#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqe s SER 73 N 0.00 0.25 -0.18 1.61 1.04 -1.26 -5.17 113.70 109.99 2yqe s SER 73 Ca 0.00 -1.27 -0.08 0.00 0.48 0.00 0.00 55.95 55.08 2yqe s SER 73 Cb 0.00 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.68 2yqe s SER 73 CO 0.00 -1.00 0.40 -0.94 0.98 0.00 0.00 173.24 172.68 2yqe s SER 74 N -3.14 -0.31 0.00 7.02 1.04 -1.26 -5.05 113.70 112.00 2yqe s SER 74 Ca 0.33 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.67 2yqe s SER 74 Cb 0.03 1.04 0.00 0.00 0.10 0.00 0.00 66.02 67.19 2yqe s SER 74 CO 0.13 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.74 2yqe n GLY 75 N 4.90 -0.59 3.95 7.32 0.00 -1.26 -5.13 105.19 114.37 2yqe n GLY 75 Ca -0.15 0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 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 -4.00 3.65 0.29 1.61 0.15 -1.26 -5.01 113.70 109.14 2yqe s SER 76 Ca 0.00 0.10 -0.29 0.00 0.70 0.00 0.00 55.95 56.46 2yqe s SER 76 Cb 0.00 -0.30 -0.10 0.00 -1.71 0.00 0.00 66.02 63.90 2yqe s SER 76 CO 0.00 -2.36 1.43 -0.55 1.20 0.00 0.00 173.24 172.96 2yqe s SER 77 N -4.81 6.61 0.00 5.45 0.15 -1.26 -4.96 113.70 114.87 2yqe s SER 77 Ca 0.70 2.76 0.00 0.00 0.70 0.00 0.00 55.95 60.11 2yqe s SER 77 Cb -0.05 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.62 2yqe s SER 77 CO 0.50 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2yqe n GLY 78 N 1.58 4.74 1.97 9.45 0.00 -1.26 -4.99 105.19 116.67 2yqe n GLY 78 Ca 0.04 -0.65 -0.18 0.00 0.00 0.00 0.00 46.02 45.23 2yqe n GLY 78 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2yqe n THR 79 N 0.00 2.87 0.08 2.61 5.66 -1.26 -4.48 114.28 119.75 2yqe n THR 79 Ca 0.00 -1.83 -0.07 0.00 -3.05 0.00 0.00 64.05 59.09 2yqe n THR 79 Cb 0.00 -1.36 -0.05 0.00 -1.55 0.00 0.00 70.33 67.37 2yqe n THR 79 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 2yqe h ARG 80 N 1.66 -0.28 0.22 1.09 2.47 -1.97 -3.31 114.38 114.26 2yqe h ARG 80 Ca 0.31 0.02 -0.35 0.00 -1.26 0.00 0.00 59.98 58.70 2yqe h ARG 80 Cb 0.89 0.06 0.02 0.00 -1.65 0.00 0.00 29.97 29.30 2yqe h ARG 80 CO 0.80 -0.02 -1.62 0.28 0.56 0.00 0.00 179.97 179.96 2yqe h VAL 81 N -1.02 1.11 -0.74 2.04 2.07 -2.02 -3.30 116.25 114.39 2yqe h VAL 81 Ca -0.03 -2.61 0.21 0.00 0.82 0.00 0.00 66.70 65.09 2yqe h VAL 81 Cb 0.39 2.90 -0.03 0.00 -1.52 0.00 0.00 31.29 33.03 2yqe h VAL 81 CO 0.05 0.84 0.88 0.50 0.02 0.00 0.00 177.57 179.85 2yqe h LYS 82 N 0.13 0.00 0.09 1.57 1.63 -1.82 0.37 116.57 118.54 2yqe h LYS 82 Ca -0.30 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 59.29 2yqe h LYS 82 Cb 2.14 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 33.76 2yqe h LYS 82 CO 0.23 0.00 -1.02 -0.07 -3.45 0.00 0.00 179.45 175.13 2yqe h LEU 83 N 0.00 0.28 -0.65 5.20 3.38 -1.65 -3.33 115.31 118.53 2yqe h LEU 83 Ca 0.35 -0.85 0.13 0.00 0.09 0.00 0.00 57.88 57.60 2yqe h LEU 83 Cb 2.10 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 42.64 2yqe h LEU 83 CO -0.00 1.45 -0.24 -1.13 0.09 0.00 0.00 178.44 178.61 2yqe h ASN 84 N -0.53 -0.85 -0.72 -0.43 -1.24 -0.35 0.55 115.58 112.00 2yqe h ASN 84 Ca -0.22 0.22 0.13 0.00 0.71 0.00 0.00 56.30 57.13 2yqe h ASN 84 Cb 1.54 0.49 -0.05 0.00 0.73 0.00 0.00 38.32 41.03 2yqe h ASN 84 CO 0.03 -0.26 0.48 0.22 -1.29 0.00 0.00 177.43 176.61 2yqe h TYR 85 N -0.06 0.52 0.21 0.67 3.20 -1.65 0.30 116.97 120.15 2yqe h TYR 85 Ca 0.29 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.17 2yqe h TYR 85 Cb 0.53 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2yqe h TYR 85 CO -0.59 0.22 -0.10 -0.07 -1.64 0.00 0.00 178.16 175.98 2yqe h LEU 86 N 0.46 -0.23 -1.77 2.82 3.38 -0.12 -2.40 115.31 117.44 2yqe h LEU 86 Ca 0.35 0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.52 2yqe h LEU 86 Cb 0.72 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 2yqe h LEU 86 CO -0.11 0.03 0.55 0.44 0.09 0.00 0.00 178.44 179.43 2yqe h ASP 87 N -0.67 0.20 0.06 -0.43 3.32 -0.80 0.60 116.42 118.70 2yqe h ASP 87 Ca -0.03 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2yqe h ASP 87 Cb 0.21 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2yqe h ASP 87 CO 0.05 0.09 -0.03 1.56 -1.72 0.00 0.00 179.24 179.18 2yqe h GLN 88 N 0.20 -0.08 -1.00 3.56 1.08 -0.47 -0.11 115.11 118.30 2yqe h GLN 88 Ca 0.39 0.01 0.20 0.00 -1.45 0.00 0.00 58.65 57.79 2yqe h GLN 88 Cb 1.23 0.02 -0.10 0.00 -0.05 0.00 0.00 27.48 28.58 2yqe h GLN 88 CO -0.08 -0.05 0.61 0.97 -0.95 0.00 0.00 178.83 179.33 2yqe h ILE 89 N -0.11 0.69 -0.61 2.54 2.10 -1.19 0.46 117.51 121.38 2yqe h ILE 89 Ca -0.01 -0.24 -0.08 0.00 1.08 0.00 0.00 64.86 65.61 2yqe h ILE 89 Cb 0.06 -0.08 -0.02 0.00 -1.09 0.00 0.00 36.82 35.69 2yqe h ILE 89 CO 0.01 0.13 0.07 0.00 -1.08 0.00 0.00 178.15 177.28 2yqe h ALA 90 N 1.64 0.81 -0.01 0.18 0.00 -0.93 -2.30 119.26 118.65 2yqe h ALA 90 Ca 0.57 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2yqe h ALA 90 Cb 0.97 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2yqe h ALA 90 CO -0.36 0.59 0.02 -0.22 0.00 0.00 0.00 179.25 179.28 2yqe h LYS 91 N 0.93 0.00 0.13 0.00 3.64 0.11 0.32 116.57 121.69 2yqe h LYS 91 Ca 0.18 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.24 2yqe h LYS 91 Cb 0.47 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2yqe h LYS 91 CO 0.02 0.00 -1.59 0.35 -2.27 0.00 0.00 179.45 175.96 2yqe h PHE 92 N 0.00 0.50 0.07 1.91 3.57 -1.08 -3.35 116.94 118.56 2yqe h PHE 92 Ca 0.00 -0.37 -0.00 0.00 3.53 0.00 0.00 57.97 61.14 2yqe h PHE 92 Cb 0.04 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.76 2yqe h PHE 92 CO 0.00 1.44 -0.03 -1.49 -2.23 0.00 0.00 178.31 176.00 2yqe h TRP 93 N 0.08 -0.08 -1.12 0.41 4.06 -0.82 -3.17 115.95 115.31 2yqe h TRP 93 Ca -0.27 -0.00 0.33 0.00 2.06 0.00 0.00 58.89 61.01 2yqe h TRP 93 Cb 2.03 0.03 -0.04 0.00 -1.00 0.00 0.00 29.16 30.18 2yqe h TRP 93 CO 0.07 0.24 1.22 -0.85 -3.56 0.00 0.00 178.44 175.56 2yqe n GLU 94 N -4.80 0.01 -0.08 0.49 0.28 0.10 0.10 120.64 116.75 2yqe n GLU 94 Ca -0.04 1.00 -0.15 0.00 -0.16 0.00 0.00 57.16 57.81 2yqe n GLU 94 Cb 0.18 -2.47 -0.12 0.00 1.43 0.00 0.00 31.44 30.46 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 1.58 -1.05 3.84 2.04 -1.70 -3.32 117.51 118.90 2yqe h ILE 95 Ca 0.53 -2.27 0.28 0.00 1.00 0.00 0.00 64.86 64.40 2yqe h ILE 95 Cb 2.96 3.07 -0.07 0.00 -0.74 0.00 0.00 36.82 42.04 2yqe h ILE 95 CO -0.01 0.54 0.71 1.56 0.00 0.00 0.00 178.15 180.95 2yqe h GLN 96 N -1.00 0.25 0.00 2.37 1.08 0.71 -3.45 115.11 115.08 2yqe h GLN 96 Ca -0.06 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 2yqe h GLN 96 Cb 1.02 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 2yqe h GLN 96 CO -0.04 0.16 0.00 0.41 -0.95 0.00 0.00 178.83 178.42 2yqe n GLY 97 N -1.57 1.27 3.45 3.46 0.00 -0.92 -5.09 105.19 105.78 2yqe n GLY 97 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.73 5.60 1.10 1.61 0.01 -1.25 -4.97 113.70 115.07 2yqe s SER 98 Ca 0.00 -0.52 -0.17 0.00 1.31 0.00 0.00 55.95 56.57 2yqe s SER 98 Cb 0.00 -2.01 0.13 0.00 0.21 0.00 0.00 66.02 64.35 2yqe s SER 98 CO 0.00 -0.20 0.27 -0.24 0.41 0.00 0.00 173.24 173.48 2yqe n SER 99 N 4.99 -2.15 -4.67 2.44 2.88 -1.26 -3.85 113.62 111.99 2yqe n SER 99 Ca -0.14 -0.05 -0.41 0.00 -1.33 0.00 0.00 58.87 56.94 2yqe n SER 99 Cb 0.49 -1.06 -0.04 0.00 -0.75 0.00 0.00 64.21 62.85 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 -2.47 4.19 -0.05 2.46 2.96 -1.26 -4.84 118.68 119.68 2yqe s LEU 100 Ca 0.59 1.13 0.04 0.00 -0.22 0.00 0.00 54.13 55.67 2yqe s LEU 100 Cb -0.16 -3.17 -0.00 0.00 0.50 0.00 0.00 46.19 43.36 2yqe s LEU 100 CO 0.66 -0.34 -0.17 -0.75 -1.32 0.00 0.00 176.35 174.43 2yqe s LYS 101 N 1.93 1.84 -0.17 1.98 2.20 -1.26 -5.11 119.74 121.14 2yqe s LYS 101 Ca 0.37 -0.60 -0.05 0.00 -0.36 0.00 0.00 55.97 55.33 2yqe s LYS 101 Cb -0.17 -1.57 -0.03 0.00 -1.51 0.00 0.00 37.83 34.55 2yqe s LYS 101 CO 0.13 0.22 0.00 0.42 -0.36 0.00 0.00 175.35 175.76 2yqe s ILE 102 N 0.11 4.23 1.13 5.43 1.01 -1.26 -5.11 121.20 126.74 2yqe s ILE 102 Ca -0.06 -0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.19 2yqe s ILE 102 Cb -0.12 -2.88 0.25 0.00 0.01 0.00 0.00 42.46 39.72 2yqe s ILE 102 CO 0.03 0.48 1.10 -2.16 0.00 0.00 0.00 174.94 174.39 2yqe s PRO 103 N 0.40 -0.62 -0.22 2.79 0.04 -1.26 -4.96 135.00 131.17 2yqe s PRO 103 Ca -0.01 0.15 0.01 0.00 0.04 0.00 0.00 61.00 61.19 2yqe s PRO 103 Cb -0.14 -1.65 0.05 0.00 0.04 0.00 0.00 34.50 32.81 2yqe s PRO 103 CO 0.02 -3.35 -0.08 -0.80 0.04 0.00 0.00 177.00 172.83 2yqe s ASN 104 N -3.71 3.71 -0.10 6.66 -0.87 -1.26 -3.61 114.94 115.76 2yqe s ASN 104 Ca 0.69 -1.08 0.02 0.00 -1.57 0.00 0.00 52.86 50.92 2yqe s ASN 104 Cb -0.13 -1.23 -0.02 0.00 -0.02 0.00 0.00 41.25 39.85 2yqe s ASN 104 CO 0.57 -0.20 -0.16 -0.69 -2.57 0.00 0.00 177.10 174.05 2yqe s VAL 105 N 1.37 2.87 -1.13 1.60 1.01 -0.63 -4.70 120.40 120.80 2yqe s VAL 105 Ca -0.04 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 2yqe s VAL 105 Cb -0.18 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2yqe s VAL 105 CO -0.07 0.55 0.96 -0.62 0.00 0.00 0.00 175.10 175.92 2yqe n GLU 106 N 3.13 -4.55 -3.70 2.72 -0.58 -1.26 -2.24 120.64 114.16 2yqe n GLU 106 Ca -0.18 0.86 -0.27 0.00 -0.42 0.00 0.00 57.16 57.14 2yqe n GLU 106 Cb 0.52 -5.84 -0.05 0.00 -0.57 0.00 0.00 31.44 25.50 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 -3.70 -1.39 -3.57 3.49 1.85 -1.26 -4.84 116.66 107.24 2yqe n ARG 107 Ca -0.19 0.09 -0.15 0.00 -1.00 0.00 0.00 57.85 56.61 2yqe n ARG 107 Cb 0.65 -4.29 -0.06 0.00 -1.05 0.00 0.00 32.46 27.72 2yqe n ARG 107 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2yqe s LYS 108 N -6.09 1.02 0.33 2.89 2.47 -0.95 -5.14 119.74 114.26 2yqe s LYS 108 Ca 0.53 -0.14 -0.29 0.00 -1.56 0.00 0.00 55.97 54.51 2yqe s LYS 108 Cb -0.31 0.47 -0.11 0.00 -1.46 0.00 0.00 37.83 36.42 2yqe s LYS 108 CO 0.66 -0.36 1.56 -1.50 0.16 0.00 0.00 175.35 175.87 2yqe s ILE 109 N -2.17 2.04 0.26 5.43 2.07 -1.26 -1.61 121.20 125.96 2yqe s ILE 109 Ca -0.07 0.03 -0.29 0.00 -1.41 0.00 0.00 60.65 58.91 2yqe s ILE 109 Cb -0.01 -3.02 -0.09 0.00 0.13 0.00 0.00 42.46 39.47 2yqe s ILE 109 CO 0.01 0.01 0.98 -0.22 -1.91 0.00 0.00 174.94 173.80 2yqe s LEU 110 N -1.13 4.58 -1.23 8.50 0.20 -1.24 -4.81 118.68 123.56 2yqe s LEU 110 Ca 0.59 2.02 -0.12 0.00 0.69 0.00 0.00 54.13 57.32 2yqe s LEU 110 Cb -0.48 -3.67 0.18 0.00 -0.43 0.00 0.00 46.19 41.80 2yqe s LEU 110 CO 0.54 0.05 1.58 -0.67 -0.29 0.00 0.00 176.35 177.56 2yqe n ASP 111 N 1.29 5.24 0.31 3.68 -0.08 -1.26 -4.78 116.55 120.94 2yqe n ASP 111 Ca -0.01 -3.04 0.18 0.00 -1.51 0.00 0.00 54.79 50.41 2yqe n ASP 111 Cb 0.47 -1.52 1.00 0.00 2.34 0.00 0.00 41.12 43.41 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 8.78 0.00 0.18 -2.67 -0.00 -1.99 -1.88 115.31 117.72 2yqe h LEU 112 Ca 0.33 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.21 2yqe h LEU 112 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.44 2yqe h LEU 112 CO 1.37 0.02 -0.08 0.22 -0.00 0.00 0.00 178.44 179.97 2yqe h TYR 113 N 0.00 -0.22 0.02 0.17 3.20 -1.94 -3.22 116.97 114.98 2yqe h TYR 113 Ca -0.00 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.89 2yqe h TYR 113 Cb 0.11 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 2yqe h TYR 113 CO 0.00 -0.14 -0.25 1.03 -1.64 0.00 0.00 178.16 177.16 2yqe h SER 114 N -0.48 -0.75 -0.35 -2.11 0.87 -1.96 -2.39 113.55 106.39 2yqe h SER 114 Ca -0.02 0.10 0.03 0.00 -1.23 0.00 0.00 61.79 60.67 2yqe h SER 114 Cb 0.18 0.30 -0.04 0.00 -0.44 0.00 0.00 62.40 62.40 2yqe h SER 114 CO 0.04 -0.32 -0.21 -0.11 -0.53 0.00 0.00 176.83 175.70 2yqe n LEU 115 N -5.37 -0.37 -0.04 2.23 7.94 -0.71 -0.18 117.00 120.49 2yqe n LEU 115 Ca -0.05 1.04 -0.08 0.00 -1.11 0.00 0.00 56.01 55.81 2yqe n LEU 115 Cb 0.28 -0.29 -0.02 0.00 0.53 0.00 0.00 43.42 43.93 2yqe n LEU 115 CO 0.22 -0.71 0.75 -1.28 -1.11 0.00 0.00 177.39 175.25 2yqe h SER 116 N 0.00 -0.54 -0.52 1.96 0.87 -1.53 -1.39 113.55 112.40 2yqe h SER 116 Ca 0.06 0.11 0.09 0.00 -1.23 0.00 0.00 61.79 60.82 2yqe h SER 116 Cb 0.14 0.27 -0.10 0.00 -0.44 0.00 0.00 62.40 62.27 2yqe h SER 116 CO -0.33 -0.21 -0.33 0.11 -0.53 0.00 0.00 176.83 175.54 2yqe h LYS 117 N -0.17 -0.19 -0.43 2.24 1.79 -0.04 0.13 116.57 119.90 2yqe h LYS 117 Ca 0.13 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.66 2yqe h LYS 117 Cb 0.36 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.01 2yqe h LYS 117 CO -0.32 -0.13 0.18 0.82 -1.08 0.00 0.00 179.45 178.92 2yqe h ILE 118 N -0.20 0.90 0.56 1.86 2.04 -0.12 0.35 117.51 122.91 2yqe h ILE 118 Ca 0.21 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2yqe h ILE 118 Cb 0.54 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 2yqe h ILE 118 CO -0.62 0.07 -0.41 0.58 0.00 0.00 0.00 178.15 177.77 2yqe h VAL 119 N 0.36 0.00 -0.98 1.67 2.07 -0.01 0.18 116.25 119.54 2yqe h VAL 119 Ca 0.20 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.79 2yqe h VAL 119 Cb 0.16 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.86 2yqe h VAL 119 CO -0.18 0.00 0.63 0.40 0.02 0.00 0.00 177.57 178.44 2yqe h ILE 120 N -0.93 1.06 0.81 4.57 2.04 -0.72 -2.02 117.51 122.33 2yqe h ILE 120 Ca -0.07 -0.39 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 2yqe h ILE 120 Cb 0.76 -0.16 0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2yqe h ILE 120 CO 0.04 0.21 -0.39 -0.33 0.00 0.00 0.00 178.15 177.67 2yqe h GLU 121 N 1.13 -1.05 -0.88 2.37 4.39 -0.07 -2.75 114.58 117.73 2yqe h GLU 121 Ca 0.43 0.07 0.23 0.00 0.34 0.00 0.00 59.36 60.44 2yqe h GLU 121 Cb 0.20 0.24 -0.15 0.00 -0.10 0.00 0.00 28.75 28.94 2yqe h GLU 121 CO -0.18 -0.70 0.18 0.93 -1.16 0.00 0.00 179.01 178.08 2yqe h GLU 122 N -1.09 0.16 0.00 2.33 4.39 -0.40 -3.42 114.58 116.54 2yqe h GLU 122 Ca -0.11 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2yqe h GLU 122 Cb 0.84 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2yqe h GLU 122 CO 0.18 0.11 0.00 0.41 -1.16 0.00 0.00 179.01 178.55 2yqe n GLY 123 N -1.40 0.00 2.73 -3.84 0.00 -1.03 -4.92 105.19 96.74 2yqe n GLY 123 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.85 0.13 -0.02 0.00 -0.79 -3.83 105.19 98.83 2yqe n GLY 124 Ca 0.00 -1.81 -0.22 0.00 0.00 0.00 0.00 46.02 43.99 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 0.37 -0.69 1.61 5.03 -1.93 -3.31 116.97 118.05 2yqe h TYR 125 Ca 0.00 -0.27 -0.06 0.00 2.58 0.00 0.00 58.73 60.97 2yqe h TYR 125 Cb 0.00 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 38.24 2yqe h TYR 125 CO 0.00 1.65 0.19 0.93 -1.32 0.00 0.00 178.16 179.61 2yqe h GLU 126 N -0.27 1.09 0.13 1.82 5.08 -1.96 -1.68 114.58 118.78 2yqe h GLU 126 Ca -0.37 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 57.74 2yqe h GLU 126 Cb 1.80 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.90 2yqe h GLU 126 CO 0.02 0.95 -0.08 0.00 -1.00 0.00 0.00 179.01 178.90 2yqe h ALA 127 N 1.15 -0.98 -0.91 3.43 0.00 -1.73 0.90 119.26 121.12 2yqe h ALA 127 Ca 0.22 -0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.30 2yqe h ALA 127 Cb 0.34 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 2yqe h ALA 127 CO -0.00 -0.97 0.61 -0.84 0.00 0.00 0.00 179.25 178.04 2yqe h ILE 128 N -0.19 0.66 -0.20 0.00 -0.00 -1.64 0.27 117.51 116.40 2yqe h ILE 128 Ca -0.02 -0.13 -0.10 0.00 -0.00 0.00 0.00 64.86 64.61 2yqe h ILE 128 Cb 0.15 0.23 -0.01 0.00 -0.00 0.00 0.00 36.82 37.20 2yqe h ILE 128 CO 0.02 0.07 -0.30 0.00 -0.00 0.00 0.00 178.15 177.94 2yqe h LYS 130 N 0.35 0.32 -0.34 0.00 1.57 0.21 -2.79 116.57 115.90 2yqe h LYS 130 Ca 0.05 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2yqe h LYS 130 Cb 0.71 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.01 2yqe h LYS 130 CO 0.05 0.63 0.00 -3.47 -0.57 0.00 0.00 179.45 176.09 2yqe n ASP 131 N -4.65 1.19 -4.03 0.86 2.03 -0.88 -4.90 116.55 106.17 2yqe n ASP 131 Ca -0.06 -2.05 -0.33 0.00 0.52 0.00 0.00 54.79 52.88 2yqe n ASP 131 Cb 0.29 -0.21 -0.02 0.00 -0.72 0.00 0.00 41.12 40.46 2yqe n ASP 131 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2yqe n ARG 132 N 0.04 -1.60 0.20 -0.67 5.12 -0.67 -4.84 116.66 114.24 2yqe n ARG 132 Ca 0.06 0.26 0.12 0.00 -1.93 0.00 0.00 57.85 56.36 2yqe n ARG 132 Cb 0.22 -3.74 0.21 0.00 -1.16 0.00 0.00 32.46 27.98 2yqe n ARG 132 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2yqe h ARG 133 N -2.03 0.00 -0.71 5.56 2.47 -0.94 -3.35 114.38 115.38 2yqe h ARG 133 Ca -0.66 0.00 0.23 0.00 -1.26 0.00 0.00 59.98 58.28 2yqe h ARG 133 Cb 1.39 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.57 2yqe h ARG 133 CO 0.60 0.00 0.13 0.91 0.56 0.00 0.00 179.97 182.17 2yqe n TRP 134 N -2.94 0.57 0.07 3.04 5.03 -1.26 0.15 117.44 122.11 2yqe n TRP 134 Ca 0.04 0.85 -0.12 0.00 3.03 0.00 0.00 57.50 61.31 2yqe n TRP 134 Cb 0.51 -1.11 -0.05 0.00 -1.03 0.00 0.00 31.31 29.63 2yqe n TRP 134 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 2yqe h ALA 135 N 1.43 -0.19 0.07 6.99 0.00 -1.94 -1.61 119.26 124.00 2yqe h ALA 135 Ca 0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 2yqe h ALA 135 Cb 1.11 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2yqe h ALA 135 CO -0.63 -0.64 -0.03 0.00 0.00 0.00 0.00 179.25 177.94 2yqe h ARG 136 N -0.25 -0.09 -0.90 0.00 2.47 0.11 -2.43 114.38 113.28 2yqe h ARG 136 Ca 0.03 0.01 0.25 0.00 -1.26 0.00 0.00 59.98 59.01 2yqe h ARG 136 Cb 0.28 0.02 -0.15 0.00 -1.65 0.00 0.00 29.97 28.47 2yqe h ARG 136 CO -0.10 0.33 0.23 0.28 0.56 0.00 0.00 179.97 181.27 2yqe h VAL 137 N -0.54 0.25 0.18 2.04 2.07 -0.47 0.30 116.25 120.09 2yqe h VAL 137 Ca -0.01 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2yqe h VAL 137 Cb 0.46 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2yqe h VAL 137 CO 0.02 0.03 -0.09 0.00 0.02 0.00 0.00 177.57 177.55 2yqe h ALA 138 N 1.83 -0.24 -0.25 1.67 0.00 -1.28 -3.01 119.26 117.97 2yqe h ALA 138 Ca 0.58 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 55.36 2yqe h ALA 138 Cb 1.21 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2yqe h ALA 138 CO -0.70 -0.42 0.27 0.37 0.00 0.00 0.00 179.25 178.77 2yqe h GLN 139 N -0.67 0.00 0.00 0.00 4.15 -0.60 0.15 115.11 118.14 2yqe h GLN 139 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 2yqe h GLN 139 Cb 0.48 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 2yqe h GLN 139 CO 0.04 0.00 -0.14 0.00 -1.93 0.00 0.00 178.83 176.80 2yqe h ARG 140 N 0.00 0.00 -0.73 1.69 3.08 -0.33 -1.32 114.38 116.77 2yqe h ARG 140 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2yqe h ARG 140 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2yqe h ARG 140 CO -0.00 0.14 0.00 -0.11 -1.07 0.00 0.00 179.97 178.93 2yqe n LEU 141 N -3.87 3.07 -2.90 3.04 7.94 0.53 -4.87 117.00 119.95 2yqe n LEU 141 Ca -0.02 -1.55 -0.15 0.00 -1.11 0.00 0.00 56.01 53.17 2yqe n LEU 141 Cb 0.23 -0.54 0.07 0.00 0.53 0.00 0.00 43.42 43.71 2yqe n LEU 141 CO 0.32 0.44 0.12 1.41 -1.11 0.00 0.00 177.39 178.57 2yqe n HIS 142 N 0.34 -1.88 -3.62 1.96 8.25 -0.50 -5.01 115.22 114.76 2yqe n HIS 142 Ca 0.13 0.75 -0.29 0.00 -0.26 0.00 0.00 57.72 58.05 2yqe n HIS 142 Cb 0.65 -4.32 -0.04 0.00 1.12 0.00 0.00 29.99 27.40 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 -3.27 3.48 -0.09 4.41 2.02 -1.24 -5.05 117.35 117.61 2yqe s TYR 143 Ca 0.15 0.49 -0.30 0.00 -0.37 0.00 0.00 57.07 57.05 2yqe s TYR 143 Cb -0.07 -1.97 -0.04 0.00 -0.40 0.00 0.00 41.96 39.49 2yqe s TYR 143 CO 0.57 0.36 1.52 -1.25 -1.57 0.00 0.00 175.55 175.18 2yqe s PRO 144 N -3.08 4.20 -0.20 -1.71 0.04 -1.26 -4.74 135.00 128.25 2yqe s PRO 144 Ca 0.41 2.01 -0.29 0.00 0.04 0.00 0.00 61.00 63.17 2yqe s PRO 144 Cb -0.11 -3.90 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 2yqe s PRO 144 CO 0.27 -0.79 1.60 -1.25 0.04 0.00 0.00 177.00 176.87 2yqe s PRO 145 N 3.83 3.85 0.00 0.56 0.04 -1.26 -3.94 135.00 138.08 2yqe s PRO 145 Ca 0.67 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.42 2yqe s PRO 145 Cb -0.29 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.23 2yqe s PRO 145 CO 0.24 -1.22 0.00 0.41 0.04 0.00 0.00 177.00 176.47 2yqe n GLY 146 N 4.55 1.73 3.43 0.56 0.00 -1.26 -5.13 105.19 109.07 2yqe n GLY 146 Ca 0.18 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.36 -1.12 1.61 4.01 -1.25 -4.80 118.16 116.24 2yqe n LYS 147 Ca 0.00 -0.06 -0.20 0.00 -0.51 0.00 0.00 58.31 57.54 2yqe n LYS 147 Cb 0.00 -1.90 -0.13 0.00 -0.51 0.00 0.00 35.03 32.49 2yqe n LYS 147 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2yqe n ASN 148 N -1.60 6.17 0.02 4.39 5.15 -1.26 -4.56 115.26 123.57 2yqe n ASN 148 Ca 0.07 -2.56 -0.12 0.00 -0.60 0.00 0.00 54.58 51.36 2yqe n ASN 148 Cb 0.54 -1.44 -0.08 0.00 -0.53 0.00 0.00 39.78 38.27 2yqe n ASN 148 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2yqe h ILE 149 N 2.23 1.12 -0.81 -1.44 2.04 -1.92 -3.11 117.51 115.62 2yqe h ILE 149 Ca 0.37 -0.35 0.10 0.00 1.00 0.00 0.00 64.86 65.98 2yqe h ILE 149 Cb 1.16 1.33 -0.11 0.00 -0.74 0.00 0.00 36.82 38.46 2yqe h ILE 149 CO 0.65 0.09 -0.39 0.61 0.00 0.00 0.00 178.15 179.11 2yqe n GLY 150 N -0.70 -1.88 0.47 5.37 0.00 -1.26 -1.04 105.19 106.15 2yqe n GLY 150 Ca -0.07 0.93 -0.18 0.00 0.00 0.00 0.00 46.02 46.71 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 -1.17 -0.95 1.61 0.87 -1.94 -2.39 113.55 109.59 2yqe h SER 151 Ca 0.21 0.07 0.14 0.00 -1.23 0.00 0.00 61.79 60.98 2yqe h SER 151 Cb 0.41 0.35 -0.15 0.00 -0.44 0.00 0.00 62.40 62.58 2yqe h SER 151 CO -0.78 -0.67 -0.40 -0.11 -0.53 0.00 0.00 176.83 174.33 2yqe n LEU 152 N -5.27 -0.68 0.06 2.23 0.00 -0.21 -1.05 117.00 112.08 2yqe n LEU 152 Ca -0.13 1.66 -0.07 0.00 0.00 0.00 0.00 56.01 57.47 2yqe n LEU 152 Cb 0.45 -0.35 -0.04 0.00 0.00 0.00 0.00 43.42 43.48 2yqe n LEU 152 CO 0.30 -1.47 0.51 -0.07 0.00 0.00 0.00 177.39 176.66 2yqe h LEU 153 N 0.00 -0.63 -0.96 -1.96 3.38 -1.00 -0.59 115.31 113.55 2yqe h LEU 153 Ca 0.30 0.06 0.27 0.00 0.09 0.00 0.00 57.88 58.60 2yqe h LEU 153 Cb 0.54 0.23 -0.18 0.00 0.09 0.00 0.00 40.66 41.34 2yqe h LEU 153 CO -0.93 -0.24 0.06 -0.09 0.09 0.00 0.00 178.44 177.33 2yqe h ARG 154 N -0.33 0.03 0.50 1.13 2.43 -0.70 -0.81 114.38 116.64 2yqe h ARG 154 Ca -0.01 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2yqe h ARG 154 Cb 0.32 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2yqe h ARG 154 CO -0.10 0.02 -0.27 0.77 -1.51 0.00 0.00 179.97 178.88 2yqe h SER 155 N 0.03 -0.67 -0.86 -3.80 0.02 -0.46 -1.97 113.55 105.84 2yqe h SER 155 Ca 0.59 0.03 0.14 0.00 -0.84 0.00 0.00 61.79 61.72 2yqe h SER 155 Cb 1.22 0.18 -0.15 0.00 0.14 0.00 0.00 62.40 63.80 2yqe h SER 155 CO -0.88 -0.44 -0.34 0.45 -1.14 0.00 0.00 176.83 174.48 2yqe h HIS 156 N -0.71 -0.94 0.04 3.45 3.86 0.20 0.83 115.15 121.88 2yqe h HIS 156 Ca -0.07 0.09 0.01 0.00 -1.16 0.00 0.00 60.37 59.24 2yqe h HIS 156 Cb 0.56 0.54 -0.02 0.00 1.06 0.00 0.00 27.41 29.54 2yqe h HIS 156 CO 0.05 -0.40 -0.25 -0.92 0.86 0.00 0.00 177.93 177.27 2yqe h TYR 157 N -0.05 -0.73 0.00 2.45 5.03 -1.15 0.33 116.97 122.85 2yqe h TYR 157 Ca 0.33 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.66 2yqe h TYR 157 Cb 0.59 0.31 0.00 0.00 1.55 0.00 0.00 36.73 39.19 2yqe h TYR 157 CO -0.78 -0.28 0.00 0.39 -1.32 0.00 0.00 178.16 176.18 2yqe n GLU 158 N -3.87 0.00 -0.08 1.82 1.02 -0.66 0.23 120.64 119.10 2yqe n GLU 158 Ca -0.04 0.40 -0.16 0.00 -0.02 0.00 0.00 57.16 57.34 2yqe n GLU 158 Cb 0.19 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.00 2yqe n GLU 158 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2yqe h ARG 159 N 0.00 0.00 0.00 3.49 2.43 0.31 -3.35 114.38 117.26 2yqe h ARG 159 Ca 0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 2yqe h ARG 159 Cb 0.09 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 2yqe h ARG 159 CO 0.00 0.93 -1.55 -0.89 -1.51 0.00 0.00 179.97 176.94 2yqe n ILE 160 N -4.55 0.56 1.62 1.20 5.41 0.90 -4.54 119.36 119.96 2yqe n ILE 160 Ca -0.18 -0.21 0.13 0.00 1.00 0.00 0.00 62.75 63.48 2yqe n ILE 160 Cb 0.53 -0.85 0.75 0.00 -0.71 0.00 0.00 39.64 39.36 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 -2.79 0.00 0.13 1.39 5.41 0.62 -3.35 119.36 120.77 2yqe n ILE 161 Ca -0.17 0.00 -0.06 0.00 1.00 0.00 0.00 62.75 63.52 2yqe n ILE 161 Cb 0.68 -0.58 -0.03 0.00 -0.71 0.00 0.00 39.64 39.00 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 -0.37 -0.10 1.39 3.20 -0.91 -2.75 116.97 117.42 2yqe h TYR 162 Ca 0.00 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 2yqe h TYR 162 Cb 0.00 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2yqe h TYR 162 CO 0.00 -0.23 -0.46 -1.00 -1.64 0.00 0.00 178.16 174.83 2yqe h PRO 163 N -0.99 0.24 -0.56 1.82 0.13 -1.85 -2.42 132.00 128.37 2yqe h PRO 163 Ca -0.04 -0.13 -0.09 0.00 -0.87 0.00 0.00 66.00 64.87 2yqe h PRO 163 Cb 0.31 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.42 2yqe h PRO 163 CO 0.07 0.66 -0.02 -0.92 -0.23 0.00 0.00 178.00 177.56 2yqe h TYR 164 N 0.20 1.07 0.14 1.56 3.20 -1.69 0.39 116.97 121.84 2yqe h TYR 164 Ca 0.01 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 2yqe h TYR 164 Cb 0.89 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2yqe h TYR 164 CO 0.02 0.96 -0.07 0.93 -1.64 0.00 0.00 178.16 178.36 2yqe h GLU 165 N 0.90 -0.18 -0.66 1.82 4.39 -1.40 -2.18 114.58 117.27 2yqe h GLU 165 Ca 0.16 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.83 2yqe h GLU 165 Cb 0.55 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 2yqe h GLU 165 CO 0.03 0.28 0.25 0.00 -1.16 0.00 0.00 179.01 178.41 2yqe h MET 166 N -0.79 1.01 0.19 2.33 -0.00 -1.46 -1.70 114.93 114.51 2yqe h MET 166 Ca -0.02 -0.19 -0.01 0.00 -0.00 0.00 0.00 59.70 59.48 2yqe h MET 166 Cb 0.54 -0.16 -0.00 0.00 -0.00 0.00 0.00 31.60 31.98 2yqe h MET 166 CO 0.03 0.85 -0.11 0.35 -0.00 0.00 0.00 176.91 178.03 2yqe h PHE 167 N 0.95 -0.28 -0.97 -0.10 3.57 -0.29 -2.78 116.94 117.03 2yqe h PHE 167 Ca 0.22 -0.00 -0.59 0.00 3.53 0.00 0.00 57.97 61.13 2yqe h PHE 167 Cb 0.24 0.10 -0.24 0.00 2.79 0.00 0.00 35.95 38.83 2yqe h PHE 167 CO 0.02 -0.17 0.75 1.04 -2.23 0.00 0.00 178.31 177.72 2yqe n GLN 168 N -5.22 2.45 0.06 1.11 6.02 -0.82 -4.58 117.38 116.40 2yqe n GLN 168 Ca -0.09 -2.81 -0.08 0.00 -0.01 0.00 0.00 57.00 54.01 2yqe n GLN 168 Cb 0.15 -2.10 -0.05 0.00 1.02 0.00 0.00 30.24 29.25 2yqe n GLN 168 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2yqe h SER 169 N 2.03 -0.21 0.00 1.08 0.87 -1.01 -3.47 113.55 112.83 2yqe h SER 169 Ca 0.51 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2yqe h SER 169 Cb 0.75 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2yqe h SER 169 CO 1.32 0.33 0.00 0.61 -0.53 0.00 0.00 176.83 178.56 2yqe n GLY 170 N 0.90 -0.36 0.00 5.77 0.00 -1.26 -5.09 105.19 105.15 2yqe n GLY 170 Ca -0.06 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2yqe n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32