#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqe n SER 73 N 0.00 -1.63 -0.04 1.61 3.41 -1.26 -4.93 113.62 110.78 2yqe n SER 73 Ca 0.00 0.52 -0.14 0.00 -0.26 0.00 0.00 58.87 58.99 2yqe n SER 73 Cb 0.00 -1.19 -0.11 0.00 -0.26 0.00 0.00 64.21 62.65 2yqe n SER 73 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2yqe h SER 74 N -0.64 0.04 0.00 4.04 0.87 -2.11 -3.50 113.55 112.26 2yqe h SER 74 Ca -0.45 -0.75 0.00 0.00 -1.23 0.00 0.00 61.79 59.37 2yqe h SER 74 Cb 1.34 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 2yqe h SER 74 CO 0.40 0.78 0.00 0.61 -0.53 0.00 0.00 176.83 178.09 2yqe n GLY 75 N 0.93 -0.56 3.64 5.77 0.00 -1.26 -5.14 105.19 108.57 2yqe n GLY 75 Ca -0.09 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 2yqe n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yqe s SER 76 N -4.00 -1.09 -0.09 1.61 1.04 -1.26 -5.06 113.70 104.85 2yqe s SER 76 Ca 0.00 1.56 -0.06 0.00 0.48 0.00 0.00 55.95 57.93 2yqe s SER 76 Cb 0.00 2.07 -0.04 0.00 0.10 0.00 0.00 66.02 68.15 2yqe s SER 76 CO 0.00 -0.22 -0.14 -0.24 0.98 0.00 0.00 173.24 173.62 2yqe n SER 77 N 5.17 0.90 0.00 7.02 2.88 -1.26 -5.15 113.62 123.18 2yqe n SER 77 Ca -0.14 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2yqe n SER 77 Cb 0.51 -0.35 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 2yqe n SER 77 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yqe n GLY 78 N 2.41 3.50 3.56 0.46 0.00 -1.26 -5.02 105.19 108.84 2yqe n GLY 78 Ca -0.18 -1.60 -0.20 0.00 0.00 0.00 0.00 46.02 44.05 2yqe n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yqe s THR 79 N -2.00 3.04 -0.00 2.61 2.01 -1.26 -4.54 115.64 115.49 2yqe s THR 79 Ca 0.00 -0.02 -0.00 0.00 0.31 0.00 0.00 61.69 61.98 2yqe s THR 79 Cb 0.00 -3.08 -0.00 0.00 0.01 0.00 0.00 72.50 69.43 2yqe s THR 79 CO 0.00 -0.08 -0.00 0.54 -0.69 0.00 0.00 174.62 174.39 2yqe n ARG 80 N 8.88 0.01 0.04 4.92 5.12 -1.26 -4.83 116.66 129.53 2yqe n ARG 80 Ca 0.44 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 56.17 2yqe n ARG 80 Cb 0.46 -0.51 -0.13 0.00 -1.16 0.00 0.00 32.46 31.13 2yqe n ARG 80 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2yqe h VAL 81 N -0.01 1.43 -1.30 1.55 2.07 -2.03 -3.28 116.25 114.67 2yqe h VAL 81 Ca -0.01 -2.31 0.41 0.00 0.82 0.00 0.00 66.70 65.61 2yqe h VAL 81 Cb 0.99 2.82 -0.08 0.00 -1.52 0.00 0.00 31.29 33.50 2yqe h VAL 81 CO -0.00 0.67 0.90 0.29 0.02 0.00 0.00 177.57 179.45 2yqe n LYS 82 N -4.10 -0.01 0.12 1.57 4.01 -1.26 0.15 118.16 118.63 2yqe n LYS 82 Ca -0.12 0.89 -0.13 0.00 -0.51 0.00 0.00 58.31 58.44 2yqe n LYS 82 Cb 0.79 -1.91 -0.08 0.00 -0.51 0.00 0.00 35.03 33.31 2yqe n LYS 82 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 2yqe h LEU 83 N 0.00 -0.26 -0.98 -0.35 3.38 -1.88 -3.06 115.31 112.16 2yqe h LEU 83 Ca 0.70 -0.21 0.12 0.00 0.09 0.00 0.00 57.88 58.58 2yqe h LEU 83 Cb 2.57 0.07 -0.14 0.00 0.09 0.00 0.00 40.66 43.24 2yqe h LEU 83 CO -0.17 0.09 -0.47 -3.20 0.09 0.00 0.00 178.44 174.78 2yqe n ASN 84 N -5.08 -0.81 -0.29 -0.43 5.15 0.40 0.13 115.26 114.34 2yqe n ASN 84 Ca -0.09 1.72 0.11 0.00 -0.60 0.00 0.00 54.58 55.72 2yqe n ASN 84 Cb 0.24 -0.32 0.35 0.00 -0.53 0.00 0.00 39.78 39.52 2yqe n ASN 84 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2yqe h TYR 85 N 0.00 0.88 0.47 1.20 3.20 -1.58 0.11 116.97 121.24 2yqe h TYR 85 Ca 0.26 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 2yqe h TYR 85 Cb 0.50 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.50 2yqe h TYR 85 CO -0.92 0.33 -0.23 -0.07 -1.64 0.00 0.00 178.16 175.63 2yqe h LEU 86 N 0.75 -0.53 -1.69 2.82 3.38 0.12 -2.44 115.31 117.72 2yqe h LEU 86 Ca 0.46 -0.02 0.20 0.00 0.09 0.00 0.00 57.88 58.62 2yqe h LEU 86 Cb 0.68 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.52 2yqe h LEU 86 CO -0.22 -0.11 0.57 0.44 0.09 0.00 0.00 178.44 179.21 2yqe h ASP 87 N -1.14 0.26 0.15 -0.43 5.19 -0.12 -0.12 116.42 120.23 2yqe h ASP 87 Ca -0.06 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 2yqe h ASP 87 Cb 0.52 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.00 2yqe h ASP 87 CO 0.11 0.11 -0.07 1.56 -3.12 0.00 0.00 179.24 177.82 2yqe h GLN 88 N 0.27 -0.20 -1.00 3.56 4.20 -0.79 -0.01 115.11 121.14 2yqe h GLN 88 Ca 0.42 0.01 0.23 0.00 0.06 0.00 0.00 58.65 59.38 2yqe h GLN 88 Cb 1.23 0.05 -0.09 0.00 0.30 0.00 0.00 27.48 28.96 2yqe h GLN 88 CO -0.11 -0.13 0.63 0.97 -0.67 0.00 0.00 178.83 179.52 2yqe h ILE 89 N -0.28 0.61 0.19 2.54 2.10 -1.16 -1.31 117.51 120.20 2yqe h ILE 89 Ca -0.02 -0.17 -0.01 0.00 1.08 0.00 0.00 64.86 65.74 2yqe h ILE 89 Cb 0.16 0.05 0.00 0.00 -1.09 0.00 0.00 36.82 35.94 2yqe h ILE 89 CO 0.03 0.09 -0.09 0.00 -1.08 0.00 0.00 178.15 177.10 2yqe h ALA 90 N 1.63 -0.26 -1.44 0.18 0.00 -1.04 -2.59 119.26 115.75 2yqe h ALA 90 Ca 0.57 -0.17 0.42 0.00 0.00 0.00 0.00 54.91 55.73 2yqe h ALA 90 Cb 1.26 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2yqe h ALA 90 CO -0.31 -0.49 1.02 -0.22 0.00 0.00 0.00 179.25 179.26 2yqe h LYS 91 N -0.57 0.02 0.22 0.00 3.64 0.21 0.75 116.57 120.84 2yqe h LYS 91 Ca -0.03 -0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.03 2yqe h LYS 91 Cb 0.43 -0.01 0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2yqe h LYS 91 CO 0.04 0.02 -1.42 0.35 -2.27 0.00 0.00 179.45 176.17 2yqe h PHE 92 N 0.02 0.97 0.29 1.91 3.57 -1.29 -3.32 116.94 119.10 2yqe h PHE 92 Ca 0.70 -0.69 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2yqe h PHE 92 Cb 2.72 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 41.42 2yqe h PHE 92 CO -0.00 1.53 -0.14 -1.49 -2.23 0.00 0.00 178.31 175.98 2yqe h TRP 93 N 0.18 -0.36 -1.25 0.41 4.06 0.77 -2.92 115.95 116.84 2yqe h TRP 93 Ca -0.24 -0.01 0.39 0.00 2.06 0.00 0.00 58.89 61.10 2yqe h TRP 93 Cb 2.10 0.12 -0.08 0.00 -1.00 0.00 0.00 29.16 30.30 2yqe h TRP 93 CO 0.12 -0.22 0.86 -0.85 -3.56 0.00 0.00 178.44 174.79 2yqe n GLU 94 N -3.86 -0.01 -0.03 0.49 0.28 0.26 0.19 120.64 117.95 2yqe n GLU 94 Ca -0.05 0.88 -0.13 0.00 -0.16 0.00 0.00 57.16 57.70 2yqe n GLU 94 Cb 0.15 -1.86 -0.11 0.00 1.43 0.00 0.00 31.44 31.05 2yqe n GLU 94 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2yqe h ILE 95 N 0.00 1.51 0.00 3.84 2.04 -1.64 -3.13 117.51 120.12 2yqe h ILE 95 Ca 0.68 -1.62 0.00 0.00 1.00 0.00 0.00 64.86 64.92 2yqe h ILE 95 Cb 2.46 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 41.14 2yqe h ILE 95 CO -0.18 0.41 0.21 1.56 0.00 0.00 0.00 178.15 180.14 2yqe h GLN 96 N -0.71 0.00 0.00 2.37 1.08 0.22 -3.45 115.11 114.62 2yqe h GLN 96 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2yqe h GLN 96 Cb 0.69 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 2yqe h GLN 96 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 2yqe n GLY 97 N -1.20 2.94 3.56 3.46 0.00 -0.80 -5.00 105.19 108.15 2yqe n GLY 97 Ca -0.02 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 2yqe n GLY 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yqe s SER 98 N 0.15 6.33 0.95 1.61 1.04 -1.26 -4.91 113.70 117.61 2yqe s SER 98 Ca 0.00 -1.12 -0.17 0.00 0.48 0.00 0.00 55.95 55.14 2yqe s SER 98 Cb 0.00 -2.57 -0.13 0.00 0.10 0.00 0.00 66.02 63.42 2yqe s SER 98 CO 0.00 -1.67 -0.61 -0.24 0.98 0.00 0.00 173.24 171.70 2yqe n SER 99 N 9.32 -5.38 -4.86 7.02 2.88 -1.26 -4.49 113.62 116.86 2yqe n SER 99 Ca 0.25 0.24 -0.36 0.00 -1.33 0.00 0.00 58.87 57.68 2yqe n SER 99 Cb 0.50 -0.82 -0.06 0.00 -0.75 0.00 0.00 64.21 63.09 2yqe n SER 99 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2yqe s LEU 100 N 6.70 4.38 -0.05 2.46 2.96 -1.26 -4.93 118.68 128.94 2yqe s LEU 100 Ca 0.43 0.88 -0.02 0.00 -0.22 0.00 0.00 54.13 55.21 2yqe s LEU 100 Cb -0.21 -2.93 0.03 0.00 0.50 0.00 0.00 46.19 43.58 2yqe s LEU 100 CO 0.80 0.20 0.04 -0.54 -1.32 0.00 0.00 176.35 175.52 2yqe s LYS 101 N -1.71 0.14 -0.20 1.98 1.02 -1.26 -5.12 119.74 114.59 2yqe s LYS 101 Ca 0.31 0.28 -0.21 0.00 0.02 0.00 0.00 55.97 56.37 2yqe s LYS 101 Cb -0.15 -0.62 -0.02 0.00 -0.52 0.00 0.00 37.83 36.52 2yqe s LYS 101 CO 0.17 -0.30 0.65 0.42 -0.92 0.00 0.00 175.35 175.37 2yqe s ILE 102 N 1.99 5.00 0.75 2.17 1.01 -1.26 -5.06 121.20 125.80 2yqe s ILE 102 Ca 0.03 1.23 -0.12 0.00 0.00 0.00 0.00 60.65 61.80 2yqe s ILE 102 Cb -0.12 -3.97 0.04 0.00 0.01 0.00 0.00 42.46 38.43 2yqe s ILE 102 CO -0.04 0.09 1.10 -2.16 0.00 0.00 0.00 174.94 173.93 2yqe s PRO 103 N 2.00 2.38 -0.36 2.79 0.04 -1.26 -4.96 135.00 135.63 2yqe s PRO 103 Ca 0.29 1.22 -0.05 0.00 0.04 0.00 0.00 61.00 62.50 2yqe s PRO 103 Cb -0.16 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.53 2yqe s PRO 103 CO 0.10 -1.55 0.13 -0.80 0.04 0.00 0.00 177.00 174.92 2yqe s ASN 104 N -3.20 5.27 -0.10 6.66 -0.87 -1.26 -3.66 114.94 117.78 2yqe s ASN 104 Ca 0.63 -1.38 -0.00 0.00 -1.57 0.00 0.00 52.86 50.53 2yqe s ASN 104 Cb -0.18 -1.85 -0.03 0.00 -0.02 0.00 0.00 41.25 39.17 2yqe s ASN 104 CO 0.53 -0.39 -0.07 -0.69 -2.57 0.00 0.00 177.10 173.91 2yqe s VAL 105 N 1.33 3.64 -1.20 1.60 1.01 -0.77 -4.59 120.40 121.42 2yqe s VAL 105 Ca 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 2yqe s VAL 105 Cb -0.21 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.66 2yqe s VAL 105 CO 0.01 0.56 1.03 -0.62 0.00 0.00 0.00 175.10 176.08 2yqe n GLU 106 N 2.73 -6.90 -3.09 2.72 -0.58 -1.26 -2.03 120.64 112.23 2yqe n GLU 106 Ca -0.18 0.78 -0.17 0.00 -0.42 0.00 0.00 57.16 57.17 2yqe n GLU 106 Cb 0.53 -5.65 -0.01 0.00 -0.57 0.00 0.00 31.44 25.73 2yqe n GLU 106 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2yqe n ARG 107 N -4.36 -2.76 -3.59 3.49 1.85 -1.26 -4.89 116.66 105.15 2yqe n ARG 107 Ca -0.12 0.35 -0.13 0.00 -1.00 0.00 0.00 57.85 56.95 2yqe n ARG 107 Cb 0.60 -4.97 -0.05 0.00 -1.05 0.00 0.00 32.46 26.99 2yqe n ARG 107 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 2yqe s LYS 108 N -5.70 1.03 0.51 2.89 -2.85 -0.86 -5.15 119.74 109.61 2yqe s LYS 108 Ca 0.27 -0.31 -0.22 0.00 -1.00 0.00 0.00 55.97 54.71 2yqe s LYS 108 Cb -0.15 0.47 -0.07 0.00 -2.06 0.00 0.00 37.83 36.02 2yqe s LYS 108 CO 0.33 -0.38 1.24 1.51 0.10 0.00 0.00 175.35 178.15 2yqe n ILE 109 N 0.33 3.32 -3.34 3.79 3.06 -1.26 -1.85 119.36 123.41 2yqe n ILE 109 Ca -0.18 -0.50 -0.42 0.00 -2.50 0.00 0.00 62.75 59.15 2yqe n ILE 109 Cb 0.61 -1.51 -0.09 0.00 0.54 0.00 0.00 39.64 39.19 2yqe n ILE 109 CO 0.00 0.00 0.00 -0.22 -2.50 0.00 0.00 176.55 173.83 2yqe s LEU 110 N -2.44 4.54 -1.28 9.51 0.20 -1.24 -4.78 118.68 123.18 2yqe s LEU 110 Ca 0.69 -0.31 -0.18 0.00 0.69 0.00 0.00 54.13 55.01 2yqe s LEU 110 Cb -0.45 -2.42 0.07 0.00 -0.43 0.00 0.00 46.19 42.96 2yqe s LEU 110 CO 0.52 -0.45 1.72 -0.62 -0.29 0.00 0.00 176.35 177.24 2yqe s ASP 111 N 1.77 6.79 0.26 3.68 2.15 -1.26 -4.80 116.67 125.26 2yqe s ASP 111 Ca 0.14 -2.37 -0.02 0.00 0.43 0.00 0.00 52.55 50.73 2yqe s ASP 111 Cb -0.16 -2.58 0.50 0.00 -0.30 0.00 0.00 42.92 40.37 2yqe s ASP 111 CO 0.13 -1.22 1.78 0.17 -0.17 0.00 0.00 175.17 175.85 2yqe h LEU 112 N 12.67 0.58 -0.91 -1.34 -0.00 -1.99 -2.17 115.31 122.15 2yqe h LEU 112 Ca 0.43 0.08 0.15 0.00 -0.00 0.00 0.00 57.88 58.54 2yqe h LEU 112 Cb 0.88 -0.02 -0.15 0.00 -0.00 0.00 0.00 40.66 41.36 2yqe h LEU 112 CO 1.45 0.28 -0.36 0.22 -0.00 0.00 0.00 178.44 180.03 2yqe h TYR 113 N 0.68 -0.99 -0.39 0.17 3.20 -1.91 0.34 116.97 118.08 2yqe h TYR 113 Ca 0.45 0.10 -0.01 0.00 3.14 0.00 0.00 58.73 62.41 2yqe h TYR 113 Cb 0.57 0.57 -0.02 0.00 1.54 0.00 0.00 36.73 39.39 2yqe h TYR 113 CO -0.08 -0.40 0.22 0.77 -1.64 0.00 0.00 178.16 177.03 2yqe h SER 114 N -0.03 0.47 0.38 -2.11 0.02 -1.81 -1.10 113.55 109.38 2yqe h SER 114 Ca 0.34 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 2yqe h SER 114 Cb 0.60 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 2yqe h SER 114 CO -0.93 0.41 -0.32 0.25 -1.14 0.00 0.00 176.83 175.10 2yqe h LEU 115 N 0.50 -0.85 -0.76 5.07 5.85 -0.36 0.27 115.31 125.03 2yqe h LEU 115 Ca 0.14 0.06 0.15 0.00 0.84 0.00 0.00 57.88 59.07 2yqe h LEU 115 Cb 0.03 0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.23 2yqe h LEU 115 CO -0.02 -0.44 0.27 0.28 -0.34 0.00 0.00 178.44 178.18 2yqe h SER 116 N -0.68 0.20 0.39 1.25 0.02 -0.69 -1.49 113.55 112.54 2yqe h SER 116 Ca -0.05 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 2yqe h SER 116 Cb 0.57 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2yqe h SER 116 CO -0.00 0.05 -0.19 0.11 -1.14 0.00 0.00 176.83 175.66 2yqe h LYS 117 N 0.38 -0.50 -1.33 3.45 1.79 -0.93 -1.28 116.57 118.15 2yqe h LYS 117 Ca 0.42 0.03 0.39 0.00 -2.18 0.00 0.00 60.65 59.31 2yqe h LYS 117 Cb 0.68 0.11 -0.05 0.00 -1.58 0.00 0.00 32.23 31.39 2yqe h LYS 117 CO -0.45 -0.33 1.11 0.82 -1.08 0.00 0.00 179.45 179.52 2yqe h ILE 118 N -0.53 0.15 0.07 1.86 2.04 -0.19 1.03 117.51 121.95 2yqe h ILE 118 Ca -0.05 0.00 -0.26 0.00 1.00 0.00 0.00 64.86 65.54 2yqe h ILE 118 Cb 0.40 0.19 0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2yqe h ILE 118 CO 0.09 0.00 -1.08 0.58 0.00 0.00 0.00 178.15 177.74 2yqe h VAL 119 N 0.00 1.31 -0.20 1.67 2.07 -0.87 -2.81 116.25 117.43 2yqe h VAL 119 Ca 0.63 -2.35 -0.18 0.00 0.82 0.00 0.00 66.70 65.63 2yqe h VAL 119 Cb 2.84 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 35.23 2yqe h VAL 119 CO -0.01 0.71 -0.57 0.40 0.02 0.00 0.00 177.57 178.13 2yqe h ILE 120 N 0.22 1.30 -0.61 4.57 2.04 0.21 -0.55 117.51 124.70 2yqe h ILE 120 Ca -0.15 -1.79 -0.03 0.00 1.00 0.00 0.00 64.86 63.89 2yqe h ILE 120 Cb 1.76 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 39.69 2yqe h ILE 120 CO 0.21 0.56 0.26 1.05 0.00 0.00 0.00 178.15 180.23 2yqe h GLU 121 N 0.45 0.88 0.00 2.37 4.11 -0.90 -1.73 114.58 119.76 2yqe h GLU 121 Ca -0.02 -0.13 -0.05 0.00 0.07 0.00 0.00 59.36 59.24 2yqe h GLU 121 Cb 1.19 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 2yqe h GLU 121 CO 0.12 0.71 -0.22 0.93 0.07 0.00 0.00 179.01 180.63 2yqe h GLU 122 N 0.87 0.00 0.00 1.06 5.08 -1.48 -3.45 114.58 116.67 2yqe h GLU 122 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2yqe h GLU 122 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2yqe h GLU 122 CO -0.02 0.22 0.00 0.41 -1.00 0.00 0.00 179.01 178.61 2yqe n GLY 123 N -0.57 0.49 1.55 -3.84 0.00 -0.68 -4.84 105.19 97.30 2yqe n GLY 123 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2yqe n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yqe n GLY 124 N 0.00 -2.45 0.12 -0.02 0.00 -0.22 -3.99 105.19 98.63 2yqe n GLY 124 Ca 0.00 -1.87 -0.21 0.00 0.00 0.00 0.00 46.02 43.93 2yqe n GLY 124 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2yqe h TYR 125 N 0.00 0.40 -0.70 1.61 5.03 -1.94 -3.30 116.97 118.08 2yqe h TYR 125 Ca 0.00 -0.29 -0.01 0.00 2.58 0.00 0.00 58.73 61.01 2yqe h TYR 125 Cb 0.00 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.23 2yqe h TYR 125 CO 0.00 1.58 0.41 0.93 -1.32 0.00 0.00 178.16 179.76 2yqe h GLU 126 N -0.32 0.96 0.13 1.82 4.39 -1.94 -0.81 114.58 118.82 2yqe h GLU 126 Ca -0.32 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.28 2yqe h GLU 126 Cb 1.75 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 30.21 2yqe h GLU 126 CO 0.04 0.69 -0.06 0.00 -1.16 0.00 0.00 179.01 178.51 2yqe h ALA 127 N 1.48 -1.01 -0.91 3.43 0.00 -1.71 -0.53 119.26 120.01 2yqe h ALA 127 Ca 0.25 -0.04 0.19 0.00 0.00 0.00 0.00 54.91 55.31 2yqe h ALA 127 Cb -0.01 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2yqe h ALA 127 CO -0.04 -1.00 0.59 -0.84 0.00 0.00 0.00 179.25 177.96 2yqe h ILE 128 N -0.18 0.71 -0.47 0.00 -0.00 -1.63 0.16 117.51 116.10 2yqe h ILE 128 Ca -0.02 -0.17 -0.06 0.00 -0.00 0.00 0.00 64.86 64.61 2yqe h ILE 128 Cb 0.14 0.18 -0.02 0.00 -0.00 0.00 0.00 36.82 37.11 2yqe h ILE 128 CO 0.03 0.09 0.04 0.00 -0.00 0.00 0.00 178.15 178.31 2yqe h LYS 130 N 0.71 0.86 -0.70 0.00 3.11 0.98 -2.87 116.57 118.65 2yqe h LYS 130 Ca 0.15 -0.39 -0.02 0.00 -2.81 0.00 0.00 60.65 57.58 2yqe h LYS 130 Cb 0.38 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.58 2yqe h LYS 130 CO 0.01 1.03 0.02 -0.25 -2.81 0.00 0.00 179.45 177.45 2yqe n ASP 131 N -4.21 4.49 -3.87 4.20 8.00 -0.86 -4.92 116.55 119.39 2yqe n ASP 131 Ca -0.02 -2.72 -0.25 0.00 0.71 0.00 0.00 54.79 52.51 2yqe n ASP 131 Cb 0.45 -0.65 -0.07 0.00 -0.02 0.00 0.00 41.12 40.83 2yqe n ASP 131 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2yqe n ARG 132 N 0.41 -0.92 -0.23 -1.24 1.85 -0.09 -4.73 116.66 111.70 2yqe n ARG 132 Ca 0.22 0.08 0.02 0.00 -1.00 0.00 0.00 57.85 57.17 2yqe n ARG 132 Cb 0.98 -2.88 0.11 0.00 -1.05 0.00 0.00 32.46 29.62 2yqe n ARG 132 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2yqe n ARG 133 N -3.64 2.00 -0.01 2.89 1.74 0.55 -4.21 116.66 115.98 2yqe n ARG 133 Ca -0.19 -0.88 -0.11 0.00 -0.77 0.00 0.00 57.85 55.90 2yqe n ARG 133 Cb 0.50 -1.61 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 2yqe n ARG 133 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 2yqe h TRP 134 N 1.17 0.15 -0.69 -1.55 4.06 -1.85 -2.19 115.95 115.05 2yqe h TRP 134 Ca 0.00 0.00 0.15 0.00 2.06 0.00 0.00 58.89 61.10 2yqe h TRP 134 Cb 0.80 -0.05 -0.11 0.00 -1.00 0.00 0.00 29.16 28.79 2yqe h TRP 134 CO 0.28 0.11 0.05 0.00 -3.56 0.00 0.00 178.44 175.32 2yqe h ALA 135 N 1.02 0.75 0.79 1.49 0.00 -1.94 -0.89 119.26 120.47 2yqe h ALA 135 Ca 0.04 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 2yqe h ALA 135 Cb 0.00 0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.13 2yqe h ALA 135 CO -0.01 -0.39 -0.38 0.00 0.00 0.00 0.00 179.25 178.47 2yqe h ARG 136 N 0.15 -1.02 -1.26 0.00 2.47 -1.81 -2.35 114.38 110.55 2yqe h ARG 136 Ca 0.37 0.07 0.37 0.00 -1.26 0.00 0.00 59.98 59.53 2yqe h ARG 136 Cb 0.63 0.23 -0.07 0.00 -1.65 0.00 0.00 29.97 29.12 2yqe h ARG 136 CO -0.57 -0.67 0.88 0.28 0.56 0.00 0.00 179.97 180.46 2yqe h VAL 137 N -1.16 0.35 0.44 2.04 2.07 -0.80 -0.61 116.25 118.59 2yqe h VAL 137 Ca -0.11 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2yqe h VAL 137 Cb 0.83 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2yqe h VAL 137 CO 0.18 0.02 -0.21 0.00 0.02 0.00 0.00 177.57 177.57 2yqe h ALA 138 N 1.42 -0.59 -0.71 1.67 0.00 -0.83 -3.16 119.26 117.07 2yqe h ALA 138 Ca 0.64 -0.17 0.20 0.00 0.00 0.00 0.00 54.91 55.59 2yqe h ALA 138 Cb 2.33 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 20.32 2yqe h ALA 138 CO -0.11 -0.59 0.53 0.37 0.00 0.00 0.00 179.25 179.45 2yqe h GLN 139 N -1.07 0.00 -1.00 0.00 -0.00 -0.64 -0.04 115.11 112.36 2yqe h GLN 139 Ca -0.06 0.00 0.16 0.00 -0.00 0.00 0.00 58.65 58.75 2yqe h GLN 139 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 27.48 27.92 2yqe h GLN 139 CO 0.10 0.00 0.62 0.00 0.00 0.00 0.00 178.83 179.55 2yqe h ARG 140 N 0.00 0.83 -0.77 1.69 2.47 -1.23 0.49 114.38 117.86 2yqe h ARG 140 Ca 0.33 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 59.01 2yqe h ARG 140 Cb 1.38 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 2yqe h ARG 140 CO -0.00 0.55 0.00 -0.11 0.56 0.00 0.00 179.97 180.96 2yqe n LEU 141 N -4.68 1.47 -3.31 3.04 7.94 -0.03 -4.84 117.00 116.59 2yqe n LEU 141 Ca 0.21 -0.74 -0.20 0.00 -1.11 0.00 0.00 56.01 54.17 2yqe n LEU 141 Cb 0.48 -0.43 0.08 0.00 0.53 0.00 0.00 43.42 44.07 2yqe n LEU 141 CO 0.25 0.27 0.19 1.41 -1.11 0.00 0.00 177.39 178.40 2yqe n HIS 142 N 0.04 -2.46 -2.81 1.96 8.25 0.17 -4.99 115.22 115.38 2yqe n HIS 142 Ca 0.04 0.91 -0.32 0.00 -0.26 0.00 0.00 57.72 58.09 2yqe n HIS 142 Cb 0.33 -4.75 -0.05 0.00 1.12 0.00 0.00 29.99 26.64 2yqe n HIS 142 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2yqe s TYR 143 N -3.30 3.40 -0.24 4.41 2.02 -1.23 -5.00 117.35 117.41 2yqe s TYR 143 Ca 0.37 1.31 -0.29 0.00 -0.37 0.00 0.00 57.07 58.10 2yqe s TYR 143 Cb -0.16 -2.64 -0.02 0.00 -0.40 0.00 0.00 41.96 38.73 2yqe s TYR 143 CO 0.67 -0.12 1.63 -1.25 -1.57 0.00 0.00 175.55 174.91 2yqe s PRO 144 N -3.52 3.73 -0.36 -1.71 0.04 -1.26 -4.73 135.00 127.18 2yqe s PRO 144 Ca 0.56 1.60 -0.28 0.00 0.04 0.00 0.00 61.00 62.92 2yqe s PRO 144 Cb -0.10 -4.05 -0.01 0.00 0.04 0.00 0.00 34.50 30.38 2yqe s PRO 144 CO 0.24 -1.37 1.71 -1.25 0.04 0.00 0.00 177.00 176.37 2yqe s PRO 145 N 4.79 3.35 0.00 0.56 0.04 -1.26 -3.99 135.00 138.50 2yqe s PRO 145 Ca 0.72 1.26 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2yqe s PRO 145 Cb -0.24 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.13 2yqe s PRO 145 CO 0.30 -1.83 0.00 0.41 0.04 0.00 0.00 177.00 175.91 2yqe n GLY 146 N 5.36 0.29 3.72 0.56 0.00 -1.26 -5.14 105.19 108.73 2yqe n GLY 146 Ca 0.21 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.99 2yqe n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yqe s LYS 147 N 0.00 2.30 -1.10 1.61 3.01 -1.26 -4.82 119.74 119.48 2yqe s LYS 147 Ca 0.00 1.93 -0.24 0.00 -1.01 0.00 0.00 55.97 56.66 2yqe s LYS 147 Cb 0.00 -1.83 -0.10 0.00 -1.01 0.00 0.00 37.83 34.89 2yqe s LYS 147 CO 0.00 -1.76 1.98 1.21 0.51 0.00 0.00 175.35 177.30 2yqe s ASN 148 N -1.68 4.78 -0.20 2.83 3.84 -1.26 -4.62 114.94 118.63 2yqe s ASN 148 Ca 0.79 -1.31 -0.14 0.00 0.21 0.00 0.00 52.86 52.40 2yqe s ASN 148 Cb -0.34 -2.58 -0.20 0.00 -0.55 0.00 0.00 41.25 37.58 2yqe s ASN 148 CO 0.43 -3.29 0.12 -0.38 -2.79 0.00 0.00 177.10 171.18 2yqe n ILE 149 N 8.03 1.60 -0.36 -5.21 5.41 -1.26 -4.08 119.36 123.49 2yqe n ILE 149 Ca 0.43 -0.30 -0.07 0.00 1.00 0.00 0.00 62.75 63.81 2yqe n ILE 149 Cb 0.47 -1.88 -0.05 0.00 -0.71 0.00 0.00 39.64 37.46 2yqe n ILE 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2yqe n GLY 150 N 1.62 -2.12 0.15 7.39 0.00 -1.26 0.06 105.19 111.02 2yqe n GLY 150 Ca -0.37 1.02 -0.07 0.00 0.00 0.00 0.00 46.02 46.60 2yqe n GLY 150 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2yqe h SER 151 N 0.00 0.08 -0.40 1.61 0.02 -1.97 -1.99 113.55 110.90 2yqe h SER 151 Ca 0.19 0.04 0.08 0.00 -0.84 0.00 0.00 61.79 61.26 2yqe h SER 151 Cb 0.40 0.04 -0.08 0.00 0.14 0.00 0.00 62.40 62.90 2yqe h SER 151 CO -0.83 0.08 -0.17 0.25 -1.14 0.00 0.00 176.83 175.02 2yqe h LEU 152 N 0.23 -0.60 0.31 5.07 6.46 -0.52 -1.23 115.31 125.03 2yqe h LEU 152 Ca 0.15 0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 58.05 2yqe h LEU 152 Cb 0.14 0.33 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 2yqe h LEU 152 CO -0.17 -0.21 -0.20 -0.07 -0.62 0.00 0.00 178.44 177.16 2yqe h LEU 153 N -0.10 -0.52 -0.92 2.25 3.38 -0.62 -2.10 115.31 116.68 2yqe h LEU 153 Ca 0.20 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.33 2yqe h LEU 153 Cb 0.40 0.15 -0.14 0.00 0.09 0.00 0.00 40.66 41.16 2yqe h LEU 153 CO -0.46 -0.31 -0.39 -1.14 0.09 0.00 0.00 178.44 176.23 2yqe n ARG 154 N -3.54 -0.25 0.04 1.13 0.63 -0.78 -1.16 116.66 112.73 2yqe n ARG 154 Ca -0.06 1.42 -0.09 0.00 -0.92 0.00 0.00 57.85 58.20 2yqe n ARG 154 Cb 0.20 -2.10 -0.05 0.00 0.45 0.00 0.00 32.46 30.96 2yqe n ARG 154 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2yqe h SER 155 N 0.00 -0.87 -1.41 6.15 4.64 -1.13 -0.07 113.55 120.85 2yqe h SER 155 Ca 0.29 0.09 0.44 0.00 -0.47 0.00 0.00 61.79 62.15 2yqe h SER 155 Cb 0.53 0.33 -0.11 0.00 -0.31 0.00 0.00 62.40 62.84 2yqe h SER 155 CO -0.91 -0.29 0.95 0.45 -0.87 0.00 0.00 176.83 176.17 2yqe h HIS 156 N -0.38 0.36 0.02 4.77 3.86 -0.42 0.81 115.15 124.18 2yqe h HIS 156 Ca 0.00 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2yqe h HIS 156 Cb 0.39 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.77 2yqe h HIS 156 CO -0.42 -0.12 -0.01 -0.92 0.86 0.00 0.00 177.93 177.33 2yqe h TYR 157 N 0.08 -0.03 0.00 2.45 5.03 0.08 -1.41 116.97 123.18 2yqe h TYR 157 Ca 0.79 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 62.10 2yqe h TYR 157 Cb 2.69 0.01 0.00 0.00 1.55 0.00 0.00 36.73 40.98 2yqe h TYR 157 CO -0.00 -0.02 0.00 0.39 -1.32 0.00 0.00 178.16 177.21 2yqe n GLU 158 N -2.15 0.00 -0.08 1.82 4.71 -0.44 0.24 120.64 124.75 2yqe n GLU 158 Ca -0.00 0.47 -0.12 0.00 -0.01 0.00 0.00 57.16 57.49 2yqe n GLU 158 Cb 0.01 -1.51 -0.08 0.00 -1.01 0.00 0.00 31.44 28.85 2yqe n GLU 158 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 2yqe h ARG 159 N 0.00 0.00 0.00 3.49 9.65 0.63 -3.35 114.38 124.79 2yqe h ARG 159 Ca 0.00 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.70 2yqe h ARG 159 Cb 0.03 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 2yqe h ARG 159 CO 0.00 0.67 -1.70 -0.89 2.80 0.00 0.00 179.97 180.84 2yqe n ILE 160 N -4.59 0.71 1.64 1.20 5.41 -0.53 -4.50 119.36 118.69 2yqe n ILE 160 Ca -0.15 -0.28 0.14 0.00 1.00 0.00 0.00 62.75 63.46 2yqe n ILE 160 Cb 0.42 -0.92 0.79 0.00 -0.71 0.00 0.00 39.64 39.22 2yqe n ILE 160 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2yqe n ILE 161 N -2.82 0.02 0.18 1.39 5.41 0.65 -3.38 119.36 120.80 2yqe n ILE 161 Ca -0.21 0.01 -0.08 0.00 1.00 0.00 0.00 62.75 63.46 2yqe n ILE 161 Cb 0.74 -0.58 -0.04 0.00 -0.71 0.00 0.00 39.64 39.05 2yqe n ILE 161 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 2yqe h TYR 162 N 0.00 -0.49 -0.26 1.39 3.20 -0.67 -2.85 116.97 117.30 2yqe h TYR 162 Ca 0.00 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.72 2yqe h TYR 162 Cb 0.03 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2yqe h TYR 162 CO 0.00 -0.30 -0.42 -1.00 -1.64 0.00 0.00 178.16 174.80 2yqe h PRO 163 N -1.11 0.63 -0.39 1.82 0.13 -1.85 -2.29 132.00 128.95 2yqe h PRO 163 Ca -0.05 -0.33 0.01 0.00 -0.87 0.00 0.00 66.00 64.75 2yqe h PRO 163 Cb 0.40 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 2yqe h PRO 163 CO 0.09 0.94 0.24 -0.92 -0.23 0.00 0.00 178.00 178.12 2yqe h TYR 164 N 0.52 0.45 0.55 1.56 3.20 -1.69 0.54 116.97 122.10 2yqe h TYR 164 Ca 0.04 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2yqe h TYR 164 Cb 0.95 -0.15 0.01 0.00 1.54 0.00 0.00 36.73 39.07 2yqe h TYR 164 CO 0.04 0.27 -0.26 0.93 -1.64 0.00 0.00 178.16 177.50 2yqe h GLU 165 N 0.49 -0.71 -0.98 1.82 4.39 -1.49 -2.29 114.58 115.80 2yqe h GLU 165 Ca 0.15 0.05 0.13 0.00 0.34 0.00 0.00 59.36 60.03 2yqe h GLU 165 Cb -0.02 0.16 -0.08 0.00 -0.10 0.00 0.00 28.75 28.70 2yqe h GLU 165 CO -0.05 -0.47 0.62 0.00 -1.16 0.00 0.00 179.01 177.94 2yqe h MET 166 N -1.18 0.88 0.12 2.33 -0.00 -1.43 -1.95 114.93 113.70 2yqe h MET 166 Ca -0.08 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.70 59.57 2yqe h MET 166 Cb 0.57 -0.20 0.00 0.00 -0.00 0.00 0.00 31.60 31.97 2yqe h MET 166 CO 0.12 0.58 -0.06 0.35 -0.00 0.00 0.00 176.91 177.91 2yqe h PHE 167 N 0.90 -0.15 -1.13 -0.10 3.57 0.06 -2.88 116.94 117.22 2yqe h PHE 167 Ca 0.49 -0.00 -0.53 0.00 3.53 0.00 0.00 57.97 61.46 2yqe h PHE 167 Cb 0.58 0.05 -0.19 0.00 2.79 0.00 0.00 35.95 39.18 2yqe h PHE 167 CO -0.00 -0.09 0.53 1.04 -2.23 0.00 0.00 178.31 177.56 2yqe n GLN 168 N -5.16 2.39 -4.04 1.11 1.13 -0.76 -4.87 117.38 107.18 2yqe n GLN 168 Ca -0.08 -2.48 -0.31 0.00 -1.94 0.00 0.00 57.00 52.19 2yqe n GLN 168 Cb 0.09 -2.10 -0.16 0.00 0.11 0.00 0.00 30.24 28.18 2yqe n GLN 168 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2yqe s SER 169 N -0.02 3.05 0.00 1.08 1.04 -1.05 -4.94 113.70 112.85 2yqe s SER 169 Ca 0.54 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.31 2yqe s SER 169 Cb 0.38 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 65.21 2yqe s SER 169 CO -0.21 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.55 2yqe n GLY 170 N 4.70 -1.92 0.74 7.32 0.00 -1.26 -5.03 105.19 109.74 2yqe n GLY 170 Ca -0.17 0.77 0.13 0.00 0.00 0.00 0.00 46.02 46.75 2yqe n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32