#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2czu h GLN 36 N 0.00 0.50 -0.19 2.61 4.15 -2.01 0.22 115.11 120.39 2czu h GLN 36 Ca 0.00 -0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.44 2czu h GLN 36 Cb 0.00 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 2czu h GLN 36 CO 0.00 0.33 0.24 -0.44 -1.93 0.00 0.00 178.83 177.03 2czu h ASP 37 N 0.52 0.00 1.05 -0.69 3.45 -2.01 -0.77 116.42 117.97 2czu h ASP 37 Ca 0.55 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 58.01 2czu h ASP 37 Cb 0.97 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.74 2czu h ASP 37 CO -0.46 0.00 -0.01 0.11 -1.57 0.00 0.00 179.24 177.31 2czu h LYS 38 N 0.00 0.00 -0.42 3.56 1.79 -0.99 -2.99 116.57 117.52 2czu h LYS 38 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2czu h LYS 38 Cb 0.56 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2czu h LYS 38 CO -0.00 0.01 0.00 1.19 -1.08 0.00 0.00 179.45 179.57 2czu n PHE 39 N -3.10 0.54 -1.14 -1.35 3.01 -0.30 -4.83 117.46 110.29 2czu n PHE 39 Ca 0.01 -0.27 -0.29 0.00 1.01 0.00 0.00 57.45 57.91 2czu n PHE 39 Cb 0.31 0.00 0.19 0.00 -0.01 0.00 0.00 39.48 39.97 2czu n PHE 39 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2czu s LEU 40 N -1.41 1.45 0.00 4.37 1.43 -1.13 -4.80 118.68 118.58 2czu s LEU 40 Ca 0.39 1.13 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 2czu s LEU 40 Cb 0.22 -3.26 0.00 0.00 0.03 0.00 0.00 46.19 43.19 2czu s LEU 40 CO 0.31 -3.28 0.00 0.61 0.23 0.00 0.00 176.35 174.22 2czu n GLY 41 N -1.03 -1.90 3.70 -3.19 0.00 0.13 -4.85 105.19 98.05 2czu n GLY 41 Ca 0.05 -1.99 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 2czu n GLY 41 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2czu s ARG 42 N 0.00 4.37 0.23 1.61 3.52 -1.26 0.32 118.95 127.74 2czu s ARG 42 Ca 0.00 0.78 0.01 0.00 -0.13 0.00 0.00 55.73 56.40 2czu s ARG 42 Cb 0.00 -3.48 -0.05 0.00 -1.56 0.00 0.00 34.95 29.86 2czu s ARG 42 CO 0.00 -0.01 0.06 -1.58 -0.81 0.00 0.00 175.30 172.96 2czu s TRP 43 N 1.10 1.42 -0.05 5.12 0.52 0.38 -4.71 118.94 122.72 2czu s TRP 43 Ca 0.34 -1.13 0.01 0.00 0.02 0.00 0.00 56.10 55.35 2czu s TRP 43 Cb -0.17 -0.82 0.02 0.00 -1.15 0.00 0.00 33.47 31.35 2czu s TRP 43 CO 0.15 -0.30 -0.07 0.71 0.02 0.00 0.00 176.95 177.47 2czu s TYR 44 N -3.73 0.94 -0.36 -1.98 2.02 0.89 -0.94 117.35 114.20 2czu s TYR 44 Ca 0.33 -0.30 -0.29 0.00 -0.37 0.00 0.00 57.07 56.44 2czu s TYR 44 Cb 0.07 -0.77 0.01 0.00 -0.40 0.00 0.00 41.96 40.87 2czu s TYR 44 CO 0.10 -0.21 1.30 -1.54 -1.57 0.00 0.00 175.55 173.63 2czu s SER 45 N 0.84 6.58 -0.01 2.29 1.04 -0.51 -0.27 113.70 123.65 2czu s SER 45 Ca -0.12 0.97 0.09 0.00 0.48 0.00 0.00 55.95 57.38 2czu s SER 45 Cb -0.15 -2.54 -0.14 0.00 0.10 0.00 0.00 66.02 63.29 2czu s SER 45 CO 0.01 -1.20 0.23 0.00 0.98 0.00 0.00 173.24 173.26 2czu n ALA 46 N 7.98 2.46 -2.92 5.32 0.00 0.17 -3.61 120.51 129.92 2czu n ALA 46 Ca 0.15 -0.23 -0.12 0.00 0.00 0.00 0.00 53.44 53.24 2czu n ALA 46 Cb 0.47 -0.33 -0.13 0.00 0.00 0.00 0.00 19.45 19.46 2czu n ALA 46 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2czu s GLY 47 N -2.93 -0.02 -0.10 0.00 0.00 -0.90 -1.60 107.32 101.77 2czu s GLY 47 Ca -0.03 0.10 -0.07 0.00 0.00 0.00 0.00 44.72 44.73 2czu s GLY 47 CO 0.39 0.08 0.24 -2.27 0.00 0.00 0.00 173.10 171.54 2czu s LEU 48 N -0.06 0.76 -0.03 0.66 2.96 -0.52 -0.79 118.68 121.66 2czu s LEU 48 Ca -0.01 0.49 -0.05 0.00 -0.22 0.00 0.00 54.13 54.34 2czu s LEU 48 Cb -0.01 0.76 0.01 0.00 0.50 0.00 0.00 46.19 47.45 2czu s LEU 48 CO 0.00 -0.12 0.13 0.00 -1.32 0.00 0.00 176.35 175.03 2czu s ALA 49 N 0.70 -0.31 0.07 5.97 0.00 -0.24 -1.70 121.76 126.26 2czu s ALA 49 Ca -0.05 0.13 -0.27 0.00 0.00 0.00 0.00 51.96 51.77 2czu s ALA 49 Cb -0.06 -0.08 0.09 0.00 0.00 0.00 0.00 23.12 23.07 2czu s ALA 49 CO -0.04 -0.12 1.11 0.45 0.00 0.00 0.00 175.76 177.15 2czu s SER 50 N -0.56 -0.12 0.00 0.00 0.15 -1.14 -0.66 113.70 111.37 2czu s SER 50 Ca -0.06 -0.28 0.04 0.00 0.70 0.00 0.00 55.95 56.35 2czu s SER 50 Cb -0.04 0.34 0.04 0.00 -1.71 0.00 0.00 66.02 64.65 2czu s SER 50 CO 0.01 -0.63 0.69 -0.46 1.20 0.00 0.00 173.24 174.05 2czu n ASN 51 N -0.48 1.48 -3.77 5.45 2.04 -1.15 -4.81 115.26 114.02 2czu n ASN 51 Ca -0.07 -1.28 -0.28 0.00 -0.44 0.00 0.00 54.58 52.51 2czu n ASN 51 Cb 0.62 -0.01 0.25 0.00 -2.53 0.00 0.00 39.78 38.10 2czu n ASN 51 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 2czu n SER 52 N 0.20 -3.14 0.04 0.53 2.88 -1.26 -4.91 113.62 107.95 2czu n SER 52 Ca 0.03 -0.52 -0.22 0.00 -1.33 0.00 0.00 58.87 56.83 2czu n SER 52 Cb 0.13 -1.03 -0.14 0.00 -0.75 0.00 0.00 64.21 62.42 2czu n SER 52 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2czu h SER 53 N -3.06 0.50 0.43 -3.46 0.02 -1.99 -3.24 113.55 102.76 2czu h SER 53 Ca -0.46 -0.92 -0.01 0.00 -0.84 0.00 0.00 61.79 59.56 2czu h SER 53 Cb 1.24 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.59 2czu h SER 53 CO 0.32 1.81 -0.52 -0.25 -1.14 0.00 0.00 176.83 177.05 2czu h TRP 54 N 0.09 -1.45 -0.17 3.45 7.01 -1.93 -0.61 115.95 122.33 2czu h TRP 54 Ca -0.38 0.02 0.05 0.00 2.11 0.00 0.00 58.89 60.68 2czu h TRP 54 Cb 2.06 0.57 -0.05 0.00 -2.10 0.00 0.00 29.16 29.64 2czu h TRP 54 CO 0.09 -0.67 -0.17 0.35 -2.79 0.00 0.00 178.44 175.25 2czu h PHE 55 N -0.97 -0.44 -0.64 2.65 3.57 -1.95 -1.42 116.94 117.74 2czu h PHE 55 Ca -0.05 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.55 2czu h PHE 55 Cb 0.86 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.78 2czu h PHE 55 CO -0.30 -0.24 0.42 0.00 -2.23 0.00 0.00 178.31 175.96 2czu h ARG 56 N -0.19 0.55 -0.70 1.11 3.08 -1.54 0.37 114.38 117.06 2czu h ARG 56 Ca 0.11 -0.03 -0.34 0.00 0.07 0.00 0.00 59.98 59.79 2czu h ARG 56 Cb 0.36 -0.12 -0.20 0.00 0.08 0.00 0.00 29.97 30.08 2czu h ARG 56 CO -0.29 0.37 0.31 0.39 -1.07 0.00 0.00 179.97 179.68 2czu n GLU 57 N -4.48 2.24 0.00 0.04 1.02 -0.25 -4.44 120.64 114.77 2czu n GLU 57 Ca 0.10 -3.09 0.00 0.00 -0.02 0.00 0.00 57.16 54.15 2czu n GLU 57 Cb 0.28 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.68 2czu n GLU 57 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2czu n LYS 58 N -1.03 0.00 -0.28 3.49 5.02 -0.61 -4.95 118.16 119.79 2czu n LYS 58 Ca 0.47 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.87 2czu n LYS 58 Cb 1.37 -0.00 0.36 0.00 -0.02 0.00 0.00 35.03 36.74 2czu n LYS 58 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2czu h LYS 59 N 0.00 0.70 0.00 1.97 2.10 -0.48 -1.17 116.57 119.69 2czu h LYS 59 Ca 0.00 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.58 2czu h LYS 59 Cb 0.12 -0.16 -0.00 0.00 -0.90 0.00 0.00 32.23 31.29 2czu h LYS 59 CO 0.00 0.47 -0.11 0.00 -2.00 0.00 0.00 179.45 177.80 2czu h ALA 60 N 1.59 1.75 -0.59 0.07 0.00 -1.89 -2.70 119.26 117.50 2czu h ALA 60 Ca 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2czu h ALA 60 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2czu h ALA 60 CO -0.22 0.14 0.00 1.33 0.00 0.00 0.00 179.25 180.50 2czu n VAL 61 N -4.32 0.78 -3.07 0.00 0.24 -0.46 -4.96 118.33 106.55 2czu n VAL 61 Ca -0.03 -0.88 -0.39 0.00 -2.04 0.00 0.00 64.34 61.00 2czu n VAL 61 Cb 0.19 0.67 -0.05 0.00 -1.47 0.00 0.00 33.84 33.18 2czu n VAL 61 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2czu s LEU 62 N -1.19 4.47 0.33 1.34 1.43 -1.02 -4.96 118.68 119.08 2czu s LEU 62 Ca 0.45 1.39 0.06 0.00 -1.03 0.00 0.00 54.13 55.00 2czu s LEU 62 Cb 0.24 -3.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.27 2czu s LEU 62 CO 0.32 0.09 -0.01 -0.31 0.23 0.00 0.00 176.35 176.68 2czu s TYR 63 N -0.36 2.15 0.31 0.29 1.51 -1.26 -4.41 117.35 115.57 2czu s TYR 63 Ca 0.35 -0.75 -0.29 0.00 -1.01 0.00 0.00 57.07 55.37 2czu s TYR 63 Cb -0.20 -1.37 -0.10 0.00 -0.11 0.00 0.00 41.96 40.17 2czu s TYR 63 CO 0.22 0.27 1.39 1.41 -1.11 0.00 0.00 175.55 177.73 2czu s MET 64 N -3.76 4.27 0.19 -0.62 -2.45 -0.02 -4.85 119.30 112.06 2czu s MET 64 Ca 0.34 2.32 0.10 0.00 -1.25 0.00 0.00 55.69 57.20 2czu s MET 64 Cb 0.07 -3.07 -0.04 0.00 1.25 0.00 0.00 34.83 33.04 2czu s MET 64 CO 0.15 -0.34 -0.18 0.00 1.05 0.00 0.00 175.02 175.70 2czu s ALA 65 N -0.68 2.71 -0.25 4.11 0.00 -1.24 -4.48 121.76 121.93 2czu s ALA 65 Ca 0.54 -1.58 -0.10 0.00 0.00 0.00 0.00 51.96 50.81 2czu s ALA 65 Cb -0.42 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.17 2czu s ALA 65 CO 0.51 0.44 0.15 0.21 0.00 0.00 0.00 175.76 177.07 2czu s LYS 66 N -2.77 3.97 -0.14 0.00 2.20 -0.92 -1.43 119.74 120.65 2czu s LYS 66 Ca 0.23 -0.32 0.02 0.00 -0.36 0.00 0.00 55.97 55.54 2czu s LYS 66 Cb -0.08 -3.53 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 2czu s LYS 66 CO 0.12 -0.04 -0.21 0.99 -0.36 0.00 0.00 175.35 175.84 2czu s THR 67 N 1.34 2.03 -0.20 3.43 2.01 -0.11 -0.99 115.64 123.15 2czu s THR 67 Ca 0.07 -0.96 -0.08 0.00 0.31 0.00 0.00 61.69 61.03 2czu s THR 67 Cb -0.15 -1.80 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 2czu s THR 67 CO 0.07 0.54 0.07 -0.69 -0.69 0.00 0.00 174.62 173.92 2czu s VAL 68 N 0.88 4.79 -0.13 3.82 1.01 0.04 -0.47 120.40 130.34 2czu s VAL 68 Ca -0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 2czu s VAL 68 Cb -0.15 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 2czu s VAL 68 CO -0.03 0.43 -0.02 -0.69 0.00 0.00 0.00 175.10 174.79 2czu s VAL 69 N 0.60 4.12 0.17 2.92 1.01 0.15 -1.44 120.40 127.93 2czu s VAL 69 Ca 0.04 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 61.65 2czu s VAL 69 Cb -0.13 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 2czu s VAL 69 CO 0.01 0.53 0.26 0.00 0.00 0.00 0.00 175.10 175.90 2czu s ALA 70 N -0.11 0.22 0.59 5.51 0.00 -0.77 -0.70 121.76 126.49 2czu s ALA 70 Ca 0.03 -1.05 -0.20 0.00 0.00 0.00 0.00 51.96 50.74 2czu s ALA 70 Cb -0.13 0.94 -0.03 0.00 0.00 0.00 0.00 23.12 23.89 2czu s ALA 70 CO 0.02 -0.64 1.31 -2.14 0.00 0.00 0.00 175.76 174.31 2czu s PRO 71 N -4.00 2.92 0.34 0.00 0.02 -1.26 0.09 135.00 133.10 2czu s PRO 71 Ca 0.21 2.10 0.07 0.00 0.02 0.00 0.00 61.00 63.40 2czu s PRO 71 Cb 0.04 -2.07 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 2czu s PRO 71 CO 0.02 -1.32 0.41 -1.54 -0.33 0.00 0.00 177.00 174.25 2czu s SER 72 N -1.21 5.74 0.18 2.53 1.04 0.21 -4.25 113.70 117.94 2czu s SER 72 Ca 0.76 -0.29 -0.14 0.00 0.48 0.00 0.00 55.95 56.76 2czu s SER 72 Cb -0.38 -1.14 0.17 0.00 0.10 0.00 0.00 66.02 64.78 2czu s SER 72 CO 0.42 -0.41 1.69 0.74 0.98 0.00 0.00 173.24 176.66 2czu h THR 73 N 1.01 0.65 -0.06 2.02 2.02 -1.96 -2.23 112.91 114.35 2czu h THR 73 Ca -0.45 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2czu h THR 73 Cb 1.26 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2czu h THR 73 CO 0.54 0.02 0.00 1.21 0.37 0.00 0.00 175.52 177.67 2czu n GLU 74 N -5.21 1.24 0.00 6.66 4.07 -1.26 -4.85 120.64 121.30 2czu n GLU 74 Ca 0.05 -0.37 0.00 0.00 -0.06 0.00 0.00 57.16 56.78 2czu n GLU 74 Cb 0.25 -1.30 0.00 0.00 -0.06 0.00 0.00 31.44 30.33 2czu n GLU 74 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2czu n GLY 75 N 0.88 0.50 0.00 8.31 0.00 -0.84 -4.81 105.19 109.23 2czu n GLY 75 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2czu n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2czu n GLY 76 N -1.82 1.27 3.18 -0.02 0.00 -1.26 -4.72 105.19 101.82 2czu n GLY 76 Ca 0.00 -1.63 -0.27 0.00 0.00 0.00 0.00 46.02 44.12 2czu n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2czu s LEU 77 N 0.00 1.99 -0.16 0.99 1.43 0.25 -0.62 118.68 122.57 2czu s LEU 77 Ca 0.00 -0.37 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 2czu s LEU 77 Cb 0.00 -1.03 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 2czu s LEU 77 CO 0.00 0.21 0.29 0.20 0.23 0.00 0.00 176.35 177.28 2czu s ASN 78 N -0.24 6.44 -0.23 2.29 -0.87 0.11 -0.11 114.94 122.32 2czu s ASN 78 Ca 0.02 0.51 0.02 0.00 -1.57 0.00 0.00 52.86 51.85 2czu s ASN 78 Cb -0.10 -2.18 0.05 0.00 -0.02 0.00 0.00 41.25 39.00 2czu s ASN 78 CO 0.01 0.11 -0.12 -0.76 -2.57 0.00 0.00 177.10 173.77 2czu s LEU 79 N 0.39 2.93 -0.35 0.60 1.02 0.99 -1.85 118.68 122.40 2czu s LEU 79 Ca 0.16 -1.15 -0.10 0.00 0.02 0.00 0.00 54.13 53.06 2czu s LEU 79 Cb -0.13 -1.45 0.01 0.00 0.02 0.00 0.00 46.19 44.64 2czu s LEU 79 CO 0.04 -0.15 0.18 -0.89 0.02 0.00 0.00 176.35 175.55 2czu s THR 80 N 1.21 4.54 -0.08 5.49 2.01 -0.52 -0.14 115.64 128.15 2czu s THR 80 Ca -0.05 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.27 2czu s THR 80 Cb -0.18 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 2czu s THR 80 CO -0.07 -0.11 -0.08 -0.44 -0.69 0.00 0.00 174.62 173.23 2czu s SER 81 N 1.57 4.50 -0.20 3.53 0.01 0.49 -0.78 113.70 122.82 2czu s SER 81 Ca 0.03 -0.08 -0.04 0.00 1.31 0.00 0.00 55.95 57.17 2czu s SER 81 Cb -0.18 -1.19 -0.01 0.00 0.21 0.00 0.00 66.02 64.85 2czu s SER 81 CO 0.06 0.33 -0.05 -0.89 0.41 0.00 0.00 173.24 173.11 2czu s THR 82 N -0.62 3.45 0.12 1.44 2.01 -0.16 -0.66 115.64 121.22 2czu s THR 82 Ca 0.09 -0.48 -0.07 0.00 0.31 0.00 0.00 61.69 61.54 2czu s THR 82 Cb -0.11 -2.55 -0.01 0.00 0.01 0.00 0.00 72.50 69.83 2czu s THR 82 CO 0.02 0.44 0.19 0.72 -0.69 0.00 0.00 174.62 175.30 2czu s PHE 83 N 1.19 0.40 -0.33 4.92 -0.71 0.49 -2.15 117.98 121.79 2czu s PHE 83 Ca 0.02 -0.80 -0.17 0.00 -1.04 0.00 0.00 56.93 54.94 2czu s PHE 83 Cb -0.14 -0.15 -0.01 0.00 -1.21 0.00 0.00 43.02 41.50 2czu s PHE 83 CO -0.01 -0.60 0.44 -1.17 -1.34 0.00 0.00 175.22 172.54 2czu s LEU 84 N -2.94 4.32 -0.09 -1.99 2.96 -1.26 0.52 118.68 120.20 2czu s LEU 84 Ca 0.13 -0.03 -0.07 0.00 -0.22 0.00 0.00 54.13 53.95 2czu s LEU 84 Cb 0.05 -2.48 -0.02 0.00 0.50 0.00 0.00 46.19 44.23 2czu s LEU 84 CO -0.04 -0.38 -0.13 -1.14 -1.32 0.00 0.00 176.35 173.33 2czu n ARG 85 N 5.55 0.30 -3.11 1.98 3.00 -0.55 -4.72 116.66 119.11 2czu n ARG 85 Ca -0.07 0.38 -0.19 0.00 -0.00 0.00 0.00 57.85 57.97 2czu n ARG 85 Cb 0.49 -1.31 -0.05 0.00 0.00 0.00 0.00 32.46 31.60 2czu n ARG 85 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2czu n LYS 86 N -3.75 0.54 -2.36 -0.14 5.02 -1.26 -4.87 118.16 111.34 2czu n LYS 86 Ca -0.05 -2.77 -0.20 0.00 -2.02 0.00 0.00 58.31 53.27 2czu n LYS 86 Cb 0.20 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 33.76 2czu n LYS 86 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2czu n ASN 87 N 2.10 -5.68 -3.81 4.39 4.13 -1.26 -4.97 115.26 110.15 2czu n ASN 87 Ca 0.21 -0.00 -0.12 0.00 1.68 0.00 0.00 54.58 56.34 2czu n ASN 87 Cb 0.54 -4.71 -0.12 0.00 -1.54 0.00 0.00 39.78 33.94 2czu n ASN 87 CO 0.00 0.00 0.00 -1.58 0.28 0.00 0.00 177.26 175.96 2czu s GLN 88 N -4.95 0.25 -0.26 3.52 0.74 -1.26 -5.13 119.66 112.56 2czu s GLN 88 Ca 0.00 0.18 -0.24 0.00 0.05 0.00 0.00 55.36 55.35 2czu s GLN 88 Cb 0.00 0.12 -0.00 0.00 1.10 0.00 0.00 33.01 34.22 2czu s GLN 88 CO 0.00 -0.04 0.81 0.00 -0.55 0.00 0.00 175.29 175.51 2czu s GLU 90 N 2.87 2.01 -0.03 0.00 2.02 0.19 -4.94 118.70 120.81 2czu s GLU 90 Ca 0.34 -1.62 0.02 0.00 0.02 0.00 0.00 54.97 53.72 2czu s GLU 90 Cb -0.15 -1.96 0.01 0.00 0.10 0.00 0.00 34.13 32.13 2czu s GLU 90 CO 0.09 0.31 -0.06 0.99 0.02 0.00 0.00 175.26 176.61 2czu s THR 91 N -2.43 0.58 0.05 3.63 2.01 -1.26 -0.38 115.64 117.85 2czu s THR 91 Ca 0.31 -0.21 0.04 0.00 0.31 0.00 0.00 61.69 62.14 2czu s THR 91 Cb -0.05 -0.56 -0.02 0.00 0.01 0.00 0.00 72.50 71.87 2czu s THR 91 CO 0.18 0.21 -0.11 -0.75 -0.69 0.00 0.00 174.62 173.46 2czu s LYS 92 N 0.53 0.67 -0.18 4.92 2.20 0.17 -4.97 119.74 123.07 2czu s LYS 92 Ca -0.07 -0.80 -0.00 0.00 -0.36 0.00 0.00 55.97 54.73 2czu s LYS 92 Cb -0.11 -0.56 0.01 0.00 -1.51 0.00 0.00 37.83 35.66 2czu s LYS 92 CO 0.00 0.12 -0.15 0.42 -0.36 0.00 0.00 175.35 175.38 2czu s ILE 93 N -1.23 2.54 -0.04 5.43 1.01 -1.26 -0.38 121.20 127.27 2czu s ILE 93 Ca -0.05 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.85 2czu s ILE 93 Cb -0.09 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 2czu s ILE 93 CO 0.01 0.51 -0.15 -0.04 0.00 0.00 0.00 174.94 175.27 2czu s MET 94 N 1.15 2.45 -0.27 2.79 -1.94 0.80 -4.96 119.30 119.33 2czu s MET 94 Ca 0.01 -0.73 -0.04 0.00 -1.71 0.00 0.00 55.69 53.23 2czu s MET 94 Cb -0.14 -2.35 0.02 0.00 2.01 0.00 0.00 34.83 34.37 2czu s MET 94 CO -0.06 0.62 -0.00 0.08 -0.01 0.00 0.00 175.02 175.64 2czu s VAL 95 N -0.74 3.30 -0.51 -6.03 1.01 -1.26 -0.01 120.40 116.16 2czu s VAL 95 Ca 0.12 -0.93 -0.20 0.00 0.00 0.00 0.00 61.98 60.97 2czu s VAL 95 Cb -0.11 -2.71 0.06 0.00 0.00 0.00 0.00 36.38 33.62 2czu s VAL 95 CO 0.01 0.12 0.67 -0.76 0.00 0.00 0.00 175.10 175.15 2czu s LEU 96 N 1.38 4.83 0.12 3.92 1.43 0.84 -4.53 118.68 126.67 2czu s LEU 96 Ca 0.01 -0.82 -0.30 0.00 -1.03 0.00 0.00 54.13 51.99 2czu s LEU 96 Cb -0.17 -2.51 -0.06 0.00 0.03 0.00 0.00 46.19 43.48 2czu s LEU 96 CO -0.02 -0.94 0.96 -1.10 0.23 0.00 0.00 176.35 175.48 2czu s GLN 97 N 2.83 4.71 0.40 1.70 -1.52 -0.22 -0.59 119.66 126.98 2czu s GLN 97 Ca 0.17 1.46 -0.25 0.00 -1.95 0.00 0.00 55.36 54.79 2czu s GLN 97 Cb -0.18 -3.37 -0.11 0.00 -0.22 0.00 0.00 33.01 29.13 2czu s GLN 97 CO 0.13 0.23 1.16 -0.35 -0.25 0.00 0.00 175.29 176.21 2czu n PRO 98 N 2.69 1.69 -2.46 2.91 -0.04 -1.26 -0.49 135.00 138.04 2czu n PRO 98 Ca 0.02 0.60 -0.25 0.00 -0.04 0.00 0.00 63.50 63.83 2czu n PRO 98 Cb 0.49 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.74 2czu n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2czu n ALA 99 N -0.24 4.94 -0.45 0.55 0.00 0.35 -4.63 120.51 121.04 2czu n ALA 99 Ca 0.08 -4.20 0.00 0.00 0.00 0.00 0.00 53.44 49.31 2czu n ALA 99 Cb 0.39 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.28 2czu n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2czu n GLY 100 N -0.47 2.02 3.57 0.00 0.00 -1.26 -4.80 105.19 104.24 2czu n GLY 100 Ca 0.37 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.23 2czu n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2czu s ALA 101 N -3.38 -1.79 0.05 4.61 0.00 -1.26 -5.10 121.76 114.90 2czu s ALA 101 Ca 0.00 1.61 -0.35 0.00 0.00 0.00 0.00 51.96 53.22 2czu s ALA 101 Cb 0.00 -0.51 -0.14 0.00 0.00 0.00 0.00 23.12 22.48 2czu s ALA 101 CO 0.00 -0.35 1.66 -2.30 0.00 0.00 0.00 175.76 174.77 2czu n PRO 102 N 1.59 2.01 -0.52 0.00 -0.02 -1.26 -1.21 135.00 135.58 2czu n PRO 102 Ca -0.17 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2czu n PRO 102 Cb 0.56 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2czu n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2czu n GLY 103 N 3.70 0.75 3.19 -1.23 0.00 -1.26 -4.98 105.19 105.36 2czu n GLY 103 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2czu n GLY 103 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2czu s HIS 104 N -2.55 2.55 0.15 1.61 3.76 -0.35 -1.80 115.29 118.65 2czu s HIS 104 Ca 0.00 -1.14 -0.00 0.00 -0.15 0.00 0.00 55.06 53.77 2czu s HIS 104 Cb 0.00 -1.72 -0.04 0.00 1.11 0.00 0.00 32.58 31.93 2czu s HIS 104 CO 0.00 -0.49 0.06 0.71 -0.85 0.00 0.00 174.74 174.17 2czu s TYR 105 N 0.54 1.00 0.08 1.40 2.02 0.24 -0.50 117.35 122.13 2czu s TYR 105 Ca -0.14 -1.21 0.09 0.00 -0.37 0.00 0.00 57.07 55.44 2czu s TYR 105 Cb -0.17 -0.55 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 2czu s TYR 105 CO 0.05 -0.47 -0.25 0.95 -1.57 0.00 0.00 175.55 174.25 2czu s THR 106 N -3.98 2.06 -0.05 -0.71 -4.23 0.35 -0.43 115.64 108.66 2czu s THR 106 Ca 0.27 -1.48 -0.02 0.00 -1.18 0.00 0.00 61.69 59.27 2czu s THR 106 Cb 0.07 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 72.14 2czu s THR 106 CO 0.04 0.22 0.10 -0.47 -0.54 0.00 0.00 174.62 173.97 2czu s TYR 107 N -0.91 -0.09 -0.36 3.99 5.04 -0.26 -1.06 117.35 123.69 2czu s TYR 107 Ca 0.11 0.33 -0.25 0.00 -2.44 0.00 0.00 57.07 54.83 2czu s TYR 107 Cb -0.10 -0.11 0.01 0.00 0.35 0.00 0.00 41.96 42.12 2czu s TYR 107 CO 0.03 -0.12 0.86 0.45 -1.34 0.00 0.00 175.55 175.43 2czu s SER 108 N 0.92 6.63 0.00 4.32 0.15 -1.26 -0.66 113.70 123.79 2czu s SER 108 Ca -0.07 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2czu s SER 108 Cb -0.10 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2czu s SER 108 CO -0.04 -0.79 0.00 -0.24 1.20 0.00 0.00 173.24 173.37 2czu n SER 109 N 6.59 0.00 0.00 5.45 2.88 -0.27 -4.96 113.62 123.31 2czu n SER 109 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2czu n SER 109 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2czu n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2czu n SER 112 N 0.00 0.00 0.00 -3.46 2.88 -1.26 -4.14 113.62 107.64 2czu n SER 112 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2czu n SER 112 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2czu n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2czu n GLY 113 N 0.00 2.70 3.63 0.46 0.00 -1.26 -4.98 105.19 105.73 2czu n GLY 113 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2czu n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2czu s SER 114 N -0.19 2.39 0.08 1.61 1.04 -1.26 -5.02 113.70 112.34 2czu s SER 114 Ca 0.00 1.56 0.04 0.00 0.48 0.00 0.00 55.95 58.03 2czu s SER 114 Cb 0.00 -2.23 -0.04 0.00 0.10 0.00 0.00 66.02 63.85 2czu s SER 114 CO 0.00 -3.33 0.01 -0.63 0.98 0.00 0.00 173.24 170.27 2czu s ILE 115 N -2.73 4.08 0.12 -1.02 -1.09 -1.26 -1.11 121.20 118.19 2czu s ILE 115 Ca 0.66 -0.92 0.08 0.00 -2.23 0.00 0.00 60.65 58.24 2czu s ILE 115 Cb -0.21 -2.93 -0.04 0.00 -1.58 0.00 0.00 42.46 37.70 2czu s ILE 115 CO 0.60 0.15 -0.20 -1.00 -1.23 0.00 0.00 174.94 173.25 2czu s HIS 116 N -1.29 1.82 -0.33 3.97 3.76 0.16 -4.35 115.29 119.04 2czu s HIS 116 Ca 0.25 -0.43 -0.05 0.00 -0.15 0.00 0.00 55.06 54.69 2czu s HIS 116 Cb -0.12 -0.97 0.05 0.00 1.11 0.00 0.00 32.58 32.65 2czu s HIS 116 CO 0.18 0.25 0.07 -1.12 -0.85 0.00 0.00 174.74 173.27 2czu s SER 117 N -2.14 5.16 -0.15 1.40 0.01 -0.38 -1.10 113.70 116.49 2czu s SER 117 Ca 0.09 -1.25 -0.07 0.00 1.31 0.00 0.00 55.95 56.03 2czu s SER 117 Cb -0.09 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.29 2czu s SER 117 CO 0.05 -0.32 0.11 -0.69 0.41 0.00 0.00 173.24 172.80 2czu s VAL 118 N 1.33 5.25 0.03 3.43 1.01 0.43 -2.23 120.40 129.65 2czu s VAL 118 Ca -0.02 0.12 0.02 0.00 0.00 0.00 0.00 61.98 62.10 2czu s VAL 118 Cb -0.20 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 2czu s VAL 118 CO 0.01 0.54 -0.08 -0.94 0.00 0.00 0.00 175.10 174.64 2czu s SER 119 N -0.42 0.88 -0.51 3.32 1.04 -0.21 -0.59 113.70 117.21 2czu s SER 119 Ca 0.11 -0.44 -0.24 0.00 0.48 0.00 0.00 55.95 55.86 2czu s SER 119 Cb -0.12 0.00 0.04 0.00 0.10 0.00 0.00 66.02 66.04 2czu s SER 119 CO 0.02 -0.12 0.88 -0.69 0.98 0.00 0.00 173.24 174.30 2czu s VAL 120 N -1.05 4.49 0.00 5.02 1.01 -0.75 -0.77 120.40 128.36 2czu s VAL 120 Ca -0.06 0.34 -0.25 0.00 0.00 0.00 0.00 61.98 62.01 2czu s VAL 120 Cb -0.08 -4.46 -0.18 0.00 0.00 0.00 0.00 36.38 31.67 2czu s VAL 120 CO 0.00 -0.96 1.27 0.58 0.00 0.00 0.00 175.10 176.00 2czu h VAL 121 N 6.01 0.99 -2.72 2.92 2.07 -0.88 -3.47 116.25 121.17 2czu h VAL 121 Ca -0.26 -0.77 -0.08 0.00 0.82 0.00 0.00 66.70 66.42 2czu h VAL 121 Cb 1.08 1.45 -0.18 0.00 -1.52 0.00 0.00 31.29 32.12 2czu h VAL 121 CO 1.04 0.18 -0.02 -0.70 0.02 0.00 0.00 177.57 178.08 2czu s GLU 122 N -4.58 0.94 -0.16 1.57 2.12 -1.19 -5.02 118.70 112.38 2czu s GLU 122 Ca -0.15 -0.15 -0.30 0.00 0.36 0.00 0.00 54.97 54.73 2czu s GLU 122 Cb 0.02 0.43 0.13 0.00 0.26 0.00 0.00 34.13 34.98 2czu s GLU 122 CO 0.60 -0.31 1.04 0.00 -0.54 0.00 0.00 175.26 176.05 2czu s ALA 123 N -1.97 -1.95 -0.26 6.30 0.00 -1.26 -0.13 121.76 122.47 2czu s ALA 123 Ca -0.08 1.56 -0.01 0.00 0.00 0.00 0.00 51.96 53.43 2czu s ALA 123 Cb -0.01 -0.65 0.08 0.00 0.00 0.00 0.00 23.12 22.54 2czu s ALA 123 CO 0.02 -0.36 0.05 1.21 0.00 0.00 0.00 175.76 176.68 2czu s ASN 124 N -1.32 3.71 0.49 0.00 3.84 0.66 -4.98 114.94 117.34 2czu s ASN 124 Ca 0.01 -1.34 0.16 0.00 0.21 0.00 0.00 52.86 51.90 2czu s ASN 124 Cb -0.01 -0.88 0.88 0.00 -0.55 0.00 0.00 41.25 40.69 2czu s ASN 124 CO -0.01 -0.35 1.43 0.10 -2.79 0.00 0.00 177.10 175.48 2czu h TYR 125 N 8.09 0.00 -0.02 0.43 -0.00 -1.88 0.58 116.97 124.17 2czu h TYR 125 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.58 2czu h TYR 125 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.79 2czu h TYR 125 CO 0.37 0.00 -0.39 -0.25 -0.00 0.00 0.00 178.16 177.89 2czu n ASP 126 N -2.38 2.05 0.00 0.10 8.00 -1.26 -4.75 116.55 118.31 2czu n ASP 126 Ca -0.01 -1.52 0.00 0.00 0.71 0.00 0.00 54.79 53.97 2czu n ASP 126 Cb 0.47 0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 2czu n ASP 126 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2czu n GLU 127 N 0.09 0.00 -3.76 -1.24 1.02 0.18 -4.75 120.64 112.18 2czu n GLU 127 Ca 0.10 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.17 2czu n GLU 127 Cb 0.47 -0.14 -0.02 0.00 -0.02 0.00 0.00 31.44 31.73 2czu n GLU 127 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 2czu s TYR 128 N -2.00 -0.25 -0.11 -0.32 -0.85 0.35 -1.30 117.35 112.87 2czu s TYR 128 Ca 0.00 -0.14 -0.04 0.00 -0.52 0.00 0.00 57.07 56.37 2czu s TYR 128 Cb 0.00 0.67 0.05 0.00 0.38 0.00 0.00 41.96 43.06 2czu s TYR 128 CO 0.00 -1.09 0.23 0.00 -1.52 0.00 0.00 175.55 173.17 2czu s ALA 129 N -3.77 -0.44 -0.34 9.51 0.00 -0.75 -0.24 121.76 125.72 2czu s ALA 129 Ca 0.09 0.85 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 2czu s ALA 129 Cb -0.04 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2czu s ALA 129 CO 0.02 -0.46 0.19 -1.17 0.00 0.00 0.00 175.76 174.34 2czu s LEU 130 N 1.97 4.44 0.03 0.00 0.20 0.81 -1.00 118.68 125.13 2czu s LEU 130 Ca -0.02 -0.68 0.04 0.00 0.69 0.00 0.00 54.13 54.15 2czu s LEU 130 Cb -0.12 -2.04 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 2czu s LEU 130 CO -0.08 -0.28 -0.05 -0.76 -0.29 0.00 0.00 176.35 174.90 2czu s LEU 131 N 1.62 3.27 -0.08 -0.68 1.43 0.58 -0.14 118.68 124.68 2czu s LEU 131 Ca 0.04 -0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.04 2czu s LEU 131 Cb -0.18 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 2czu s LEU 131 CO 0.07 0.25 -0.24 0.12 0.23 0.00 0.00 176.35 176.78 2czu s PHE 132 N -1.10 2.45 -0.06 0.29 5.36 0.05 -0.76 117.98 124.22 2czu s PHE 132 Ca 0.20 -0.87 0.03 0.00 -0.96 0.00 0.00 56.93 55.33 2czu s PHE 132 Cb -0.11 -1.63 0.01 0.00 -0.34 0.00 0.00 43.02 40.95 2czu s PHE 132 CO 0.11 -0.31 -0.15 0.45 -1.46 0.00 0.00 175.22 173.86 2czu s SER 133 N 0.10 1.97 -0.04 6.13 0.15 0.10 -1.04 113.70 121.08 2czu s SER 133 Ca -0.11 -0.33 0.04 0.00 0.70 0.00 0.00 55.95 56.24 2czu s SER 133 Cb -0.16 -0.78 -0.00 0.00 -1.71 0.00 0.00 66.02 63.37 2czu s SER 133 CO 0.06 0.08 -0.15 0.00 1.20 0.00 0.00 173.24 174.43 2czu s ARG 134 N 0.42 1.60 0.27 5.44 1.70 -0.95 0.15 118.95 127.58 2czu s ARG 134 Ca -0.11 -0.53 0.02 0.00 -0.47 0.00 0.00 55.73 54.64 2czu s ARG 134 Cb -0.14 -1.40 -0.04 0.00 -0.57 0.00 0.00 34.95 32.79 2czu s ARG 134 CO 0.04 0.20 0.13 0.20 -1.08 0.00 0.00 175.30 174.78 2czu s GLY 135 N 0.11 1.84 -0.30 3.88 0.00 0.03 -1.26 107.32 111.63 2czu s GLY 135 Ca -0.04 -1.80 -0.04 0.00 0.00 0.00 0.00 44.72 42.84 2czu s GLY 135 CO 0.02 -1.56 0.76 -1.59 0.00 0.00 0.00 173.10 170.72 2czu s THR 136 N -3.75 -0.75 -0.48 0.90 2.01 -1.26 -1.01 115.64 111.30 2czu s THR 136 Ca 0.37 0.00 0.22 0.00 0.31 0.00 0.00 61.69 62.59 2czu s THR 136 Cb 0.06 -0.94 0.23 0.00 0.01 0.00 0.00 72.50 71.87 2czu s THR 136 CO 0.15 0.00 1.68 0.29 -0.69 0.00 0.00 174.62 176.05 2czu n LYS 137 N 5.41 0.17 0.00 4.92 5.02 -0.43 -4.90 118.16 128.36 2czu n LYS 137 Ca -0.01 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 2czu n LYS 137 Cb 0.53 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 2czu n LYS 137 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2czu n GLY 138 N -0.21 -0.23 3.54 0.72 0.00 -1.26 -4.96 105.19 102.79 2czu n GLY 138 Ca 0.02 -1.21 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 2czu n GLY 138 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2czu n PRO 139 N -0.81 0.78 0.00 1.61 -0.02 -1.26 0.09 135.00 135.39 2czu n PRO 139 Ca 0.00 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2czu n PRO 139 Cb 0.00 -3.00 0.00 0.00 -0.02 0.00 0.00 33.50 30.48 2czu n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2czu n GLY 140 N 6.14 0.51 2.28 -1.23 0.00 -1.26 -4.95 105.19 106.68 2czu n GLY 140 Ca 0.44 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.15 2czu n GLY 140 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2czu n GLN 141 N -1.34 3.03 -2.94 1.61 6.02 0.11 -4.99 117.38 118.88 2czu n GLN 141 Ca 0.00 -3.65 -0.40 0.00 -0.01 0.00 0.00 57.00 52.94 2czu n GLN 141 Cb 0.00 -2.28 -0.04 0.00 1.02 0.00 0.00 30.24 28.93 2czu n GLN 141 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2czu s ASP 142 N -2.43 7.17 0.08 1.08 -0.00 -1.25 -1.31 116.67 120.01 2czu s ASP 142 Ca 0.59 1.41 0.08 0.00 -0.00 0.00 0.00 52.55 54.62 2czu s ASP 142 Cb 0.47 -2.47 -0.03 0.00 -0.00 0.00 0.00 42.92 40.88 2czu s ASP 142 CO -0.03 -0.09 -0.20 0.72 -0.00 0.00 0.00 175.17 175.57 2czu s PHE 143 N 0.48 1.71 0.04 4.23 -0.12 -0.18 -4.96 117.98 119.19 2czu s PHE 143 Ca 0.41 -0.41 0.06 0.00 -0.05 0.00 0.00 56.93 56.94 2czu s PHE 143 Cb -0.20 -0.96 -0.02 0.00 -0.63 0.00 0.00 43.02 41.21 2czu s PHE 143 CO 0.22 0.16 -0.18 1.03 -0.05 0.00 0.00 175.22 176.40 2czu s ARG 144 N -1.71 1.22 -0.10 1.99 0.52 -1.26 -0.79 118.95 118.82 2czu s ARG 144 Ca 0.06 -0.86 -0.04 0.00 -0.52 0.00 0.00 55.73 54.36 2czu s ARG 144 Cb -0.10 -1.29 0.05 0.00 0.52 0.00 0.00 34.95 34.13 2czu s ARG 144 CO 0.03 0.33 0.21 1.41 0.02 0.00 0.00 175.30 177.30 2czu s MET 145 N -1.14 0.13 -0.19 3.54 1.75 0.12 -2.94 119.30 120.58 2czu s MET 145 Ca 0.05 0.55 -0.08 0.00 -1.25 0.00 0.00 55.69 54.96 2czu s MET 145 Cb -0.08 -0.15 -0.04 0.00 2.84 0.00 0.00 34.83 37.40 2czu s MET 145 CO 0.02 -0.22 0.09 0.00 -0.65 0.00 0.00 175.02 174.25 2czu s ALA 146 N 1.72 3.52 -0.06 4.11 0.00 0.17 0.03 121.76 131.25 2czu s ALA 146 Ca -0.04 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2czu s ALA 146 Cb -0.11 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2czu s ALA 146 CO -0.07 0.18 -0.16 0.99 0.00 0.00 0.00 175.76 176.70 2czu s THR 147 N 0.33 1.40 -0.26 0.00 2.01 0.06 -1.08 115.64 118.11 2czu s THR 147 Ca 0.05 -0.66 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 2czu s THR 147 Cb -0.12 -1.23 0.03 0.00 0.01 0.00 0.00 72.50 71.19 2czu s THR 147 CO -0.01 0.41 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.06 2czu s LEU 148 N 0.34 3.32 0.07 4.42 2.96 0.03 -0.31 118.68 129.51 2czu s LEU 148 Ca -0.10 -0.96 -0.02 0.00 -0.22 0.00 0.00 54.13 52.83 2czu s LEU 148 Cb -0.14 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 2czu s LEU 148 CO 0.04 -0.15 0.26 -0.31 -1.32 0.00 0.00 176.35 174.86 2czu s TYR 149 N 1.30 3.51 0.01 5.38 2.02 -0.17 -0.65 117.35 128.76 2czu s TYR 149 Ca -0.01 0.36 0.01 0.00 -0.37 0.00 0.00 57.07 57.06 2czu s TYR 149 Cb -0.17 -1.85 -0.01 0.00 -0.40 0.00 0.00 41.96 39.53 2czu s TYR 149 CO -0.04 0.55 -0.04 0.45 -1.57 0.00 0.00 175.55 174.90 2czu s SER 150 N -2.39 0.48 0.41 2.29 0.15 0.63 -1.81 113.70 113.46 2czu s SER 150 Ca 0.35 -0.23 0.22 0.00 0.70 0.00 0.00 55.95 56.99 2czu s SER 150 Cb -0.13 -0.01 0.79 0.00 -1.71 0.00 0.00 66.02 64.97 2czu s SER 150 CO 0.26 -0.06 1.77 0.03 1.20 0.00 0.00 173.24 176.44 2czu h ARG 151 N 5.52 0.00 -6.31 5.44 2.47 -1.48 0.25 114.38 120.27 2czu h ARG 151 Ca -0.29 0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 57.82 2czu h ARG 151 Cb 1.20 0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 29.39 2czu h ARG 151 CO 0.47 0.28 -0.73 0.95 0.56 0.00 0.00 179.97 181.50 2czu s THR 152 N -3.60 2.90 -0.38 2.04 -4.23 -1.26 -4.77 115.64 106.35 2czu s THR 152 Ca 0.01 -2.05 0.27 0.00 -1.18 0.00 0.00 61.69 58.74 2czu s THR 152 Cb 0.10 -2.50 0.31 0.00 1.34 0.00 0.00 72.50 71.76 2czu s THR 152 CO 0.66 -0.29 1.78 1.56 -0.54 0.00 0.00 174.62 177.79 2czu h GLN 153 N 2.42 0.00 -5.91 3.99 4.20 -1.96 -3.44 115.11 114.42 2czu h GLN 153 Ca -0.44 0.00 -0.63 0.00 0.06 0.00 0.00 58.65 57.65 2czu h GLN 153 Cb 1.24 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.96 2czu h GLN 153 CO 0.57 0.00 -0.33 0.99 -0.67 0.00 0.00 178.83 179.40 2czu s THR 154 N -3.34 5.23 -0.11 -0.54 2.01 -1.26 -4.97 115.64 112.66 2czu s THR 154 Ca 0.05 0.45 0.04 0.00 0.31 0.00 0.00 61.69 62.54 2czu s THR 154 Cb 0.09 -3.59 0.00 0.00 0.01 0.00 0.00 72.50 69.02 2czu s THR 154 CO 0.53 0.49 -0.24 -0.22 -0.69 0.00 0.00 174.62 174.49 2czu s LEU 155 N -1.37 2.09 0.21 4.42 2.96 -1.26 -4.98 118.68 120.75 2czu s LEU 155 Ca 0.24 -0.57 -0.30 0.00 -0.22 0.00 0.00 54.13 53.28 2czu s LEU 155 Cb -0.14 -1.42 -0.08 0.00 0.50 0.00 0.00 46.19 45.05 2czu s LEU 155 CO 0.12 0.14 1.02 -0.54 -1.32 0.00 0.00 176.35 175.78 2czu s LYS 156 N 0.46 4.71 0.34 1.98 1.02 -1.26 -4.91 119.74 122.08 2czu s LYS 156 Ca -0.16 1.61 0.12 0.00 0.02 0.00 0.00 55.97 57.56 2czu s LYS 156 Cb -0.17 -3.28 0.95 0.00 -0.52 0.00 0.00 37.83 34.81 2czu s LYS 156 CO 0.06 0.28 1.73 -0.44 -0.92 0.00 0.00 175.35 176.06 2czu h ASP 157 N 4.60 0.61 0.04 2.83 5.19 -1.99 0.61 116.42 128.32 2czu h ASP 157 Ca -0.45 0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.08 2czu h ASP 157 Cb 1.21 0.03 -0.00 0.00 0.18 0.00 0.00 39.33 40.75 2czu h ASP 157 CO 0.70 0.08 -0.04 -0.33 -3.12 0.00 0.00 179.24 176.53 2czu h GLU 158 N 0.52 0.00 0.09 3.56 3.07 -1.99 0.14 114.58 119.97 2czu h GLU 158 Ca 0.64 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 59.25 2czu h GLU 158 Cb 1.33 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 2czu h GLU 158 CO -0.44 0.04 -1.14 1.25 -1.40 0.00 0.00 179.01 177.31 2czu h LEU 159 N 0.00 0.42 -0.69 1.33 5.85 -0.19 -2.55 115.31 119.47 2czu h LEU 159 Ca -0.00 -0.41 -0.08 0.00 0.84 0.00 0.00 57.88 58.22 2czu h LEU 159 Cb 0.07 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2czu h LEU 159 CO 0.00 1.29 0.07 0.11 -0.34 0.00 0.00 178.44 179.58 2czu h LYS 160 N 0.10 1.09 -0.55 1.25 1.57 -0.15 -2.10 116.57 117.79 2czu h LYS 160 Ca -0.11 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.29 2czu h LYS 160 Cb 1.85 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 34.02 2czu h LYS 160 CO 0.19 1.01 0.06 0.93 -0.57 0.00 0.00 179.45 181.07 2czu h GLU 161 N 1.01 0.93 -0.64 3.15 5.08 -0.79 -1.04 114.58 122.28 2czu h GLU 161 Ca 0.19 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2czu h GLU 161 Cb 0.47 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2czu h GLU 161 CO 0.02 0.91 0.40 -0.22 -1.00 0.00 0.00 179.01 179.12 2czu h LYS 162 N 0.81 0.85 -0.01 2.33 3.64 -1.26 0.17 116.57 123.10 2czu h LYS 162 Ca 0.16 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2czu h LYS 162 Cb 0.45 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2czu h LYS 162 CO 0.02 0.59 0.00 0.35 -2.27 0.00 0.00 179.45 178.14 2czu h PHE 163 N 0.86 0.01 -0.51 1.91 3.57 -1.10 0.06 116.94 121.74 2czu h PHE 163 Ca 0.23 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.76 2czu h PHE 163 Cb -0.06 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 2czu h PHE 163 CO -0.02 0.18 0.30 1.15 -2.23 0.00 0.00 178.31 177.68 2czu h THR 164 N -0.15 1.03 0.25 4.41 2.02 -0.99 0.95 112.91 120.42 2czu h THR 164 Ca 0.00 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2czu h THR 164 Cb 0.17 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 2czu h THR 164 CO -0.00 0.11 -0.15 0.74 0.37 0.00 0.00 175.52 176.59 2czu h THR 165 N 0.59 0.69 -0.88 3.16 2.02 -0.48 -0.32 112.91 117.68 2czu h THR 165 Ca 0.21 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.40 2czu h THR 165 Cb 0.05 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2czu h THR 165 CO -0.11 0.00 0.58 0.15 0.37 0.00 0.00 175.52 176.51 2czu h PHE 166 N -0.38 1.12 -0.74 3.16 3.57 -0.76 -0.49 116.94 122.42 2czu h PHE 166 Ca -0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2czu h PHE 166 Cb 0.31 -0.38 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 2czu h PHE 166 CO -0.09 0.71 0.42 0.77 -2.23 0.00 0.00 178.31 177.90 2czu h SER 167 N 1.20 0.90 0.11 0.41 0.02 -0.55 -2.52 113.55 113.12 2czu h SER 167 Ca 0.32 -0.08 -0.16 0.00 -0.84 0.00 0.00 61.79 61.04 2czu h SER 167 Cb -0.13 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.17 2czu h SER 167 CO -0.07 0.72 -0.57 0.11 -1.14 0.00 0.00 176.83 175.88 2czu h LYS 168 N 1.01 0.47 0.00 3.45 1.57 -0.64 -1.80 116.57 120.64 2czu h LYS 168 Ca 0.26 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2czu h LYS 168 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2czu h LYS 168 CO -0.05 0.91 0.00 0.00 -0.57 0.00 0.00 179.45 179.75 2czu n ALA 169 N -2.51 1.67 -0.19 3.86 0.00 -0.23 -0.72 120.51 122.39 2czu n ALA 169 Ca -0.03 -0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.41 2czu n ALA 169 Cb 0.61 -1.15 0.13 0.00 0.00 0.00 0.00 19.45 19.04 2czu n ALA 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2czu n GLN 170 N -1.21 2.88 -1.84 0.00 1.13 -0.78 -4.96 117.38 112.60 2czu n GLN 170 Ca 0.05 -2.00 0.00 0.00 -1.94 0.00 0.00 57.00 53.11 2czu n GLN 170 Cb 0.06 -1.25 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2czu n GLN 170 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2czu n GLY 171 N 0.26 0.43 3.50 1.08 0.00 0.11 -5.05 105.19 105.51 2czu n GLY 171 Ca 0.10 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.91 2czu n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2czu s LEU 172 N 0.00 3.14 0.60 0.99 1.43 -0.75 -5.01 118.68 119.07 2czu s LEU 172 Ca 0.00 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 2czu s LEU 172 Cb 0.00 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.52 2czu s LEU 172 CO 0.00 0.22 0.88 0.42 0.23 0.00 0.00 176.35 178.10 2czu s THR 173 N 0.03 3.08 0.41 5.49 -4.23 -1.26 -3.76 115.64 115.40 2czu s THR 173 Ca -0.01 -0.29 0.08 0.00 -1.18 0.00 0.00 61.69 60.30 2czu s THR 173 Cb -0.14 -3.23 0.28 0.00 1.34 0.00 0.00 72.50 70.76 2czu s THR 173 CO 0.03 -0.21 2.04 -0.33 -0.54 0.00 0.00 174.62 175.61 2czu h GLU 174 N -0.17 0.52 0.00 3.99 5.08 -1.97 0.28 114.58 122.30 2czu h GLU 174 Ca -0.44 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 2czu h GLU 174 Cb 1.28 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2czu h GLU 174 CO 0.58 0.34 0.00 1.05 -1.00 0.00 0.00 179.01 179.99 2czu h GLU 175 N 0.53 0.00 -0.03 2.33 4.11 -2.01 -0.60 114.58 118.92 2czu h GLU 175 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 2czu h GLU 175 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2czu h GLU 175 CO -0.04 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.79 2czu n ASP 176 N -3.02 2.18 -4.45 3.06 8.00 0.95 -4.89 116.55 118.39 2czu n ASP 176 Ca -0.01 -1.73 -0.33 0.00 0.71 0.00 0.00 54.79 53.43 2czu n ASP 176 Cb 0.20 -0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.16 2czu n ASP 176 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2czu s ILE 177 N -1.99 3.36 -0.06 0.53 1.01 -0.23 -2.90 121.20 120.92 2czu s ILE 177 Ca 0.34 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.38 2czu s ILE 177 Cb 0.21 -2.42 0.03 0.00 0.01 0.00 0.00 42.46 40.29 2czu s ILE 177 CO 0.32 0.53 0.15 0.54 0.00 0.00 0.00 174.94 176.48 2czu s VAL 178 N 0.07 -0.03 -0.48 2.92 0.11 -0.69 -4.95 120.40 117.36 2czu s VAL 178 Ca -0.03 0.09 -0.17 0.00 -2.93 0.00 0.00 61.98 58.94 2czu s VAL 178 Cb -0.14 -0.24 0.06 0.00 -1.53 0.00 0.00 36.38 34.53 2czu s VAL 178 CO 0.04 0.04 0.46 -0.36 -3.33 0.00 0.00 175.10 171.94 2czu s PHE 179 N 0.67 3.19 -0.13 1.54 0.08 -1.26 -1.43 117.98 120.63 2czu s PHE 179 Ca -0.05 -0.77 -0.38 0.00 0.12 0.00 0.00 56.93 55.86 2czu s PHE 179 Cb -0.07 -3.22 -0.15 0.00 -0.57 0.00 0.00 43.02 39.01 2czu s PHE 179 CO -0.03 -0.84 1.67 1.28 -0.10 0.00 0.00 175.22 177.19 2czu n LEU 180 N 5.49 2.46 -4.77 -0.37 4.77 -0.63 -4.94 117.00 119.01 2czu n LEU 180 Ca -0.10 1.07 -0.38 0.00 -0.03 0.00 0.00 56.01 56.56 2czu n LEU 180 Cb 0.45 -1.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.29 2czu n LEU 180 CO 0.49 -0.49 0.79 -2.16 -1.33 0.00 0.00 177.39 174.69 2czu s PRO 181 N 2.78 4.26 -0.11 3.23 0.04 -1.26 -4.40 135.00 139.54 2czu s PRO 181 Ca 0.93 1.71 -0.29 0.00 0.04 0.00 0.00 61.00 63.39 2czu s PRO 181 Cb -0.95 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 30.77 2czu s PRO 181 CO 0.57 -0.10 1.60 -1.14 0.04 0.00 0.00 177.00 177.97 2czu s GLN 182 N -2.12 4.09 0.71 4.56 0.74 -1.26 -0.84 119.66 125.54 2czu s GLN 182 Ca 0.54 2.00 -0.14 0.00 0.05 0.00 0.00 55.36 57.81 2czu s GLN 182 Cb -0.28 -3.97 0.03 0.00 1.10 0.00 0.00 33.01 29.89 2czu s GLN 182 CO 0.35 -0.95 1.14 -2.14 -0.55 0.00 0.00 175.29 173.15 2czu s PRO 183 N 4.14 2.39 0.11 1.67 0.02 -1.26 -4.93 135.00 137.14 2czu s PRO 183 Ca 0.71 1.49 0.07 0.00 0.02 0.00 0.00 61.00 63.29 2czu s PRO 183 Cb -0.30 -1.89 -0.21 0.00 0.02 0.00 0.00 34.50 32.12 2czu s PRO 183 CO 0.28 -1.59 1.26 0.22 -0.33 0.00 0.00 177.00 176.84 2czu h ASP 184 N -0.36 0.00 -3.94 2.53 1.82 -1.98 -3.45 116.42 111.05 2czu h ASP 184 Ca -0.46 0.00 -0.34 0.00 -0.39 0.00 0.00 57.03 55.84 2czu h ASP 184 Cb 1.26 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 41.20 2czu h ASP 184 CO 0.51 1.00 -0.29 2.29 -1.61 0.00 0.00 179.24 181.15 2czu n LYS 185 N -3.34 0.68 -1.12 0.28 2.85 -1.26 -4.73 118.16 111.52 2czu n LYS 185 Ca -0.01 -2.11 -0.04 0.00 -1.05 0.00 0.00 58.31 55.10 2czu n LYS 185 Cb 0.94 1.20 -0.02 0.00 -0.65 0.00 0.00 35.03 36.50 2czu n LYS 185 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2czu n ILE 187 N -2.56 0.00 -1.10 0.00 5.41 -1.26 -4.53 119.36 115.32 2czu n ILE 187 Ca -0.04 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.71 2czu n ILE 187 Cb 0.30 0.41 0.00 0.00 -0.71 0.00 0.00 39.64 39.63 2czu n ILE 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2czu n GLN 188 N 0.00 0.00 0.00 0.38 3.00 -1.26 -5.01 117.38 114.49 2czu n GLN 188 Ca 0.00 0.41 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 2czu n GLN 188 Cb 0.00 -3.79 0.00 0.00 0.00 0.00 0.00 30.24 26.45 2czu n GLN 188 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45