#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sq3 s ILE 4 N 0.00 2.38 0.93 -1.33 -4.36 -1.26 -4.97 121.20 112.59 1sq3 s ILE 4 Ca 0.00 0.32 -0.12 0.00 -0.26 0.00 0.00 60.65 60.60 1sq3 s ILE 4 Cb 0.00 -3.21 0.15 0.00 1.25 0.00 0.00 42.46 40.65 1sq3 s ILE 4 CO 0.00 0.05 1.09 -0.94 0.24 0.00 0.00 174.94 175.39 1sq3 s SER 5 N 0.37 3.19 0.13 4.36 1.04 -1.26 -4.89 113.70 116.65 1sq3 s SER 5 Ca 0.60 1.34 0.08 0.00 0.48 0.00 0.00 55.95 58.46 1sq3 s SER 5 Cb -0.45 -2.02 -0.17 0.00 0.10 0.00 0.00 66.02 63.48 1sq3 s SER 5 CO 0.46 -2.80 1.28 -0.33 0.98 0.00 0.00 173.24 172.83 1sq3 h GLU 6 N -1.66 0.00 -1.46 4.02 5.08 -2.05 -2.46 114.58 116.05 1sq3 h GLU 6 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1sq3 h GLU 6 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1sq3 h GLU 6 CO 0.56 0.91 0.00 0.36 -1.00 0.00 0.00 179.01 179.85 1sq3 n LYS 7 N -3.32 0.60 0.00 2.33 2.85 -1.26 -1.54 118.16 117.82 1sq3 n LYS 7 Ca -0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1sq3 n LYS 7 Cb 0.92 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 34.10 1sq3 n LYS 7 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1sq3 n VAL 9 N 0.81 0.00 -0.15 0.58 0.31 -0.93 -1.72 118.33 117.24 1sq3 n VAL 9 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 1sq3 n VAL 9 Cb 0.30 0.00 0.12 0.00 -0.91 0.00 0.00 33.84 33.36 1sq3 n VAL 9 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1sq3 h GLU 10 N 0.00 0.89 -0.11 5.55 4.57 -1.58 -0.02 114.58 123.89 1sq3 h GLU 10 Ca 0.00 -0.24 -0.22 0.00 -1.18 0.00 0.00 59.36 57.72 1sq3 h GLU 10 Cb 0.00 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.49 1sq3 h GLU 10 CO 0.00 0.87 -0.82 0.00 -1.18 0.00 0.00 179.01 177.88 1sq3 h ALA 11 N 1.20 0.35 -0.76 2.92 0.00 -1.59 0.77 119.26 122.15 1sq3 h ALA 11 Ca 0.16 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1sq3 h ALA 11 Cb 0.45 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1sq3 h ALA 11 CO 0.02 0.71 0.35 -0.07 0.00 0.00 0.00 179.25 180.26 1sq3 h LEU 12 N 0.45 0.98 -0.62 0.00 3.38 -1.79 -2.66 115.31 115.04 1sq3 h LEU 12 Ca -0.06 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 1sq3 h LEU 12 Cb 1.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1sq3 h LEU 12 CO 0.16 0.84 -0.54 0.78 0.09 0.00 0.00 178.44 179.76 1sq3 h ASN 13 N 1.08 0.45 0.03 -0.43 2.35 -0.14 -0.53 115.58 118.39 1sq3 h ASN 13 Ca 0.26 -0.24 -0.14 0.00 -0.55 0.00 0.00 56.30 55.63 1sq3 h ASN 13 Cb 0.12 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1sq3 h ASN 13 CO -0.03 0.91 -0.45 0.03 -1.65 0.00 0.00 177.43 176.24 1sq3 h ARG 14 N 0.32 0.50 -0.14 0.81 2.47 -0.79 -2.27 114.38 115.28 1sq3 h ARG 14 Ca 0.01 -0.27 -0.11 0.00 -1.26 0.00 0.00 59.98 58.35 1sq3 h ARG 14 Cb 1.06 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.38 1sq3 h ARG 14 CO 0.09 0.85 -0.38 0.37 0.56 0.00 0.00 179.97 181.46 1sq3 h GLN 15 N 0.40 0.30 -0.62 0.04 5.75 -1.16 0.12 115.11 119.94 1sq3 h GLN 15 Ca 0.03 -0.13 -0.05 0.00 -0.15 0.00 0.00 58.65 58.34 1sq3 h GLN 15 Cb 0.94 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.46 1sq3 h GLN 15 CO 0.08 0.64 0.18 0.82 -2.65 0.00 0.00 178.83 177.90 1sq3 h ILE 16 N 0.25 1.25 -0.67 2.39 2.04 -0.81 0.08 117.51 122.05 1sq3 h ILE 16 Ca 0.03 -0.86 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1sq3 h ILE 16 Cb 0.79 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1sq3 h ILE 16 CO 0.06 0.33 0.31 -1.13 0.00 0.00 0.00 178.15 177.72 1sq3 h ASN 17 N 0.90 0.89 0.25 1.72 -1.24 -0.81 -1.76 115.58 115.52 1sq3 h ASN 17 Ca 0.20 -0.14 -0.07 0.00 0.71 0.00 0.00 56.30 57.00 1sq3 h ASN 17 Cb 0.31 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 1sq3 h ASN 17 CO -0.00 0.78 -0.28 0.00 -1.29 0.00 0.00 177.43 176.63 1sq3 h ALA 18 N 1.14 1.46 -0.02 1.57 0.00 -0.34 -0.64 119.26 122.44 1sq3 h ALA 18 Ca 0.23 -0.28 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 1sq3 h ALA 18 Cb 0.14 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1sq3 h ALA 18 CO -0.03 0.39 -0.93 0.93 0.00 0.00 0.00 179.25 179.62 1sq3 h GLU 19 N 0.06 0.49 -0.26 0.00 4.39 -0.47 -1.64 114.58 117.14 1sq3 h GLU 19 Ca 0.01 -0.50 -0.08 0.00 0.34 0.00 0.00 59.36 59.13 1sq3 h GLU 19 Cb 0.53 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1sq3 h GLU 19 CO 0.04 1.14 -0.15 0.82 -1.16 0.00 0.00 179.01 179.70 1sq3 h ILE 20 N 0.29 1.30 -0.92 3.13 2.04 -1.16 -1.95 117.51 120.24 1sq3 h ILE 20 Ca -0.08 -1.26 0.12 0.00 1.00 0.00 0.00 64.86 64.64 1sq3 h ILE 20 Cb 1.56 1.57 -0.08 0.00 -0.74 0.00 0.00 36.82 39.12 1sq3 h ILE 20 CO 0.17 0.39 0.55 0.22 0.00 0.00 0.00 178.15 179.48 1sq3 h TYR 21 N 0.29 0.99 -0.53 1.37 3.20 -1.13 -1.44 116.97 119.72 1sq3 h TYR 21 Ca 0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 1sq3 h TYR 21 Cb 0.67 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1sq3 h TYR 21 CO 0.07 0.36 0.31 0.77 -1.64 0.00 0.00 178.16 178.03 1sq3 h SER 22 N 0.85 0.64 -0.76 -2.11 0.02 -0.71 0.45 113.55 111.92 1sq3 h SER 22 Ca 0.47 -0.07 0.13 0.00 -0.84 0.00 0.00 61.79 61.49 1sq3 h SER 22 Cb 0.52 -0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.80 1sq3 h SER 22 CO -0.29 0.52 0.34 0.00 -1.14 0.00 0.00 176.83 176.27 1sq3 h ALA 23 N 1.15 1.09 0.04 3.77 0.00 -0.63 -1.89 119.26 122.79 1sq3 h ALA 23 Ca 0.19 0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.97 1sq3 h ALA 23 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1sq3 h ALA 23 CO -0.03 -0.15 -1.04 -0.92 0.00 0.00 0.00 179.25 177.11 1sq3 h TYR 24 N 0.52 0.22 -0.03 0.00 3.20 0.32 0.25 116.97 121.44 1sq3 h TYR 24 Ca 0.41 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 62.14 1sq3 h TYR 24 Cb 0.57 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1sq3 h TYR 24 CO -0.13 1.08 -0.03 1.25 -1.64 0.00 0.00 178.16 178.68 1sq3 h LEU 25 N 0.05 -0.09 -0.68 2.82 5.85 -0.04 0.21 115.31 123.43 1sq3 h LEU 25 Ca -0.06 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 1sq3 h LEU 25 Cb 1.76 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.81 1sq3 h LEU 25 CO 0.15 -0.04 0.24 1.88 -0.34 0.00 0.00 178.44 180.33 1sq3 h TYR 26 N -0.04 1.05 -0.91 1.25 0.05 -0.94 -2.39 116.97 115.04 1sq3 h TYR 26 Ca 0.03 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 1sq3 h TYR 26 Cb 0.07 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.46 1sq3 h TYR 26 CO -0.12 0.83 0.55 1.25 -1.05 0.00 0.00 178.16 179.62 1sq3 h LEU 27 N 0.97 1.10 -2.01 3.88 5.85 -0.07 -1.07 115.31 123.97 1sq3 h LEU 27 Ca 0.22 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1sq3 h LEU 27 Cb 0.25 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1sq3 h LEU 27 CO -0.01 0.85 0.00 -0.24 -0.34 0.00 0.00 178.44 178.70 1sq3 n SER 28 N -4.38 0.00 0.00 1.25 2.88 0.02 -2.37 113.62 111.02 1sq3 n SER 28 Ca 0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 1sq3 n SER 28 Cb 0.06 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1sq3 n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sq3 n ALA 30 N 0.91 0.00 -0.32 -1.46 0.00 -0.41 -2.02 120.51 117.22 1sq3 n ALA 30 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1sq3 n ALA 30 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 1sq3 n ALA 30 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1sq3 h SER 31 N 0.00 1.00 -0.31 0.00 0.87 -1.75 0.07 113.55 113.42 1sq3 h SER 31 Ca 0.00 -0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1sq3 h SER 31 Cb 0.00 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.69 1sq3 h SER 31 CO 0.00 0.74 0.19 0.22 -0.53 0.00 0.00 176.83 177.45 1sq3 h TYR 32 N 1.17 0.41 -0.16 2.24 3.20 -1.67 -1.76 116.97 120.40 1sq3 h TYR 32 Ca 0.31 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.97 1sq3 h TYR 32 Cb -0.11 -0.14 0.01 0.00 1.54 0.00 0.00 36.73 38.03 1sq3 h TYR 32 CO -0.01 0.30 -0.74 0.74 -1.64 0.00 0.00 178.16 176.81 1sq3 h PHE 33 N 0.41 0.98 -1.00 -3.82 0.04 -1.79 -1.17 116.94 110.60 1sq3 h PHE 33 Ca 0.11 -0.42 0.18 0.00 2.80 0.00 0.00 57.97 60.64 1sq3 h PHE 33 Cb 0.00 -0.16 -0.10 0.00 2.20 0.00 0.00 35.95 37.89 1sq3 h PHE 33 CO -0.04 1.24 0.62 -0.44 -0.60 0.00 0.00 178.31 179.08 1sq3 h ASP 34 N 0.51 0.79 0.97 2.17 3.32 -0.88 -1.37 116.42 121.93 1sq3 h ASP 34 Ca -0.04 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1sq3 h ASP 34 Cb 1.35 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1sq3 h ASP 34 CO 0.15 0.31 0.00 -1.54 -1.72 0.00 0.00 179.24 176.44 1sq3 n SER 35 N -4.72 0.76 -0.20 6.45 3.41 -0.46 -2.65 113.62 116.20 1sq3 n SER 35 Ca 0.22 0.65 0.09 0.00 -0.26 0.00 0.00 58.87 59.57 1sq3 n SER 35 Cb 0.54 -0.82 0.16 0.00 -0.26 0.00 0.00 64.21 63.82 1sq3 n SER 35 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1sq3 n ILE 36 N -2.29 1.96 -1.17 -1.33 -5.35 -0.83 -5.00 119.36 105.34 1sq3 n ILE 36 Ca 0.03 -2.36 -0.03 0.00 -0.27 0.00 0.00 62.75 60.12 1sq3 n ILE 36 Cb 0.29 -0.24 -0.01 0.00 -1.74 0.00 0.00 39.64 37.94 1sq3 n ILE 36 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1sq3 n GLY 37 N -1.33 0.61 3.11 3.28 0.00 -1.03 -4.99 105.19 104.83 1sq3 n GLY 37 Ca 0.17 -0.91 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 1sq3 n GLY 37 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sq3 n LEU 38 N -0.39 4.77 0.25 0.99 4.77 -0.58 -4.88 117.00 121.93 1sq3 n LEU 38 Ca -0.03 -5.14 0.14 0.00 -0.03 0.00 0.00 56.01 50.94 1sq3 n LEU 38 Cb 0.14 -1.18 0.52 0.00 -2.33 0.00 0.00 43.42 40.57 1sq3 n LEU 38 CO 0.05 1.56 0.90 0.11 -1.33 0.00 0.00 177.39 178.68 1sq3 h LYS 39 N 5.95 0.00 -0.00 3.23 1.57 -1.92 -1.34 116.57 124.06 1sq3 h LYS 39 Ca 0.17 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1sq3 h LYS 39 Cb 0.79 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 1sq3 h LYS 39 CO 0.95 0.07 -0.00 0.78 -0.57 0.00 0.00 179.45 180.69 1sq3 h GLY 40 N 2.44 0.00 1.58 3.86 0.00 -1.90 -0.51 103.07 108.54 1sq3 h GLY 40 Ca -0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1sq3 h GLY 40 CO 0.01 0.00 0.12 0.74 0.00 0.00 0.00 176.54 177.42 1sq3 h PHE 41 N -0.32 0.54 -0.12 5.60 -1.00 -1.63 -1.45 116.94 118.57 1sq3 h PHE 41 Ca 0.00 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.74 1sq3 h PHE 41 Cb 0.32 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.71 1sq3 h PHE 41 CO 0.04 0.45 -0.00 1.03 -1.61 0.00 0.00 178.31 178.22 1sq3 h SER 42 N 0.54 0.20 -0.52 2.17 0.87 -1.22 -2.50 113.55 113.10 1sq3 h SER 42 Ca 0.13 -0.31 0.10 0.00 -1.23 0.00 0.00 61.79 60.48 1sq3 h SER 42 Cb 0.16 -0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 61.97 1sq3 h SER 42 CO -0.01 0.47 -0.07 -1.13 -0.53 0.00 0.00 176.83 175.55 1sq3 h ASN 43 N -0.06 -0.37 0.00 6.23 -0.73 -0.86 -1.14 115.58 118.64 1sq3 h ASN 43 Ca 0.03 0.14 0.00 0.00 1.87 0.00 0.00 56.30 58.35 1sq3 h ASN 43 Cb 0.36 0.28 0.00 0.00 0.27 0.00 0.00 38.32 39.23 1sq3 h ASN 43 CO 0.01 -0.13 0.00 1.87 -0.37 0.00 0.00 177.43 178.80 1sq3 n TRP 44 N -5.32 0.00 0.00 0.67 -0.00 -0.57 -1.29 117.44 110.94 1sq3 n TRP 44 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.55 1sq3 n TRP 44 Cb 0.28 -0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.59 1sq3 n TRP 44 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1sq3 n ARG 46 N 0.37 0.00 -0.36 5.87 5.12 -0.43 -1.44 116.66 125.79 1sq3 n ARG 46 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1sq3 n ARG 46 Cb 0.00 0.00 0.14 0.00 -1.16 0.00 0.00 32.46 31.44 1sq3 n ARG 46 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1sq3 h VAL 47 N 0.00 1.14 0.00 1.55 2.07 -1.45 -2.62 116.25 116.93 1sq3 h VAL 47 Ca 0.00 -0.41 -0.15 0.00 0.82 0.00 0.00 66.70 66.96 1sq3 h VAL 47 Cb 0.00 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.59 1sq3 h VAL 47 CO 0.00 0.22 -0.72 -0.61 0.02 0.00 0.00 177.57 176.48 1sq3 h GLN 48 N 1.19 0.00 0.05 1.57 5.75 -1.50 -1.05 115.11 121.12 1sq3 h GLN 48 Ca 0.39 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.90 1sq3 h GLN 48 Cb 0.05 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 1sq3 h GLN 48 CO -0.14 0.72 -0.09 2.35 -2.65 0.00 0.00 178.83 179.02 1sq3 h TRP 49 N 0.00 -0.23 -0.96 3.99 2.91 -1.76 0.19 115.95 120.09 1sq3 h TRP 49 Ca -0.01 0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.07 1sq3 h TRP 49 Cb 1.31 0.09 -0.06 0.00 -0.51 0.00 0.00 29.16 29.99 1sq3 h TRP 49 CO 0.00 -0.14 0.62 1.96 -1.03 0.00 0.00 178.44 179.85 1sq3 h GLN 50 N -0.18 1.12 -0.52 2.65 4.20 -1.37 -1.29 115.11 119.71 1sq3 h GLN 50 Ca 0.02 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 1sq3 h GLN 50 Cb 0.19 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1sq3 h GLN 50 CO -0.06 0.74 0.08 1.49 -0.67 0.00 0.00 178.83 180.42 1sq3 h GLU 51 N 1.15 0.87 -0.12 1.46 4.81 -0.51 -3.13 114.58 119.12 1sq3 h GLU 51 Ca 0.41 -0.23 -0.14 0.00 -0.13 0.00 0.00 59.36 59.27 1sq3 h GLU 51 Cb 0.12 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1sq3 h GLU 51 CO -0.16 0.85 -0.52 0.93 -0.73 0.00 0.00 179.01 179.39 1sq3 h GLU 52 N 0.75 0.33 -0.90 1.92 4.39 -0.22 -0.87 114.58 119.97 1sq3 h GLU 52 Ca 0.16 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1sq3 h GLU 52 Cb 0.41 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1sq3 h GLU 52 CO 0.01 0.77 0.00 1.28 -1.16 0.00 0.00 179.01 179.91 1sq3 n LEU 53 N -3.95 0.00 0.00 1.33 4.32 -0.53 -1.25 117.00 116.92 1sq3 n LEU 53 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 1sq3 n LEU 53 Cb 0.57 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.37 1sq3 n LEU 53 CO 0.44 0.00 0.00 1.41 -1.22 0.00 0.00 177.39 178.02 1sq3 n HIS 55 N 0.70 0.00 0.39 -1.77 8.25 -0.33 -4.71 115.22 117.75 1sq3 n HIS 55 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1sq3 n HIS 55 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1sq3 n HIS 55 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1sq3 n ALA 56 N 0.00 1.76 -0.37 -1.41 0.00 -0.38 -4.73 120.51 115.38 1sq3 n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sq3 n ALA 56 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.45 1sq3 n ALA 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1sq3 n LYS 58 N 0.59 -0.66 0.00 0.00 4.81 -1.26 -4.69 118.16 116.95 1sq3 n LYS 58 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1sq3 n LYS 58 Cb 0.15 -0.26 0.00 0.00 0.02 0.00 0.00 35.03 34.95 1sq3 n LYS 58 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1sq3 n PHE 60 N -0.11 0.00 0.12 5.64 -0.00 -1.26 -2.58 117.46 119.27 1sq3 n PHE 60 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1sq3 n PHE 60 Cb 0.02 0.00 0.27 0.00 -0.00 0.00 0.00 39.48 39.77 1sq3 n PHE 60 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1sq3 h ASP 61 N 0.00 0.17 0.41 -2.13 3.32 -1.98 -3.19 116.42 113.02 1sq3 h ASP 61 Ca 0.00 -0.06 -0.22 0.00 0.02 0.00 0.00 57.03 56.77 1sq3 h ASP 61 Cb 0.00 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1sq3 h ASP 61 CO 0.00 0.54 -0.93 0.15 -1.72 0.00 0.00 179.24 177.28 1sq3 h PHE 62 N 0.14 0.52 0.31 4.55 3.57 -1.90 -1.43 116.94 122.70 1sq3 h PHE 62 Ca 0.01 -0.29 -0.02 0.00 3.53 0.00 0.00 57.97 61.21 1sq3 h PHE 62 Cb 0.74 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.43 1sq3 h PHE 62 CO 0.01 1.11 -0.15 0.28 -2.23 0.00 0.00 178.31 177.32 1sq3 h VAL 63 N 0.19 0.70 -0.57 1.41 2.07 -1.86 0.20 116.25 118.40 1sq3 h VAL 63 Ca -0.07 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.48 1sq3 h VAL 63 Cb 1.57 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 1sq3 h VAL 63 CO 0.16 0.00 0.38 -1.28 0.02 0.00 0.00 177.57 176.85 1sq3 h SER 64 N -0.43 0.51 0.30 0.57 0.87 -1.59 0.98 113.55 114.77 1sq3 h SER 64 Ca -0.04 -0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.34 1sq3 h SER 64 Cb 0.33 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 1sq3 h SER 64 CO 0.07 0.34 -0.71 -0.08 -0.53 0.00 0.00 176.83 175.92 1sq3 h GLU 65 N 0.59 0.35 0.00 2.24 4.57 -0.56 -1.76 114.58 120.01 1sq3 h GLU 65 Ca 0.24 -0.29 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 1sq3 h GLU 65 Cb 0.21 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1sq3 h GLU 65 CO -0.07 0.93 0.00 0.54 -1.18 0.00 0.00 179.01 179.23 1sq3 n ARG 66 N -3.83 0.37 0.00 1.92 5.12 0.65 -4.85 116.66 116.04 1sq3 n ARG 66 Ca -0.04 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1sq3 n ARG 66 Cb 0.69 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.49 1sq3 n ARG 66 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sq3 n GLY 67 N 0.99 0.96 3.39 -0.13 0.00 -0.66 -4.61 105.19 105.12 1sq3 n GLY 67 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 1sq3 n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sq3 n GLY 68 N -1.99 0.93 2.96 -0.02 0.00 0.31 -4.99 105.19 102.40 1sq3 n GLY 68 Ca 0.00 -2.06 -0.27 0.00 0.00 0.00 0.00 46.02 43.69 1sq3 n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sq3 s ARG 69 N -4.66 1.74 0.12 1.61 6.06 -1.26 -3.90 118.95 118.66 1sq3 s ARG 69 Ca 0.57 -0.36 -0.30 0.00 -2.50 0.00 0.00 55.73 53.13 1sq3 s ARG 69 Cb -0.03 -1.65 -0.07 0.00 0.06 0.00 0.00 34.95 33.26 1sq3 s ARG 69 CO 0.37 -0.18 1.24 0.08 -2.50 0.00 0.00 175.30 174.32 1sq3 s VAL 70 N 1.37 3.69 -0.19 7.11 1.01 -1.26 -4.96 120.40 127.18 1sq3 s VAL 70 Ca -0.01 1.28 -0.01 0.00 0.00 0.00 0.00 61.98 63.24 1sq3 s VAL 70 Cb -0.14 -3.82 -0.00 0.00 0.00 0.00 0.00 36.38 32.42 1sq3 s VAL 70 CO -0.05 0.14 -0.11 -0.75 0.00 0.00 0.00 175.10 174.32 1sq3 s LYS 71 N 0.58 3.26 -0.07 2.72 2.47 -1.26 -5.11 119.74 122.34 1sq3 s LYS 71 Ca 0.58 -0.70 -0.19 0.00 -1.56 0.00 0.00 55.97 54.10 1sq3 s LYS 71 Cb -0.32 -2.78 -0.05 0.00 -1.46 0.00 0.00 37.83 33.22 1sq3 s LYS 71 CO 0.32 -0.10 0.51 -0.51 0.16 0.00 0.00 175.35 175.73 1sq3 s LEU 72 N 1.16 4.35 0.33 5.43 1.43 -1.26 -4.87 118.68 125.24 1sq3 s LEU 72 Ca 0.01 0.96 0.09 0.00 -1.03 0.00 0.00 54.13 54.16 1sq3 s LEU 72 Cb -0.14 -2.77 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 1sq3 s LEU 72 CO -0.04 0.07 -0.01 -0.31 0.23 0.00 0.00 176.35 176.29 1sq3 s TYR 73 N 0.15 2.53 0.64 0.29 2.02 -1.26 -5.10 117.35 116.62 1sq3 s TYR 73 Ca 0.28 -0.41 -0.18 0.00 -0.37 0.00 0.00 57.07 56.39 1sq3 s TYR 73 Cb -0.16 -1.41 -0.02 0.00 -0.40 0.00 0.00 41.96 39.97 1sq3 s TYR 73 CO 0.13 0.52 1.27 0.00 -1.57 0.00 0.00 175.55 175.90 1sq3 s ALA 74 N -2.50 2.41 -0.26 3.71 0.00 -1.26 -4.97 121.76 118.88 1sq3 s ALA 74 Ca 0.34 1.14 -0.09 0.00 0.00 0.00 0.00 51.96 53.35 1sq3 s ALA 74 Cb -0.01 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 1sq3 s ALA 74 CO 0.19 -1.49 0.12 0.08 0.00 0.00 0.00 175.76 174.65 1sq3 s VAL 75 N -1.48 4.68 0.49 0.00 1.01 -1.26 -5.05 120.40 118.80 1sq3 s VAL 75 Ca 0.81 -0.06 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 1sq3 s VAL 75 Cb -0.35 -3.21 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 1sq3 s VAL 75 CO 0.38 0.30 1.22 -1.61 0.00 0.00 0.00 175.10 175.39 1sq3 s GLU 76 N 1.67 3.52 0.08 2.72 0.41 -1.26 -4.94 118.70 120.89 1sq3 s GLU 76 Ca 0.07 1.90 -0.30 0.00 -0.41 0.00 0.00 54.97 56.22 1sq3 s GLU 76 Cb -0.15 -2.32 -0.10 0.00 -1.78 0.00 0.00 34.13 29.78 1sq3 s GLU 76 CO 0.06 -0.78 1.92 -2.00 -0.49 0.00 0.00 175.26 173.98 1sq3 s GLU 77 N -2.81 4.14 0.55 1.61 2.12 -1.26 -4.99 118.70 118.06 1sq3 s GLU 77 Ca 0.67 2.62 -0.05 0.00 0.36 0.00 0.00 54.97 58.58 1sq3 s GLU 77 Cb -0.32 -3.93 -0.00 0.00 0.26 0.00 0.00 34.13 30.14 1sq3 s GLU 77 CO 0.38 -0.92 0.85 -1.25 -0.54 0.00 0.00 175.26 173.78 1sq3 s PRO 78 N 3.77 3.04 0.84 4.30 0.04 -1.26 -5.06 135.00 140.67 1sq3 s PRO 78 Ca 0.86 -0.05 -0.11 0.00 0.04 0.00 0.00 61.00 61.74 1sq3 s PRO 78 Cb -0.44 -2.33 0.10 0.00 0.04 0.00 0.00 34.50 31.87 1sq3 s PRO 78 CO 0.40 -0.56 1.14 -1.25 0.04 0.00 0.00 177.00 176.77 1sq3 s PRO 79 N -4.88 1.55 0.00 0.56 0.04 -1.26 -4.97 135.00 126.04 1sq3 s PRO 79 Ca 0.52 1.47 0.00 0.00 0.04 0.00 0.00 61.00 63.03 1sq3 s PRO 79 Cb -0.10 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1sq3 s PRO 79 CO 0.44 -2.22 0.00 -1.13 0.04 0.00 0.00 177.00 174.13 1sq3 n SER 80 N -3.80 0.13 -4.23 6.66 3.41 -1.26 -4.88 113.62 109.65 1sq3 n SER 80 Ca 0.11 -0.25 -0.17 0.00 -0.26 0.00 0.00 58.87 58.30 1sq3 n SER 80 Cb 0.52 0.53 -0.11 0.00 -0.26 0.00 0.00 64.21 64.89 1sq3 n SER 80 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1sq3 s GLU 81 N -0.56 1.01 0.04 4.33 0.41 -1.26 -4.66 118.70 118.01 1sq3 s GLU 81 Ca 0.00 -1.27 -0.08 0.00 -0.41 0.00 0.00 54.97 53.21 1sq3 s GLU 81 Cb 0.00 -0.80 -0.00 0.00 -1.78 0.00 0.00 34.13 31.55 1sq3 s GLU 81 CO 0.00 0.14 0.16 -1.58 -0.49 0.00 0.00 175.26 173.49 1sq3 s TRP 82 N -2.41 0.12 0.15 1.61 0.51 -1.26 -5.06 118.94 112.60 1sq3 s TRP 82 Ca 0.10 -0.39 0.31 0.00 -2.12 0.00 0.00 56.10 53.99 1sq3 s TRP 82 Cb -0.03 -0.08 1.28 0.00 -0.81 0.00 0.00 33.47 33.83 1sq3 s TRP 82 CO 0.02 -0.42 1.96 -0.44 -0.51 0.00 0.00 176.95 177.56 1sq3 h ASP 83 N 3.45 0.00 -5.15 2.95 3.32 -2.00 -3.47 116.42 115.52 1sq3 h ASP 83 Ca -0.32 0.00 0.36 0.00 0.02 0.00 0.00 57.03 57.09 1sq3 h ASP 83 Cb 1.19 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.57 1sq3 h ASP 83 CO 0.50 0.07 0.97 -0.94 -1.72 0.00 0.00 179.24 178.13 1sq3 s SER 84 N -5.85 -0.01 0.23 6.45 1.04 -1.26 -4.95 113.70 109.34 1sq3 s SER 84 Ca 0.01 -0.01 -0.08 0.00 0.48 0.00 0.00 55.95 56.35 1sq3 s SER 84 Cb 0.10 0.02 0.37 0.00 0.10 0.00 0.00 66.02 66.61 1sq3 s SER 84 CO 0.57 -0.04 1.69 -0.65 0.98 0.00 0.00 173.24 175.79 1sq3 h PRO 85 N 2.00 0.25 -0.39 4.02 0.11 -2.00 -1.26 132.00 134.73 1sq3 h PRO 85 Ca -0.20 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.89 1sq3 h PRO 85 Cb 1.16 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1sq3 h PRO 85 CO 0.25 0.16 0.24 1.25 -0.21 0.00 0.00 178.00 179.69 1sq3 h LEU 86 N 0.26 0.47 -1.58 2.35 5.85 -1.95 -1.65 115.31 119.06 1sq3 h LEU 86 Ca 0.36 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 59.06 1sq3 h LEU 86 Cb 0.58 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1sq3 h LEU 86 CO -0.46 0.39 0.33 0.00 -0.34 0.00 0.00 178.44 178.35 1sq3 h ALA 87 N 1.10 1.78 -0.30 1.25 0.00 -1.76 -0.68 119.26 120.65 1sq3 h ALA 87 Ca 0.14 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1sq3 h ALA 87 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1sq3 h ALA 87 CO -0.03 0.17 -0.43 0.00 0.00 0.00 0.00 179.25 178.96 1sq3 h ALA 88 N 1.72 0.67 0.00 0.00 0.00 -0.35 -2.54 119.26 118.75 1sq3 h ALA 88 Ca 0.20 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1sq3 h ALA 88 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1sq3 h ALA 88 CO -0.05 0.67 -0.44 0.74 0.00 0.00 0.00 179.25 180.17 1sq3 h PHE 89 N 0.61 0.00 -0.46 0.00 0.04 -0.93 -1.59 116.94 114.62 1sq3 h PHE 89 Ca 0.04 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1sq3 h PHE 89 Cb 0.99 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.12 1sq3 h PHE 89 CO 0.05 0.21 0.07 0.93 -0.60 0.00 0.00 178.31 178.98 1sq3 h GLU 90 N 0.00 0.76 -0.27 1.51 5.08 -1.08 -0.79 114.58 119.80 1sq3 h GLU 90 Ca -0.02 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1sq3 h GLU 90 Cb 1.17 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1sq3 h GLU 90 CO 0.02 0.78 0.15 1.25 -1.00 0.00 0.00 179.01 180.21 1sq3 h HIS 91 N 0.63 0.37 -0.21 4.33 2.76 -1.35 -1.06 115.15 120.61 1sq3 h HIS 91 Ca 0.14 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.36 1sq3 h HIS 91 Cb 0.39 -0.12 -0.07 0.00 1.55 0.00 0.00 27.41 29.16 1sq3 h HIS 91 CO 0.03 0.30 -0.27 0.28 -1.30 0.00 0.00 177.93 176.97 1sq3 h VAL 92 N 0.32 0.35 -0.45 5.26 2.07 -1.01 0.70 116.25 123.49 1sq3 h VAL 92 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.67 1sq3 h VAL 92 Cb 0.05 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 1sq3 h VAL 92 CO -0.02 0.00 0.18 0.22 0.02 0.00 0.00 177.57 177.98 1sq3 h TYR 93 N -0.30 0.32 -0.42 1.57 3.20 -0.75 0.25 116.97 120.85 1sq3 h TYR 93 Ca 0.12 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 1sq3 h TYR 93 Cb 0.49 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 1sq3 h TYR 93 CO -0.40 0.13 0.10 0.93 -1.64 0.00 0.00 178.16 177.28 1sq3 h GLU 94 N 0.37 0.67 -0.55 1.82 3.07 -0.52 0.14 114.58 119.57 1sq3 h GLU 94 Ca 0.21 -0.16 0.07 0.00 -0.50 0.00 0.00 59.36 58.98 1sq3 h GLU 94 Cb 0.18 -0.09 -0.06 0.00 -0.84 0.00 0.00 28.75 27.94 1sq3 h GLU 94 CO -0.19 0.68 0.24 1.25 -1.40 0.00 0.00 179.01 179.58 1sq3 h HIS 95 N 0.54 0.42 -0.34 4.33 2.76 0.85 -1.91 115.15 121.79 1sq3 h HIS 95 Ca 0.13 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.21 1sq3 h HIS 95 Cb 0.31 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 1sq3 h HIS 95 CO 0.02 0.16 -0.25 0.93 -1.30 0.00 0.00 177.93 177.49 1sq3 h GLU 96 N 0.44 0.69 -0.46 5.26 4.39 0.54 0.54 114.58 125.98 1sq3 h GLU 96 Ca 0.26 -0.28 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 1sq3 h GLU 96 Cb 0.25 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1sq3 h GLU 96 CO -0.23 0.87 0.07 0.28 -1.16 0.00 0.00 179.01 178.84 1sq3 h VAL 97 N 0.60 1.21 0.01 3.13 2.07 -0.45 0.09 116.25 122.92 1sq3 h VAL 97 Ca 0.08 -0.81 -0.20 0.00 0.82 0.00 0.00 66.70 66.60 1sq3 h VAL 97 Cb 0.74 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1sq3 h VAL 97 CO 0.06 0.29 -0.91 -1.13 0.02 0.00 0.00 177.57 175.90 1sq3 h ASN 98 N 0.68 0.17 -0.47 0.57 -1.24 -0.82 -0.77 115.58 113.69 1sq3 h ASN 98 Ca 0.15 -0.15 0.02 0.00 0.71 0.00 0.00 56.30 57.03 1sq3 h ASN 98 Cb 0.31 -0.05 -0.03 0.00 0.73 0.00 0.00 38.32 39.28 1sq3 h ASN 98 CO 0.00 0.99 0.29 0.58 -1.29 0.00 0.00 177.43 178.00 1sq3 h VAL 99 N 0.06 1.07 -0.51 2.57 2.07 -0.24 -1.98 116.25 119.29 1sq3 h VAL 99 Ca -0.04 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.32 1sq3 h VAL 99 Cb 1.57 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 1sq3 h VAL 99 CO 0.13 0.11 0.27 0.74 0.02 0.00 0.00 177.57 178.84 1sq3 h THR 100 N 0.59 0.97 -0.92 2.57 2.02 -0.60 -0.66 112.91 116.88 1sq3 h THR 100 Ca 0.18 -0.18 0.13 0.00 0.77 0.00 0.00 66.41 67.31 1sq3 h THR 100 Cb -0.01 0.40 -0.09 0.00 -1.74 0.00 0.00 68.15 66.71 1sq3 h THR 100 CO -0.07 0.09 0.54 0.50 0.37 0.00 0.00 175.52 176.95 1sq3 h LYS 101 N 0.52 0.80 -0.28 6.66 3.64 -0.44 0.22 116.57 127.69 1sq3 h LYS 101 Ca 0.22 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.41 1sq3 h LYS 101 Cb 0.12 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 1sq3 h LYS 101 CO -0.15 0.53 -0.39 -0.09 -2.27 0.00 0.00 179.45 177.07 1sq3 h ARG 102 N 0.82 0.75 -0.73 1.90 9.65 -0.66 -0.78 114.38 125.33 1sq3 h ARG 102 Ca 0.47 -0.44 -0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1sq3 h ARG 102 Cb 0.55 0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.13 1sq3 h ARG 102 CO -0.30 1.07 0.46 0.82 2.80 0.00 0.00 179.97 184.82 1sq3 h ILE 103 N 0.50 1.20 0.00 1.20 1.08 0.03 -2.05 117.51 119.47 1sq3 h ILE 103 Ca 0.03 -0.42 -0.03 0.00 -0.39 0.00 0.00 64.86 64.04 1sq3 h ILE 103 Cb 0.99 0.16 -0.00 0.00 -3.07 0.00 0.00 36.82 34.90 1sq3 h ILE 103 CO 0.09 0.21 -0.16 0.45 -0.69 0.00 0.00 178.15 178.04 1sq3 h HIS 104 N 1.00 0.00 -0.38 1.37 3.86 -0.52 -0.20 115.15 120.28 1sq3 h HIS 104 Ca 0.26 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.33 1sq3 h HIS 104 Cb -0.06 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 1sq3 h HIS 104 CO -0.01 0.16 -0.33 0.93 0.86 0.00 0.00 177.93 179.54 1sq3 h GLU 105 N 0.00 0.86 -0.62 2.45 5.08 -0.74 -2.18 114.58 119.43 1sq3 h GLU 105 Ca -0.00 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 57.90 1sq3 h GLU 105 Cb 0.29 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1sq3 h GLU 105 CO 0.02 1.06 0.20 -0.07 -1.00 0.00 0.00 179.01 179.22 1sq3 h LEU 106 N 0.72 0.86 -0.05 1.33 3.38 -0.37 -3.15 115.31 118.04 1sq3 h LEU 106 Ca 0.07 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 1sq3 h LEU 106 Cb 0.89 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1sq3 h LEU 106 CO 0.08 0.81 -0.27 0.58 0.09 0.00 0.00 178.44 179.73 1sq3 h VAL 107 N 0.90 1.45 0.00 1.22 2.07 -1.18 -1.76 116.25 118.96 1sq3 h VAL 107 Ca 0.20 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 66.00 1sq3 h VAL 107 Cb 0.25 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.44 1sq3 h VAL 107 CO -0.01 0.49 0.00 -0.62 0.02 0.00 0.00 177.57 177.45 1sq3 n GLU 108 N -4.49 0.00 -0.50 1.57 -0.58 -0.83 -4.56 120.64 111.25 1sq3 n GLU 108 Ca -0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 1sq3 n GLU 108 Cb 0.48 -0.80 0.00 0.00 -0.57 0.00 0.00 31.44 30.55 1sq3 n GLU 108 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1sq3 n ALA 110 N 0.04 -0.07 0.00 0.62 0.00 -0.66 -4.62 120.51 115.82 1sq3 n ALA 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sq3 n ALA 110 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.40 1sq3 n ALA 110 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1sq3 n GLN 112 N -0.23 0.00 -0.03 0.00 7.27 -1.26 -0.87 117.38 122.25 1sq3 n GLN 112 Ca 0.00 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.19 1sq3 n GLN 112 Cb 0.04 0.00 0.50 0.00 2.41 0.00 0.00 30.24 33.18 1sq3 n GLN 112 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1sq3 n GLU 113 N 0.00 1.61 -2.28 3.69 1.02 -1.26 -4.89 120.64 118.53 1sq3 n GLU 113 Ca 0.00 -0.90 -0.10 0.00 -0.02 0.00 0.00 57.16 56.14 1sq3 n GLU 113 Cb 0.00 -1.44 -0.01 0.00 -0.02 0.00 0.00 31.44 29.97 1sq3 n GLU 113 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1sq3 n LYS 114 N 0.10 -2.19 -2.40 3.49 5.02 -0.82 -4.85 118.16 116.51 1sq3 n LYS 114 Ca 0.18 0.51 -0.37 0.00 -2.02 0.00 0.00 58.31 56.61 1sq3 n LYS 114 Cb 0.31 -5.04 -0.03 0.00 -0.02 0.00 0.00 35.03 30.25 1sq3 n LYS 114 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1sq3 s ASP 115 N -2.00 6.12 0.20 4.39 -1.08 -0.05 -4.78 116.67 119.47 1sq3 s ASP 115 Ca 0.00 -1.47 0.06 0.00 -0.52 0.00 0.00 52.55 50.62 1sq3 s ASP 115 Cb 0.00 -2.57 0.12 0.00 -1.46 0.00 0.00 42.92 39.01 1sq3 s ASP 115 CO 0.00 -1.87 1.47 -0.26 0.52 0.00 0.00 175.17 175.02 1sq3 h PHE 116 N 9.74 0.15 -0.15 -5.34 0.04 -1.89 -2.02 116.94 117.46 1sq3 h PHE 116 Ca 0.22 -0.07 -0.03 0.00 2.80 0.00 0.00 57.97 60.89 1sq3 h PHE 116 Cb 0.98 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 39.10 1sq3 h PHE 116 CO 1.29 0.83 -0.04 0.00 -0.60 0.00 0.00 178.31 179.79 1sq3 h ALA 117 N 1.15 0.21 -0.48 2.45 0.00 -1.95 0.36 119.26 121.00 1sq3 h ALA 117 Ca -0.02 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1sq3 h ALA 117 Cb 1.35 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1sq3 h ALA 117 CO 0.11 -0.03 -0.06 1.15 0.00 0.00 0.00 179.25 180.41 1sq3 h THR 118 N -0.01 1.26 -0.65 0.00 2.02 -1.94 -1.39 112.91 112.20 1sq3 h THR 118 Ca 0.04 -1.13 0.13 0.00 0.77 0.00 0.00 66.41 66.21 1sq3 h THR 118 Cb 0.47 0.96 -0.09 0.00 -1.74 0.00 0.00 68.15 67.74 1sq3 h THR 118 CO 0.02 0.39 0.14 0.22 0.37 0.00 0.00 175.52 176.66 1sq3 h TYR 119 N 0.77 0.22 -0.20 3.16 3.20 -1.28 -0.29 116.97 122.56 1sq3 h TYR 119 Ca 0.14 0.04 -0.21 0.00 3.14 0.00 0.00 58.73 61.83 1sq3 h TYR 119 Cb 0.56 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.83 1sq3 h TYR 119 CO 0.03 -0.05 -0.71 -0.97 -1.64 0.00 0.00 178.16 174.83 1sq3 h ASN 120 N 0.27 0.95 -0.20 -2.11 -0.73 -0.32 -3.07 115.58 110.36 1sq3 h ASN 120 Ca 0.35 -0.59 -0.10 0.00 1.87 0.00 0.00 56.30 57.83 1sq3 h ASN 120 Cb 0.55 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 38.84 1sq3 h ASN 120 CO -0.44 1.39 -0.20 0.15 -0.37 0.00 0.00 177.43 177.96 1sq3 h PHE 121 N 0.58 0.72 0.00 0.67 3.04 -1.15 -2.59 116.94 118.22 1sq3 h PHE 121 Ca -0.03 -0.15 0.00 0.00 3.98 0.00 0.00 57.97 61.77 1sq3 h PHE 121 Cb 1.33 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 39.66 1sq3 h PHE 121 CO 0.08 0.80 0.00 1.28 -2.02 0.00 0.00 178.31 178.45 1sq3 n LEU 122 N -4.13 0.53 0.17 0.59 4.77 -0.13 -2.98 117.00 115.82 1sq3 n LEU 122 Ca 0.00 0.66 0.02 0.00 -0.03 0.00 0.00 56.01 56.67 1sq3 n LEU 122 Cb 0.40 -0.62 0.37 0.00 -2.33 0.00 0.00 43.42 41.24 1sq3 n LEU 122 CO 0.43 -0.61 0.77 1.56 -1.33 0.00 0.00 177.39 178.21 1sq3 h GLN 123 N 0.00 0.05 -0.57 3.23 1.08 -1.43 -0.62 115.11 116.85 1sq3 h GLN 123 Ca 0.00 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.14 1sq3 h GLN 123 Cb 0.25 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 1sq3 h GLN 123 CO 0.00 0.36 0.17 2.35 -0.95 0.00 0.00 178.83 180.76 1sq3 h TRP 124 N 0.05 0.89 0.00 2.96 7.01 -1.73 -1.10 115.95 124.03 1sq3 h TRP 124 Ca 0.01 -0.07 -0.12 0.00 2.11 0.00 0.00 58.89 60.81 1sq3 h TRP 124 Cb 0.58 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1sq3 h TRP 124 CO 0.00 0.72 -0.59 1.88 -2.79 0.00 0.00 178.44 177.67 1sq3 h TYR 125 N 0.84 0.00 -0.28 2.65 -1.99 -1.35 -1.33 116.97 115.51 1sq3 h TYR 125 Ca 0.19 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 1sq3 h TYR 125 Cb 0.26 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.98 1sq3 h TYR 125 CO 0.02 0.59 -0.01 0.28 -0.00 0.00 0.00 178.16 179.03 1sq3 h VAL 126 N 0.00 1.26 -0.52 -2.88 2.07 -0.04 -2.12 116.25 114.03 1sq3 h VAL 126 Ca -0.01 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.46 1sq3 h VAL 126 Cb 1.12 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 1sq3 h VAL 126 CO 0.08 0.31 -0.02 0.00 0.02 0.00 0.00 177.57 177.95 1sq3 h ALA 127 N 0.81 0.70 -0.72 1.67 0.00 -1.28 -2.89 119.26 117.55 1sq3 h ALA 127 Ca 0.08 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.73 1sq3 h ALA 127 Cb 0.45 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1sq3 h ALA 127 CO 0.02 0.54 0.48 1.49 0.00 0.00 0.00 179.25 181.77 1sq3 h GLU 128 N 0.80 0.79 0.00 0.00 4.57 -1.12 -2.61 114.58 117.01 1sq3 h GLU 128 Ca 0.14 -0.05 -0.10 0.00 -1.18 0.00 0.00 59.36 58.18 1sq3 h GLU 128 Cb 0.56 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1sq3 h GLU 128 CO 0.03 0.52 -0.47 1.96 -1.18 0.00 0.00 179.01 179.87 1sq3 h GLN 129 N 0.81 0.00 0.00 1.92 1.08 -1.17 0.32 115.11 118.07 1sq3 h GLN 129 Ca 0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 1sq3 h GLN 129 Cb 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1sq3 h GLN 129 CO -0.09 0.47 0.00 0.28 -0.95 0.00 0.00 178.83 178.54 1sq3 n VAL 130 N -3.61 1.31 0.59 -0.54 0.31 -0.98 -1.49 118.33 113.92 1sq3 n VAL 130 Ca -0.00 0.61 0.12 0.00 -0.01 0.00 0.00 64.34 65.06 1sq3 n VAL 130 Cb 0.56 -1.60 0.21 0.00 -0.91 0.00 0.00 33.84 32.10 1sq3 n VAL 130 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1sq3 n GLU 131 N -2.00 2.39 -0.25 5.55 0.00 -1.26 -2.23 120.64 122.84 1sq3 n GLU 131 Ca -0.01 -2.08 0.03 0.00 0.00 0.00 0.00 57.16 55.11 1sq3 n GLU 131 Cb 0.04 -1.49 0.16 0.00 0.00 0.00 0.00 31.44 30.15 1sq3 n GLU 131 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1sq3 h GLU 132 N 4.34 0.54 -0.47 5.31 4.39 -0.64 -1.95 114.58 126.10 1sq3 h GLU 132 Ca 0.00 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.61 1sq3 h GLU 132 Cb 0.95 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.46 1sq3 h GLU 132 CO 0.00 0.36 0.08 0.93 -1.16 0.00 0.00 179.01 179.22 1sq3 h GLU 133 N 0.55 0.77 -0.41 2.33 5.08 -1.19 -2.82 114.58 118.90 1sq3 h GLU 133 Ca 0.38 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 1sq3 h GLU 133 Cb 0.47 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1sq3 h GLU 133 CO -0.32 0.78 -0.14 0.00 -1.00 0.00 0.00 179.01 178.33 1sq3 h ALA 134 N 0.96 0.98 -0.33 3.43 0.00 -0.96 -0.97 119.26 122.36 1sq3 h ALA 134 Ca 0.14 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1sq3 h ALA 134 Cb 0.38 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1sq3 h ALA 134 CO 0.01 0.60 -0.35 0.77 0.00 0.00 0.00 179.25 180.28 1sq3 h SER 135 N 0.68 0.87 -0.06 0.00 0.02 -1.36 -0.23 113.55 113.47 1sq3 h SER 135 Ca 0.11 -0.48 -0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1sq3 h SER 135 Cb 0.62 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1sq3 h SER 135 CO 0.04 1.17 0.03 0.00 -1.14 0.00 0.00 176.83 176.93 1sq3 h ALA 136 N 0.73 0.07 -0.40 3.77 0.00 -1.47 -3.11 119.26 118.85 1sq3 h ALA 136 Ca 0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1sq3 h ALA 136 Cb 0.94 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1sq3 h ALA 136 CO 0.09 -0.36 -0.01 1.25 0.00 0.00 0.00 179.25 180.22 1sq3 h LEU 137 N -0.04 0.61 -1.38 0.00 5.85 -1.04 -1.00 115.31 118.31 1sq3 h LEU 137 Ca 0.02 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1sq3 h LEU 137 Cb 0.13 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1sq3 h LEU 137 CO -0.00 0.68 0.25 0.44 -0.34 0.00 0.00 178.44 179.47 1sq3 h ASP 138 N 0.61 0.60 0.47 1.25 3.32 -0.97 0.18 116.42 121.87 1sq3 h ASP 138 Ca 0.12 -0.04 -0.30 0.00 0.02 0.00 0.00 57.03 56.83 1sq3 h ASP 138 Cb 0.39 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1sq3 h ASP 138 CO 0.01 0.50 -1.47 0.40 -1.72 0.00 0.00 179.24 176.97 1sq3 h ILE 139 N 0.68 1.24 -0.34 0.35 2.04 -1.44 -0.50 117.51 119.54 1sq3 h ILE 139 Ca 0.17 -2.84 0.03 0.00 1.00 0.00 0.00 64.86 63.22 1sq3 h ILE 139 Cb 0.05 2.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.92 1sq3 h ILE 139 CO -0.03 0.84 0.15 0.58 0.00 0.00 0.00 178.15 179.69 1sq3 h VAL 140 N 0.08 0.96 -0.50 1.67 2.07 -0.57 0.15 116.25 120.11 1sq3 h VAL 140 Ca -0.22 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 1sq3 h VAL 140 Cb 2.02 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 1sq3 h VAL 140 CO 0.18 0.06 0.04 -0.33 0.02 0.00 0.00 177.57 177.54 1sq3 h GLU 141 N 0.32 0.81 -0.09 1.57 5.08 -0.66 -1.71 114.58 119.90 1sq3 h GLU 141 Ca 0.14 -0.20 -0.12 0.00 -1.00 0.00 0.00 59.36 58.18 1sq3 h GLU 141 Cb 0.07 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1sq3 h GLU 141 CO -0.11 0.79 -0.48 -0.22 -1.00 0.00 0.00 179.01 177.98 1sq3 h LYS 142 N 0.76 0.24 0.00 2.33 3.64 -0.63 -1.95 116.57 120.96 1sq3 h LYS 142 Ca 0.15 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1sq3 h LYS 142 Cb 0.41 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1sq3 h LYS 142 CO 0.01 0.67 -0.17 -0.07 -2.27 0.00 0.00 179.45 177.63 1sq3 h LEU 143 N 0.19 0.00 0.01 5.20 3.38 -0.55 -1.88 115.31 121.67 1sq3 h LEU 143 Ca 0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 1sq3 h LEU 143 Cb 0.93 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.69 1sq3 h LEU 143 CO 0.07 0.17 -0.75 0.03 0.09 0.00 0.00 178.44 178.05 1sq3 h ARG 144 N 0.00 0.49 -0.85 1.13 3.08 -0.86 -1.87 114.38 115.50 1sq3 h ARG 144 Ca -0.00 -0.54 0.18 0.00 0.07 0.00 0.00 59.98 59.69 1sq3 h ARG 144 Cb 0.99 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 31.14 1sq3 h ARG 144 CO 0.02 1.18 0.56 1.25 -1.07 0.00 0.00 179.97 181.92 1sq3 h LEU 145 N 0.02 0.43 0.05 3.04 6.46 -1.22 -2.94 115.31 121.14 1sq3 h LEU 145 Ca -0.10 0.04 -0.26 0.00 -0.12 0.00 0.00 57.88 57.44 1sq3 h LEU 145 Cb 1.46 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 41.32 1sq3 h LEU 145 CO 0.15 0.19 -1.33 0.40 -0.62 0.00 0.00 178.44 177.24 1sq3 h ILE 146 N 0.44 1.35 0.00 4.05 2.04 -1.29 -3.48 117.51 120.62 1sq3 h ILE 146 Ca 0.43 -3.06 0.00 0.00 1.00 0.00 0.00 64.86 63.24 1sq3 h ILE 146 Cb 1.01 2.74 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 1sq3 h ILE 146 CO -0.16 0.82 0.00 0.61 0.00 0.00 0.00 178.15 179.42 1sq3 n GLY 147 N 1.50 1.95 0.18 5.37 0.00 -0.71 -1.83 105.19 111.66 1sq3 n GLY 147 Ca -0.09 0.50 0.11 0.00 0.00 0.00 0.00 46.02 46.54 1sq3 n GLY 147 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1sq3 n GLU 148 N 3.68 0.46 -1.93 1.61 -0.58 -1.26 -4.89 120.64 117.72 1sq3 n GLU 148 Ca 0.00 -0.37 -0.43 0.00 -0.42 0.00 0.00 57.16 55.94 1sq3 n GLU 148 Cb 0.00 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 1sq3 n GLU 148 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1sq3 s ASP 149 N -2.80 5.87 0.26 1.62 -1.08 -0.76 -4.87 116.67 114.91 1sq3 s ASP 149 Ca 0.13 1.48 0.19 0.00 -0.52 0.00 0.00 52.55 53.83 1sq3 s ASP 149 Cb 0.17 -2.52 0.09 0.00 -1.46 0.00 0.00 42.92 39.19 1sq3 s ASP 149 CO 0.74 -1.70 1.27 0.11 0.52 0.00 0.00 175.17 176.11 1sq3 h LYS 150 N 13.03 0.00 -0.48 4.34 1.57 -1.90 -2.46 116.57 130.67 1sq3 h LYS 150 Ca -0.35 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.37 1sq3 h LYS 150 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1sq3 h LYS 150 CO 1.01 0.20 0.10 0.00 -0.57 0.00 0.00 179.45 180.19 1sq3 h ARG 151 N 0.00 0.79 -0.45 3.15 3.08 -1.99 -0.55 114.38 118.40 1sq3 h ARG 151 Ca -0.03 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1sq3 h ARG 151 Cb 1.22 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 1sq3 h ARG 151 CO 0.03 0.78 0.04 0.00 -1.07 0.00 0.00 179.97 179.74 1sq3 h ALA 152 N 0.98 1.22 -0.10 0.04 0.00 -1.93 -0.50 119.26 118.97 1sq3 h ALA 152 Ca 0.15 -0.23 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1sq3 h ALA 152 Cb 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1sq3 h ALA 152 CO 0.00 0.52 -0.65 1.25 0.00 0.00 0.00 179.25 180.38 1sq3 h LEU 153 N 0.68 0.43 -0.55 0.00 5.85 -1.15 -1.99 115.31 118.58 1sq3 h LEU 153 Ca 0.14 -0.26 -0.16 0.00 0.84 0.00 0.00 57.88 58.45 1sq3 h LEU 153 Cb 0.36 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1sq3 h LEU 153 CO 0.01 0.96 -0.69 -0.07 -0.34 0.00 0.00 178.44 178.31 1sq3 h LEU 154 N 0.27 0.23 0.23 2.25 4.07 -0.51 -0.25 115.31 121.61 1sq3 h LEU 154 Ca -0.01 -0.15 -0.01 0.00 0.08 0.00 0.00 57.88 57.79 1sq3 h LEU 154 Cb 1.19 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.86 1sq3 h LEU 154 CO 0.11 0.85 -0.13 0.15 -1.08 0.00 0.00 178.44 178.34 1sq3 h PHE 155 N 0.14 -0.33 -0.72 1.13 3.04 -0.99 -1.43 116.94 117.78 1sq3 h PHE 155 Ca -0.02 -0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.01 1sq3 h PHE 155 Cb 1.23 0.11 -0.05 0.00 2.56 0.00 0.00 35.95 39.80 1sq3 h PHE 155 CO 0.02 -0.20 0.48 1.25 -2.02 0.00 0.00 178.31 177.84 1sq3 h LEU 156 N -0.34 0.60 -0.41 0.59 5.85 -1.10 -1.11 115.31 119.39 1sq3 h LEU 156 Ca -0.03 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1sq3 h LEU 156 Cb 0.27 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1sq3 h LEU 156 CO 0.04 0.37 0.15 -0.78 -0.34 0.00 0.00 178.44 177.88 1sq3 h ASP 157 N 0.67 0.58 -0.84 1.25 3.58 -0.64 -0.11 116.42 120.92 1sq3 h ASP 157 Ca 0.33 -0.18 -0.02 0.00 0.42 0.00 0.00 57.03 57.57 1sq3 h ASP 157 Cb 0.39 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 1sq3 h ASP 157 CO -0.11 0.61 0.43 0.50 -2.88 0.00 0.00 179.24 177.79 1sq3 h LYS 158 N 0.53 1.19 -0.67 0.28 3.64 -0.64 -1.59 116.57 119.31 1sq3 h LYS 158 Ca 0.14 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.31 1sq3 h LYS 158 Cb 0.21 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 1sq3 h LYS 158 CO -0.01 0.89 0.23 1.49 -2.27 0.00 0.00 179.45 179.78 1sq3 h GLU 159 N 1.19 1.02 0.00 1.90 4.81 -0.25 -2.53 114.58 120.72 1sq3 h GLU 159 Ca 0.29 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1sq3 h GLU 159 Cb 0.07 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1sq3 h GLU 159 CO -0.04 0.88 0.00 -0.07 -0.73 0.00 0.00 179.01 179.04 1sq3 h LEU 160 N 0.96 0.00 -0.97 1.64 4.07 -0.69 -2.12 115.31 118.20 1sq3 h LEU 160 Ca 0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.18 1sq3 h LEU 160 Cb 0.26 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.00 1sq3 h LEU 160 CO -0.01 0.00 0.00 0.77 -1.08 0.00 0.00 178.44 178.12 1sq3 h SER 161 N 0.00 0.00 1.02 -0.43 4.64 -0.84 -2.86 113.55 115.08 1sq3 h SER 161 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1sq3 h SER 161 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 1sq3 h SER 161 CO 0.00 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.89 1sq3 h LEU 162 N 0.00 0.00 -9.94 5.97 4.07 -1.38 -3.47 115.31 110.56 1sq3 h LEU 162 Ca 0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 1sq3 h LEU 162 Cb 0.51 0.00 0.07 0.00 1.08 0.00 0.00 40.66 42.32 1sq3 h LEU 162 CO 0.00 0.00 0.58 -0.60 -1.08 0.00 0.00 178.44 177.34 1sq3 s ARG 163 N -3.28 3.99 0.00 1.13 3.52 -1.08 -5.16 118.95 118.07 1sq3 s ARG 163 Ca 0.06 2.06 0.00 0.00 -0.13 0.00 0.00 55.73 57.72 1sq3 s ARG 163 Cb 0.10 -2.73 0.00 0.00 -1.56 0.00 0.00 34.95 30.76 1sq3 s ARG 163 CO 0.48 -0.44 0.43 1.04 -0.81 0.00 0.00 175.30 175.99