#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 -3.76 -4.18 1.61 7.64 -1.26 -4.96 113.62 108.72 2yqe n SER 73 Ca 0.00 -0.85 -0.11 0.00 1.01 0.00 0.00 58.87 58.92 2yqe n SER 73 Cb 0.00 -3.59 -0.10 0.00 -1.01 0.00 0.00 64.21 59.51 2yqe n SER 73 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yqe s SER 74 N -3.50 0.61 0.00 6.43 1.04 -1.26 -5.12 113.70 111.90 2yqe s SER 74 Ca 0.56 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.80 2yqe s SER 74 Cb -0.29 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.07 2yqe s SER 74 CO 0.85 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 175.01 2yqe n GLY 75 N -0.13 -0.97 3.01 7.32 0.00 -1.26 -4.98 105.19 108.18 2yqe n GLY 75 Ca -0.06 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 44.09 2yqe n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yqe s SER 76 N -1.96 1.40 -0.19 1.61 0.15 -1.26 -5.10 113.70 108.36 2yqe s SER 76 Ca 0.00 -0.22 -0.40 0.00 0.70 0.00 0.00 55.95 56.02 2yqe s SER 76 Cb 0.00 -0.46 -0.17 0.00 -1.71 0.00 0.00 66.02 63.68 2yqe s SER 76 CO 0.00 0.06 1.53 -0.24 1.20 0.00 0.00 173.24 175.79 2yqe n SER 77 N 3.43 1.71 0.00 5.45 2.88 -1.26 -4.71 113.62 121.12 2yqe n SER 77 Ca -0.20 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.46 2yqe n SER 77 Cb 0.53 -1.08 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 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 3.40 -1.33 3.53 0.46 0.00 -1.26 -5.06 105.19 104.93 2yqe n GLY 78 Ca 0.24 0.45 -0.30 0.00 0.00 0.00 0.00 46.02 46.42 2yqe n GLY 78 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2yqe n THR 79 N -0.68 -0.02 0.02 2.61 -1.04 -1.26 -4.60 114.28 109.30 2yqe n THR 79 Ca 0.00 -0.43 -0.02 0.00 -2.04 0.00 0.00 64.05 61.56 2yqe n THR 79 Cb 0.00 -1.32 -0.01 0.00 -1.82 0.00 0.00 70.33 67.18 2yqe n THR 79 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2yqe n ARG 80 N 8.05 0.05 0.02 -2.82 3.00 -1.26 -4.85 116.66 118.85 2yqe n ARG 80 Ca 0.55 0.02 -0.16 0.00 -0.00 0.00 0.00 57.85 58.26 2yqe n ARG 80 Cb 0.28 -0.59 -0.14 0.00 0.00 0.00 0.00 32.46 32.00 2yqe n ARG 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2yqe h VAL 81 N -0.10 0.89 -1.48 5.15 2.07 -2.03 -3.35 116.25 117.41 2yqe h VAL 81 Ca -0.02 -2.62 0.43 0.00 0.82 0.00 0.00 66.70 65.30 2yqe h VAL 81 Cb 0.41 2.58 -0.06 0.00 -1.52 0.00 0.00 31.29 32.70 2yqe h VAL 81 CO -0.01 0.75 1.32 0.11 0.02 0.00 0.00 177.57 179.75 2yqe h LYS 82 N 0.05 0.00 0.14 1.57 1.57 -1.91 0.50 116.57 118.48 2yqe h LYS 82 Ca -0.31 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2yqe h LYS 82 Cb 2.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.33 2yqe h LYS 82 CO 0.11 0.00 -0.07 -0.07 -0.57 0.00 0.00 179.45 178.86 2yqe h LEU 83 N 0.00 -0.16 -0.75 2.94 3.38 -1.90 -3.34 115.31 115.48 2yqe h LEU 83 Ca 0.70 -0.35 0.07 0.00 0.09 0.00 0.00 57.88 58.39 2yqe h LEU 83 Cb 3.33 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 44.03 2yqe h LEU 83 CO -0.01 0.43 -0.49 -1.13 0.09 0.00 0.00 178.44 177.34 2yqe h ASN 84 N -0.92 -1.76 -1.67 -0.43 -1.24 -0.21 0.86 115.58 110.21 2yqe h ASN 84 Ca -0.02 0.26 0.52 0.00 0.71 0.00 0.00 56.30 57.77 2yqe h ASN 84 Cb 0.50 0.77 -0.11 0.00 0.73 0.00 0.00 38.32 40.22 2yqe h ASN 84 CO 0.03 -0.21 1.15 0.00 -1.29 0.00 0.00 177.43 177.11 2yqe n TYR 85 N -4.87 0.33 0.04 0.67 9.36 -1.15 0.17 117.16 121.71 2yqe n TYR 85 Ca 0.01 0.33 -0.19 0.00 3.32 0.00 0.00 57.90 61.37 2yqe n TYR 85 Cb 0.23 -0.80 -0.12 0.00 -0.63 0.00 0.00 39.34 38.02 2yqe n TYR 85 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2yqe h LEU 86 N 0.00 0.62 -0.85 2.98 3.38 0.60 -2.93 115.31 119.11 2yqe h LEU 86 Ca 0.90 -0.82 0.08 0.00 0.09 0.00 0.00 57.88 58.13 2yqe h LEU 86 Cb 3.29 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 43.78 2yqe h LEU 86 CO -0.22 1.37 0.51 0.44 0.09 0.00 0.00 178.44 180.62 2yqe h ASP 87 N -0.05 0.76 0.50 -0.43 5.19 0.26 0.29 116.42 122.94 2yqe h ASP 87 Ca -0.12 0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.30 2yqe h ASP 87 Cb 1.55 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.94 2yqe h ASP 87 CO 0.16 0.46 -0.24 1.56 -3.12 0.00 0.00 179.24 178.06 2yqe h GLN 88 N 0.88 -0.65 -1.00 3.56 7.50 -1.38 -0.60 115.11 123.43 2yqe h GLN 88 Ca 0.39 0.04 0.17 0.00 0.50 0.00 0.00 58.65 59.75 2yqe h GLN 88 Cb 0.28 0.15 -0.10 0.00 0.05 0.00 0.00 27.48 27.86 2yqe h GLN 88 CO -0.21 -0.43 0.62 0.97 -1.50 0.00 0.00 178.83 178.27 2yqe h ILE 89 N -0.88 0.78 -0.49 2.54 2.10 -1.41 -0.58 117.51 119.55 2yqe h ILE 89 Ca -0.07 -0.28 -0.06 0.00 1.08 0.00 0.00 64.86 65.53 2yqe h ILE 89 Cb 0.51 -0.12 -0.02 0.00 -1.09 0.00 0.00 36.82 36.10 2yqe h ILE 89 CO 0.11 0.15 0.09 0.00 -1.08 0.00 0.00 178.15 177.42 2yqe h ALA 90 N 1.61 0.65 -0.09 0.18 0.00 -0.41 -2.33 119.26 118.87 2yqe h ALA 90 Ca 0.55 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.25 2yqe h ALA 90 Cb 0.77 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2yqe h ALA 90 CO -0.33 0.38 0.07 -0.22 0.00 0.00 0.00 179.25 179.15 2yqe h LYS 91 N 0.69 0.00 0.08 0.00 3.64 0.50 0.17 116.57 121.64 2yqe h LYS 91 Ca 0.15 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.24 2yqe h LYS 91 Cb 0.39 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.23 2yqe h LYS 91 CO 0.01 0.00 -1.18 0.35 -2.27 0.00 0.00 179.45 176.36 2yqe h PHE 92 N 0.00 1.01 0.31 1.91 3.57 -1.01 -3.26 116.94 119.47 2yqe h PHE 92 Ca 0.04 -0.61 -0.02 0.00 3.53 0.00 0.00 57.97 60.92 2yqe h PHE 92 Cb 0.18 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2yqe h PHE 92 CO 0.00 1.45 -0.15 -1.49 -2.23 0.00 0.00 178.31 175.89 2yqe h TRP 93 N 0.31 -0.39 -1.25 0.41 4.06 -0.81 -3.05 115.95 115.23 2yqe h TRP 93 Ca -0.17 -0.01 0.45 0.00 2.06 0.00 0.00 58.89 61.22 2yqe h TRP 93 Cb 1.84 0.13 -0.14 0.00 -1.00 0.00 0.00 29.16 29.99 2yqe h TRP 93 CO 0.11 -0.14 0.78 -0.85 -3.56 0.00 0.00 178.44 174.79 2yqe n GLU 94 N -5.05 -0.04 -0.04 0.49 0.28 0.50 0.12 120.64 116.89 2yqe n GLU 94 Ca -0.07 1.24 -0.13 0.00 -0.16 0.00 0.00 57.16 58.04 2yqe n GLU 94 Cb 0.22 -2.39 -0.08 0.00 1.43 0.00 0.00 31.44 30.62 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 1.36 -0.84 3.84 2.04 -1.60 -3.10 117.51 119.21 2yqe h ILE 95 Ca 0.84 -1.28 0.16 0.00 1.00 0.00 0.00 64.86 65.59 2yqe h ILE 95 Cb 2.62 1.95 -0.06 0.00 -0.74 0.00 0.00 36.82 40.59 2yqe h ILE 95 CO -0.51 0.37 0.55 1.56 0.00 0.00 0.00 178.15 180.12 2yqe h GLN 96 N -0.12 0.48 0.00 2.37 1.08 0.11 -3.46 115.11 115.57 2yqe h GLN 96 Ca 0.02 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2yqe h GLN 96 Cb 0.64 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2yqe h GLN 96 CO 0.03 0.32 0.00 0.41 -0.95 0.00 0.00 178.83 178.64 2yqe n GLY 97 N -1.49 1.94 3.86 3.46 0.00 -0.81 -5.11 105.19 107.04 2yqe n GLY 97 Ca 0.17 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 2yqe n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yqe s SER 98 N -0.32 6.67 0.62 1.61 0.01 -1.25 -4.94 113.70 116.10 2yqe s SER 98 Ca 0.00 0.83 -0.11 0.00 1.31 0.00 0.00 55.95 57.98 2yqe s SER 98 Cb 0.00 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 2yqe s SER 98 CO 0.00 0.15 1.03 -0.94 0.41 0.00 0.00 173.24 173.89 2yqe s SER 99 N -1.78 6.14 0.03 2.44 1.04 -1.26 -3.40 113.70 116.90 2yqe s SER 99 Ca 0.34 1.46 -0.19 0.00 0.48 0.00 0.00 55.95 58.05 2yqe s SER 99 Cb -0.14 -2.48 -0.06 0.00 0.10 0.00 0.00 66.02 63.44 2yqe s SER 99 CO 0.18 -0.93 0.54 -0.22 0.98 0.00 0.00 173.24 173.80 2yqe s LEU 100 N -5.14 4.48 0.02 2.42 2.96 -1.26 -4.95 118.68 117.21 2yqe s LEU 100 Ca 0.56 1.16 0.03 0.00 -0.22 0.00 0.00 54.13 55.66 2yqe s LEU 100 Cb -0.11 -2.84 -0.01 0.00 0.50 0.00 0.00 46.19 43.73 2yqe s LEU 100 CO 0.52 0.23 -0.08 -0.75 -1.32 0.00 0.00 176.35 174.95 2yqe s LYS 101 N -0.81 0.60 -0.19 1.98 2.20 -1.26 -5.13 119.74 117.13 2yqe s LYS 101 Ca 0.28 -0.52 -0.04 0.00 -0.36 0.00 0.00 55.97 55.33 2yqe s LYS 101 Cb -0.18 -0.52 -0.02 0.00 -1.51 0.00 0.00 37.83 35.60 2yqe s LYS 101 CO 0.17 0.13 -0.02 0.42 -0.36 0.00 0.00 175.35 175.68 2yqe s ILE 102 N -0.72 3.74 0.71 5.43 1.01 -1.26 -5.11 121.20 125.01 2yqe s ILE 102 Ca -0.02 -0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.11 2yqe s ILE 102 Cb -0.06 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.76 2yqe s ILE 102 CO 0.00 0.44 1.10 -2.16 0.00 0.00 0.00 174.94 174.32 2yqe s PRO 103 N 1.00 2.55 -0.23 2.79 0.04 -1.26 -4.91 135.00 134.98 2yqe s PRO 103 Ca 0.01 1.28 -0.06 0.00 0.04 0.00 0.00 61.00 62.27 2yqe s PRO 103 Cb -0.14 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 2yqe s PRO 103 CO 0.01 -1.43 0.03 -0.80 0.04 0.00 0.00 177.00 174.85 2yqe s ASN 104 N -2.97 4.92 -0.03 6.66 0.01 -1.26 -2.93 114.94 119.34 2yqe s ASN 104 Ca 0.64 -0.23 0.05 0.00 -0.71 0.00 0.00 52.86 52.62 2yqe s ASN 104 Cb -0.19 -1.87 -0.03 0.00 0.41 0.00 0.00 41.25 39.58 2yqe s ASN 104 CO 0.48 -0.00 -0.18 -0.69 -1.51 0.00 0.00 177.10 175.20 2yqe s VAL 105 N 1.40 2.74 -1.38 1.60 1.01 0.12 -4.71 120.40 121.17 2yqe s VAL 105 Ca 0.05 -0.91 -0.08 0.00 0.00 0.00 0.00 61.98 61.04 2yqe s VAL 105 Cb -0.15 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.18 2yqe s VAL 105 CO 0.02 0.55 0.38 -0.62 0.00 0.00 0.00 175.10 175.43 2yqe n GLU 106 N 2.22 -1.83 -3.63 2.72 -0.58 -1.26 0.50 120.64 118.78 2yqe n GLU 106 Ca -0.17 0.26 -0.27 0.00 -0.42 0.00 0.00 57.16 56.57 2yqe n GLU 106 Cb 0.52 -3.87 -0.02 0.00 -0.57 0.00 0.00 31.44 27.50 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 -4.53 -3.11 -3.65 3.49 1.85 -1.26 -4.91 116.66 104.53 2yqe n ARG 107 Ca -0.26 0.39 -0.15 0.00 -1.00 0.00 0.00 57.85 56.83 2yqe n ARG 107 Cb 0.66 -5.08 -0.07 0.00 -1.05 0.00 0.00 32.46 26.92 2yqe n ARG 107 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 2yqe s LYS 108 N -6.28 0.85 0.37 2.89 1.02 0.18 -5.15 119.74 113.63 2yqe s LYS 108 Ca 0.50 -0.04 -0.28 0.00 0.02 0.00 0.00 55.97 56.18 2yqe s LYS 108 Cb -0.27 0.39 -0.11 0.00 -0.52 0.00 0.00 37.83 37.32 2yqe s LYS 108 CO 0.62 -0.26 1.43 -1.50 -0.92 0.00 0.00 175.35 174.72 2yqe s ILE 109 N -1.42 2.24 -0.22 2.17 2.07 -1.26 0.14 121.20 124.91 2yqe s ILE 109 Ca -0.12 0.24 -0.21 0.00 -1.41 0.00 0.00 60.65 59.16 2yqe s ILE 109 Cb -0.03 -3.15 -0.02 0.00 0.13 0.00 0.00 42.46 39.39 2yqe s ILE 109 CO 0.06 0.05 0.64 -0.22 -1.91 0.00 0.00 174.94 173.56 2yqe s LEU 110 N -2.07 4.11 -1.28 8.50 0.20 -1.15 -4.76 118.68 122.23 2yqe s LEU 110 Ca 0.52 0.79 -0.17 0.00 0.69 0.00 0.00 54.13 55.96 2yqe s LEU 110 Cb -0.44 -2.89 0.10 0.00 -0.43 0.00 0.00 46.19 42.53 2yqe s LEU 110 CO 0.60 -0.32 1.68 -0.67 -0.29 0.00 0.00 176.35 177.34 2yqe n ASP 111 N 5.36 4.99 0.28 3.68 -0.08 -1.26 -4.77 116.55 124.76 2yqe n ASP 111 Ca -0.01 -2.93 0.17 0.00 -1.51 0.00 0.00 54.79 50.51 2yqe n ASP 111 Cb 0.49 -1.70 0.96 0.00 2.34 0.00 0.00 41.12 43.21 2yqe n ASP 111 CO 0.00 0.00 0.00 0.17 0.12 0.00 0.00 177.20 177.49 2yqe h LEU 112 N 11.78 0.00 0.46 -2.67 -0.00 -1.97 -2.51 115.31 120.40 2yqe h LEU 112 Ca 0.42 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.28 2yqe h LEU 112 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 2yqe h LEU 112 CO 1.42 0.00 -0.22 0.22 -0.00 0.00 0.00 178.44 179.86 2yqe h TYR 113 N 0.00 -0.57 0.82 0.17 3.20 -1.89 -3.04 116.97 115.67 2yqe h TYR 113 Ca 0.02 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2yqe h TYR 113 Cb 0.17 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.63 2yqe h TYR 113 CO 0.00 -0.25 -0.49 0.77 -1.64 0.00 0.00 178.16 176.55 2yqe h SER 114 N -0.88 -1.23 -0.11 -2.11 0.02 -1.87 -2.31 113.55 105.07 2yqe h SER 114 Ca -0.06 0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2yqe h SER 114 Cb 0.58 0.35 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 2yqe h SER 114 CO 0.10 -0.76 -0.07 -0.11 -1.14 0.00 0.00 176.83 174.85 2yqe n LEU 115 N -5.63 -0.12 -0.12 5.07 7.94 -1.05 -0.25 117.00 122.84 2yqe n LEU 115 Ca -0.15 0.81 -0.08 0.00 -1.11 0.00 0.00 56.01 55.48 2yqe n LEU 115 Cb 0.51 -0.33 -0.02 0.00 0.53 0.00 0.00 43.42 44.11 2yqe n LEU 115 CO 0.36 -0.47 0.63 -1.28 -1.11 0.00 0.00 177.39 175.52 2yqe h SER 116 N 0.00 -1.12 -0.51 1.96 0.87 -1.54 -1.49 113.55 111.73 2yqe h SER 116 Ca 0.02 0.19 0.09 0.00 -1.23 0.00 0.00 61.79 60.86 2yqe h SER 116 Cb 0.05 0.52 -0.10 0.00 -0.44 0.00 0.00 62.40 62.42 2yqe h SER 116 CO -0.10 -0.33 -0.35 0.11 -0.53 0.00 0.00 176.83 175.63 2yqe h LYS 117 N -0.26 -0.21 -0.16 2.24 1.79 -0.07 0.54 116.57 120.43 2yqe h LYS 117 Ca 0.17 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.70 2yqe h LYS 117 Cb 0.54 0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.18 2yqe h LYS 117 CO -0.54 -0.14 -0.29 0.82 -1.08 0.00 0.00 179.45 178.23 2yqe h ILE 118 N -0.22 0.34 0.35 1.86 2.04 0.34 -1.73 117.51 120.49 2yqe h ILE 118 Ca 0.20 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.05 2yqe h ILE 118 Cb 0.55 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2yqe h ILE 118 CO -0.62 0.00 -0.52 0.58 0.00 0.00 0.00 178.15 177.58 2yqe h VAL 119 N -0.34 0.00 -0.92 1.67 2.07 -0.33 0.18 116.25 118.58 2yqe h VAL 119 Ca 0.11 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.89 2yqe h VAL 119 Cb 0.51 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.12 2yqe h VAL 119 CO -0.35 0.00 0.18 0.40 0.02 0.00 0.00 177.57 177.82 2yqe h ILE 120 N -0.91 0.19 -0.07 4.57 2.04 -0.69 0.13 117.51 122.78 2yqe h ILE 120 Ca -0.04 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 2yqe h ILE 120 Cb 0.83 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2yqe h ILE 120 CO -0.16 0.02 -0.04 -0.33 0.00 0.00 0.00 178.15 177.65 2yqe h GLU 121 N 0.11 0.14 -0.94 2.37 4.39 -0.64 -3.12 114.58 116.90 2yqe h GLU 121 Ca 0.59 -0.06 0.27 0.00 0.34 0.00 0.00 59.36 60.50 2yqe h GLU 121 Cb 1.25 -0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.75 2yqe h GLU 121 CO -0.76 0.52 0.37 0.93 -1.16 0.00 0.00 179.01 178.92 2yqe h GLU 122 N -0.25 0.24 0.00 2.33 5.08 0.21 -3.43 114.58 118.76 2yqe h GLU 122 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2yqe h GLU 122 Cb 0.48 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.68 2yqe h GLU 122 CO 0.01 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.59 2yqe n GLY 123 N -1.34 0.00 0.21 -3.84 0.00 -0.74 -4.92 105.19 94.56 2yqe n GLY 123 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 -3.16 0.14 -0.02 0.00 -1.11 -3.97 105.19 97.06 2yqe n GLY 124 Ca 0.00 -1.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.00 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 0.56 -0.29 1.61 5.03 -1.94 -3.25 116.97 118.69 2yqe h TYR 125 Ca 0.00 -0.41 -0.03 0.00 2.58 0.00 0.00 58.73 60.87 2yqe h TYR 125 Cb 0.00 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.24 2yqe h TYR 125 CO 0.00 1.66 0.04 0.93 -1.32 0.00 0.00 178.16 179.47 2yqe h GLU 126 N -0.07 0.42 0.01 1.82 5.08 -1.98 -0.84 114.58 119.02 2yqe h GLU 126 Ca -0.35 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2yqe h GLU 126 Cb 1.95 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.13 2yqe h GLU 126 CO 0.11 0.42 -0.00 0.00 -1.00 0.00 0.00 179.01 178.53 2yqe h ALA 127 N 1.64 -0.61 -0.92 3.43 0.00 -1.70 -0.95 119.26 120.14 2yqe h ALA 127 Ca 0.10 -0.00 0.24 0.00 0.00 0.00 0.00 54.91 55.25 2yqe h ALA 127 Cb 0.21 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2yqe h ALA 127 CO 0.00 -0.61 0.64 -0.84 0.00 0.00 0.00 179.25 178.43 2yqe h ILE 128 N -0.02 0.59 -0.34 0.00 -0.00 -1.60 0.14 117.51 116.27 2yqe h ILE 128 Ca -0.00 -0.07 -0.13 0.00 -0.00 0.00 0.00 64.86 64.66 2yqe h ILE 128 Cb 0.01 0.38 -0.01 0.00 -0.00 0.00 0.00 36.82 37.20 2yqe h ILE 128 CO 0.00 0.04 -0.31 0.00 -0.00 0.00 0.00 178.15 177.88 2yqe h LYS 130 N 0.59 0.00 -0.65 0.00 1.57 0.68 -2.17 116.57 116.59 2yqe h LYS 130 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2yqe h LYS 130 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 2yqe h LYS 130 CO 0.08 0.29 0.00 -0.25 -0.57 0.00 0.00 179.45 178.99 2yqe n ASP 131 N -3.91 4.55 -4.22 0.86 8.00 -0.63 -4.96 116.55 116.24 2yqe n ASP 131 Ca -0.02 -2.36 -0.31 0.00 0.71 0.00 0.00 54.79 52.81 2yqe n ASP 131 Cb 0.36 -0.55 -0.09 0.00 -0.02 0.00 0.00 41.12 40.82 2yqe n ASP 131 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2yqe n ARG 132 N 1.18 -0.88 0.00 -1.24 1.74 -0.54 -4.78 116.66 112.14 2yqe n ARG 132 Ca 0.25 0.08 0.14 0.00 -0.77 0.00 0.00 57.85 57.56 2yqe n ARG 132 Cb 0.83 -3.31 0.66 0.00 -1.02 0.00 0.00 32.46 29.62 2yqe n ARG 132 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2yqe n ARG 133 N -4.47 0.82 -0.35 5.56 5.12 0.31 -4.05 116.66 119.60 2yqe n ARG 133 Ca -0.30 -0.26 0.24 0.00 -1.93 0.00 0.00 57.85 55.60 2yqe n ARG 133 Cb 0.66 -1.49 0.48 0.00 -1.16 0.00 0.00 32.46 30.94 2yqe n ARG 133 CO 0.00 0.00 0.00 -1.49 -1.93 0.00 0.00 177.63 174.21 2yqe h TRP 134 N 0.62 0.87 0.24 -1.55 4.06 -1.87 0.98 115.95 119.31 2yqe h TRP 134 Ca 0.00 0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.98 2yqe h TRP 134 Cb 0.31 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.22 2yqe h TRP 134 CO 0.00 -0.09 -0.22 0.00 -3.56 0.00 0.00 178.44 174.57 2yqe h ALA 135 N 1.76 -0.47 -0.23 1.49 0.00 -1.95 -1.56 119.26 118.30 2yqe h ALA 135 Ca 0.70 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.52 2yqe h ALA 135 Cb 1.64 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 2yqe h ALA 135 CO -0.51 -0.79 0.06 0.00 0.00 0.00 0.00 179.25 178.00 2yqe h ARG 136 N -0.49 0.36 -0.99 0.00 2.47 -1.24 -2.36 114.38 112.13 2yqe h ARG 136 Ca -0.01 -0.09 0.22 0.00 -1.26 0.00 0.00 59.98 58.85 2yqe h ARG 136 Cb 0.45 -0.05 -0.09 0.00 -1.65 0.00 0.00 29.97 28.63 2yqe h ARG 136 CO -0.04 0.47 0.63 0.28 0.56 0.00 0.00 179.97 181.87 2yqe h VAL 137 N 0.19 0.62 -0.02 2.04 2.07 -0.78 0.26 116.25 120.64 2yqe h VAL 137 Ca 0.07 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2yqe h VAL 137 Cb 0.27 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 2yqe h VAL 137 CO 0.00 0.10 -0.04 0.00 0.02 0.00 0.00 177.57 177.65 2yqe h ALA 138 N 1.63 0.03 -0.05 1.67 0.00 -1.02 -3.12 119.26 118.41 2yqe h ALA 138 Ca 0.56 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 55.17 2yqe h ALA 138 Cb 1.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2yqe h ALA 138 CO -0.31 -0.14 0.06 1.96 0.00 0.00 0.00 179.25 180.82 2yqe h GLN 139 N -0.52 0.00 -0.04 0.00 4.20 -0.71 -0.70 115.11 117.34 2yqe h GLN 139 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2yqe h GLN 139 Cb 0.64 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2yqe h GLN 139 CO 0.01 0.00 -0.12 0.00 -0.67 0.00 0.00 178.83 178.05 2yqe h ARG 140 N 0.00 0.07 -0.91 1.46 2.47 -0.93 -1.59 114.38 114.94 2yqe h ARG 140 Ca 0.02 -0.01 -0.20 0.00 -1.26 0.00 0.00 59.98 58.53 2yqe h ARG 140 Cb 0.14 -0.01 -0.12 0.00 -1.65 0.00 0.00 29.97 28.33 2yqe h ARG 140 CO -0.00 0.19 0.25 -0.11 0.56 0.00 0.00 179.97 180.86 2yqe n LEU 141 N -4.36 4.69 -3.52 3.04 7.94 -0.27 -4.87 117.00 119.65 2yqe n LEU 141 Ca -0.02 -2.44 -0.19 0.00 -1.11 0.00 0.00 56.01 52.25 2yqe n LEU 141 Cb 0.21 -0.67 0.07 0.00 0.53 0.00 0.00 43.42 43.56 2yqe n LEU 141 CO 0.36 0.70 0.03 1.41 -1.11 0.00 0.00 177.39 178.78 2yqe n HIS 142 N -0.17 -2.10 -3.99 1.96 8.25 -0.60 -5.00 115.22 113.57 2yqe n HIS 142 Ca 0.28 0.89 -0.29 0.00 -0.26 0.00 0.00 57.72 58.34 2yqe n HIS 142 Cb 1.05 -4.72 -0.05 0.00 1.12 0.00 0.00 29.99 27.39 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 -3.48 3.35 -0.34 4.41 2.02 -1.22 -5.04 117.35 117.05 2yqe s TYR 143 Ca 0.05 0.13 -0.29 0.00 -0.37 0.00 0.00 57.07 56.59 2yqe s TYR 143 Cb -0.01 -1.66 -0.01 0.00 -0.40 0.00 0.00 41.96 39.88 2yqe s TYR 143 CO 0.76 0.54 1.69 -1.25 -1.57 0.00 0.00 175.55 175.73 2yqe s PRO 144 N -2.69 3.43 0.14 -1.71 0.04 -1.26 -4.63 135.00 128.33 2yqe s PRO 144 Ca 0.32 1.33 -0.31 0.00 0.04 0.00 0.00 61.00 62.39 2yqe s PRO 144 Cb -0.12 -4.14 -0.08 0.00 0.04 0.00 0.00 34.50 30.20 2yqe s PRO 144 CO 0.25 -1.74 1.34 -1.25 0.04 0.00 0.00 177.00 175.65 2yqe s PRO 145 N 5.40 4.35 0.00 0.56 0.04 -1.26 -3.96 135.00 140.14 2yqe s PRO 145 Ca 0.75 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.83 2yqe s PRO 145 Cb -0.21 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2yqe s PRO 145 CO 0.33 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.43 2yqe n GLY 146 N 3.07 3.35 3.22 0.56 0.00 -1.26 -5.11 105.19 109.01 2yqe n GLY 146 Ca 0.09 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2yqe n GLY 146 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yqe n LYS 147 N 0.00 -4.94 -1.20 1.61 4.76 -1.25 -4.87 118.16 112.26 2yqe n LYS 147 Ca 0.00 -1.47 -0.26 0.00 -2.87 0.00 0.00 58.31 53.71 2yqe n LYS 147 Cb 0.00 -1.92 0.04 0.00 -1.84 0.00 0.00 35.03 31.31 2yqe n LYS 147 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2yqe n ASN 148 N -5.83 6.97 0.03 4.39 4.13 -1.26 -4.61 115.26 119.08 2yqe n ASN 148 Ca 0.14 -3.39 -0.12 0.00 1.68 0.00 0.00 54.58 52.90 2yqe n ASN 148 Cb 0.61 -1.06 -0.06 0.00 -1.54 0.00 0.00 39.78 37.72 2yqe n ASN 148 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2yqe h ILE 149 N 1.22 0.97 -0.81 2.41 2.04 -1.91 -3.10 117.51 118.33 2yqe h ILE 149 Ca 0.43 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.38 2yqe h ILE 149 Cb 0.78 0.97 -0.10 0.00 -0.74 0.00 0.00 36.82 37.72 2yqe h ILE 149 CO 1.11 0.00 -0.45 0.61 0.00 0.00 0.00 178.15 179.42 2yqe n GLY 150 N -1.11 -2.02 0.47 5.37 0.00 -1.26 -0.86 105.19 105.77 2yqe n GLY 150 Ca -0.06 0.95 -0.16 0.00 0.00 0.00 0.00 46.02 46.75 2yqe n GLY 150 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2yqe h SER 151 N 0.00 -1.51 -0.95 1.61 0.87 -1.93 -1.60 113.55 110.04 2yqe h SER 151 Ca 0.16 0.15 0.19 0.00 -1.23 0.00 0.00 61.79 61.07 2yqe h SER 151 Cb 0.36 0.55 -0.18 0.00 -0.44 0.00 0.00 62.40 62.69 2yqe h SER 151 CO -0.77 -0.55 -0.23 -0.11 -0.53 0.00 0.00 176.83 174.64 2yqe n LEU 152 N -5.35 -0.33 0.22 2.23 0.00 -0.04 -1.21 117.00 112.51 2yqe n LEU 152 Ca -0.09 1.63 -0.09 0.00 0.00 0.00 0.00 56.01 57.47 2yqe n LEU 152 Cb 0.40 -0.50 -0.04 0.00 0.00 0.00 0.00 43.42 43.28 2yqe n LEU 152 CO 0.16 -1.57 0.52 -0.07 0.00 0.00 0.00 177.39 176.43 2yqe h LEU 153 N 0.00 -0.48 -0.92 -1.96 3.38 -0.64 -1.60 115.31 113.10 2yqe h LEU 153 Ca 0.46 0.02 0.38 0.00 0.09 0.00 0.00 57.88 58.83 2yqe h LEU 153 Cb 0.71 0.13 -0.16 0.00 0.09 0.00 0.00 40.66 41.42 2yqe h LEU 153 CO -0.97 -0.34 0.49 -1.14 0.09 0.00 0.00 178.44 176.57 2yqe n ARG 154 N -3.51 -0.06 0.12 1.13 0.63 -0.46 -0.98 116.66 113.54 2yqe n ARG 154 Ca -0.07 1.26 -0.05 0.00 -0.92 0.00 0.00 57.85 58.08 2yqe n ARG 154 Cb 0.22 -2.27 -0.02 0.00 0.45 0.00 0.00 32.46 30.84 2yqe n ARG 154 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 2yqe h SER 155 N 0.00 -0.28 -1.59 6.15 0.02 -0.90 -1.27 113.55 115.69 2yqe h SER 155 Ca 0.78 0.01 0.46 0.00 -0.84 0.00 0.00 61.79 62.20 2yqe h SER 155 Cb 2.05 0.07 -0.06 0.00 0.14 0.00 0.00 62.40 64.60 2yqe h SER 155 CO -0.71 -0.14 1.17 0.45 -1.14 0.00 0.00 176.83 176.47 2yqe h HIS 156 N -0.45 0.00 0.11 3.45 3.86 -0.05 1.67 115.15 123.74 2yqe h HIS 156 Ca -0.03 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.91 2yqe h HIS 156 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.73 2yqe h HIS 156 CO 0.10 0.00 -1.21 -0.92 0.86 0.00 0.00 177.93 176.76 2yqe h TYR 157 N 0.00 0.49 -0.00 2.45 5.03 -1.03 0.27 116.97 124.19 2yqe h TYR 157 Ca 0.75 -0.35 0.00 0.00 2.58 0.00 0.00 58.73 61.71 2yqe h TYR 157 Cb 3.09 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 41.34 2yqe h TYR 157 CO 0.00 1.26 -0.44 0.39 -1.32 0.00 0.00 178.16 178.05 2yqe n GLU 158 N -3.55 0.02 -0.12 1.82 1.02 0.50 0.14 120.64 120.47 2yqe n GLU 158 Ca -0.08 -0.01 -0.16 0.00 -0.02 0.00 0.00 57.16 56.89 2yqe n GLU 158 Cb 1.00 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.82 2yqe n GLU 158 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2yqe n ARG 159 N -1.48 0.59 -0.07 3.49 5.12 0.28 -4.28 116.66 120.29 2yqe n ARG 159 Ca 0.06 0.13 -0.15 0.00 -1.93 0.00 0.00 57.85 55.96 2yqe n ARG 159 Cb 0.34 -1.46 -0.05 0.00 -1.16 0.00 0.00 32.46 30.12 2yqe n ARG 159 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2yqe n ILE 160 N -3.17 0.78 1.85 0.55 5.41 0.05 -4.55 119.36 120.27 2yqe n ILE 160 Ca -0.41 -0.20 0.10 0.00 1.00 0.00 0.00 62.75 63.24 2yqe n ILE 160 Cb 0.94 -1.68 0.59 0.00 -0.71 0.00 0.00 39.64 38.77 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 -3.62 0.00 0.16 1.39 5.41 -0.67 -3.64 119.36 118.39 2yqe n ILE 161 Ca -0.28 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.40 2yqe n ILE 161 Cb 0.70 -0.37 -0.04 0.00 -0.71 0.00 0.00 39.64 39.22 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 -0.45 -0.03 1.39 3.20 0.11 -3.11 116.97 118.09 2yqe h TYR 162 Ca 0.00 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 2yqe h TYR 162 Cb 0.00 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 2yqe h TYR 162 CO 0.00 -0.28 -0.03 -1.00 -1.64 0.00 0.00 178.16 175.22 2yqe h PRO 163 N -1.08 0.06 -1.04 1.82 0.13 -1.85 -2.36 132.00 127.69 2yqe h PRO 163 Ca -0.05 -0.03 0.27 0.00 -0.87 0.00 0.00 66.00 65.32 2yqe h PRO 163 Cb 0.37 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.39 2yqe h PRO 163 CO 0.08 0.53 0.64 -0.92 -0.23 0.00 0.00 178.00 178.11 2yqe h TYR 164 N -0.41 0.81 0.17 1.56 3.20 -1.74 0.38 116.97 120.94 2yqe h TYR 164 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2yqe h TYR 164 Cb 0.52 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.56 2yqe h TYR 164 CO 0.09 0.04 -0.08 0.93 -1.64 0.00 0.00 178.16 177.51 2yqe h GLU 165 N 0.46 -0.21 -1.12 1.82 4.39 -1.52 -2.12 114.58 116.27 2yqe h GLU 165 Ca 0.63 0.01 0.32 0.00 0.34 0.00 0.00 59.36 60.67 2yqe h GLU 165 Cb 1.44 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 30.09 2yqe h GLU 165 CO -0.39 -0.14 0.79 0.00 -1.16 0.00 0.00 179.01 178.11 2yqe h MET 166 N -0.74 0.06 -0.02 2.33 -0.00 -1.00 0.12 114.93 115.68 2yqe h MET 166 Ca -0.02 -0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.60 2yqe h MET 166 Cb 0.17 -0.01 0.01 0.00 -0.00 0.00 0.00 31.60 31.76 2yqe h MET 166 CO 0.04 0.04 -0.30 0.35 -0.00 0.00 0.00 176.91 177.04 2yqe h PHE 167 N 0.06 0.33 -0.65 -0.10 3.04 -0.32 -3.30 116.94 116.00 2yqe h PHE 167 Ca 0.55 -0.17 0.07 0.00 3.98 0.00 0.00 57.97 62.40 2yqe h PHE 167 Cb 2.07 -0.04 -0.06 0.00 2.56 0.00 0.00 35.95 40.48 2yqe h PHE 167 CO -0.00 0.95 0.34 1.96 -2.02 0.00 0.00 178.31 179.54 2yqe h GLN 168 N -0.39 0.60 -6.01 1.11 1.08 -0.10 -3.36 115.11 108.05 2yqe h GLN 168 Ca -0.03 -0.04 -0.47 0.00 -1.45 0.00 0.00 58.65 56.66 2yqe h GLN 168 Cb 1.02 -0.14 -0.06 0.00 -0.05 0.00 0.00 27.48 28.25 2yqe h GLN 168 CO 0.06 0.40 1.15 0.45 -0.95 0.00 0.00 178.83 179.94 2yqe s SER 169 N -5.55 5.64 0.00 1.46 0.15 -0.57 -4.44 113.70 110.39 2yqe s SER 169 Ca -0.13 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.10 2yqe s SER 169 Cb 0.16 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2yqe s SER 169 CO 0.76 -2.21 0.00 0.61 1.20 0.00 0.00 173.24 173.59 2yqe n GLY 170 N 6.15 -1.61 0.18 9.45 0.00 -1.26 -4.92 105.19 113.19 2yqe n GLY 170 Ca 0.24 0.73 0.15 0.00 0.00 0.00 0.00 46.02 47.15 2yqe n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32