#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zqt n LEU 7 N 0.00 -1.44 -4.60 3.14 4.77 -1.26 -4.98 117.00 112.62 2zqt n LEU 7 Ca 0.00 1.72 -0.28 0.00 -0.03 0.00 0.00 56.01 57.41 2zqt n LEU 7 Cb 0.00 -1.32 0.21 0.00 -2.33 0.00 0.00 43.42 39.98 2zqt n LEU 7 CO 0.00 0.00 0.59 -2.84 -1.33 0.00 0.00 177.39 173.82 2zqt s PRO 8 N -4.73 -0.22 0.12 3.23 0.02 -1.26 -4.84 135.00 127.32 2zqt s PRO 8 Ca 0.00 0.55 -0.35 0.00 0.02 0.00 0.00 61.00 61.22 2zqt s PRO 8 Cb 0.00 -1.66 -0.15 0.00 0.02 0.00 0.00 34.50 32.71 2zqt s PRO 8 CO 0.00 -3.18 1.48 -2.30 -0.33 0.00 0.00 177.00 172.68 2zqt n PRO 9 N -4.49 1.72 0.00 5.54 -0.02 -1.26 -2.12 135.00 134.37 2zqt n PRO 9 Ca 0.05 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2zqt n PRO 9 Cb 0.57 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2zqt n PRO 9 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zqt n GLY 10 N 3.06 3.32 3.77 -1.23 0.00 -1.26 -4.93 105.19 107.93 2zqt n GLY 10 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2zqt n GLY 10 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2zqt s TRP 11 N -2.37 3.79 -0.02 1.61 0.52 -0.90 -0.19 118.94 121.37 2zqt s TRP 11 Ca 0.00 1.43 -0.04 0.00 0.02 0.00 0.00 56.10 57.51 2zqt s TRP 11 Cb 0.00 -2.70 0.00 0.00 -1.15 0.00 0.00 33.47 29.62 2zqt s TRP 11 CO 0.00 0.42 0.09 -2.00 0.02 0.00 0.00 176.95 175.47 2zqt s GLU 12 N -0.58 0.24 0.02 4.98 2.12 0.05 -4.82 118.70 120.71 2zqt s GLU 12 Ca 0.34 -0.12 -0.30 0.00 0.36 0.00 0.00 54.97 55.25 2zqt s GLU 12 Cb -0.21 0.10 -0.05 0.00 0.26 0.00 0.00 34.13 34.24 2zqt s GLU 12 CO 0.22 -0.04 1.15 0.21 -0.54 0.00 0.00 175.26 176.25 2zqt s LYS 13 N -0.56 4.45 0.29 4.30 2.20 -1.26 -1.18 119.74 127.98 2zqt s LYS 13 Ca -0.06 1.67 0.03 0.00 -0.36 0.00 0.00 55.97 57.24 2zqt s LYS 13 Cb -0.04 -3.41 -0.06 0.00 -1.51 0.00 0.00 37.83 32.81 2zqt s LYS 13 CO 0.00 -0.25 0.06 1.03 -0.36 0.00 0.00 175.35 175.84 2zqt s ARG 14 N 1.27 1.53 0.02 4.03 1.81 0.26 -4.96 118.95 122.91 2zqt s ARG 14 Ca 0.57 -1.84 0.06 0.00 -1.72 0.00 0.00 55.73 52.80 2zqt s ARG 14 Cb -0.27 -0.63 -0.02 0.00 -0.45 0.00 0.00 34.95 33.58 2zqt s ARG 14 CO 0.27 -0.21 -0.19 1.41 -0.68 0.00 0.00 175.30 175.91 2zqt s MET 15 N -3.94 1.33 0.19 3.54 -2.45 -1.26 -0.91 119.30 115.80 2zqt s MET 15 Ca 0.36 -0.81 -0.30 0.00 -1.25 0.00 0.00 55.69 53.69 2zqt s MET 15 Cb 0.08 -1.37 -0.09 0.00 1.25 0.00 0.00 34.83 34.70 2zqt s MET 15 CO 0.14 0.36 1.33 -1.12 1.05 0.00 0.00 175.02 176.78 2zqt s SER 16 N -0.91 6.86 0.73 1.11 0.01 -0.28 -4.95 113.70 116.27 2zqt s SER 16 Ca 0.06 2.41 -0.12 0.00 1.31 0.00 0.00 55.95 59.62 2zqt s SER 16 Cb -0.08 -2.61 0.03 0.00 0.21 0.00 0.00 66.02 63.57 2zqt s SER 16 CO 0.01 -0.56 1.11 -0.13 0.41 0.00 0.00 173.24 174.07 2zqt s ARG 17 N 0.07 2.66 0.00 12.44 0.52 -1.26 -2.36 118.95 131.02 2zqt s ARG 17 Ca 0.58 0.44 0.00 0.00 -0.52 0.00 0.00 55.73 56.23 2zqt s ARG 17 Cb -0.37 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.10 2zqt s ARG 17 CO 0.37 -1.17 0.00 0.45 0.02 0.00 0.00 175.30 174.97 2zqt n SER 18 N -3.09 0.00 0.00 0.23 2.88 -1.26 -4.61 113.62 107.77 2zqt n SER 18 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 2zqt n SER 18 Cb 0.58 -1.48 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 2zqt n SER 18 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2zqt n SER 19 N 0.00 0.00 -0.14 -3.46 2.88 -1.23 -5.11 113.62 106.57 2zqt n SER 19 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2zqt n SER 19 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2zqt n SER 19 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2zqt n GLY 20 N 1.35 0.45 3.74 0.46 0.00 -1.00 -4.80 105.19 105.39 2zqt n GLY 20 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2zqt n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2zqt s ARG 21 N 0.00 4.65 0.18 1.61 3.00 -1.26 -4.70 118.95 122.43 2zqt s ARG 21 Ca 0.00 1.65 -0.30 0.00 0.00 0.00 0.00 55.73 57.08 2zqt s ARG 21 Cb 0.00 -3.29 -0.07 0.00 0.00 0.00 0.00 34.95 31.59 2zqt s ARG 21 CO 0.00 0.18 1.00 0.08 0.00 0.00 0.00 175.30 176.55 2zqt s VAL 22 N -0.42 4.15 0.30 3.52 1.01 -1.26 -1.13 120.40 126.57 2zqt s VAL 22 Ca 0.47 1.93 -0.01 0.00 0.00 0.00 0.00 61.98 64.37 2zqt s VAL 22 Cb -0.28 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 31.88 2zqt s VAL 22 CO 0.34 0.36 0.41 0.00 0.00 0.00 0.00 175.10 176.22 2zqt n TYR 23 N 2.19 -1.26 -5.05 5.22 4.11 -0.08 -4.88 117.16 117.40 2zqt n TYR 23 Ca 0.01 -2.09 -0.29 0.00 -0.00 0.00 0.00 57.90 55.53 2zqt n TYR 23 Cb 0.47 0.46 -0.16 0.00 -0.00 0.00 0.00 39.34 40.11 2zqt n TYR 23 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2zqt s TYR 24 N -3.18 2.13 -0.02 -3.48 1.51 0.02 -0.58 117.35 113.75 2zqt s TYR 24 Ca 0.26 -0.69 0.06 0.00 -1.01 0.00 0.00 57.07 55.69 2zqt s TYR 24 Cb -0.01 -1.42 -0.01 0.00 -0.11 0.00 0.00 41.96 40.41 2zqt s TYR 24 CO 0.19 -0.24 -0.19 0.12 -1.11 0.00 0.00 175.55 174.32 2zqt s PHE 25 N 0.07 1.72 -0.28 2.71 5.36 -0.33 -0.99 117.98 126.24 2zqt s PHE 25 Ca -0.07 -0.36 -0.08 0.00 -0.96 0.00 0.00 56.93 55.46 2zqt s PHE 25 Cb -0.14 -1.12 -0.01 0.00 -0.34 0.00 0.00 43.02 41.42 2zqt s PHE 25 CO 0.04 -0.06 0.09 1.21 -1.46 0.00 0.00 175.22 175.04 2zqt s ASN 26 N -0.35 5.20 0.24 6.13 3.84 0.19 -0.77 114.94 129.41 2zqt s ASN 26 Ca 0.05 -0.47 0.23 0.00 0.21 0.00 0.00 52.86 52.88 2zqt s ASN 26 Cb -0.08 -1.92 0.95 0.00 -0.55 0.00 0.00 41.25 39.64 2zqt s ASN 26 CO -0.00 -0.13 1.70 1.41 -2.79 0.00 0.00 177.10 177.29 2zqt n HIS 27 N 4.91 0.76 -0.11 0.43 8.25 0.73 0.31 115.22 130.50 2zqt n HIS 27 Ca -0.15 0.29 -0.18 0.00 -0.26 0.00 0.00 57.72 57.42 2zqt n HIS 27 Cb 0.50 -0.97 -0.12 0.00 1.12 0.00 0.00 29.99 30.51 2zqt n HIS 27 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2zqt n ILE 28 N -2.18 1.51 0.90 1.59 5.41 -1.26 -4.52 119.36 120.80 2zqt n ILE 28 Ca 0.02 -0.60 0.10 0.00 1.00 0.00 0.00 62.75 63.28 2zqt n ILE 28 Cb 0.24 -1.38 -0.09 0.00 -0.71 0.00 0.00 39.64 37.70 2zqt n ILE 28 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2zqt n THR 29 N -3.24 0.01 -1.26 1.39 -2.24 -1.20 -4.07 114.28 103.65 2zqt n THR 29 Ca -0.44 -0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.20 2zqt n THR 29 Cb 1.01 0.83 -0.04 0.00 -2.10 0.00 0.00 70.33 70.03 2zqt n THR 29 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2zqt n ASN 30 N -1.58 -5.27 -4.77 3.42 5.03 0.15 -1.54 115.26 110.70 2zqt n ASN 30 Ca 0.03 0.22 -0.38 0.00 0.87 0.00 0.00 54.58 55.32 2zqt n ASN 30 Cb 0.35 -3.57 -0.02 0.00 -1.02 0.00 0.00 39.78 35.53 2zqt n ASN 30 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2zqt s ALA 31 N -1.94 3.15 -0.02 5.41 0.00 -1.23 -3.61 121.76 123.52 2zqt s ALA 31 Ca 0.00 1.02 0.05 0.00 0.00 0.00 0.00 51.96 53.02 2zqt s ALA 31 Cb 0.00 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 2zqt s ALA 31 CO 0.00 -0.60 -0.16 -1.12 0.00 0.00 0.00 175.76 173.87 2zqt s SER 32 N -1.08 1.98 0.04 0.00 0.01 -1.26 -0.64 113.70 112.75 2zqt s SER 32 Ca 0.58 -0.31 -0.20 0.00 1.31 0.00 0.00 55.95 57.33 2zqt s SER 32 Cb -0.32 -0.34 0.04 0.00 0.21 0.00 0.00 66.02 65.61 2zqt s SER 32 CO 0.40 0.18 0.46 0.00 0.41 0.00 0.00 173.24 174.69 2zqt s GLN 33 N -0.23 0.95 0.23 12.44 -2.07 -0.16 -4.99 119.66 125.83 2zqt s GLN 33 Ca 0.03 -0.28 0.05 0.00 -1.82 0.00 0.00 55.36 53.34 2zqt s GLN 33 Cb -0.08 0.43 0.21 0.00 -1.09 0.00 0.00 33.01 32.48 2zqt s GLN 33 CO 0.00 -0.33 1.53 -1.49 -1.32 0.00 0.00 175.29 173.69 2zqt h TRP 34 N 2.99 0.25 -3.46 9.60 4.06 -1.89 0.09 115.95 127.58 2zqt h TRP 34 Ca -0.31 -0.11 -0.52 0.00 2.06 0.00 0.00 58.89 60.01 2zqt h TRP 34 Cb 1.20 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 29.32 2zqt h TRP 34 CO 0.40 0.79 0.48 -1.21 -3.56 0.00 0.00 178.44 175.35 2zqt s GLU 35 N -3.62 4.56 0.24 0.49 8.01 -1.26 -4.62 118.70 122.50 2zqt s GLU 35 Ca -0.03 1.69 -0.31 0.00 0.01 0.00 0.00 54.97 56.33 2zqt s GLU 35 Cb 0.12 -3.31 -0.13 0.00 -4.31 0.00 0.00 34.13 26.49 2zqt s GLU 35 CO 0.80 -0.01 1.52 -2.13 0.01 0.00 0.00 175.26 175.45 2zqt n ARG 36 N 2.90 2.32 0.00 1.61 0.63 -1.26 -4.74 116.66 118.12 2zqt n ARG 36 Ca 0.04 0.83 0.15 0.00 -0.92 0.00 0.00 57.85 57.95 2zqt n ARG 36 Cb 0.47 -2.56 0.76 0.00 0.45 0.00 0.00 32.46 31.58 2zqt n ARG 36 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2zqt n PRO 37 N 2.49 0.48 -3.78 -0.14 -0.04 -1.26 -4.77 135.00 127.98 2zqt n PRO 37 Ca 0.12 0.01 -0.10 0.00 -0.04 0.00 0.00 63.50 63.49 2zqt n PRO 37 Cb 0.33 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.22 2zqt n PRO 37 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2zqt s SER 38 N -2.51 -0.04 -0.15 3.54 1.04 -1.26 -4.89 113.70 109.43 2zqt s SER 38 Ca 0.30 -0.40 -0.13 0.00 0.48 0.00 0.00 55.95 56.21 2zqt s SER 38 Cb 0.20 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 2zqt s SER 38 CO 0.44 -0.69 -0.24 0.61 0.98 0.00 0.00 173.24 174.34 2zqt n GLY 39 N 0.23 -0.77 2.60 7.32 0.00 -1.26 -5.05 105.19 108.26 2zqt n GLY 39 Ca -0.17 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 2zqt n GLY 39 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2zqt s GLY 45 N -4.47 0.83 -0.13 -0.02 0.00 -1.26 -5.05 107.32 97.22 2zqt s GLY 45 Ca -0.20 -1.52 -0.02 0.00 0.00 0.00 0.00 44.72 42.97 2zqt s GLY 45 CO 0.30 1.89 -0.05 1.25 0.00 0.00 0.00 173.10 176.49 2zqt s LYS 46 N 1.64 3.38 -0.00 2.90 2.20 -1.26 -5.11 119.74 123.49 2zqt s LYS 46 Ca 0.11 -0.53 -0.01 0.00 -0.36 0.00 0.00 55.97 55.19 2zqt s LYS 46 Cb -0.18 -2.81 -0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2zqt s LYS 46 CO -0.24 0.38 0.02 0.54 -0.36 0.00 0.00 175.35 175.69 2zqt s ASN 47 N -0.02 0.04 0.00 1.43 4.22 -1.26 -4.80 114.94 114.55 2zqt s ASN 47 Ca 0.01 -0.10 0.00 0.00 -2.14 0.00 0.00 52.86 50.63 2zqt s ASN 47 Cb -0.13 0.09 0.00 0.00 1.28 0.00 0.00 41.25 42.48 2zqt s ASN 47 CO 0.03 -0.11 0.00 0.61 -2.04 0.00 0.00 177.10 175.59 2zqt n GLY 48 N 2.58 0.49 0.15 0.45 0.00 -1.26 -4.95 105.19 102.65 2zqt n GLY 48 Ca -0.16 -0.56 0.02 0.00 0.00 0.00 0.00 46.02 45.32 2zqt n GLY 48 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2zqt h GLN 49 N 0.56 0.00 0.00 1.61 4.15 -2.04 -3.49 115.11 115.91 2zqt h GLN 49 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2zqt h GLN 49 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2zqt h GLN 49 CO 0.00 0.53 0.00 0.41 -1.93 0.00 0.00 178.83 177.84 2zqt n GLY 50 N 0.72 0.92 3.78 2.39 0.00 -1.26 -4.81 105.19 106.93 2zqt n GLY 50 Ca 0.00 -0.76 -0.22 0.00 0.00 0.00 0.00 46.02 45.05 2zqt n GLY 50 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2zqt s GLU 51 N 0.00 2.63 0.62 1.61 -1.05 -1.26 -5.10 118.70 116.14 2zqt s GLU 51 Ca 0.00 -1.31 -0.17 0.00 -0.15 0.00 0.00 54.97 53.33 2zqt s GLU 51 Cb 0.00 -2.38 -0.02 0.00 -0.44 0.00 0.00 34.13 31.29 2zqt s GLU 51 CO 0.00 0.22 1.17 -1.25 0.95 0.00 0.00 175.26 176.35 2zqt s PRO 52 N -3.87 2.86 0.42 -4.83 0.04 -1.26 -4.93 135.00 123.44 2zqt s PRO 52 Ca 0.37 1.67 0.22 0.00 0.04 0.00 0.00 61.00 63.30 2zqt s PRO 52 Cb -0.06 -1.93 0.35 0.00 0.04 0.00 0.00 34.50 32.90 2zqt s PRO 52 CO 0.24 -1.25 1.60 0.00 0.04 0.00 0.00 177.00 177.63 2zqt h ALA 53 N 0.55 0.96 -2.76 8.56 0.00 -1.98 -3.46 119.26 121.13 2zqt h ALA 53 Ca -0.49 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.22 2zqt h ALA 53 Cb 1.28 -0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.84 2zqt h ALA 53 CO 0.54 0.08 -0.36 0.50 0.00 0.00 0.00 179.25 180.02 2zqt s ARG 54 N -3.20 0.51 0.08 0.00 3.52 -1.26 -4.54 118.95 114.06 2zqt s ARG 54 Ca 0.06 -0.02 0.01 0.00 -0.13 0.00 0.00 55.73 55.66 2zqt s ARG 54 Cb 0.06 0.23 -0.04 0.00 -1.56 0.00 0.00 34.95 33.63 2zqt s ARG 54 CO 0.67 -0.12 -0.06 0.14 -0.81 0.00 0.00 175.30 175.13 2zqt s VAL 55 N -0.79 0.59 -0.09 7.11 -7.23 -0.96 -4.98 120.40 114.06 2zqt s VAL 55 Ca -0.09 -1.77 0.03 0.00 -1.81 0.00 0.00 61.98 58.34 2zqt s VAL 55 Cb -0.05 -1.47 -0.01 0.00 0.56 0.00 0.00 36.38 35.41 2zqt s VAL 55 CO 0.02 -0.81 -0.20 -0.60 -0.31 0.00 0.00 175.10 173.20 2zqt s ARG 56 N -3.47 2.89 0.08 4.82 3.52 -0.42 -0.73 118.95 125.64 2zqt s ARG 56 Ca 0.07 -0.81 0.03 0.00 -0.13 0.00 0.00 55.73 54.89 2zqt s ARG 56 Cb 0.03 -2.36 -0.03 0.00 -1.56 0.00 0.00 34.95 31.03 2zqt s ARG 56 CO -0.05 0.32 -0.08 0.00 -0.81 0.00 0.00 175.30 174.68 2zqt s SER 58 N -2.26 4.66 0.09 0.00 0.01 -0.02 -1.16 113.70 115.02 2zqt s SER 58 Ca 0.01 -0.58 -0.09 0.00 1.31 0.00 0.00 55.95 56.60 2zqt s SER 58 Cb -0.04 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.28 2zqt s SER 58 CO -0.01 0.01 0.21 -1.38 0.41 0.00 0.00 173.24 172.47 2zqt s HIS 59 N -2.24 0.11 -0.17 2.43 -3.43 -0.24 -0.70 115.29 111.05 2zqt s HIS 59 Ca 0.31 -0.51 0.01 0.00 -0.80 0.00 0.00 55.06 54.07 2zqt s HIS 59 Cb -0.07 -0.03 0.02 0.00 -1.43 0.00 0.00 32.58 31.07 2zqt s HIS 59 CO 0.20 -0.55 -0.19 -1.17 -2.00 0.00 0.00 174.74 171.03 2zqt s LEU 60 N -2.78 2.06 -0.17 5.38 0.20 0.23 -4.49 118.68 119.11 2zqt s LEU 60 Ca 0.04 -0.62 -0.05 0.00 0.69 0.00 0.00 54.13 54.19 2zqt s LEU 60 Cb 0.04 -1.43 -0.03 0.00 -0.43 0.00 0.00 46.19 44.34 2zqt s LEU 60 CO -0.10 0.00 -0.00 -0.22 -0.29 0.00 0.00 176.35 175.73 2zqt s LEU 61 N 1.26 3.43 -0.26 -0.68 2.96 -1.26 -0.83 118.68 123.29 2zqt s LEU 61 Ca 0.03 -0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.84 2zqt s LEU 61 Cb -0.13 -1.84 0.02 0.00 0.50 0.00 0.00 46.19 44.73 2zqt s LEU 61 CO -0.11 0.16 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.37 2zqt s VAL 62 N 0.42 3.24 0.60 1.68 1.01 0.39 0.14 120.40 127.89 2zqt s VAL 62 Ca -0.01 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 61.01 2zqt s VAL 62 Cb -0.14 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.61 2zqt s VAL 62 CO 0.02 0.17 0.92 -0.54 0.00 0.00 0.00 175.10 175.68 2zqt s LYS 63 N 1.39 2.91 0.33 2.72 1.02 -1.26 -1.40 119.74 125.45 2zqt s LYS 63 Ca 0.01 0.04 0.05 0.00 0.02 0.00 0.00 55.97 56.09 2zqt s LYS 63 Cb -0.17 -2.24 -0.02 0.00 -0.52 0.00 0.00 37.83 34.88 2zqt s LYS 63 CO -0.02 -0.74 0.34 -3.38 -0.92 0.00 0.00 175.35 170.62 2zqt s HIS 64 N -3.03 1.56 0.59 3.18 -3.43 -1.26 -4.81 115.29 108.09 2zqt s HIS 64 Ca 0.54 -1.56 0.30 0.00 -0.80 0.00 0.00 55.06 53.54 2zqt s HIS 64 Cb -0.11 -0.53 1.84 0.00 -1.43 0.00 0.00 32.58 32.36 2zqt s HIS 64 CO 0.46 -0.95 2.26 0.66 -2.00 0.00 0.00 174.74 175.17 2zqt h SER 65 N 2.13 0.00 -0.41 7.38 4.64 -0.89 -1.32 113.55 125.08 2zqt h SER 65 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2zqt h SER 65 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2zqt h SER 65 CO 0.37 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.33 2zqt n GLN 66 N -3.82 2.39 -1.73 4.77 1.13 -1.26 -4.80 117.38 114.05 2zqt n GLN 66 Ca -0.03 -2.11 -0.37 0.00 -1.94 0.00 0.00 57.00 52.55 2zqt n GLN 66 Cb 0.08 -1.49 0.07 0.00 0.11 0.00 0.00 30.24 29.01 2zqt n GLN 66 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2zqt n SER 67 N 1.29 2.16 -0.14 1.08 7.64 -0.50 -4.89 113.62 120.27 2zqt n SER 67 Ca 0.19 0.85 0.11 0.00 1.01 0.00 0.00 58.87 61.03 2zqt n SER 67 Cb 0.55 -1.56 0.44 0.00 -1.01 0.00 0.00 64.21 62.63 2zqt n SER 67 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 2zqt h ARG 68 N 0.64 0.53 -3.08 1.43 0.11 -1.14 -3.23 114.38 109.65 2zqt h ARG 68 Ca -0.51 -0.03 -0.61 0.00 0.10 0.00 0.00 59.98 58.92 2zqt h ARG 68 Cb 1.34 -0.12 -0.40 0.00 1.11 0.00 0.00 29.97 31.90 2zqt h ARG 68 CO 0.53 0.35 -0.72 0.50 0.10 0.00 0.00 179.97 180.73 2zqt s ARG 69 N -5.51 1.37 -0.71 0.08 3.52 -1.26 -5.03 118.95 111.41 2zqt s ARG 69 Ca -0.09 -2.06 -0.07 0.00 -0.13 0.00 0.00 55.73 53.39 2zqt s ARG 69 Cb 0.20 -2.47 -0.14 0.00 -1.56 0.00 0.00 34.95 30.98 2zqt s ARG 69 CO 0.76 -1.14 2.77 -0.35 -0.81 0.00 0.00 175.30 176.53 2zqt n PRO 70 N 3.54 2.35 -3.64 5.12 -0.04 -1.22 -4.74 135.00 136.37 2zqt n PRO 70 Ca 0.08 -1.38 -0.14 0.00 -0.04 0.00 0.00 63.50 62.02 2zqt n PRO 70 Cb 0.34 -2.30 -0.06 0.00 -0.04 0.00 0.00 33.50 31.44 2zqt n PRO 70 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2zqt s SER 71 N 2.49 -0.35 0.33 3.54 0.15 -1.26 -1.20 113.70 117.40 2zqt s SER 71 Ca 0.55 0.12 -0.18 0.00 0.70 0.00 0.00 55.95 57.14 2zqt s SER 71 Cb 0.19 0.44 0.04 0.00 -1.71 0.00 0.00 66.02 64.98 2zqt s SER 71 CO -0.03 -0.65 0.74 -0.94 1.20 0.00 0.00 173.24 173.57 2zqt s SER 72 N -1.85 -0.11 0.57 5.45 1.04 -0.60 -4.96 113.70 113.24 2zqt s SER 72 Ca -0.07 -0.88 0.38 0.00 0.48 0.00 0.00 55.95 55.86 2zqt s SER 72 Cb -0.01 0.78 1.98 0.00 0.10 0.00 0.00 66.02 68.87 2zqt s SER 72 CO -0.00 -1.50 2.15 4.11 0.98 0.00 0.00 173.24 178.98 2zqt h TRP 73 N 2.01 0.00 0.06 5.02 5.08 -1.93 -2.01 115.95 124.17 2zqt h TRP 73 Ca -0.25 0.00 -0.29 0.00 1.08 0.00 0.00 58.89 59.42 2zqt h TRP 73 Cb 1.25 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 27.38 2zqt h TRP 73 CO 0.88 0.00 -1.55 0.00 -1.28 0.00 0.00 178.44 176.49 2zqt h ARG 74 N 0.00 0.12 -2.02 0.12 3.08 -1.89 -3.46 114.38 110.33 2zqt h ARG 74 Ca 0.00 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.86 2zqt h ARG 74 Cb 0.09 0.08 -0.21 0.00 0.08 0.00 0.00 29.97 30.00 2zqt h ARG 74 CO 0.00 0.89 0.01 1.14 -1.07 0.00 0.00 179.97 180.93 2zqt s GLN 75 N -2.62 0.70 0.26 0.04 -2.07 -0.76 -5.03 119.66 110.18 2zqt s GLN 75 Ca -0.07 1.22 -0.04 0.00 -1.82 0.00 0.00 55.36 54.64 2zqt s GLN 75 Cb 0.08 0.15 0.51 0.00 -1.09 0.00 0.00 33.01 32.65 2zqt s GLN 75 CO 0.83 -0.15 1.65 1.49 -1.32 0.00 0.00 175.29 177.78 2zqt h GLU 76 N 7.02 0.15 -4.04 9.60 4.81 -1.91 -1.59 114.58 128.62 2zqt h GLU 76 Ca -0.30 -0.01 -0.58 0.00 -0.13 0.00 0.00 59.36 58.34 2zqt h GLU 76 Cb 1.23 -0.03 -0.39 0.00 0.63 0.00 0.00 28.75 30.18 2zqt h GLU 76 CO 0.16 0.10 -0.77 0.21 -0.73 0.00 0.00 179.01 177.98 2zqt s LYS 77 N -6.06 1.23 -0.13 1.92 2.47 -1.26 -4.37 119.74 113.54 2zqt s LYS 77 Ca -0.13 -0.89 -0.29 0.00 -1.56 0.00 0.00 55.97 53.09 2zqt s LYS 77 Cb 0.23 -2.41 -0.02 0.00 -1.46 0.00 0.00 37.83 34.17 2zqt s LYS 77 CO 0.76 -0.68 1.28 0.42 0.16 0.00 0.00 175.35 177.29 2zqt s ILE 78 N 1.53 4.21 -0.31 5.43 -1.09 -0.34 -4.89 121.20 125.73 2zqt s ILE 78 Ca -0.02 1.48 0.06 0.00 -2.23 0.00 0.00 60.65 59.95 2zqt s ILE 78 Cb -0.18 -3.96 -0.05 0.00 -1.58 0.00 0.00 42.46 36.69 2zqt s ILE 78 CO -0.09 -0.10 0.28 0.35 -1.23 0.00 0.00 174.94 174.15 2zqt n THR 79 N 5.18 0.00 -2.01 2.92 -2.24 -1.26 -4.02 114.28 112.85 2zqt n THR 79 Ca 0.13 -0.38 -0.36 0.00 -2.27 0.00 0.00 64.05 61.18 2zqt n THR 79 Cb 0.45 1.01 0.03 0.00 -2.10 0.00 0.00 70.33 69.72 2zqt n THR 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2zqt s ARG 80 N -1.46 3.02 0.77 -0.78 1.70 -1.26 -4.59 118.95 116.35 2zqt s ARG 80 Ca 0.03 1.85 -0.12 0.00 -0.47 0.00 0.00 55.73 57.02 2zqt s ARG 80 Cb 0.04 -1.97 0.05 0.00 -0.57 0.00 0.00 34.95 32.51 2zqt s ARG 80 CO 0.22 -1.18 1.11 0.95 -1.08 0.00 0.00 175.30 175.33 2zqt s THR 81 N -1.57 3.02 0.30 4.99 -4.23 -1.26 -0.43 115.64 116.46 2zqt s THR 81 Ca 0.77 0.33 -0.01 0.00 -1.18 0.00 0.00 61.69 61.60 2zqt s THR 81 Cb -0.31 -3.21 0.27 0.00 1.34 0.00 0.00 72.50 70.59 2zqt s THR 81 CO 0.34 -0.43 1.94 0.50 -0.54 0.00 0.00 174.62 176.43 2zqt h LYS 82 N -0.95 1.05 -0.45 3.99 3.64 -1.94 -0.47 116.57 121.44 2zqt h LYS 82 Ca -0.46 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 58.84 2zqt h LYS 82 Cb 1.27 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 2zqt h LYS 82 CO 0.62 0.69 0.22 0.93 -2.27 0.00 0.00 179.45 179.65 2zqt h GLU 83 N 1.08 0.64 -0.64 1.90 3.07 -1.99 -1.03 114.58 117.61 2zqt h GLU 83 Ca 0.34 -0.09 -0.06 0.00 -0.50 0.00 0.00 59.36 59.05 2zqt h GLU 83 Cb 0.02 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 27.78 2zqt h GLU 83 CO -0.10 0.54 0.15 0.93 -1.40 0.00 0.00 179.01 179.13 2zqt h GLU 84 N 0.58 1.01 -0.80 2.33 5.08 -1.81 -1.62 114.58 119.36 2zqt h GLU 84 Ca 0.16 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2zqt h GLU 84 Cb 0.10 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 2zqt h GLU 84 CO -0.02 0.90 0.39 0.00 -1.00 0.00 0.00 179.01 179.28 2zqt h ALA 85 N 1.19 1.02 -0.36 3.43 0.00 -0.86 -1.90 119.26 121.79 2zqt h ALA 85 Ca 0.20 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2zqt h ALA 85 Cb 0.35 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2zqt h ALA 85 CO 0.00 0.58 -0.11 1.25 0.00 0.00 0.00 179.25 180.97 2zqt h LEU 86 N 1.12 0.60 -0.48 0.00 5.85 -0.74 -0.28 115.31 121.38 2zqt h LEU 86 Ca 0.27 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 2zqt h LEU 86 Cb 0.10 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 2zqt h LEU 86 CO -0.04 0.75 0.17 1.05 -0.34 0.00 0.00 178.44 180.04 2zqt h GLU 87 N 0.57 0.72 -0.23 1.25 4.11 -0.95 0.80 114.58 120.85 2zqt h GLU 87 Ca 0.10 -0.14 -0.01 0.00 0.07 0.00 0.00 59.36 59.38 2zqt h GLU 87 Cb 0.53 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2zqt h GLU 87 CO 0.03 0.67 0.11 -0.07 0.07 0.00 0.00 179.01 179.82 2zqt h LEU 88 N 0.63 0.30 -0.50 3.06 3.38 -0.91 -0.78 115.31 120.50 2zqt h LEU 88 Ca 0.16 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.06 2zqt h LEU 88 Cb 0.22 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 2zqt h LEU 88 CO -0.01 0.33 0.23 0.40 0.09 0.00 0.00 178.44 179.49 2zqt h ILE 89 N 0.25 0.92 -0.92 1.22 1.08 -0.76 -0.26 117.51 119.04 2zqt h ILE 89 Ca 0.08 -0.16 -0.01 0.00 -0.39 0.00 0.00 64.86 64.39 2zqt h ILE 89 Cb 0.11 0.43 -0.04 0.00 -3.07 0.00 0.00 36.82 34.25 2zqt h ILE 89 CO -0.01 0.08 0.55 0.78 -0.69 0.00 0.00 178.15 178.86 2zqt h ASN 90 N 0.45 1.11 -0.52 1.72 2.35 -0.60 -0.98 115.58 119.12 2zqt h ASN 90 Ca 0.22 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 2zqt h ASN 90 Cb 0.16 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 2zqt h ASN 90 CO -0.18 0.86 0.22 1.23 -1.65 0.00 0.00 177.43 177.91 2zqt h GLY 91 N 1.28 0.82 0.94 2.83 0.00 -0.35 -1.37 103.07 107.22 2zqt h GLY 91 Ca 0.33 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 2zqt h GLY 91 CO -0.06 0.41 0.09 -0.97 0.00 0.00 0.00 176.54 176.01 2zqt h TYR 92 N 0.69 0.70 -0.61 5.60 0.05 -0.59 -1.04 116.97 121.76 2zqt h TYR 92 Ca 0.17 -0.09 0.03 0.00 0.05 0.00 0.00 58.73 58.90 2zqt h TYR 92 Cb 0.17 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.67 2zqt h TYR 92 CO 0.00 0.67 0.37 0.82 -1.05 0.00 0.00 178.16 178.97 2zqt h ILE 93 N 0.53 1.06 -0.66 -2.88 2.04 -1.04 -0.93 117.51 115.62 2zqt h ILE 93 Ca 0.13 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 2zqt h ILE 93 Cb 0.33 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 2zqt h ILE 93 CO 0.00 0.13 0.28 -0.61 0.00 0.00 0.00 178.15 177.96 2zqt h GLN 94 N 0.72 0.97 -0.41 2.37 -0.00 -0.98 -0.66 115.11 117.13 2zqt h GLN 94 Ca 0.25 -0.16 -0.08 0.00 -0.00 0.00 0.00 58.65 58.65 2zqt h GLN 94 Cb 0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 27.48 27.34 2zqt h GLN 94 CO -0.11 0.80 -0.09 -0.22 0.00 0.00 0.00 178.83 179.20 2zqt h LYS 95 N 0.93 0.71 -0.11 1.69 3.64 -0.74 -0.52 116.57 122.16 2zqt h LYS 95 Ca 0.22 -0.22 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2zqt h LYS 95 Cb 0.17 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2zqt h LYS 95 CO -0.02 0.79 -0.29 0.82 -2.27 0.00 0.00 179.45 178.48 2zqt h ILE 96 N 0.65 1.38 -0.10 2.00 2.04 -0.81 -2.14 117.51 120.54 2zqt h ILE 96 Ca 0.12 -1.60 -0.05 0.00 1.00 0.00 0.00 64.86 64.33 2zqt h ILE 96 Cb 0.54 2.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2zqt h ILE 96 CO 0.03 0.47 -0.18 0.11 0.00 0.00 0.00 178.15 178.58 2zqt h LYS 97 N -0.03 0.16 0.00 2.37 1.57 -1.01 -2.64 116.57 116.99 2zqt h LYS 97 Ca -0.00 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 2zqt h LYS 97 Cb 0.90 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 2zqt h LYS 97 CO 0.06 0.34 -0.30 0.66 -0.57 0.00 0.00 179.45 179.64 2zqt h SER 98 N 0.15 0.00 0.00 0.86 4.64 -1.07 -3.47 113.55 114.66 2zqt h SER 98 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2zqt h SER 98 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2zqt h SER 98 CO 0.03 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.90 2zqt n GLY 99 N 0.27 0.39 0.16 -0.77 0.00 -0.99 -4.95 105.19 99.29 2zqt n GLY 99 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2zqt n GLY 99 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2zqt h GLU 100 N 4.17 0.00 -4.85 1.61 4.81 -1.73 -3.45 114.58 115.15 2zqt h GLU 100 Ca 0.00 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.95 2zqt h GLU 100 Cb 0.00 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.23 2zqt h GLU 100 CO 0.00 0.51 -0.69 -1.21 -0.73 0.00 0.00 179.01 176.89 2zqt s GLU 101 N -3.71 1.00 0.13 1.92 0.41 -0.84 -5.03 118.70 112.59 2zqt s GLU 101 Ca -0.01 -1.44 0.07 0.00 -0.41 0.00 0.00 54.97 53.18 2zqt s GLU 101 Cb 0.13 -0.38 -0.04 0.00 -1.78 0.00 0.00 34.13 32.05 2zqt s GLU 101 CO 0.74 -0.02 -0.07 0.16 -0.49 0.00 0.00 175.26 175.58 2zqt s ASP 102 N -3.13 4.51 0.11 -0.19 -4.77 -1.26 -4.16 116.67 107.78 2zqt s ASP 102 Ca 0.17 -0.40 -0.24 0.00 -3.30 0.00 0.00 52.55 48.78 2zqt s ASP 102 Cb 0.05 -0.89 -0.09 0.00 -1.09 0.00 0.00 42.92 40.89 2zqt s ASP 102 CO -0.00 0.15 1.69 0.15 0.70 0.00 0.00 175.17 177.86 2zqt h PHE 103 N 3.28 -0.27 -0.72 2.11 3.04 -1.97 -1.86 116.94 120.55 2zqt h PHE 103 Ca -0.48 0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.51 2zqt h PHE 103 Cb 1.18 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 39.76 2zqt h PHE 103 CO 0.62 -0.16 0.45 0.93 -2.02 0.00 0.00 178.31 178.12 2zqt h GLU 104 N -0.19 0.85 -0.52 1.11 3.07 -1.97 0.61 114.58 117.54 2zqt h GLU 104 Ca 0.03 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 2zqt h GLU 104 Cb 0.23 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.93 2zqt h GLU 104 CO -0.10 0.56 0.21 0.66 -1.40 0.00 0.00 179.01 178.95 2zqt h SER 105 N 0.87 0.71 -0.58 1.42 4.64 -1.83 -0.49 113.55 118.28 2zqt h SER 105 Ca 0.29 -0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.37 2zqt h SER 105 Cb 0.03 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 61.92 2zqt h SER 105 CO -0.12 0.68 0.07 -0.07 -0.87 0.00 0.00 176.83 176.52 2zqt h LEU 106 N 0.69 0.95 -0.38 5.97 3.38 -0.89 -2.42 115.31 122.61 2zqt h LEU 106 Ca 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2zqt h LEU 106 Cb 0.19 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2zqt h LEU 106 CO -0.02 0.99 0.21 0.00 0.09 0.00 0.00 178.44 179.71 2zqt h ALA 107 N 1.00 0.49 -0.74 1.53 0.00 -0.63 0.11 119.26 121.02 2zqt h ALA 107 Ca 0.17 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.07 2zqt h ALA 107 Cb 0.46 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2zqt h ALA 107 CO 0.02 0.01 0.49 0.77 0.00 0.00 0.00 179.25 180.54 2zqt h SER 108 N 0.49 0.68 0.23 0.00 0.02 -0.98 -2.01 113.55 111.98 2zqt h SER 108 Ca 0.13 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.74 2zqt h SER 108 Cb 0.06 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2zqt h SER 108 CO -0.02 0.43 -1.85 1.56 -1.14 0.00 0.00 176.83 175.81 2zqt h GLN 109 N 0.77 0.26 0.00 3.45 4.20 -1.04 -3.43 115.11 119.31 2zqt h GLN 109 Ca 0.32 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2zqt h GLN 109 Cb 0.27 0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.22 2zqt h GLN 109 CO -0.11 1.13 0.00 1.19 -0.67 0.00 0.00 178.83 180.37 2zqt n PHE 110 N -3.45 0.00 -2.21 2.96 3.72 0.35 -5.02 117.46 113.81 2zqt n PHE 110 Ca -0.26 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.72 2zqt n PHE 110 Cb 1.05 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.56 2zqt n PHE 110 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2zqt s SER 111 N -0.42 6.88 0.00 4.37 0.15 -0.76 -4.83 113.70 119.10 2zqt s SER 111 Ca 0.00 2.37 0.29 0.00 0.70 0.00 0.00 55.95 59.31 2zqt s SER 111 Cb 0.00 -2.60 1.47 0.00 -1.71 0.00 0.00 66.02 63.17 2zqt s SER 111 CO 0.00 -0.56 2.01 0.47 1.20 0.00 0.00 173.24 176.36 2zqt n ASP 112 N 3.05 0.00 -4.81 5.45 8.00 0.12 -4.76 116.55 123.60 2zqt n ASP 112 Ca 0.08 -0.11 -0.35 0.00 0.71 0.00 0.00 54.79 55.11 2zqt n ASP 112 Cb 0.43 -0.29 -0.06 0.00 -0.02 0.00 0.00 41.12 41.17 2zqt n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2zqt h SER 114 N 3.02 0.00 0.15 0.00 4.64 -2.00 -1.34 113.55 118.03 2zqt h SER 114 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2zqt h SER 114 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2zqt h SER 114 CO 0.65 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.07 2zqt n SER 115 N -2.81 0.00 -0.01 4.97 3.41 -1.26 -2.16 113.62 115.76 2zqt n SER 115 Ca -0.02 -0.06 0.19 0.00 -0.26 0.00 0.00 58.87 58.72 2zqt n SER 115 Cb 0.09 -0.18 0.66 0.00 -0.26 0.00 0.00 64.21 64.52 2zqt n SER 115 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2zqt h ALA 116 N 2.64 2.42 0.00 7.33 0.00 -1.49 0.16 119.26 130.32 2zqt h ALA 116 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2zqt h ALA 116 Cb 0.07 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2zqt h ALA 116 CO 0.00 -0.57 -0.08 1.57 0.00 0.00 0.00 179.25 180.16 2zqt h LYS 117 N 0.06 0.00 -0.69 0.00 2.10 -1.70 -1.42 116.57 114.93 2zqt h LYS 117 Ca 0.26 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.59 2zqt h LYS 117 Cb 0.94 0.00 -0.19 0.00 -0.90 0.00 0.00 32.23 32.08 2zqt h LYS 117 CO -0.02 0.08 0.30 0.00 -2.00 0.00 0.00 179.45 177.81 2zqt n ALA 118 N -2.18 4.81 -2.56 0.07 0.00 -0.22 -4.91 120.51 115.52 2zqt n ALA 118 Ca -0.01 -2.83 -0.19 0.00 0.00 0.00 0.00 53.44 50.40 2zqt n ALA 118 Cb 0.26 -1.13 -0.00 0.00 0.00 0.00 0.00 19.45 18.58 2zqt n ALA 118 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2zqt n ARG 119 N -0.91 -2.42 0.00 0.00 1.74 -0.53 -2.03 116.66 112.50 2zqt n ARG 119 Ca 0.45 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 58.41 2zqt n ARG 119 Cb 1.36 -5.56 0.00 0.00 -1.02 0.00 0.00 32.46 27.24 2zqt n ARG 119 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zqt n GLY 120 N -1.06 1.48 3.72 -0.13 0.00 0.39 -4.62 105.19 104.97 2zqt n GLY 120 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2zqt n GLY 120 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2zqt s ASP 121 N -2.02 6.68 0.00 1.61 2.15 -0.86 -1.08 116.67 123.15 2zqt s ASP 121 Ca 0.00 2.51 0.14 0.00 0.43 0.00 0.00 52.55 55.63 2zqt s ASP 121 Cb 0.00 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.99 2zqt s ASP 121 CO 0.00 -0.75 0.75 0.18 -0.17 0.00 0.00 175.17 175.18 2zqt n LEU 122 N 3.90 1.31 0.00 -1.34 4.77 -0.30 -4.81 117.00 120.52 2zqt n LEU 122 Ca 0.13 -0.70 0.01 0.00 -0.03 0.00 0.00 56.01 55.42 2zqt n LEU 122 Cb 0.40 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2zqt n LEU 122 CO 0.60 0.26 -0.01 0.61 -1.33 0.00 0.00 177.39 177.52 2zqt n GLY 123 N 1.15 -2.00 3.85 -0.72 0.00 -1.25 -4.91 105.19 101.31 2zqt n GLY 123 Ca 0.05 -1.39 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 2zqt n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zqt s ALA 124 N -1.17 3.37 0.20 4.61 0.00 -1.26 -3.21 121.76 124.31 2zqt s ALA 124 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 51.96 51.76 2zqt s ALA 124 Cb 0.00 -2.70 0.03 0.00 0.00 0.00 0.00 23.12 20.45 2zqt s ALA 124 CO 0.00 0.37 0.53 -0.59 0.00 0.00 0.00 175.76 176.07 2zqt s PHE 125 N -1.95 -0.09 0.37 0.00 -0.71 0.10 -4.97 117.98 110.73 2zqt s PHE 125 Ca 0.53 -0.26 0.08 0.00 -1.04 0.00 0.00 56.93 56.24 2zqt s PHE 125 Cb -0.10 0.39 -0.05 0.00 -1.21 0.00 0.00 43.02 42.04 2zqt s PHE 125 CO 0.18 -0.93 0.12 -1.12 -1.34 0.00 0.00 175.22 172.14 2zqt s SER 126 N -2.88 4.46 0.52 1.98 0.01 -1.26 -2.26 113.70 114.26 2zqt s SER 126 Ca 0.10 -0.94 -0.22 0.00 1.31 0.00 0.00 55.95 56.19 2zqt s SER 126 Cb -0.01 -0.58 -0.06 0.00 0.21 0.00 0.00 66.02 65.57 2zqt s SER 126 CO -0.02 -0.38 1.24 0.54 0.41 0.00 0.00 173.24 175.04 2zqt n ARG 127 N -1.13 1.58 -0.13 12.44 1.74 -1.26 -2.61 116.66 127.29 2zqt n ARG 127 Ca -0.03 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 2zqt n ARG 127 Cb 0.63 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 2zqt n ARG 127 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2zqt n GLY 128 N 0.89 0.61 0.04 -0.13 0.00 -1.26 -4.94 105.19 100.40 2zqt n GLY 128 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 2zqt n GLY 128 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2zqt n GLN 129 N -2.00 0.71 -4.52 1.61 -0.06 -1.07 -5.01 117.38 107.04 2zqt n GLN 129 Ca 0.00 -0.13 -0.24 0.00 -2.00 0.00 0.00 57.00 54.63 2zqt n GLN 129 Cb 0.00 -1.49 -0.11 0.00 -4.06 0.00 0.00 30.24 24.58 2zqt n GLN 129 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2zqt s ALA 130 N -3.10 2.70 0.52 1.69 0.00 -1.26 -5.08 121.76 117.23 2zqt s ALA 130 Ca -0.08 -2.16 -0.23 0.00 0.00 0.00 0.00 51.96 49.49 2zqt s ALA 130 Cb 0.11 0.45 -0.06 0.00 0.00 0.00 0.00 23.12 23.62 2zqt s ALA 130 CO 0.83 -0.23 1.37 -0.65 0.00 0.00 0.00 175.76 177.08 2zqt s GLN 131 N -3.81 3.29 0.19 0.00 -0.21 -1.26 -4.68 119.66 113.17 2zqt s GLN 131 Ca 0.36 2.26 -0.17 0.00 0.02 0.00 0.00 55.36 57.84 2zqt s GLN 131 Cb 0.09 -2.35 0.15 0.00 1.00 0.00 0.00 33.01 31.90 2zqt s GLN 131 CO 0.17 -1.08 1.63 -0.22 -2.12 0.00 0.00 175.29 173.66 2zqt h LYS 132 N 1.68 -0.06 -0.24 2.91 1.63 -1.98 0.85 116.57 121.36 2zqt h LYS 132 Ca -0.51 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.22 2zqt h LYS 132 Cb 1.29 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.92 2zqt h LYS 132 CO 0.58 -0.04 -0.17 -1.35 -3.45 0.00 0.00 179.45 175.02 2zqt h PRO 133 N -0.06 0.41 -0.20 1.90 0.11 -1.91 0.15 132.00 132.39 2zqt h PRO 133 Ca 0.24 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 66.18 2zqt h PRO 133 Cb 0.43 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 2zqt h PRO 133 CO -0.55 0.57 -0.07 0.35 -0.21 0.00 0.00 178.00 178.08 2zqt h PHE 134 N 0.37 0.46 -0.26 0.65 3.04 -1.56 -1.94 116.94 117.71 2zqt h PHE 134 Ca 0.07 -0.11 -0.01 0.00 3.98 0.00 0.00 57.97 61.90 2zqt h PHE 134 Cb 0.52 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.91 2zqt h PHE 134 CO 0.01 0.68 0.13 1.49 -2.02 0.00 0.00 178.31 178.60 2zqt h GLU 135 N 0.12 0.38 -0.39 1.11 4.81 -0.48 -0.87 114.58 119.25 2zqt h GLU 135 Ca 0.05 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2zqt h GLU 135 Cb 0.54 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 2zqt h GLU 135 CO 0.02 0.37 0.26 -0.44 -0.73 0.00 0.00 179.01 178.50 2zqt h ASP 136 N 0.29 0.45 -0.26 1.04 3.32 -0.73 -1.53 116.42 119.00 2zqt h ASP 136 Ca 0.09 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 2zqt h ASP 136 Cb 0.12 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2zqt h ASP 136 CO -0.01 0.33 0.14 0.00 -1.72 0.00 0.00 179.24 177.98 2zqt h ALA 137 N 1.14 0.34 -0.68 3.45 0.00 -1.24 -2.34 119.26 119.93 2zqt h ALA 137 Ca 0.14 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.01 2zqt h ALA 137 Cb -0.06 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2zqt h ALA 137 CO -0.03 -0.13 0.43 0.77 0.00 0.00 0.00 179.25 180.28 2zqt h SER 138 N 0.31 0.70 1.09 0.00 0.02 -0.76 -1.57 113.55 113.33 2zqt h SER 138 Ca 0.09 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2zqt h SER 138 Cb 0.07 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.45 2zqt h SER 138 CO -0.01 0.49 0.00 0.49 -1.14 0.00 0.00 176.83 176.65 2zqt n PHE 139 N -4.67 0.40 0.46 3.45 3.01 -0.61 -2.70 117.46 116.80 2zqt n PHE 139 Ca 0.07 0.13 0.11 0.00 1.01 0.00 0.00 57.45 58.77 2zqt n PHE 139 Cb 0.08 -0.70 -0.02 0.00 -0.01 0.00 0.00 39.48 38.83 2zqt n PHE 139 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2zqt n ALA 140 N -1.63 3.30 -1.77 4.37 0.00 -0.84 -4.64 120.51 119.30 2zqt n ALA 140 Ca 0.06 -0.41 -0.38 0.00 0.00 0.00 0.00 53.44 52.70 2zqt n ALA 140 Cb 0.34 -0.94 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 2zqt n ALA 140 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2zqt s LEU 141 N -4.11 4.28 0.44 0.00 1.43 -0.65 -4.95 118.68 115.12 2zqt s LEU 141 Ca 0.02 2.17 -0.01 0.00 -1.03 0.00 0.00 54.13 55.28 2zqt s LEU 141 Cb 0.14 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.36 2zqt s LEU 141 CO 0.82 -0.42 0.68 -0.13 0.23 0.00 0.00 176.35 177.53 2zqt s ARG 142 N -2.13 3.23 0.13 1.70 0.52 -1.26 -4.98 118.95 116.15 2zqt s ARG 142 Ca 0.54 -0.31 -0.34 0.00 -0.52 0.00 0.00 55.73 55.10 2zqt s ARG 142 Cb -0.27 -2.53 -0.13 0.00 0.52 0.00 0.00 34.95 32.54 2zqt s ARG 142 CO 0.34 -0.19 1.65 2.41 0.02 0.00 0.00 175.30 179.52 2zqt n THR 143 N -2.08 0.11 -0.17 0.02 -1.04 -1.26 -1.09 114.28 108.77 2zqt n THR 143 Ca -0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2zqt n THR 143 Cb 0.57 -1.64 0.00 0.00 -1.82 0.00 0.00 70.33 67.43 2zqt n THR 143 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2zqt n GLY 144 N 3.64 1.11 3.86 3.41 0.00 0.90 -5.02 105.19 113.08 2zqt n GLY 144 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2zqt n GLY 144 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2zqt s GLU 145 N -0.55 3.88 -0.06 1.61 2.02 -0.25 -4.83 118.70 120.52 2zqt s GLU 145 Ca 0.00 0.53 0.03 0.00 0.02 0.00 0.00 54.97 55.55 2zqt s GLU 145 Cb 0.00 -2.44 -0.02 0.00 0.10 0.00 0.00 34.13 31.77 2zqt s GLU 145 CO 0.00 0.10 -0.15 1.41 0.02 0.00 0.00 175.26 176.64 2zqt s MET 146 N -3.32 2.66 0.86 1.61 -2.45 -1.26 -1.15 119.30 116.24 2zqt s MET 146 Ca 0.52 -0.71 -0.12 0.00 -1.25 0.00 0.00 55.69 54.13 2zqt s MET 146 Cb -0.10 -2.40 0.11 0.00 1.25 0.00 0.00 34.83 33.68 2zqt s MET 146 CO 0.24 0.53 1.12 -1.54 1.05 0.00 0.00 175.02 176.41 2zqt s SER 147 N -0.50 3.97 0.28 1.11 1.04 0.79 -4.79 113.70 115.60 2zqt s SER 147 Ca 0.07 1.15 0.00 0.00 0.48 0.00 0.00 55.95 57.65 2zqt s SER 147 Cb -0.12 -1.81 0.00 0.00 0.10 0.00 0.00 66.02 64.19 2zqt s SER 147 CO 0.02 -2.28 0.00 0.61 0.98 0.00 0.00 173.24 172.56 2zqt n GLY 148 N -2.10 -0.44 3.67 7.32 0.00 -0.59 -4.55 105.19 108.50 2zqt n GLY 148 Ca 0.07 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 2zqt n GLY 148 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2zqt s PRO 149 N -0.62 4.18 -0.17 1.61 0.02 -1.26 -4.58 135.00 134.18 2zqt s PRO 149 Ca 0.00 2.34 -0.01 0.00 0.02 0.00 0.00 61.00 63.35 2zqt s PRO 149 Cb 0.00 -3.86 -0.00 0.00 0.02 0.00 0.00 34.50 30.66 2zqt s PRO 149 CO 0.00 -0.82 -0.14 0.08 -0.33 0.00 0.00 177.00 175.79 2zqt s VAL 150 N 3.55 2.74 -0.18 3.83 1.01 -0.33 -4.77 120.40 126.25 2zqt s VAL 150 Ca 0.77 -0.73 -0.14 0.00 0.00 0.00 0.00 61.98 61.88 2zqt s VAL 150 Cb -0.38 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2zqt s VAL 150 CO 0.33 0.50 0.30 -0.36 0.00 0.00 0.00 175.10 175.88 2zqt s PHE 151 N 0.99 3.41 0.38 5.22 0.40 -1.26 -0.26 117.98 126.87 2zqt s PHE 151 Ca -0.02 0.55 0.05 0.00 -0.60 0.00 0.00 56.93 56.91 2zqt s PHE 151 Cb -0.15 -2.38 -0.02 0.00 0.51 0.00 0.00 43.02 40.98 2zqt s PHE 151 CO -0.02 0.14 0.18 0.25 0.70 0.00 0.00 175.22 176.47 2zqt n THR 152 N 3.90 0.00 0.30 0.64 -2.24 -0.46 -4.73 114.28 111.68 2zqt n THR 152 Ca -0.11 -2.36 0.17 0.00 -2.27 0.00 0.00 64.05 59.48 2zqt n THR 152 Cb 0.52 0.94 0.79 0.00 -2.10 0.00 0.00 70.33 70.48 2zqt n THR 152 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2zqt h ASP 153 N 1.72 0.00 0.62 3.42 3.32 -1.97 -2.43 116.42 121.09 2zqt h ASP 153 Ca -0.29 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.57 2zqt h ASP 153 Cb 1.19 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2zqt h ASP 153 CO 0.45 0.00 -0.84 0.28 -1.72 0.00 0.00 179.24 177.41 2zqt h SER 154 N 0.00 0.20 0.00 6.45 0.02 -1.95 0.42 113.55 118.69 2zqt h SER 154 Ca 0.00 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 2zqt h SER 154 Cb 0.24 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.72 2zqt h SER 154 CO 0.00 0.95 0.00 0.61 -1.14 0.00 0.00 176.83 177.25 2zqt n GLY 155 N 0.81 0.11 3.29 -3.77 0.00 -0.92 -4.51 105.19 100.21 2zqt n GLY 155 Ca -0.03 -1.09 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 2zqt n GLY 155 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2zqt s ILE 156 N -4.00 2.33 0.05 -0.61 1.01 -0.49 -1.36 121.20 118.12 2zqt s ILE 156 Ca 0.00 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 59.77 2zqt s ILE 156 Cb 0.00 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 2zqt s ILE 156 CO 0.00 0.56 -0.17 -1.00 0.00 0.00 0.00 174.94 174.33 2zqt s HIS 157 N 0.05 2.60 -0.15 3.97 3.76 0.64 -0.46 115.29 125.70 2zqt s HIS 157 Ca -0.09 -0.23 -0.04 0.00 -0.15 0.00 0.00 55.06 54.55 2zqt s HIS 157 Cb -0.15 -1.47 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 2zqt s HIS 157 CO 0.06 0.28 -0.02 0.42 -0.85 0.00 0.00 174.74 174.63 2zqt s ILE 158 N -0.96 4.04 -0.10 0.60 1.01 -0.01 -1.18 121.20 124.60 2zqt s ILE 158 Ca 0.15 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.53 2zqt s ILE 158 Cb -0.11 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.58 2zqt s ILE 158 CO 0.06 0.50 -0.20 -0.63 0.00 0.00 0.00 174.94 174.68 2zqt s ILE 159 N 0.24 2.50 -0.20 2.92 1.01 -1.26 -0.60 121.20 125.81 2zqt s ILE 159 Ca -0.02 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 2zqt s ILE 159 Cb -0.14 -1.98 0.01 0.00 0.01 0.00 0.00 42.46 40.36 2zqt s ILE 159 CO 0.02 0.55 -0.14 -0.22 0.00 0.00 0.00 174.94 175.16 2zqt s LEU 160 N 0.12 2.49 -0.20 2.97 2.96 0.13 -0.15 118.68 126.99 2zqt s LEU 160 Ca -0.10 -0.62 -0.24 0.00 -0.22 0.00 0.00 54.13 52.95 2zqt s LEU 160 Cb -0.16 -1.57 -0.01 0.00 0.50 0.00 0.00 46.19 44.95 2zqt s LEU 160 CO 0.06 -0.02 0.80 -0.60 -1.32 0.00 0.00 176.35 175.26 2zqt s ARG 161 N 1.34 4.24 -0.08 1.98 3.52 -0.30 -0.84 118.95 128.80 2zqt s ARG 161 Ca 0.04 0.93 0.16 0.00 -0.13 0.00 0.00 55.73 56.73 2zqt s ARG 161 Cb -0.14 -3.61 -0.23 0.00 -1.56 0.00 0.00 34.95 29.41 2zqt s ARG 161 CO -0.09 -0.40 0.24 0.25 -0.81 0.00 0.00 175.30 174.49 2zqt n THR 162 N 4.95 0.47 -1.24 4.11 -2.24 0.27 -0.07 114.28 120.53 2zqt n THR 162 Ca 0.04 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2zqt n THR 162 Cb 0.48 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 2zqt n THR 162 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88