -1.43 112.91 117.32 2p70 h THR 111 Ca 0.21 -1.52 0.17 0.00 0.77 0.00 0.00 66.41 66.03 2p70 h THR 111 Cb 0.02 1.42 -0.12 0.00 -1.74 0.00 0.00 68.15 67.73 2p70 h THR 111 CO -0.03 0.50 0.14 -0.07 0.37 0.00 0.00 175.52 176.42 2p70 h LEU 112 N 0.63 -0.08 -0.25 2.58 4.07 -0.91 0.28 115.31 121.63 2p70 h LEU 112 Ca 0.06 0.17 -0.09 0.00 0.08 0.00 0.00 57.88 58.10 2p70 h LEU 112 Cb 0.90 0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.88 2p70 h LEU 112 CO 0.08 -0.09 -0.18 1.23 -1.08 0.00 0.00 178.44 178.40 2p70 h GLY 113 N 0.21 0.62 0.88 0.83 0.00 -0.86 0.14 103.07 104.90 2p70 h GLY 113 Ca 0.43 -0.60 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 2p70 h GLY 113 CO -0.57 0.54 0.03 -2.08 0.00 0.00 0.00 176.54 174.46 2p70 h VAL 114 N 0.29 1.12 -0.73 4.60 2.07 -1.04 -1.68 116.25 120.88 2p70 h VAL 114 Ca 0.05 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 2p70 h VAL 114 Cb 0.72 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2p70 h VAL 114 CO 0.05 0.10 0.29 0.00 0.02 0.00 0.00 177.57 178.03 2p70 h ALA 115 N 0.90 0.94 -0.17 1.67 0.00 -0.87 0.24 119.26 121.97 2p70 h ALA 115 Ca 0.03 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2p70 h ALA 115 Cb 0.13 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2p70 h ALA 115 CO -0.00 0.57 -0.04 1.79 0.00 0.00 0.00 179.25 181.56 2p70 h THR 116 N 1.04 0.83 -0.49 0.00 1.35 -0.66 -0.75 112.91 114.23 2p70 h THR 116 Ca 0.24 -0.00 0.10 0.00 -0.55 0.00 0.00 66.41 66.20 2p70 h THR 116 Cb 0.21 0.83 -0.08 0.00 -1.73 0.00 0.00 68.15 67.38 2p70 h THR 116 CO -0.02 0.00 -0.00 0.00 -0.25 0.00 0.00 175.52 175.25 2p70 h PHE 118 N 0.11 0.37 -0.92 0.00 3.57 -0.29 -1.83 116.94 117.95 2p70 h PHE 118 Ca 0.25 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 2p70 h PHE 118 Cb 0.37 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 2p70 h PHE 118 CO -0.31 0.25 0.61 -0.22 -2.23 0.00 0.00 178.31 176.40 2p70 h LYS 119 N 0.38 1.18 -0.32 1.11 3.64 -0.88 -1.15 116.57 120.53 2p70 h LYS 119 Ca 0.11 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 2p70 h LYS 119 Cb -0.03 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.52 2p70 h LYS 119 CO -0.02 0.78 -0.37 0.00 -2.27 0.00 0.00 179.45 177.57 2p70 h ALA 120 N 1.35 0.73 -0.66 5.00 0.00 -0.93 -1.99 119.26 122.75 2p70 h ALA 120 Ca 0.35 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2p70 h ALA 120 Cb -0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2p70 h ALA 120 CO -0.09 0.66 0.22 0.93 0.00 0.00 0.00 179.25 180.97 2p70 h GLU 121 N 0.63 1.00 -0.44 0.00 4.39 -0.80 -1.94 114.58 117.42 2p70 h GLU 121 Ca 0.06 -0.19 -0.14 0.00 0.34 0.00 0.00 59.36 59.42 2p70 h GLU 121 Cb 0.92 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.40 2p70 h GLU 121 CO 0.08 0.85 -0.29 0.82 -1.16 0.00 0.00 179.01 179.32 2p70 h ILE 122 N 0.97 1.27 -0.79 3.13 1.08 -0.89 -2.72 117.51 119.56 2p70 h ILE 122 Ca 0.22 -1.46 -0.00 0.00 -0.39 0.00 0.00 64.86 63.23 2p70 h ILE 122 Cb 0.26 1.23 -0.04 0.00 -3.07 0.00 0.00 36.82 35.20 2p70 h ILE 122 CO -0.01 0.50 0.48 0.45 -0.69 0.00 0.00 178.15 178.88 2p70 h HIS 123 N 0.82 1.03 -0.36 1.37 3.86 -1.22 -1.16 115.15 119.49 2p70 h HIS 123 Ca 0.09 0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.38 2p70 h HIS 123 Cb 0.88 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.99 2p70 h HIS 123 CO 0.06 0.68 0.25 0.87 0.86 0.00 0.00 177.93 180.65 2p70 h LYS 124 N 1.07 0.16 0.00 2.45 1.57 -1.27 0.58 116.57 121.13 2p70 h LYS 124 Ca 0.28 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 2p70 h LYS 124 Cb -0.06 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2p70 h LYS 124 CO -0.06 0.11 -0.46 1.28 -0.57 0.00 0.00 179.45 179.75 2p70 n LEU 125 N -4.47 0.50 0.00 2.94 4.77 -0.95 -4.91 117.00 114.88 2p70 n LEU 125 Ca 0.05 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 2p70 n LEU 125 Cb 0.32 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2p70 n LEU 125 CO 0.35 0.04 0.00 0.59 -1.33 0.00 0.00 177.39 177.04 2p70 n ASN 126 N -1.72 -1.01 -0.47 -1.43 3.02 0.19 -4.96 115.26 108.89 2p70 n ASN 126 Ca 0.05 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.68 2p70 n ASN 126 Cb 0.37 -0.44 0.03 0.00 -0.61 0.00 0.00 39.78 39.13 2p70 n ASN 126 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2p70 n TRP 127 N -3.59 0.00 -2.27 3.10 7.02 -0.48 -4.58 117.44 116.64 2p70 n TRP 127 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2p70 n TRP 127 Cb 0.41 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.27 2p70 n TRP 127 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2p70 s ALA 128 N -1.64 3.56 0.63 6.99 0.00 -1.21 -3.75 121.76 126.34 2p70 s ALA 128 Ca 0.15 0.83 -0.09 0.00 0.00 0.00 0.00 51.96 52.86 2p70 s ALA 128 Cb 0.13 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.67 2p70 s ALA 128 CO 0.31 -0.87 0.99 -1.25 0.00 0.00 0.00 175.76 174.94 2p70 s PRO 129 N 2.31 3.14 0.00 0.00 0.04 -1.26 -4.91 135.00 134.33 2p70 s PRO 129 Ca 0.62 0.38 0.16 0.00 0.04 0.00 0.00 61.00 62.20 2p70 s PRO 129 Cb -0.30 -2.14 0.64 0.00 0.04 0.00 0.00 34.50 32.73 2p70 s PRO 129 CO 0.26 -0.73 1.46 -1.13 0.04 0.00 0.00 177.00 176.89 2p70 n SER 130 N -2.74 1.36 -0.02 6.66 3.41 -1.26 -4.77 113.62 116.26 2p70 n SER 130 Ca 0.05 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.90 2p70 n SER 130 Cb 0.56 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 2p70 n SER 130 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2p70 n MET 131 N 0.15 0.00 0.00 4.33 2.81 -1.26 -5.06 117.12 118.09 2p70 n MET 131 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 2p70 n MET 131 Cb 0.26 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.77 2p70 n MET 131 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23