#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zru s ILE 3 N 0.00 1.89 -0.27 2.28 1.01 -1.26 -1.20 121.20 123.64 1zru s ILE 3 Ca 0.00 -0.84 -0.15 0.00 0.00 0.00 0.00 60.65 59.66 1zru s ILE 3 Cb 0.00 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 1zru s ILE 3 CO 0.00 0.51 0.36 -0.54 0.00 0.00 0.00 174.94 175.27 1zru s LYS 4 N 1.21 3.99 -0.41 2.79 1.02 -0.07 -4.95 119.74 123.32 1zru s LYS 4 Ca 0.01 -0.01 -0.08 0.00 0.02 0.00 0.00 55.97 55.92 1zru s LYS 4 Cb -0.14 -3.66 0.09 0.00 -0.52 0.00 0.00 37.83 33.60 1zru s LYS 4 CO -0.09 -0.28 0.24 -0.80 -0.92 0.00 0.00 175.35 173.50 1zru s ASN 5 N 1.65 5.53 -0.12 2.83 -0.87 -1.26 -1.38 114.94 121.32 1zru s ASN 5 Ca 0.14 -1.61 -0.07 0.00 -1.57 0.00 0.00 52.86 49.75 1zru s ASN 5 Cb -0.16 -1.94 -0.02 0.00 -0.02 0.00 0.00 41.25 39.10 1zru s ASN 5 CO 0.10 -0.53 -0.14 -0.26 -2.57 0.00 0.00 177.10 173.70 1zru h PHE 6 N 8.32 0.00 0.00 2.20 -1.00 -1.88 -3.41 116.94 121.17 1zru h PHE 6 Ca -0.21 0.00 -0.58 0.00 2.81 0.00 0.00 57.97 60.00 1zru h PHE 6 Cb 1.07 0.00 0.02 0.00 3.61 0.00 0.00 35.95 40.66 1zru h PHE 6 CO 0.61 0.00 3.43 2.41 -1.61 0.00 0.00 178.31 183.15 1zru n THR 7 N -4.26 3.67 -3.81 -1.55 -1.04 -1.17 -4.82 114.28 101.30 1zru n THR 7 Ca -0.06 -2.21 -0.12 0.00 -2.04 0.00 0.00 64.05 59.62 1zru n THR 7 Cb 0.20 -2.46 -0.12 0.00 -1.82 0.00 0.00 70.33 66.14 1zru n THR 7 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 1zru s PHE 8 N 2.62 -0.19 -0.78 -1.42 0.40 -1.26 -4.74 117.98 112.62 1zru s PHE 8 Ca 0.59 0.46 -0.01 0.00 -0.60 0.00 0.00 56.93 57.37 1zru s PHE 8 Cb 0.15 0.06 0.00 0.00 0.51 0.00 0.00 43.02 43.75 1zru s PHE 8 CO -0.05 -0.13 0.65 1.19 0.70 0.00 0.00 175.22 177.57 1zru n PHE 9 N 2.77 -2.50 -3.32 0.36 0.99 -1.26 -4.99 117.46 109.51 1zru n PHE 9 Ca -0.14 0.99 -0.23 0.00 -0.00 0.00 0.00 57.45 58.07 1zru n PHE 9 Cb 0.58 -3.38 -0.00 0.00 -1.00 0.00 0.00 39.48 35.68 1zru n PHE 9 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1zru s GLY 19 N -2.96 1.42 0.42 1.37 0.00 -1.26 -5.04 107.32 101.26 1zru s GLY 19 Ca 0.01 -1.03 0.13 0.00 0.00 0.00 0.00 44.72 43.83 1zru s GLY 19 CO 0.83 -0.94 1.94 1.76 0.00 0.00 0.00 173.10 176.69 1zru h SER 20 N 0.69 0.07 0.16 1.64 0.02 -1.94 -2.10 113.55 112.09 1zru h SER 20 Ca -0.48 -0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.30 1zru h SER 20 Cb 1.23 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 1zru h SER 20 CO 0.59 0.27 -0.54 -0.55 -1.14 0.00 0.00 176.83 175.46 1zru h ASN 21 N 0.07 0.46 -0.35 3.07 -1.07 -1.90 0.11 115.58 115.95 1zru h ASN 21 Ca 0.01 -0.24 -0.12 0.00 0.07 0.00 0.00 56.30 56.02 1zru h ASN 21 Cb 0.39 -0.13 -0.01 0.00 -2.07 0.00 0.00 38.32 36.50 1zru h ASN 21 CO 0.03 0.91 -0.26 0.78 0.07 0.00 0.00 177.43 178.96 1zru h ASN 22 N 0.32 0.84 -0.64 6.14 4.21 -1.81 -1.23 115.58 123.41 1zru h ASN 22 Ca 0.01 -0.44 -0.08 0.00 1.21 0.00 0.00 56.30 56.99 1zru h ASN 22 Cb 1.06 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 38.00 1zru h ASN 22 CO 0.09 1.10 0.08 0.44 -1.29 0.00 0.00 177.43 177.86 1zru h ASP 23 N 0.59 1.04 -0.28 5.81 3.32 -1.30 -1.44 116.42 124.16 1zru h ASP 23 Ca 0.07 -0.26 0.06 0.00 0.02 0.00 0.00 57.03 56.92 1zru h ASP 23 Cb 0.83 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.04 1zru h ASP 23 CO 0.07 1.04 -0.09 1.23 -1.72 0.00 0.00 179.24 179.77 1zru h GLY 24 N 1.04 0.17 0.98 2.75 0.00 -0.60 0.69 103.07 108.10 1zru h GLY 24 Ca 0.20 0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.60 1zru h GLY 24 CO 0.02 -0.12 0.16 0.50 0.00 0.00 0.00 176.54 177.09 1zru h LYS 25 N -0.03 0.80 -0.33 4.80 1.57 -1.07 -1.12 116.57 121.20 1zru h LYS 25 Ca 0.14 -0.17 0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1zru h LYS 25 Cb 0.24 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.39 1zru h LYS 25 CO -0.31 0.74 0.01 1.25 -0.57 0.00 0.00 179.45 180.57 1zru h LEU 26 N 0.70 -0.10 -0.52 2.94 5.85 -0.88 -1.12 115.31 122.18 1zru h LEU 26 Ca 0.17 0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.86 1zru h LEU 26 Cb 0.28 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1zru h LEU 26 CO -0.01 -0.02 -0.06 1.88 -0.34 0.00 0.00 178.44 179.90 1zru h TYR 27 N 0.11 1.06 -0.85 1.25 0.05 -0.56 -0.59 116.97 117.44 1zru h TYR 27 Ca 0.16 -0.21 0.02 0.00 0.05 0.00 0.00 58.73 58.76 1zru h TYR 27 Cb 0.21 -0.27 -0.05 0.00 1.01 0.00 0.00 36.73 37.63 1zru h TYR 27 CO -0.22 0.99 0.55 0.52 -1.05 0.00 0.00 178.16 178.95 1zru h MET 28 N 0.83 1.06 -0.39 4.88 2.86 -0.91 -2.03 114.93 121.23 1zru h MET 28 Ca 0.14 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.62 1zru h MET 28 Cb 0.61 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1zru h MET 28 CO 0.04 0.70 -0.13 0.52 1.06 0.00 0.00 176.91 179.10 1zru h MET 29 N 1.09 0.78 -0.85 1.72 2.86 -0.69 -0.70 114.93 119.15 1zru h MET 29 Ca 0.33 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1zru h MET 29 Cb -0.04 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 1zru h MET 29 CO -0.10 0.93 0.44 -0.07 1.06 0.00 0.00 176.91 179.17 1zru h LEU 30 N 0.58 1.08 0.00 1.22 3.38 -0.82 -3.10 115.31 117.65 1zru h LEU 30 Ca 0.09 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1zru h LEU 30 Cb 0.66 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1zru h LEU 30 CO 0.05 0.89 -0.73 1.07 0.09 0.00 0.00 178.44 179.80 1zru n THR 31 N -4.35 0.06 -2.67 0.22 5.66 -0.79 -4.98 114.28 107.43 1zru n THR 31 Ca 0.08 -0.07 -0.08 0.00 -3.05 0.00 0.00 64.05 60.93 1zru n THR 31 Cb 0.11 0.36 0.04 0.00 -1.55 0.00 0.00 70.33 69.30 1zru n THR 31 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1zru n GLY 32 N 1.46 0.05 3.46 1.09 0.00 -0.36 -4.64 105.19 106.25 1zru n GLY 32 Ca 0.04 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1zru n GLY 32 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1zru s MET 33 N -4.60 1.96 0.02 1.61 0.23 -0.67 -0.51 119.30 117.34 1zru s MET 33 Ca 0.01 -1.05 0.00 0.00 -1.03 0.00 0.00 55.69 53.62 1zru s MET 33 Cb -0.00 -2.15 0.00 0.00 -1.53 0.00 0.00 34.83 31.15 1zru s MET 33 CO 0.35 0.52 0.03 -0.40 -2.03 0.00 0.00 175.02 173.49 1zru n ASP 34 N 1.32 0.18 0.00 -1.18 5.68 -1.26 -4.66 116.55 116.63 1zru n ASP 34 Ca -0.16 -1.07 0.15 0.00 -0.50 0.00 0.00 54.79 53.21 1zru n ASP 34 Cb 0.52 -0.02 0.80 0.00 -1.14 0.00 0.00 41.12 41.29 1zru n ASP 34 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1zru n TYR 35 N -1.00 0.00 -0.52 2.11 4.01 -1.26 -3.45 117.16 117.04 1zru n TYR 35 Ca 0.01 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.83 1zru n TYR 35 Cb 0.03 -0.15 0.28 0.00 -0.31 0.00 0.00 39.34 39.19 1zru n TYR 35 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1zru n ARG 36 N -1.15 3.24 -4.12 -0.72 1.74 -1.26 -4.29 116.66 110.10 1zru n ARG 36 Ca 0.18 -2.63 -0.19 0.00 -0.77 0.00 0.00 57.85 54.44 1zru n ARG 36 Cb 0.17 -1.67 -0.07 0.00 -1.02 0.00 0.00 32.46 29.87 1zru n ARG 36 CO 0.00 0.00 0.00 -2.37 -1.52 0.00 0.00 177.63 173.74 1zru n THR 37 N 0.81 0.00 -4.26 0.55 5.66 -1.22 -4.94 114.28 110.88 1zru n THR 37 Ca 0.21 -2.28 -0.14 0.00 -3.05 0.00 0.00 64.05 58.79 1zru n THR 37 Cb 0.73 1.09 -0.10 0.00 -1.55 0.00 0.00 70.33 70.49 1zru n THR 37 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1zru s ILE 38 N -3.23 0.48 0.00 1.09 -0.00 -1.26 -4.58 121.20 113.70 1zru s ILE 38 Ca 0.35 -1.99 0.02 0.00 -0.00 0.00 0.00 60.65 59.03 1zru s ILE 38 Cb 0.02 -2.41 -0.03 0.00 -0.00 0.00 0.00 42.46 40.04 1zru s ILE 38 CO 0.25 -0.19 -0.04 -0.13 -0.00 0.00 0.00 174.94 174.83 1zru s ARG 39 N -4.02 2.66 -0.19 0.37 1.81 -0.62 -4.33 118.95 114.64 1zru s ARG 39 Ca 0.32 -0.67 -0.15 0.00 -1.72 0.00 0.00 55.73 53.52 1zru s ARG 39 Cb 0.07 -2.58 0.05 0.00 -0.45 0.00 0.00 34.95 32.05 1zru s ARG 39 CO 0.09 0.61 0.49 0.50 -0.68 0.00 0.00 175.30 176.32 1zru s ARG 40 N -1.47 0.54 -0.08 3.54 3.00 -1.26 -0.70 118.95 122.52 1zru s ARG 40 Ca 0.18 0.77 -0.03 0.00 -1.00 0.00 0.00 55.73 55.65 1zru s ARG 40 Cb -0.11 0.18 0.04 0.00 0.00 0.00 0.00 34.95 35.06 1zru s ARG 40 CO 0.09 -0.10 0.15 0.21 0.00 0.00 0.00 175.30 175.65 1zru s LYS 41 N 0.74 0.04 -0.59 5.12 2.47 -0.18 -5.00 119.74 122.34 1zru s LYS 41 Ca -0.04 0.52 -0.24 0.00 -1.56 0.00 0.00 55.97 54.65 1zru s LYS 41 Cb -0.05 -0.26 0.05 0.00 -1.46 0.00 0.00 37.83 36.11 1zru s LYS 41 CO -0.05 -0.28 0.95 -0.51 0.16 0.00 0.00 175.35 175.61 1zru s ASP 42 N 2.06 6.28 0.26 1.43 1.01 -1.26 -1.01 116.67 125.44 1zru s ASP 42 Ca 0.01 -0.57 0.07 0.00 0.71 0.00 0.00 52.55 52.77 1zru s ASP 42 Cb -0.12 -2.43 0.32 0.00 1.01 0.00 0.00 42.92 41.70 1zru s ASP 42 CO -0.06 -1.30 1.60 -0.50 0.21 0.00 0.00 175.17 175.12 1zru h TRP 43 N 9.40 0.18 -3.35 4.23 4.06 -1.26 -3.43 115.95 125.78 1zru h TRP 43 Ca -0.27 -0.07 -0.38 0.00 2.06 0.00 0.00 58.89 60.24 1zru h TRP 43 Cb 1.07 -0.03 -0.16 0.00 -1.00 0.00 0.00 29.16 29.04 1zru h TRP 43 CO 0.93 0.70 -0.73 -1.54 -3.56 0.00 0.00 178.44 174.24 1zru s SER 44 N -6.88 1.99 0.24 -3.49 1.04 -1.15 -5.04 113.70 100.42 1zru s SER 44 Ca -0.03 -0.95 -0.30 0.00 0.48 0.00 0.00 55.95 55.15 1zru s SER 44 Cb 0.12 -0.05 -0.10 0.00 0.10 0.00 0.00 66.02 66.09 1zru s SER 44 CO 0.78 -0.24 1.51 -0.55 0.98 0.00 0.00 173.24 175.72 1zru s SER 45 N -2.96 6.57 0.70 7.02 0.15 -1.26 -4.32 113.70 119.59 1zru s SER 45 Ca 0.15 2.72 -0.16 0.00 0.70 0.00 0.00 55.95 59.36 1zru s SER 45 Cb -0.00 -2.62 0.02 0.00 -1.71 0.00 0.00 66.02 61.71 1zru s SER 45 CO 0.02 -0.79 1.25 -2.84 1.20 0.00 0.00 173.24 172.09 1zru s PRO 46 N 0.02 2.27 -0.17 5.44 0.02 -1.26 -4.42 135.00 136.90 1zru s PRO 46 Ca 0.63 1.93 -0.01 0.00 0.02 0.00 0.00 61.00 63.57 1zru s PRO 46 Cb -0.44 -1.83 -0.01 0.00 0.02 0.00 0.00 34.50 32.25 1zru s PRO 46 CO 0.41 -1.78 -0.11 -0.51 -0.33 0.00 0.00 177.00 174.68 1zru s LEU 47 N -4.82 2.68 -0.21 -5.54 1.43 0.54 -4.92 118.68 107.83 1zru s LEU 47 Ca 0.79 -0.40 -0.16 0.00 -1.03 0.00 0.00 54.13 53.32 1zru s LEU 47 Cb -0.34 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1zru s LEU 47 CO 0.43 0.07 0.42 0.20 0.23 0.00 0.00 176.35 177.70 1zru s ASN 48 N 0.89 6.43 -0.14 2.29 0.01 -1.26 -0.40 114.94 122.77 1zru s ASN 48 Ca -0.03 0.51 -0.04 0.00 -0.71 0.00 0.00 52.86 52.60 1zru s ASN 48 Cb -0.15 -2.24 0.06 0.00 0.41 0.00 0.00 41.25 39.33 1zru s ASN 48 CO -0.00 -0.11 0.10 -0.89 -1.51 0.00 0.00 177.10 174.69 1zru s THR 49 N 1.48 -0.13 0.00 1.60 2.01 -0.73 -4.96 115.64 114.91 1zru s THR 49 Ca 0.19 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.22 1zru s THR 49 Cb -0.15 -0.46 0.00 0.00 0.01 0.00 0.00 72.50 71.90 1zru s THR 49 CO 0.08 -0.13 0.00 0.00 -0.69 0.00 0.00 174.62 173.88 1zru n ALA 50 N 5.29 0.00 -1.88 7.40 0.00 -1.26 -2.43 120.51 127.63 1zru n ALA 50 Ca -0.06 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 1zru n ALA 50 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 1zru n ALA 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1zru n LEU 51 N 0.00 7.63 -3.77 0.00 4.77 -1.26 -3.86 117.00 120.51 1zru n LEU 51 Ca 0.00 -4.69 -0.13 0.00 -0.03 0.00 0.00 56.01 51.16 1zru n LEU 51 Cb 0.00 -1.32 -0.10 0.00 -2.33 0.00 0.00 43.42 39.66 1zru n LEU 51 CO 0.00 1.98 -0.03 0.20 -1.33 0.00 0.00 177.39 178.21 1zru s ASN 52 N 0.33 -0.27 -0.12 -1.43 0.01 -1.02 -0.53 114.94 111.91 1zru s ASN 52 Ca 0.55 0.46 0.01 0.00 -0.71 0.00 0.00 52.86 53.17 1zru s ASN 52 Cb 0.24 0.54 -0.01 0.00 0.41 0.00 0.00 41.25 42.42 1zru s ASN 52 CO -0.13 -0.19 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.41 1zru s VAL 53 N -0.24 2.66 -0.39 1.60 1.01 -0.56 -1.78 120.40 122.70 1zru s VAL 53 Ca -0.04 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.06 1zru s VAL 53 Cb -0.03 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.32 1zru s VAL 53 CO 0.01 0.54 0.22 -1.58 0.00 0.00 0.00 175.10 174.28 1zru s GLN 54 N 0.42 2.64 -0.36 2.72 0.74 0.47 -0.54 119.66 125.74 1zru s GLN 54 Ca -0.13 -1.33 -0.29 0.00 0.05 0.00 0.00 55.36 53.66 1zru s GLN 54 Cb -0.17 -3.70 0.00 0.00 1.10 0.00 0.00 33.01 30.25 1zru s GLN 54 CO 0.06 -0.85 1.41 0.71 -0.55 0.00 0.00 175.29 176.07 1zru s TYR 55 N 1.44 2.44 -0.13 1.67 2.02 0.35 -0.34 117.35 124.80 1zru s TYR 55 Ca 0.02 0.72 -0.25 0.00 -0.37 0.00 0.00 57.07 57.19 1zru s TYR 55 Cb -0.21 -4.17 -0.26 0.00 -0.40 0.00 0.00 41.96 36.92 1zru s TYR 55 CO 0.03 -2.00 0.66 1.79 -1.57 0.00 0.00 175.55 174.47 1zru h THR 56 N 6.31 1.49 -1.26 -0.71 1.35 -1.78 0.15 112.91 118.46 1zru h THR 56 Ca -0.28 -2.36 -0.12 0.00 -0.55 0.00 0.00 66.41 63.10 1zru h THR 56 Cb 1.11 3.06 -0.23 0.00 -1.73 0.00 0.00 68.15 70.37 1zru h THR 56 CO 1.06 0.58 -0.50 0.21 -0.25 0.00 0.00 175.52 176.63 1zru s ASN 57 N -6.57 -0.83 -0.08 5.36 2.47 -1.22 -2.24 114.94 111.83 1zru s ASN 57 Ca -0.20 -0.78 0.02 0.00 0.42 0.00 0.00 52.86 52.33 1zru s ASN 57 Cb 0.00 1.61 0.01 0.00 -1.45 0.00 0.00 41.25 41.43 1zru s ASN 57 CO 0.71 -0.22 -0.15 -0.89 -3.72 0.00 0.00 177.10 172.82 1zru s THR 58 N 1.96 1.39 -0.07 -5.21 2.01 -0.63 -0.62 115.64 114.46 1zru s THR 58 Ca 0.15 -0.61 -0.09 0.00 0.31 0.00 0.00 61.69 61.44 1zru s THR 58 Cb -0.08 -1.25 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 1zru s THR 58 CO -0.11 0.41 0.23 -0.44 -0.69 0.00 0.00 174.62 174.02 1zru s SER 59 N 0.68 6.51 0.02 3.53 0.01 -0.18 0.10 113.70 124.37 1zru s SER 59 Ca -0.14 0.61 0.03 0.00 1.31 0.00 0.00 55.95 57.76 1zru s SER 59 Cb -0.16 -2.12 -0.01 0.00 0.21 0.00 0.00 66.02 63.94 1zru s SER 59 CO 0.04 0.37 -0.09 -0.63 0.41 0.00 0.00 173.24 173.33 1zru s ILE 60 N -1.08 0.71 -0.18 1.44 1.01 -0.38 -1.01 121.20 121.71 1zru s ILE 60 Ca 0.19 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1zru s ILE 60 Cb -0.13 -0.65 0.01 0.00 0.01 0.00 0.00 42.46 41.70 1zru s ILE 60 CO 0.08 0.00 -0.16 -0.63 0.00 0.00 0.00 174.94 174.23 1zru s ILE 61 N -0.62 2.42 -0.07 2.92 1.01 0.13 -1.22 121.20 125.78 1zru s ILE 61 Ca -0.00 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.82 1zru s ILE 61 Cb -0.06 -2.04 0.02 0.00 0.01 0.00 0.00 42.46 40.40 1zru s ILE 61 CO 0.00 0.51 -0.05 0.00 0.00 0.00 0.00 174.94 175.40 1zru s ALA 62 N 1.20 0.92 -1.49 9.38 0.00 -0.63 -1.58 121.76 129.56 1zru s ALA 62 Ca 0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1zru s ALA 62 Cb -0.14 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.36 1zru s ALA 62 CO -0.08 -0.19 0.36 0.41 0.00 0.00 0.00 175.76 176.26 1zru n GLY 63 N 4.48 -0.51 2.78 0.00 0.00 -1.26 -1.18 105.19 109.50 1zru n GLY 63 Ca -0.17 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1zru n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zru n GLY 64 N -1.24 0.52 3.66 -0.02 0.00 -1.26 -4.69 105.19 102.16 1zru n GLY 64 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1zru n GLY 64 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zru s ARG 65 N -0.46 4.08 -0.07 1.61 1.81 -0.32 -4.31 118.95 121.29 1zru s ARG 65 Ca 0.00 -0.23 -0.17 0.00 -1.72 0.00 0.00 55.73 53.62 1zru s ARG 65 Cb 0.00 -3.54 -0.05 0.00 -0.45 0.00 0.00 34.95 30.91 1zru s ARG 65 CO 0.00 0.06 0.44 -0.47 -0.68 0.00 0.00 175.30 174.65 1zru s TYR 66 N 1.07 3.60 0.13 -0.53 5.04 -1.26 -1.60 117.35 123.80 1zru s TYR 66 Ca 0.09 0.92 -0.12 0.00 -2.44 0.00 0.00 57.07 55.51 1zru s TYR 66 Cb -0.14 -2.44 0.01 0.00 0.35 0.00 0.00 41.96 39.74 1zru s TYR 66 CO 0.05 0.35 0.31 -0.59 -1.34 0.00 0.00 175.55 174.33 1zru s PHE 67 N -0.05 0.10 -0.04 4.97 -0.12 -0.36 -2.44 117.98 120.05 1zru s PHE 67 Ca 0.24 -0.47 0.05 0.00 -0.05 0.00 0.00 56.93 56.70 1zru s PHE 67 Cb -0.16 0.07 -0.01 0.00 -0.63 0.00 0.00 43.02 42.30 1zru s PHE 67 CO 0.11 -0.68 -0.20 -1.21 -0.05 0.00 0.00 175.22 173.19 1zru s GLU 68 N -3.88 1.90 -0.39 1.99 2.02 -0.48 -1.24 118.70 118.61 1zru s GLU 68 Ca 0.08 -0.71 -0.15 0.00 0.02 0.00 0.00 54.97 54.21 1zru s GLU 68 Cb 0.03 -1.70 0.01 0.00 0.10 0.00 0.00 34.13 32.57 1zru s GLU 68 CO -0.07 0.34 0.29 -0.51 0.02 0.00 0.00 175.26 175.33 1zru s LEU 69 N -0.19 4.98 -0.31 1.80 1.43 0.11 -0.89 118.68 125.62 1zru s LEU 69 Ca 0.00 -0.79 0.01 0.00 -1.03 0.00 0.00 54.13 52.33 1zru s LEU 69 Cb -0.11 -2.16 0.07 0.00 0.03 0.00 0.00 46.19 44.03 1zru s LEU 69 CO 0.01 -0.41 -0.01 -0.76 0.23 0.00 0.00 176.35 175.42 1zru s LEU 70 N 1.70 4.07 -1.20 1.79 1.43 -0.34 -1.61 118.68 124.53 1zru s LEU 70 Ca 0.05 -1.62 -0.18 0.00 -1.03 0.00 0.00 54.13 51.36 1zru s LEU 70 Cb -0.19 -1.64 -0.00 0.00 0.03 0.00 0.00 46.19 44.39 1zru s LEU 70 CO 0.10 -0.29 0.72 0.59 0.23 0.00 0.00 176.35 177.70 1zru n ASN 71 N 4.45 -4.22 -4.30 2.29 5.03 0.34 -0.96 115.26 117.90 1zru n ASN 71 Ca -0.08 -1.03 -0.36 0.00 0.87 0.00 0.00 54.58 53.98 1zru n ASN 71 Cb 0.42 -3.23 -0.14 0.00 -1.02 0.00 0.00 39.78 35.82 1zru n ASN 71 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1zru s GLU 72 N -6.18 3.18 -0.12 3.52 2.56 -0.21 -2.25 118.70 119.20 1zru s GLU 72 Ca 0.38 -0.77 -0.05 0.00 0.00 0.00 0.00 54.97 54.52 1zru s GLU 72 Cb -0.14 -3.13 -0.04 0.00 2.00 0.00 0.00 34.13 32.82 1zru s GLU 72 CO 0.87 -0.32 0.08 0.99 -0.56 0.00 0.00 175.26 176.32 1zru s THR 73 N 1.46 4.98 -0.15 -1.70 2.01 -1.26 -0.49 115.64 120.48 1zru s THR 73 Ca 0.04 0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.06 1zru s THR 73 Cb -0.16 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.19 1zru s THR 73 CO -0.01 0.58 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 1zru s VAL 74 N -0.67 2.50 0.27 3.82 1.01 0.30 -4.97 120.40 122.66 1zru s VAL 74 Ca 0.12 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 1zru s VAL 74 Cb -0.12 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.13 1zru s VAL 74 CO 0.02 0.52 1.00 0.00 0.00 0.00 0.00 175.10 176.65 1zru s ALA 75 N 0.80 3.35 0.15 5.51 0.00 -1.26 -1.49 121.76 128.81 1zru s ALA 75 Ca -0.06 0.72 0.08 0.00 0.00 0.00 0.00 51.96 52.70 1zru s ALA 75 Cb -0.15 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1zru s ALA 75 CO -0.00 0.05 -0.11 -0.51 0.00 0.00 0.00 175.76 175.19 1zru s LEU 76 N -1.39 2.94 0.18 0.00 1.43 0.31 -4.63 118.68 117.52 1zru s LEU 76 Ca 0.43 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.71 1zru s LEU 76 Cb -0.28 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 1zru s LEU 76 CO 0.35 0.14 1.00 -0.75 0.23 0.00 0.00 176.35 177.32 1zru s LYS 77 N -2.55 4.71 0.54 1.70 2.20 -1.26 -4.86 119.74 120.23 1zru s LYS 77 Ca 0.23 1.56 -0.17 0.00 -0.36 0.00 0.00 55.97 57.23 1zru s LYS 77 Cb -0.10 -3.31 -0.06 0.00 -1.51 0.00 0.00 37.83 32.86 1zru s LYS 77 CO 0.14 0.27 1.03 0.20 -0.36 0.00 0.00 175.35 176.63 1zru s GLY 78 N -0.45 2.22 -1.39 5.54 0.00 -1.26 -4.10 107.32 107.87 1zru s GLY 78 Ca 0.46 0.40 -0.03 0.00 0.00 0.00 0.00 44.72 45.54 1zru s GLY 78 CO 0.33 0.70 0.65 1.22 0.00 0.00 0.00 173.10 176.00 1zru n ASP 79 N -1.61 -1.49 -3.64 1.64 10.43 -0.28 -4.94 116.55 116.66 1zru n ASP 79 Ca 0.08 -0.88 -0.12 0.00 2.57 0.00 0.00 54.79 56.44 1zru n ASP 79 Cb 0.53 -3.65 -0.06 0.00 1.84 0.00 0.00 41.12 39.79 1zru n ASP 79 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 1zru s SER 80 N -4.17 -0.29 -0.35 -2.24 0.15 -1.11 -4.96 113.70 100.72 1zru s SER 80 Ca 0.13 -0.08 -0.18 0.00 0.70 0.00 0.00 55.95 56.51 1zru s SER 80 Cb -0.07 0.45 -0.00 0.00 -1.71 0.00 0.00 66.02 64.69 1zru s SER 80 CO 0.84 -0.74 0.52 -0.69 1.20 0.00 0.00 173.24 174.38 1zru s VAL 81 N -2.93 5.00 -0.26 4.45 1.01 -1.26 -1.28 120.40 125.13 1zru s VAL 81 Ca -0.02 0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.20 1zru s VAL 81 Cb 0.00 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 1zru s VAL 81 CO -0.06 -0.23 0.21 0.20 0.00 0.00 0.00 175.10 175.23 1zru s ASN 82 N 1.76 6.10 -0.42 3.32 0.01 0.51 -4.66 114.94 121.56 1zru s ASN 82 Ca 0.19 0.09 -0.18 0.00 -0.71 0.00 0.00 52.86 52.25 1zru s ASN 82 Cb -0.15 -2.13 0.02 0.00 0.41 0.00 0.00 41.25 39.40 1zru s ASN 82 CO 0.13 -0.03 0.45 -0.31 -1.51 0.00 0.00 177.10 175.84 1zru s TYR 83 N 1.54 3.16 -0.20 2.20 2.02 0.49 -0.51 117.35 126.05 1zru s TYR 83 Ca 0.09 -0.36 -0.24 0.00 -0.37 0.00 0.00 57.07 56.18 1zru s TYR 83 Cb -0.15 -2.94 -0.01 0.00 -0.40 0.00 0.00 41.96 38.46 1zru s TYR 83 CO 0.09 -0.72 0.80 0.42 -1.57 0.00 0.00 175.55 174.57 1zru s ILE 84 N 2.19 4.88 0.03 2.71 -1.09 0.02 -0.81 121.20 129.13 1zru s ILE 84 Ca 0.13 1.54 0.05 0.00 -2.23 0.00 0.00 60.65 60.13 1zru s ILE 84 Cb -0.17 -4.10 -0.03 0.00 -1.58 0.00 0.00 42.46 36.58 1zru s ILE 84 CO 0.14 -0.00 -0.09 -1.00 -1.23 0.00 0.00 174.94 172.75 1zru s HIS 85 N 2.42 2.80 -0.13 3.97 3.76 0.11 -1.06 115.29 127.15 1zru s HIS 85 Ca 0.35 -0.10 -0.14 0.00 -0.15 0.00 0.00 55.06 55.03 1zru s HIS 85 Cb -0.16 -1.55 -0.05 0.00 1.11 0.00 0.00 32.58 31.93 1zru s HIS 85 CO 0.10 0.36 0.31 0.00 -0.85 0.00 0.00 174.74 174.66 1zru s ALA 86 N -1.03 3.62 -0.14 -1.40 0.00 -0.14 -1.59 121.76 121.09 1zru s ALA 86 Ca 0.18 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 51.75 1zru s ALA 86 Cb -0.11 -2.38 0.01 0.00 0.00 0.00 0.00 23.12 20.64 1zru s ALA 86 CO 0.08 0.19 -0.21 -0.80 0.00 0.00 0.00 175.76 175.02 1zru s ASN 87 N 0.12 3.05 -0.21 0.00 0.01 0.31 -1.10 114.94 117.13 1zru s ASN 87 Ca 0.18 -0.59 0.01 0.00 -0.71 0.00 0.00 52.86 51.76 1zru s ASN 87 Cb -0.14 -1.41 0.03 0.00 0.41 0.00 0.00 41.25 40.14 1zru s ASN 87 CO 0.06 0.08 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.93 1zru s ILE 88 N 0.81 2.15 -0.27 0.60 1.01 0.55 -1.31 121.20 124.74 1zru s ILE 88 Ca -0.07 -1.18 0.01 0.00 0.00 0.00 0.00 60.65 59.41 1zru s ILE 88 Cb -0.16 -2.04 0.08 0.00 0.01 0.00 0.00 42.46 40.35 1zru s ILE 88 CO -0.02 0.33 0.01 -0.62 0.00 0.00 0.00 174.94 174.65 1zru s ASP 89 N 1.23 4.02 0.16 3.58 -1.08 0.11 -1.27 116.67 123.42 1zru s ASP 89 Ca 0.00 -1.46 0.22 0.00 -0.52 0.00 0.00 52.55 50.79 1zru s ASP 89 Cb -0.16 -1.15 0.88 0.00 -1.46 0.00 0.00 42.92 41.03 1zru s ASP 89 CO -0.10 -0.31 1.67 0.18 0.52 0.00 0.00 175.17 177.13 1zru n LEU 90 N 4.66 0.45 0.20 -1.34 4.77 -1.26 -1.98 117.00 122.49 1zru n LEU 90 Ca -0.06 0.59 0.08 0.00 -0.03 0.00 0.00 56.01 56.59 1zru n LEU 90 Cb 0.43 -0.51 0.30 0.00 -2.33 0.00 0.00 43.42 41.31 1zru n LEU 90 CO 0.17 -0.38 0.70 0.71 -1.33 0.00 0.00 177.39 177.26 1zru h THR 91 N 0.00 0.59 -0.82 -5.08 1.35 -1.94 -3.35 112.91 103.67 1zru h THR 91 Ca 0.00 -1.45 -0.72 0.00 -0.55 0.00 0.00 66.41 63.69 1zru h THR 91 Cb 0.40 1.99 -0.10 0.00 -1.73 0.00 0.00 68.15 68.71 1zru h THR 91 CO 0.00 0.28 2.44 0.00 -0.25 0.00 0.00 175.52 177.99 1zru n GLN 92 N -3.31 3.20 -0.18 4.72 1.13 -0.84 -4.82 117.38 117.29 1zru n GLN 92 Ca 0.01 -3.14 0.04 0.00 -1.94 0.00 0.00 57.00 51.97 1zru n GLN 92 Cb 0.53 -3.19 0.32 0.00 0.11 0.00 0.00 30.24 28.02 1zru n GLN 92 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1zru h THR 93 N 4.27 1.08 -0.00 5.09 1.35 -1.82 -1.40 112.91 121.48 1zru h THR 93 Ca 0.47 -0.28 -0.11 0.00 -0.55 0.00 0.00 66.41 65.93 1zru h THR 93 Cb 0.70 0.18 -0.02 0.00 -1.73 0.00 0.00 68.15 67.29 1zru h THR 93 CO 1.66 0.15 -0.54 0.00 -0.25 0.00 0.00 175.52 176.55 1zru h ALA 94 N 1.59 1.11 -1.58 6.62 0.00 -1.94 -3.40 119.26 121.67 1zru h ALA 94 Ca 0.29 -0.49 -0.30 0.00 0.00 0.00 0.00 54.91 54.41 1zru h ALA 94 Cb 0.11 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 17.56 1zru h ALA 94 CO -0.09 0.67 -0.65 0.54 0.00 0.00 0.00 179.25 179.72 1zru s ASN 95 N -6.88 -0.09 0.47 0.00 6.03 -0.62 -5.01 114.94 108.84 1zru s ASN 95 Ca -0.02 -1.89 0.30 0.00 -1.03 0.00 0.00 52.86 50.23 1zru s ASN 95 Cb 0.13 1.00 1.12 0.00 -3.03 0.00 0.00 41.25 40.47 1zru s ASN 95 CO 0.75 -0.15 1.87 1.55 -2.03 0.00 0.00 177.10 179.10 1zru h PRO 96 N 5.97 0.00 -5.88 3.55 0.13 -1.52 -3.43 132.00 130.82 1zru h PRO 96 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.56 1zru h PRO 96 Cb 1.06 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.92 1zru h PRO 96 CO 0.16 0.00 -0.81 0.08 -0.23 0.00 0.00 178.00 177.20 1zru s VAL 97 N -3.52 2.71 0.06 1.56 1.01 -1.26 0.08 120.40 121.04 1zru s VAL 97 Ca 0.03 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 1zru s VAL 97 Cb 0.09 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 1zru s VAL 97 CO 0.54 0.56 0.06 -0.94 0.00 0.00 0.00 175.10 175.32 1zru s SER 98 N -0.18 0.31 0.05 3.32 1.04 -0.43 -4.98 113.70 112.85 1zru s SER 98 Ca -0.01 -0.79 0.04 0.00 0.48 0.00 0.00 55.95 55.67 1zru s SER 98 Cb -0.13 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 1zru s SER 98 CO 0.03 -0.61 -0.04 -0.76 0.98 0.00 0.00 173.24 172.85 1zru s LEU 99 N -2.69 3.32 0.05 2.42 1.43 -1.26 -0.53 118.68 121.42 1zru s LEU 99 Ca 0.03 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.96 1zru s LEU 99 Cb 0.05 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 1zru s LEU 99 CO -0.09 0.22 -0.05 -0.94 0.23 0.00 0.00 176.35 175.73 1zru s SER 100 N -1.93 0.63 -0.19 2.29 1.04 -0.62 -4.98 113.70 109.94 1zru s SER 100 Ca 0.22 -0.79 -0.02 0.00 0.48 0.00 0.00 55.95 55.84 1zru s SER 100 Cb -0.11 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.13 1zru s SER 100 CO 0.13 -0.42 -0.11 0.00 0.98 0.00 0.00 173.24 173.81 1zru s ALA 101 N -2.78 2.60 0.22 5.32 0.00 -1.26 -0.72 121.76 125.15 1zru s ALA 101 Ca -0.01 -1.15 0.06 0.00 0.00 0.00 0.00 51.96 50.86 1zru s ALA 101 Cb -0.00 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.62 1zru s ALA 101 CO -0.05 -0.31 -0.07 -1.21 0.00 0.00 0.00 175.76 174.12 1zru s GLU 102 N 1.26 1.34 0.04 0.00 2.02 0.01 -4.88 118.70 118.49 1zru s GLU 102 Ca 0.03 -1.64 0.28 0.00 0.02 0.00 0.00 54.97 53.66 1zru s GLU 102 Cb -0.14 -0.89 1.00 0.00 0.10 0.00 0.00 34.13 34.20 1zru s GLU 102 CO -0.05 0.05 1.79 0.25 0.02 0.00 0.00 175.26 177.31 1zru n THR 103 N -0.41 0.11 -4.08 3.63 -2.24 -1.26 -0.38 114.28 109.65 1zru n THR 103 Ca -0.07 -0.06 -0.10 0.00 -2.27 0.00 0.00 64.05 61.55 1zru n THR 103 Cb 0.62 -0.37 -0.09 0.00 -2.10 0.00 0.00 70.33 68.40 1zru n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zru s ALA 104 N -3.02 0.53 -0.54 6.98 0.00 -1.26 -4.87 121.76 119.58 1zru s ALA 104 Ca 0.13 -1.25 -0.28 0.00 0.00 0.00 0.00 51.96 50.55 1zru s ALA 104 Cb 0.17 0.93 0.00 0.00 0.00 0.00 0.00 23.12 24.23 1zru s ALA 104 CO 0.58 -0.57 1.52 1.21 0.00 0.00 0.00 175.76 178.50 1zru s ASN 105 N -3.03 5.98 -0.30 0.00 3.84 -1.26 -4.69 114.94 115.48 1zru s ASN 105 Ca 0.23 0.43 0.10 0.00 0.21 0.00 0.00 52.86 53.83 1zru s ASN 105 Cb 0.06 -2.54 0.57 0.00 -0.55 0.00 0.00 41.25 38.79 1zru s ASN 105 CO 0.03 -1.80 1.58 0.59 -2.79 0.00 0.00 177.10 174.71 1zru n ASN 106 N 10.10 3.29 -4.69 -4.21 3.02 -1.26 -5.01 115.26 116.51 1zru n ASN 106 Ca 0.15 -3.52 -0.44 0.00 -0.03 0.00 0.00 54.58 50.74 1zru n ASN 106 Cb 0.49 -0.67 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 1zru n ASN 106 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1zru n SER 107 N -0.88 2.98 -0.00 6.41 7.64 -1.26 -4.82 113.62 123.68 1zru n SER 107 Ca 0.37 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.39 1zru n SER 107 Cb 1.17 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1zru n SER 107 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1zru n ASN 108 N 2.06 0.58 -1.79 6.43 0.23 -0.69 -5.00 115.26 117.09 1zru n ASN 108 Ca 0.10 -0.79 -0.20 0.00 -0.53 0.00 0.00 54.58 53.17 1zru n ASN 108 Cb 0.33 0.43 -0.07 0.00 -2.08 0.00 0.00 39.78 38.39 1zru n ASN 108 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1zru n GLY 109 N 0.43 1.30 3.71 4.83 0.00 -1.26 -4.92 105.19 109.27 1zru n GLY 109 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1zru n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zru s VAL 110 N -2.77 3.12 -1.08 1.61 1.01 -1.26 -4.81 120.40 116.22 1zru s VAL 110 Ca 0.00 0.77 -0.22 0.00 0.00 0.00 0.00 61.98 62.54 1zru s VAL 110 Cb 0.00 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.94 1zru s VAL 110 CO 0.00 0.05 1.51 -0.62 0.00 0.00 0.00 175.10 176.04 1zru s ASP 111 N 1.28 6.59 0.00 3.32 -1.08 -1.26 -4.66 116.67 120.86 1zru s ASP 111 Ca 0.67 -1.72 0.26 0.00 -0.52 0.00 0.00 52.55 51.24 1zru s ASP 111 Cb -0.39 -2.56 1.14 0.00 -1.46 0.00 0.00 42.92 39.65 1zru s ASP 111 CO 0.30 -1.41 1.84 2.30 0.52 0.00 0.00 175.17 178.72 1zru n ILE 112 N 6.70 0.21 0.99 4.11 -5.35 -1.26 -2.52 119.36 122.25 1zru n ILE 112 Ca 0.36 0.05 0.12 0.00 -0.27 0.00 0.00 62.75 63.02 1zru n ILE 112 Cb 0.50 -0.61 0.20 0.00 -1.74 0.00 0.00 39.64 37.98 1zru n ILE 112 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1zru n ASN 113 N -1.46 0.57 0.00 7.28 3.02 -1.26 -4.34 115.26 119.07 1zru n ASN 113 Ca 0.07 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 1zru n ASN 113 Cb 0.28 0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 1zru n ASN 113 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1zru n ASN 114 N -1.51 0.60 -3.46 6.41 3.02 -1.17 -4.82 115.26 114.33 1zru n ASN 114 Ca 0.05 -0.89 -0.02 0.00 -0.03 0.00 0.00 54.58 53.69 1zru n ASN 114 Cb 0.34 0.13 0.01 0.00 -0.61 0.00 0.00 39.78 39.64 1zru n ASN 114 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1zru s GLY 115 N -0.13 0.02 0.65 7.41 0.00 -1.05 -5.13 107.32 109.10 1zru s GLY 115 Ca 0.00 -0.20 -0.06 0.00 0.00 0.00 0.00 44.72 44.46 1zru s GLY 115 CO 0.00 2.27 0.96 -1.35 0.00 0.00 0.00 173.10 174.98 1zru s SER 116 N -3.36 5.23 0.00 1.64 1.04 -1.26 -4.39 113.70 112.60 1zru s SER 116 Ca 0.21 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.23 1zru s SER 116 Cb -0.02 -1.42 0.00 0.00 0.10 0.00 0.00 66.02 64.68 1zru s SER 116 CO 0.04 -1.32 0.00 0.61 0.98 0.00 0.00 173.24 173.55 1zru n GLY 117 N -2.75 3.25 3.54 7.32 0.00 -1.26 -4.88 105.19 110.41 1zru n GLY 117 Ca 0.06 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 1zru n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zru s VAL 118 N -2.15 4.42 -0.11 1.61 1.01 -1.26 -4.61 120.40 119.31 1zru s VAL 118 Ca 0.00 -0.16 -0.25 0.00 0.00 0.00 0.00 61.98 61.57 1zru s VAL 118 Cb 0.00 -3.00 -0.03 0.00 0.00 0.00 0.00 36.38 33.35 1zru s VAL 118 CO 0.00 0.43 0.78 -0.22 0.00 0.00 0.00 175.10 176.10 1zru s LEU 119 N 0.75 4.25 -0.12 3.92 2.96 -0.39 -4.67 118.68 125.38 1zru s LEU 119 Ca 0.02 1.22 0.02 0.00 -0.22 0.00 0.00 54.13 55.17 1zru s LEU 119 Cb -0.14 -3.19 -0.00 0.00 0.50 0.00 0.00 46.19 43.36 1zru s LEU 119 CO 0.02 -0.26 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.05 1zru s LYS 120 N 1.45 3.16 -0.05 1.98 1.02 -1.26 -0.33 119.74 125.71 1zru s LYS 120 Ca 0.39 -0.81 -0.02 0.00 0.02 0.00 0.00 55.97 55.55 1zru s LYS 120 Cb -0.18 -2.43 0.03 0.00 -0.52 0.00 0.00 37.83 34.74 1zru s LYS 120 CO 0.16 0.17 0.09 0.54 -0.92 0.00 0.00 175.35 175.38 1zru s VAL 121 N 0.41 -0.10 0.10 3.17 0.11 -0.26 -1.70 120.40 122.14 1zru s VAL 121 Ca -0.15 0.27 -0.30 0.00 -2.93 0.00 0.00 61.98 58.88 1zru s VAL 121 Cb -0.17 -0.17 -0.05 0.00 -1.53 0.00 0.00 36.38 34.46 1zru s VAL 121 CO 0.07 0.11 0.97 0.00 -3.33 0.00 0.00 175.10 172.92 1zru n PHE 123 N 2.95 0.00 -3.89 0.00 1.16 -0.22 -4.84 117.46 112.62 1zru n PHE 123 Ca 0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.50 1zru n PHE 123 Cb 0.49 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.25 1zru n PHE 123 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1zru s ASP 124 N -0.86 0.04 -0.20 5.98 1.01 -1.18 -1.74 116.67 119.72 1zru s ASP 124 Ca 0.00 -0.15 0.01 0.00 0.71 0.00 0.00 52.55 53.13 1zru s ASP 124 Cb 0.00 0.18 0.04 0.00 1.01 0.00 0.00 42.92 44.14 1zru s ASP 124 CO 0.00 -0.24 -0.14 -0.63 0.21 0.00 0.00 175.17 174.37 1zru s ILE 125 N -0.92 1.84 -0.22 0.77 1.01 0.22 -0.80 121.20 123.10 1zru s ILE 125 Ca -0.10 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.51 1zru s ILE 125 Cb -0.06 -1.82 0.04 0.00 0.01 0.00 0.00 42.46 40.62 1zru s ILE 125 CO 0.00 0.28 -0.15 -0.69 0.00 0.00 0.00 174.94 174.38 1zru s VAL 126 N 1.33 2.19 -0.12 2.92 1.01 0.34 -0.77 120.40 127.29 1zru s VAL 126 Ca -0.00 -1.21 -0.10 0.00 0.00 0.00 0.00 61.98 60.67 1zru s VAL 126 Cb -0.16 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 1zru s VAL 126 CO -0.09 0.29 0.21 -0.89 0.00 0.00 0.00 175.10 174.62 1zru s THR 127 N 1.22 5.38 0.08 3.92 2.01 -0.03 -0.36 115.64 127.87 1zru s THR 127 Ca -0.01 0.37 0.08 0.00 0.31 0.00 0.00 61.69 62.44 1zru s THR 127 Cb -0.16 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 1zru s THR 127 CO -0.09 0.55 -0.22 0.42 -0.69 0.00 0.00 174.62 174.58 1zru s THR 128 N -0.57 1.82 0.00 -0.82 -4.23 -0.40 -0.72 115.64 110.72 1zru s THR 128 Ca 0.16 -1.46 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 1zru s THR 128 Cb -0.13 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.09 1zru s THR 128 CO 0.05 0.08 0.00 -1.54 -0.54 0.00 0.00 174.62 172.66 1zru n SER 129 N 1.34 0.00 0.18 3.99 3.41 -0.28 -2.76 113.62 119.51 1zru n SER 129 Ca -0.18 -0.26 0.14 0.00 -0.26 0.00 0.00 58.87 58.31 1zru n SER 129 Cb 0.53 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 65.01 1zru n SER 129 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1zru h GLY 130 N 0.00 0.00 0.00 5.00 0.00 -1.96 -0.74 103.07 105.37 1zru h GLY 130 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1zru h GLY 130 CO 0.00 0.00 -1.23 -1.30 0.00 0.00 0.00 176.54 174.01 1zru n THR 131 N -2.57 0.03 -3.98 4.70 -2.24 -1.26 -4.86 114.28 104.10 1zru n THR 131 Ca 0.02 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1zru n THR 131 Cb 0.30 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1zru n THR 131 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zru n GLY 132 N 2.29 0.42 3.69 3.38 0.00 -1.26 -4.01 105.19 109.70 1zru n GLY 132 Ca -0.02 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1zru n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zru s VAL 133 N -2.02 4.62 -0.14 1.61 1.01 -1.25 -1.13 120.40 123.10 1zru s VAL 133 Ca 0.00 1.90 0.18 0.00 0.00 0.00 0.00 61.98 64.06 1zru s VAL 133 Cb -0.00 -4.22 -0.25 0.00 0.00 0.00 0.00 36.38 31.91 1zru s VAL 133 CO -0.00 0.02 0.30 0.35 0.00 0.00 0.00 175.10 175.77 1zru n THR 134 N 4.49 1.08 -3.48 3.92 -2.24 0.11 -4.90 114.28 113.25 1zru n THR 134 Ca 0.09 -0.76 -0.13 0.00 -2.27 0.00 0.00 64.05 60.99 1zru n THR 134 Cb 0.48 -0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 68.24 1zru n THR 134 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1zru s SER 135 N -5.36 -0.52 -0.03 3.42 1.04 -1.15 -5.02 113.70 106.08 1zru s SER 135 Ca -0.08 0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.60 1zru s SER 135 Cb 0.08 0.50 0.01 0.00 0.10 0.00 0.00 66.02 66.71 1zru s SER 135 CO 0.84 -0.72 -0.07 -0.89 0.98 0.00 0.00 173.24 173.37 1zru s THR 136 N -2.64 0.68 -0.08 2.02 2.01 -1.26 -0.85 115.64 115.52 1zru s THR 136 Ca -0.02 -0.29 0.00 0.00 0.31 0.00 0.00 61.69 61.70 1zru s THR 136 Cb -0.01 -0.63 0.02 0.00 0.01 0.00 0.00 72.50 71.89 1zru s THR 136 CO -0.04 0.23 -0.07 -0.75 -0.69 0.00 0.00 174.62 173.29 1zru s LYS 137 N 0.36 1.35 0.60 4.92 2.20 0.05 -5.00 119.74 124.22 1zru s LYS 137 Ca -0.05 -0.23 -0.16 0.00 -0.36 0.00 0.00 55.97 55.17 1zru s LYS 137 Cb -0.10 -1.35 -0.03 0.00 -1.51 0.00 0.00 37.83 34.85 1zru s LYS 137 CO 0.00 -0.17 1.07 -1.25 -0.36 0.00 0.00 175.35 174.65 1zru s PRO 138 N 1.34 3.22 0.31 4.03 0.04 -1.26 -0.61 135.00 142.06 1zru s PRO 138 Ca -0.03 1.29 -0.28 0.00 0.04 0.00 0.00 61.00 62.01 1zru s PRO 138 Cb -0.14 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 1zru s PRO 138 CO -0.03 -0.90 1.13 0.42 0.04 0.00 0.00 177.00 177.65 1zru s ILE 139 N -2.36 3.38 0.48 0.56 -1.09 -0.71 -4.83 121.20 116.63 1zru s ILE 139 Ca 0.65 1.34 -0.22 0.00 -2.23 0.00 0.00 60.65 60.18 1zru s ILE 139 Cb -0.18 -3.83 -0.07 0.00 -1.58 0.00 0.00 42.46 36.81 1zru s ILE 139 CO 0.36 0.28 1.20 0.68 -1.23 0.00 0.00 174.94 176.24 1zru s VAL 140 N -1.23 2.88 -0.39 2.92 -7.23 -1.26 -4.93 120.40 111.16 1zru s VAL 140 Ca 0.47 0.65 -0.17 0.00 -1.81 0.00 0.00 61.98 61.12 1zru s VAL 140 Cb -0.32 -3.33 0.01 0.00 0.56 0.00 0.00 36.38 33.30 1zru s VAL 140 CO 0.41 -0.02 0.46 -1.10 -0.31 0.00 0.00 175.10 174.55 1zru s GLN 141 N -2.78 3.35 -0.21 4.82 -0.21 -1.26 -4.60 119.66 118.77 1zru s GLN 141 Ca 0.66 -0.49 -0.14 0.00 0.02 0.00 0.00 55.36 55.40 1zru s GLN 141 Cb -0.31 -3.89 -0.04 0.00 1.00 0.00 0.00 33.01 29.77 1zru s GLN 141 CO 0.37 -0.75 0.34 0.99 -2.12 0.00 0.00 175.29 174.12 1zru s THR 142 N 2.25 5.24 -0.37 -0.19 2.01 -1.26 -5.03 115.64 118.29 1zru s THR 142 Ca 0.15 0.57 -0.13 0.00 0.31 0.00 0.00 61.69 62.59 1zru s THR 142 Cb -0.16 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.68 1zru s THR 142 CO 0.14 0.27 0.25 -0.44 -0.69 0.00 0.00 174.62 174.15 1zru s SER 143 N 1.06 6.00 -0.43 3.53 0.01 -1.26 -4.54 113.70 118.07 1zru s SER 143 Ca 0.16 -0.66 -0.16 0.00 1.31 0.00 0.00 55.95 56.60 1zru s SER 143 Cb -0.14 -2.12 0.03 0.00 0.21 0.00 0.00 66.02 64.00 1zru s SER 143 CO 0.07 -0.32 0.40 -0.89 0.41 0.00 0.00 173.24 172.90 1zru s THR 144 N 1.68 5.16 0.23 1.44 2.01 0.34 -5.05 115.64 121.45 1zru s THR 144 Ca 0.05 -0.62 0.10 0.00 0.31 0.00 0.00 61.69 61.53 1zru s THR 144 Cb -0.18 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.24 1zru s THR 144 CO 0.10 -0.45 -0.18 -0.76 -0.69 0.00 0.00 174.62 172.64 1zru s LEU 145 N 1.92 2.55 0.00 4.42 1.43 -1.26 -4.63 118.68 123.10 1zru s LEU 145 Ca 0.08 -0.99 0.00 0.00 -1.03 0.00 0.00 54.13 52.19 1zru s LEU 145 Cb -0.19 -0.89 0.00 0.00 0.03 0.00 0.00 46.19 45.14 1zru s LEU 145 CO 0.11 -0.05 0.00 -0.67 0.23 0.00 0.00 176.35 175.96 1zru n ASP 146 N -0.35 0.00 -4.38 2.29 -0.08 -1.26 -4.99 116.55 107.79 1zru n ASP 146 Ca -0.08 0.02 -0.32 0.00 -1.51 0.00 0.00 54.79 52.90 1zru n ASP 146 Cb 0.60 -0.20 -0.15 0.00 2.34 0.00 0.00 41.12 43.71 1zru n ASP 146 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1zru s SER 147 N -2.17 3.66 -0.08 1.67 0.15 -1.26 -5.13 113.70 110.54 1zru s SER 147 Ca 0.00 -0.34 0.04 0.00 0.70 0.00 0.00 55.95 56.35 1zru s SER 147 Cb 0.00 -0.99 -0.01 0.00 -1.71 0.00 0.00 66.02 63.31 1zru s SER 147 CO 0.00 0.27 -0.21 -0.63 1.20 0.00 0.00 173.24 173.87 1zru s ILE 148 N -0.29 2.38 -0.18 6.45 1.01 -1.26 -5.10 121.20 124.20 1zru s ILE 148 Ca 0.01 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 59.70 1zru s ILE 148 Cb -0.13 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 1zru s ILE 148 CO 0.03 0.56 -0.06 -0.55 0.00 0.00 0.00 174.94 174.91 1zru s SER 149 N 0.00 4.35 0.04 3.58 0.15 -1.26 -5.12 113.70 115.45 1zru s SER 149 Ca -0.07 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.28 1zru s SER 149 Cb -0.15 -1.72 -0.03 0.00 -1.71 0.00 0.00 66.02 62.41 1zru s SER 149 CO 0.05 0.07 -0.05 0.54 1.20 0.00 0.00 173.24 175.05 1zru s VAL 150 N 0.92 0.34 -0.14 4.45 0.11 -1.26 -5.08 120.40 119.76 1zru s VAL 150 Ca -0.01 -1.28 -0.13 0.00 -2.93 0.00 0.00 61.98 57.63 1zru s VAL 150 Cb -0.15 -0.81 -0.11 0.00 -1.53 0.00 0.00 36.38 33.79 1zru s VAL 150 CO 0.01 -0.61 0.19 0.78 -3.33 0.00 0.00 175.10 172.14 1zru h ASN 151 N 4.08 0.00 -4.92 3.54 2.35 -2.09 -3.48 115.58 115.06 1zru h ASN 151 Ca -0.34 -0.34 -0.20 0.00 -0.55 0.00 0.00 56.30 54.87 1zru h ASN 151 Cb 1.19 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.36 1zru h ASN 151 CO 0.49 0.85 -0.71 -1.81 -1.65 0.00 0.00 177.43 174.61 1zru s ASP 152 N -5.99 0.52 0.00 5.81 1.01 -1.26 -5.15 116.67 111.61 1zru s ASP 152 Ca -0.13 -0.60 0.01 0.00 0.71 0.00 0.00 52.55 52.54 1zru s ASP 152 Cb 0.01 0.09 -0.00 0.00 1.01 0.00 0.00 42.92 44.02 1zru s ASP 152 CO 0.33 -0.31 -0.04 -0.32 0.21 0.00 0.00 175.17 175.04 1zru s MET 153 N -1.89 0.29 -0.10 8.23 -2.45 -1.26 -5.13 119.30 116.98 1zru s MET 153 Ca -0.10 -0.16 0.04 0.00 -1.25 0.00 0.00 55.69 54.21 1zru s MET 153 Cb -0.07 -0.26 0.00 0.00 1.25 0.00 0.00 34.83 35.75 1zru s MET 153 CO -0.02 0.07 -0.23 0.99 1.05 0.00 0.00 175.02 176.88 1zru s THR 154 N -0.18 2.01 -0.17 10.11 2.01 -1.26 -5.12 115.64 123.05 1zru s THR 154 Ca 0.00 -0.99 -0.00 0.00 0.31 0.00 0.00 61.69 61.01 1zru s THR 154 Cb -0.02 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.75 1zru s THR 154 CO -0.00 0.55 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.64 1zru s VAL 155 N 0.36 2.68 -0.12 3.82 1.01 -1.26 -5.00 120.40 121.89 1zru s VAL 155 Ca -0.19 -0.75 0.16 0.00 0.00 0.00 0.00 61.98 61.20 1zru s VAL 155 Cb -0.18 -2.15 -0.14 0.00 0.00 0.00 0.00 36.38 33.92 1zru s VAL 155 CO 0.09 0.51 0.83 0.77 0.00 0.00 0.00 175.10 177.29 1zru h SER 156 N 7.51 0.00 0.00 3.32 4.64 -2.07 -3.46 113.55 123.48 1zru h SER 156 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1zru h SER 156 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1zru h SER 156 CO 0.58 0.61 0.00 0.61 -0.87 0.00 0.00 176.83 177.76 1zru n GLY 157 N 1.40 0.22 3.09 -0.77 0.00 -1.26 -5.13 105.19 102.75 1zru n GLY 157 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 1zru n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zru s SER 158 N -1.00 0.25 -0.23 1.61 0.01 -1.26 -5.13 113.70 107.95 1zru s SER 158 Ca 0.00 -0.63 -0.10 0.00 1.31 0.00 0.00 55.95 56.53 1zru s SER 158 Cb 0.00 0.21 -0.05 0.00 0.21 0.00 0.00 66.02 66.39 1zru s SER 158 CO 0.00 -0.51 0.14 -0.63 0.41 0.00 0.00 173.24 172.66 1zru s ILE 159 N -2.77 5.29 -0.29 1.44 1.01 -1.26 -5.08 121.20 119.54 1zru s ILE 159 Ca -0.04 0.15 -0.13 0.00 0.00 0.00 0.00 60.65 60.63 1zru s ILE 159 Cb -0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1zru s ILE 159 CO -0.05 0.38 0.30 -0.62 0.00 0.00 0.00 174.94 174.94 1zru s ASP 160 N 0.87 6.15 0.29 3.58 2.15 -1.26 -5.09 116.67 123.36 1zru s ASP 160 Ca 0.07 0.04 0.10 0.00 0.43 0.00 0.00 52.55 53.19 1zru s ASP 160 Cb -0.13 -2.17 -0.05 0.00 -0.30 0.00 0.00 42.92 40.27 1zru s ASP 160 CO 0.03 -0.17 -0.09 0.68 -0.17 0.00 0.00 175.17 175.44 1zru s VAL 161 N 1.93 2.79 0.54 1.11 -7.23 -1.26 -5.11 120.40 113.17 1zru s VAL 161 Ca 0.11 -2.16 -0.22 0.00 -1.81 0.00 0.00 61.98 57.91 1zru s VAL 161 Cb -0.16 -2.59 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 1zru s VAL 161 CO 0.11 -0.34 1.31 -2.84 -0.31 0.00 0.00 175.10 173.03 1zru s PRO 162 N -3.61 3.21 -0.03 4.82 0.02 -1.26 -4.75 135.00 133.40 1zru s PRO 162 Ca 0.32 2.12 0.03 0.00 0.02 0.00 0.00 61.00 63.48 1zru s PRO 162 Cb -0.04 -2.24 0.00 0.00 0.02 0.00 0.00 34.50 32.24 1zru s PRO 162 CO 0.17 -1.10 -0.11 0.08 -0.33 0.00 0.00 177.00 175.72 1zru s VAL 163 N -1.37 0.92 0.06 3.83 1.01 -1.26 -1.41 120.40 122.18 1zru s VAL 163 Ca 0.71 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 62.33 1zru s VAL 163 Cb -0.38 -0.82 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1zru s VAL 163 CO 0.44 0.29 -0.17 -1.10 0.00 0.00 0.00 175.10 174.55 1zru s GLN 164 N 0.27 1.08 0.15 2.72 -0.21 -0.35 -4.99 119.66 118.33 1zru s GLN 164 Ca -0.05 -0.92 0.08 0.00 0.02 0.00 0.00 55.36 54.48 1zru s GLN 164 Cb -0.10 -1.17 -0.04 0.00 1.00 0.00 0.00 33.01 32.70 1zru s GLN 164 CO 0.01 0.29 -0.17 0.95 -2.12 0.00 0.00 175.29 174.25 1zru s THR 165 N -0.97 1.66 -0.17 -0.19 -4.23 -1.26 -0.57 115.64 109.91 1zru s THR 165 Ca 0.04 -1.86 -0.12 0.00 -1.18 0.00 0.00 61.69 58.56 1zru s THR 165 Cb -0.09 -1.76 0.05 0.00 1.34 0.00 0.00 72.50 72.05 1zru s THR 165 CO 0.02 -0.36 0.44 -0.22 -0.54 0.00 0.00 174.62 173.96 1zru s LEU 166 N -2.62 0.01 -0.16 4.79 2.96 -0.36 -5.00 118.68 118.29 1zru s LEU 166 Ca 0.14 0.92 -0.04 0.00 -0.22 0.00 0.00 54.13 54.93 1zru s LEU 166 Cb -0.05 1.46 -0.03 0.00 0.50 0.00 0.00 46.19 48.07 1zru s LEU 166 CO 0.05 -0.18 -0.02 -0.89 -1.32 0.00 0.00 176.35 173.99 1zru s THR 167 N 1.00 4.05 -0.16 3.68 2.01 -1.26 -0.12 115.64 124.84 1zru s THR 167 Ca -0.06 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1zru s THR 167 Cb -0.06 -2.79 0.01 0.00 0.01 0.00 0.00 72.50 69.68 1zru s THR 167 CO -0.08 0.49 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.44 1zru s VAL 168 N 0.37 2.11 -0.84 3.82 1.01 0.49 -4.99 120.40 122.39 1zru s VAL 168 Ca -0.03 -0.94 -0.20 0.00 0.00 0.00 0.00 61.98 60.81 1zru s VAL 168 Cb -0.14 -1.87 0.11 0.00 0.00 0.00 0.00 36.38 34.48 1zru s VAL 168 CO 0.02 0.54 1.08 -1.61 0.00 0.00 0.00 175.10 175.13 1zru s GLU 169 N 1.08 3.42 0.54 2.72 0.41 -1.26 -1.06 118.70 124.56 1zru s GLU 169 Ca -0.00 -1.41 0.33 0.00 -0.41 0.00 0.00 54.97 53.48 1zru s GLU 169 Cb -0.14 -4.70 1.28 0.00 -1.78 0.00 0.00 34.13 28.80 1zru s GLU 169 CO -0.08 -1.80 1.95 0.00 -0.49 0.00 0.00 175.26 174.84 1zru h ALA 170 N 9.14 1.00 0.00 5.21 0.00 -1.40 -0.18 119.26 133.03 1zru h ALA 170 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zru h ALA 170 Cb 1.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1zru h ALA 170 CO 1.15 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.81 1zru n GLY 171 N 0.12 2.66 2.23 0.00 0.00 -1.24 -0.31 105.19 108.65 1zru n GLY 171 Ca 0.01 -1.95 -0.16 0.00 0.00 0.00 0.00 46.02 43.92 1zru n GLY 171 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1zru n ASN 172 N 0.00 -4.22 0.00 1.61 3.02 -1.26 -1.92 115.26 112.50 1zru n ASN 172 Ca 0.00 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 1zru n ASN 172 Cb 0.00 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.35 1zru n ASN 172 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zru n GLY 173 N -0.34 0.90 3.73 7.41 0.00 -1.26 -2.25 105.19 113.38 1zru n GLY 173 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1zru n GLY 173 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1zru s LEU 174 N 0.00 4.49 -0.04 0.99 2.96 -0.81 -1.53 118.68 124.73 1zru s LEU 174 Ca 0.00 1.82 0.06 0.00 -0.22 0.00 0.00 54.13 55.79 1zru s LEU 174 Cb 0.00 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.09 1zru s LEU 174 CO 0.00 -0.10 -0.23 -1.58 -1.32 0.00 0.00 176.35 173.12 1zru s GLN 175 N 0.05 2.25 -0.10 1.98 0.74 -0.53 -1.28 119.66 122.77 1zru s GLN 175 Ca 0.48 -0.84 0.01 0.00 0.05 0.00 0.00 55.36 55.06 1zru s GLN 175 Cb -0.24 -1.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.88 1zru s GLN 175 CO 0.30 0.39 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.79 1zru s LEU 176 N -0.23 2.76 -0.30 3.68 1.43 -0.22 -0.82 118.68 124.99 1zru s LEU 176 Ca -0.00 -0.25 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 1zru s LEU 176 Cb -0.12 -1.60 0.06 0.00 0.03 0.00 0.00 46.19 44.55 1zru s LEU 176 CO 0.02 0.24 -0.00 -1.58 0.23 0.00 0.00 176.35 175.26 1zru s GLN 177 N -0.12 2.36 -0.13 1.70 -0.44 -0.23 -0.38 119.66 122.42 1zru s GLN 177 Ca -0.01 -1.32 -0.05 0.00 -2.50 0.00 0.00 55.36 51.48 1zru s GLN 177 Cb -0.14 -3.16 -0.04 0.00 -1.64 0.00 0.00 33.01 28.03 1zru s GLN 177 CO 0.03 -0.64 0.05 -0.51 0.50 0.00 0.00 175.29 174.72 1zru s LEU 178 N 1.22 3.84 -0.10 3.68 1.02 0.83 -0.84 118.68 128.33 1zru s LEU 178 Ca -0.05 0.19 0.01 0.00 0.02 0.00 0.00 54.13 54.30 1zru s LEU 178 Cb -0.20 -1.93 0.02 0.00 0.02 0.00 0.00 46.19 44.10 1zru s LEU 178 CO -0.02 0.30 -0.12 -0.89 0.02 0.00 0.00 176.35 175.65 1zru s THR 179 N -0.42 1.24 -0.11 5.49 2.01 -0.62 -1.23 115.64 122.00 1zru s THR 179 Ca 0.09 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 61.64 1zru s THR 179 Cb -0.12 -1.18 -0.01 0.00 0.01 0.00 0.00 72.50 71.21 1zru s THR 179 CO 0.02 0.39 -0.18 -0.75 -0.69 0.00 0.00 174.62 173.41 1zru s LYS 180 N 1.19 3.18 0.03 4.92 2.20 0.26 -1.32 119.74 130.20 1zru s LYS 180 Ca -0.04 -0.78 0.09 0.00 -0.36 0.00 0.00 55.97 54.88 1zru s LYS 180 Cb -0.14 -2.46 -0.03 0.00 -1.51 0.00 0.00 37.83 33.70 1zru s LYS 180 CO -0.03 0.22 -0.26 0.15 -0.36 0.00 0.00 175.35 175.06 1zru s LYS 181 N 0.29 1.87 -1.47 4.03 1.02 0.07 -1.21 119.74 124.33 1zru s LYS 181 Ca -0.14 -1.06 -0.00 0.00 0.02 0.00 0.00 55.97 54.79 1zru s LYS 181 Cb -0.17 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1zru s LYS 181 CO 0.07 0.52 0.03 -1.71 -0.92 0.00 0.00 175.35 173.34 1zru n ASN 182 N 1.94 -5.06 -3.44 2.83 5.15 -0.50 -1.60 115.26 114.58 1zru n ASN 182 Ca -0.17 0.06 -0.24 0.00 -0.60 0.00 0.00 54.58 53.63 1zru n ASN 182 Cb 0.52 -4.23 -0.01 0.00 -0.53 0.00 0.00 39.78 35.52 1zru n ASN 182 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1zru n ASN 183 N -1.95 -3.32 0.15 1.20 5.15 -1.26 -4.69 115.26 110.54 1zru n ASN 183 Ca -0.20 -0.42 0.00 0.00 -0.60 0.00 0.00 54.58 53.36 1zru n ASN 183 Cb 0.65 -2.77 0.00 0.00 -0.53 0.00 0.00 39.78 37.13 1zru n ASN 183 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1zru n ASP 184 N -2.26 -1.68 -4.68 1.20 2.03 -0.63 -4.81 116.55 105.73 1zru n ASP 184 Ca 0.00 0.55 -0.40 0.00 0.52 0.00 0.00 54.79 55.46 1zru n ASP 184 Cb 0.53 1.70 -0.05 0.00 -0.72 0.00 0.00 41.12 42.58 1zru n ASP 184 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1zru s LEU 185 N -6.53 4.20 -0.09 -2.67 2.96 -0.87 -0.74 118.68 114.94 1zru s LEU 185 Ca 0.00 1.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.96 1zru s LEU 185 Cb 0.00 -3.02 -0.01 0.00 0.50 0.00 0.00 46.19 43.66 1zru s LEU 185 CO 0.00 -0.25 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.88 1zru s VAL 186 N 1.62 2.40 -0.16 1.68 1.01 0.06 -0.75 120.40 126.25 1zru s VAL 186 Ca 0.33 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 1zru s VAL 186 Cb -0.16 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 1zru s VAL 186 CO 0.13 0.56 -0.09 -0.63 0.00 0.00 0.00 175.10 175.07 1zru s ILE 187 N 0.06 3.30 -0.17 2.22 1.01 -0.43 -1.23 121.20 125.95 1zru s ILE 187 Ca -0.09 -0.56 -0.07 0.00 0.00 0.00 0.00 60.65 59.94 1zru s ILE 187 Cb -0.15 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1zru s ILE 187 CO 0.06 0.49 0.05 -0.69 0.00 0.00 0.00 174.94 174.85 1zru s VAL 188 N 0.66 4.73 -0.20 2.92 1.01 0.85 -1.59 120.40 128.77 1zru s VAL 188 Ca -0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 1zru s VAL 188 Cb -0.15 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 1zru s VAL 188 CO 0.02 0.48 -0.06 -0.13 0.00 0.00 0.00 175.10 175.41 1zru s ARG 189 N 0.26 3.40 0.16 2.72 0.52 -0.02 -1.40 118.95 124.60 1zru s ARG 189 Ca 0.03 -0.62 -0.23 0.00 -0.52 0.00 0.00 55.73 54.39 1zru s ARG 189 Cb -0.12 -2.94 -0.08 0.00 0.52 0.00 0.00 34.95 32.32 1zru s ARG 189 CO 0.00 -0.10 0.73 -0.06 0.02 0.00 0.00 175.30 175.89 1zru s PHE 190 N 1.22 3.83 0.28 -0.53 0.08 -0.20 -1.07 117.98 121.58 1zru s PHE 190 Ca 0.03 1.51 0.04 0.00 0.12 0.00 0.00 56.93 58.63 1zru s PHE 190 Cb -0.14 -2.68 -0.02 0.00 -0.57 0.00 0.00 43.02 39.61 1zru s PHE 190 CO -0.02 0.49 0.28 1.19 -0.10 0.00 0.00 175.22 177.06 1zru n PHE 191 N 1.40 -0.83 -3.36 0.36 3.72 0.00 -3.91 117.46 114.85 1zru n PHE 191 Ca -0.06 -2.23 0.00 0.00 -0.05 0.00 0.00 57.45 55.11 1zru n PHE 191 Cb 0.50 0.30 0.00 0.00 -0.94 0.00 0.00 39.48 39.34 1zru n PHE 191 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1zru n GLY 192 N -0.51 -1.42 3.45 1.37 0.00 -1.26 -1.45 105.19 105.37 1zru n GLY 192 Ca 0.05 -1.40 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 1zru n GLY 192 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zru s SER 193 N -4.00 -0.68 -0.05 1.61 0.01 -0.58 -1.72 113.70 108.28 1zru s SER 193 Ca 0.00 1.17 -0.04 0.00 1.31 0.00 0.00 55.95 58.40 1zru s SER 193 Cb 0.00 1.09 -0.04 0.00 0.21 0.00 0.00 66.02 67.28 1zru s SER 193 CO 0.00 -0.21 0.15 -0.69 0.41 0.00 0.00 173.24 172.90 1zru s VAL 194 N 1.17 5.31 0.11 3.43 1.01 -0.32 -3.99 120.40 127.13 1zru s VAL 194 Ca -0.07 -0.08 -0.15 0.00 0.00 0.00 0.00 61.98 61.69 1zru s VAL 194 Cb -0.06 -3.41 0.03 0.00 0.00 0.00 0.00 36.38 32.94 1zru s VAL 194 CO -0.11 0.44 0.36 -0.94 0.00 0.00 0.00 175.10 174.84 1zru s SER 195 N -1.57 -0.16 -1.16 3.32 1.04 -0.95 -1.37 113.70 112.85 1zru s SER 195 Ca 0.22 -0.37 -0.03 0.00 0.48 0.00 0.00 55.95 56.25 1zru s SER 195 Cb -0.12 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.42 1zru s SER 195 CO 0.13 -0.81 0.94 0.59 0.98 0.00 0.00 173.24 175.06 1zru n ASN 196 N -0.15 -3.50 -3.92 7.02 5.03 -0.01 -4.80 115.26 114.94 1zru n ASN 196 Ca -0.16 -0.68 -0.10 0.00 0.87 0.00 0.00 54.58 54.50 1zru n ASN 196 Cb 0.63 -4.99 -0.11 0.00 -1.02 0.00 0.00 39.78 34.30 1zru n ASN 196 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1zru s ILE 197 N -3.41 0.08 0.18 2.41 1.10 -0.79 -5.00 121.20 115.77 1zru s ILE 197 Ca 0.16 -0.65 0.08 0.00 -0.51 0.00 0.00 60.65 59.74 1zru s ILE 197 Cb -0.02 -0.28 -0.04 0.00 0.15 0.00 0.00 42.46 42.26 1zru s ILE 197 CO 0.75 -0.36 -0.07 -1.10 -2.11 0.00 0.00 174.94 172.05 1zru s GLN 198 N -1.12 2.16 0.22 3.50 -0.21 -1.26 -0.80 119.66 122.15 1zru s GLN 198 Ca -0.12 -1.23 -0.32 0.00 0.02 0.00 0.00 55.36 53.71 1zru s GLN 198 Cb -0.07 -2.21 -0.14 0.00 1.00 0.00 0.00 33.01 31.59 1zru s GLN 198 CO 0.00 0.44 1.38 0.36 -2.12 0.00 0.00 175.29 175.35 1zru n LYS 199 N -0.02 1.90 0.00 2.91 2.85 -1.26 -2.08 118.16 122.47 1zru n LYS 199 Ca -0.10 0.68 0.00 0.00 -1.05 0.00 0.00 58.31 57.83 1zru n LYS 199 Cb 0.55 -2.32 0.00 0.00 -0.65 0.00 0.00 35.03 32.61 1zru n LYS 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1zru n GLY 200 N 2.24 2.38 3.78 2.58 0.00 0.70 -5.02 105.19 111.85 1zru n GLY 200 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1zru n GLY 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1zru s TRP 201 N -2.25 3.42 0.26 1.61 0.52 -0.88 -4.77 118.94 116.85 1zru s TRP 201 Ca 0.00 1.69 -0.30 0.00 0.02 0.00 0.00 56.10 57.51 1zru s TRP 201 Cb 0.00 -3.12 -0.09 0.00 -1.15 0.00 0.00 33.47 29.10 1zru s TRP 201 CO 0.00 -0.45 1.12 -0.80 0.02 0.00 0.00 176.95 176.84 1zru s ASN 202 N -1.42 7.23 0.45 2.95 0.01 -1.26 -0.88 114.94 122.01 1zru s ASN 202 Ca 0.53 2.27 -0.24 0.00 -0.71 0.00 0.00 52.86 54.71 1zru s ASN 202 Cb -0.24 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 38.73 1zru s ASN 202 CO 0.30 -0.19 1.23 -0.04 -1.51 0.00 0.00 177.10 176.89 1zru s MET 203 N -1.23 3.74 0.00 -0.60 -1.94 0.21 -4.90 119.30 114.59 1zru s MET 203 Ca 0.46 1.96 0.18 0.00 -1.71 0.00 0.00 55.69 56.58 1zru s MET 203 Cb -0.32 -2.51 0.88 0.00 2.01 0.00 0.00 34.83 34.89 1zru s MET 203 CO 0.41 -0.62 1.59 -1.13 -0.01 0.00 0.00 175.02 175.26 1zru n SER 204 N -0.35 0.60 0.00 3.03 3.41 -1.22 -4.81 113.62 114.29 1zru n SER 204 Ca 0.06 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.10 1zru n SER 204 Cb 0.46 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1zru n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zru n GLY 205 N 0.89 3.23 3.74 5.00 0.00 0.57 -4.85 105.19 113.77 1zru n GLY 205 Ca 0.14 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 1zru n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zru s THR 206 N 4.49 4.29 0.57 2.61 2.01 -0.08 -4.82 115.64 124.71 1zru s THR 206 Ca 0.00 2.05 -0.14 0.00 0.31 0.00 0.00 61.69 63.92 1zru s THR 206 Cb 0.00 -4.31 -0.06 0.00 0.01 0.00 0.00 72.50 68.14 1zru s THR 206 CO 0.00 0.39 1.01 0.26 -0.69 0.00 0.00 174.62 175.59 1zru s TRP 207 N -0.48 3.55 0.16 4.92 0.52 -1.26 -4.42 118.94 121.92 1zru s TRP 207 Ca 0.45 1.37 -0.31 0.00 0.02 0.00 0.00 56.10 57.63 1zru s TRP 207 Cb -0.25 -2.75 -0.09 0.00 -1.15 0.00 0.00 33.47 29.23 1zru s TRP 207 CO 0.31 -0.54 1.44 0.08 0.02 0.00 0.00 176.95 178.26 1zru s VAL 208 N -2.92 2.98 0.56 4.03 1.01 0.49 -4.97 120.40 121.58 1zru s VAL 208 Ca 0.57 0.73 -0.21 0.00 0.00 0.00 0.00 61.98 63.07 1zru s VAL 208 Cb -0.10 -3.47 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 1zru s VAL 208 CO 0.43 0.07 1.20 0.47 0.00 0.00 0.00 175.10 177.28 1zru n ASP 209 N 3.58 1.93 -0.26 3.32 9.92 -1.26 -4.59 116.55 129.18 1zru n ASP 209 Ca 0.11 0.92 0.07 0.00 -0.53 0.00 0.00 54.79 55.35 1zru n ASP 209 Cb 0.41 -1.50 0.18 0.00 -0.64 0.00 0.00 41.12 39.57 1zru n ASP 209 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1zru h ARG 210 N 1.07 0.15 0.00 -1.24 2.43 -1.96 -1.01 114.38 113.82 1zru h ARG 210 Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1zru h ARG 210 Cb 1.33 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1zru h ARG 210 CO 0.55 0.10 0.00 -2.30 -1.51 0.00 0.00 179.97 176.81 1zru n PRO 211 N -5.28 0.15 0.00 0.20 -0.02 -1.26 -1.43 135.00 127.36 1zru n PRO 211 Ca 0.15 0.55 0.09 0.00 -2.02 0.00 0.00 63.50 62.27 1zru n PRO 211 Cb 0.51 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1zru n PRO 211 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1zru n PHE 212 N -2.21 0.00 -2.38 6.00 3.72 -0.39 -5.00 117.46 117.20 1zru n PHE 212 Ca 0.00 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.99 1zru n PHE 212 Cb 0.11 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 1zru n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1zru s ARG 213 N -2.05 4.49 0.55 -1.08 0.52 -0.51 -4.98 118.95 115.89 1zru s ARG 213 Ca 0.16 1.86 -0.10 0.00 -0.52 0.00 0.00 55.73 57.13 1zru s ARG 213 Cb 0.15 -3.25 -0.05 0.00 0.52 0.00 0.00 34.95 32.33 1zru s ARG 213 CO 0.44 -0.08 0.94 -1.25 0.02 0.00 0.00 175.30 175.36 1zru s PRO 214 N -0.20 3.65 0.38 3.54 0.04 -1.26 -4.90 135.00 136.25 1zru s PRO 214 Ca 0.53 0.61 0.14 0.00 0.04 0.00 0.00 61.00 62.32 1zru s PRO 214 Cb -0.32 -2.19 0.77 0.00 0.04 0.00 0.00 34.50 32.80 1zru s PRO 214 CO 0.36 -0.39 1.83 0.00 0.04 0.00 0.00 177.00 178.85 1zru h ALA 215 N 0.13 1.33 -3.10 8.56 0.00 -1.67 -3.38 119.26 121.14 1zru h ALA 215 Ca -0.45 -0.33 -0.34 0.00 0.00 0.00 0.00 54.91 53.80 1zru h ALA 215 Cb 1.19 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 18.72 1zru h ALA 215 CO 0.62 0.45 -0.75 0.00 0.00 0.00 0.00 179.25 179.57 1zru s ALA 216 N -4.12 0.95 0.23 0.00 0.00 -1.26 -4.82 121.76 112.74 1zru s ALA 216 Ca -0.02 -0.99 -0.31 0.00 0.00 0.00 0.00 51.96 50.64 1zru s ALA 216 Cb 0.14 -0.01 -0.14 0.00 0.00 0.00 0.00 23.12 23.12 1zru s ALA 216 CO 0.71 0.04 1.39 1.55 0.00 0.00 0.00 175.76 179.44 1zru n VAL 217 N 1.10 0.94 -4.45 0.00 3.14 -1.26 -4.66 118.33 113.13 1zru n VAL 217 Ca -0.20 -0.23 -0.33 0.00 -2.96 0.00 0.00 64.34 60.62 1zru n VAL 217 Cb 0.55 -1.42 -0.16 0.00 -1.06 0.00 0.00 33.84 31.75 1zru n VAL 217 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 1zru s GLN 218 N -0.40 3.03 -0.33 1.45 -1.52 -0.41 -4.96 119.66 116.52 1zru s GLN 218 Ca 0.69 -0.84 -0.18 0.00 -1.95 0.00 0.00 55.36 53.08 1zru s GLN 218 Cb -0.67 -2.50 -0.01 0.00 -0.22 0.00 0.00 33.01 29.61 1zru s GLN 218 CO 0.50 -0.09 0.54 -1.12 -0.25 0.00 0.00 175.29 174.87 1zru s SER 219 N 1.00 6.37 -0.21 5.90 0.01 -1.26 -0.77 113.70 124.73 1zru s SER 219 Ca -0.02 0.16 -0.03 0.00 1.31 0.00 0.00 55.95 57.37 1zru s SER 219 Cb -0.15 -2.28 -0.01 0.00 0.21 0.00 0.00 66.02 63.80 1zru s SER 219 CO -0.06 -0.45 -0.07 -0.76 0.41 0.00 0.00 173.24 172.32 1zru s LEU 220 N 2.43 2.78 0.09 2.44 1.43 0.53 -4.96 118.68 123.43 1zru s LEU 220 Ca 0.20 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 1zru s LEU 220 Cb -0.15 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.32 1zru s LEU 220 CO 0.12 -0.00 0.95 -0.69 0.23 0.00 0.00 176.35 176.96 1zru s VAL 221 N 1.38 4.58 0.38 -1.59 1.01 -1.26 -1.86 120.40 123.05 1zru s VAL 221 Ca 0.05 2.04 0.04 0.00 0.00 0.00 0.00 61.98 64.10 1zru s VAL 221 Cb -0.14 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1zru s VAL 221 CO -0.04 0.29 0.09 -0.83 0.00 0.00 0.00 175.10 174.61 1zru s GLY 222 N 0.18 2.43 0.03 4.51 0.00 0.07 -4.59 107.32 109.95 1zru s GLY 222 Ca 0.47 -1.49 0.03 0.00 0.00 0.00 0.00 44.72 43.73 1zru s GLY 222 CO 0.29 -1.85 -0.09 -1.58 0.00 0.00 0.00 173.10 169.87 1zru s HIS 223 N -3.22 0.78 -0.30 1.90 2.46 0.32 -1.78 115.29 115.46 1zru s HIS 223 Ca 0.27 -0.34 -0.20 0.00 0.47 0.00 0.00 55.06 55.26 1zru s HIS 223 Cb 0.05 -0.47 -0.01 0.00 -0.13 0.00 0.00 32.58 32.02 1zru s HIS 223 CO 0.14 -0.03 0.63 -0.06 -2.47 0.00 0.00 174.74 172.95 1zru s PHE 224 N -0.86 3.23 0.18 3.88 0.08 -0.75 -1.10 117.98 122.64 1zru s PHE 224 Ca -0.03 0.63 -0.33 0.00 0.12 0.00 0.00 56.93 57.31 1zru s PHE 224 Cb -0.07 -2.96 -0.13 0.00 -0.57 0.00 0.00 43.02 39.29 1zru s PHE 224 CO 0.00 -0.44 1.64 0.00 -0.10 0.00 0.00 175.22 176.32 1zru n ALA 225 N 5.85 2.02 -0.99 5.36 0.00 -0.66 -1.73 120.51 130.35 1zru n ALA 225 Ca -0.01 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1zru n ALA 225 Cb 0.49 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1zru n ALA 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zru n GLY 226 N 3.62 0.54 3.54 0.00 0.00 -1.26 -4.80 105.19 106.83 1zru n GLY 226 Ca 0.16 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.93 1zru n GLY 226 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zru s ARG 227 N -0.14 1.82 -0.11 1.61 0.52 -0.71 -5.04 118.95 116.90 1zru s ARG 227 Ca 0.00 -2.04 0.16 0.00 -0.52 0.00 0.00 55.73 53.34 1zru s ARG 227 Cb 0.00 -1.19 0.66 0.00 0.52 0.00 0.00 34.95 34.95 1zru s ARG 227 CO 0.00 -0.16 1.56 -0.40 0.02 0.00 0.00 175.30 176.31 1zru n ASP 228 N -0.87 4.42 -4.69 0.23 5.68 -1.26 -4.81 116.55 115.25 1zru n ASP 228 Ca -0.05 -2.42 -0.25 0.00 -0.50 0.00 0.00 54.79 51.57 1zru n ASP 228 Cb 0.67 -0.56 -0.07 0.00 -1.14 0.00 0.00 41.12 40.02 1zru n ASP 228 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1zru s THR 229 N -1.85 3.82 0.21 2.12 -4.23 -1.26 -5.06 115.64 109.39 1zru s THR 229 Ca 0.47 -1.49 -0.01 0.00 -1.18 0.00 0.00 61.69 59.48 1zru s THR 229 Cb 0.30 -2.97 -0.04 0.00 1.34 0.00 0.00 72.50 71.14 1zru s THR 229 CO 0.22 -0.19 0.13 -0.94 -0.54 0.00 0.00 174.62 173.30 1zru s SER 230 N -3.21 0.32 0.26 3.99 1.04 -1.26 -1.81 113.70 113.03 1zru s SER 230 Ca 0.29 -1.40 -0.00 0.00 0.48 0.00 0.00 55.95 55.32 1zru s SER 230 Cb -0.09 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 1zru s SER 230 CO 0.20 -0.83 0.26 0.72 0.98 0.00 0.00 173.24 174.57 1zru s PHE 231 N -4.09 1.22 0.04 5.02 -0.12 -0.73 -4.73 117.98 114.59 1zru s PHE 231 Ca 0.39 -1.37 -0.02 0.00 -0.05 0.00 0.00 56.93 55.88 1zru s PHE 231 Cb 0.07 -0.45 -0.03 0.00 -0.63 0.00 0.00 43.02 41.98 1zru s PHE 231 CO 0.13 -0.81 -0.00 -3.38 -0.05 0.00 0.00 175.22 171.10 1zru s HIS 232 N -3.80 0.40 0.19 3.49 -3.43 -1.26 -0.75 115.29 110.12 1zru s HIS 232 Ca 0.36 -0.84 0.11 0.00 -0.80 0.00 0.00 55.06 53.89 1zru s HIS 232 Cb 0.04 -0.29 -0.04 0.00 -1.43 0.00 0.00 32.58 30.85 1zru s HIS 232 CO 0.17 -0.34 -0.24 0.96 -2.00 0.00 0.00 174.74 173.29 1zru s ILE 233 N -3.14 2.30 -0.20 -5.38 -4.36 -0.78 -0.75 121.20 108.90 1zru s ILE 233 Ca -0.00 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.31 1zru s ILE 233 Cb 0.02 -2.09 -0.04 0.00 1.25 0.00 0.00 42.46 41.60 1zru s ILE 233 CO -0.07 -0.11 0.07 -1.81 0.24 0.00 0.00 174.94 173.26 1zru s ASP 234 N -2.61 5.55 -0.39 4.36 1.01 -0.31 -0.34 116.67 123.94 1zru s ASP 234 Ca 0.20 0.01 -0.20 0.00 0.71 0.00 0.00 52.55 53.27 1zru s ASP 234 Cb -0.08 -1.97 0.01 0.00 1.01 0.00 0.00 42.92 41.89 1zru s ASP 234 CO 0.09 0.11 0.62 -0.63 0.21 0.00 0.00 175.17 175.57 1zru s ILE 235 N 0.74 4.88 0.43 0.77 1.01 0.05 -1.28 121.20 127.80 1zru s ILE 235 Ca 0.04 0.36 -0.12 0.00 0.00 0.00 0.00 60.65 60.92 1zru s ILE 235 Cb -0.13 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.16 1zru s ILE 235 CO 0.02 -0.41 0.82 0.20 0.00 0.00 0.00 174.94 175.57 1zru s ASN 236 N 1.87 6.56 0.57 3.58 0.01 -0.22 -1.28 114.94 126.03 1zru s ASN 236 Ca 0.23 1.25 0.28 0.00 -0.71 0.00 0.00 52.86 53.90 1zru s ASN 236 Cb -0.14 -2.37 1.52 0.00 0.41 0.00 0.00 41.25 40.66 1zru s ASN 236 CO 0.16 -0.44 1.99 -0.65 -1.51 0.00 0.00 177.10 176.65 1zru h PRO 237 N 1.22 0.00 -0.00 -0.60 0.11 -1.83 -0.35 132.00 130.54 1zru h PRO 237 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1zru h PRO 237 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1zru h PRO 237 CO 0.63 0.00 -0.01 0.27 -0.21 0.00 0.00 178.00 178.69 1zru n ASN 238 N -3.92 0.06 0.00 -2.05 6.94 -1.26 -4.69 115.26 110.34 1zru n ASN 238 Ca 0.07 -0.56 0.00 0.00 -0.02 0.00 0.00 54.58 54.07 1zru n ASN 238 Cb 0.55 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.82 1zru n ASN 238 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1zru n GLY 239 N 1.16 1.25 3.75 4.83 0.00 -0.14 -4.87 105.19 111.16 1zru n GLY 239 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1zru n GLY 239 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zru s SER 240 N -1.92 4.12 -0.09 1.61 1.04 -1.26 -0.38 113.70 116.82 1zru s SER 240 Ca 0.00 1.87 0.01 0.00 0.48 0.00 0.00 55.95 58.31 1zru s SER 240 Cb 0.00 -2.51 0.02 0.00 0.10 0.00 0.00 66.02 63.63 1zru s SER 240 CO 0.00 -2.29 -0.09 -0.63 0.98 0.00 0.00 173.24 171.21 1zru s ILE 241 N -2.86 1.06 -0.13 -1.02 1.01 -1.26 -1.06 121.20 116.95 1zru s ILE 241 Ca 0.62 -0.36 -0.02 0.00 0.00 0.00 0.00 60.65 60.89 1zru s ILE 241 Cb -0.18 -1.03 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1zru s ILE 241 CO 0.57 0.36 -0.04 -0.89 0.00 0.00 0.00 174.94 174.93 1zru s THR 242 N 1.25 3.89 -0.08 2.92 2.01 -0.41 -0.62 115.64 124.61 1zru s THR 242 Ca -0.03 -0.37 -0.29 0.00 0.31 0.00 0.00 61.69 61.30 1zru s THR 242 Cb -0.14 -2.67 -0.02 0.00 0.01 0.00 0.00 72.50 69.68 1zru s THR 242 CO -0.03 0.53 0.95 0.86 -0.69 0.00 0.00 174.62 176.24 1zru s TRP 243 N -0.06 3.55 -0.09 4.92 -0.11 -0.06 -1.16 118.94 125.93 1zru s TRP 243 Ca 0.01 1.55 0.13 0.00 1.22 0.00 0.00 56.10 59.01 1zru s TRP 243 Cb -0.13 -3.11 0.23 0.00 -1.50 0.00 0.00 33.47 28.96 1zru s TRP 243 CO 0.03 -0.14 1.12 0.91 -4.62 0.00 0.00 176.95 174.24 1zru n TRP 244 N 4.62 0.00 -1.62 5.86 7.02 0.07 -0.21 117.44 133.18 1zru n TRP 244 Ca 0.07 -0.73 -0.19 0.00 -1.02 0.00 0.00 57.50 55.63 1zru n TRP 244 Cb 0.50 -0.13 0.13 0.00 -2.42 0.00 0.00 31.31 29.38 1zru n TRP 244 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1zru n GLY 245 N -0.81 -1.31 3.62 6.99 0.00 -1.17 -4.13 105.19 108.38 1zru n GLY 245 Ca 0.11 -1.70 -0.28 0.00 0.00 0.00 0.00 46.02 44.14 1zru n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zru s ALA 246 N -3.95 0.52 0.39 4.61 0.00 -1.26 -4.15 121.76 117.92 1zru s ALA 246 Ca 0.49 -0.30 -0.26 0.00 0.00 0.00 0.00 51.96 51.88 1zru s ALA 246 Cb -0.01 -3.15 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 1zru s ALA 246 CO 0.34 -3.15 1.27 -0.80 0.00 0.00 0.00 175.76 173.42 1zru s ASN 247 N -3.19 6.45 -0.08 0.00 0.01 -1.26 -4.53 114.94 112.34 1zru s ASN 247 Ca 0.66 2.59 0.05 0.00 -0.71 0.00 0.00 52.86 55.44 1zru s ASN 247 Cb -0.20 -2.63 -0.01 0.00 0.41 0.00 0.00 41.25 38.81 1zru s ASN 247 CO 0.60 -0.75 -0.23 -0.63 -1.51 0.00 0.00 177.10 174.58 1zru s ILE 248 N -1.27 2.20 0.00 0.60 1.01 0.02 -5.00 121.20 118.75 1zru s ILE 248 Ca 0.55 -0.99 0.00 0.00 0.00 0.00 0.00 60.65 60.21 1zru s ILE 248 Cb -0.37 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.28 1zru s ILE 248 CO 0.47 0.56 0.00 -0.90 0.00 0.00 0.00 174.94 175.07 1zru n ASP 249 N 3.21 0.00 0.28 3.58 5.68 -1.26 -1.89 116.55 126.15 1zru n ASP 249 Ca -0.18 0.00 0.17 0.00 -0.50 0.00 0.00 54.79 54.28 1zru n ASP 249 Cb 0.52 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.21 1zru n ASP 249 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1zru h LYS 250 N 0.00 0.00 -5.82 0.11 1.57 -1.97 0.01 116.57 110.46 1zru h LYS 250 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1zru h LYS 250 Cb 0.00 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.21 1zru h LYS 250 CO 0.00 0.03 0.44 0.99 -0.57 0.00 0.00 179.45 180.35 1zru s THR 251 N -3.73 4.77 0.43 -0.16 2.01 -1.26 -4.78 115.64 112.91 1zru s THR 251 Ca 0.00 1.25 -0.25 0.00 0.31 0.00 0.00 61.69 63.00 1zru s THR 251 Cb 0.10 -4.17 -0.08 0.00 0.01 0.00 0.00 72.50 68.35 1zru s THR 251 CO 0.55 -0.26 1.35 -2.84 -0.69 0.00 0.00 174.62 172.72 1zru s PRO 252 N 3.02 3.79 -0.09 4.92 0.02 -1.26 -4.76 135.00 140.64 1zru s PRO 252 Ca 0.34 2.25 0.04 0.00 0.02 0.00 0.00 61.00 63.65 1zru s PRO 252 Cb -0.14 -2.67 0.00 0.00 0.02 0.00 0.00 34.50 31.71 1zru s PRO 252 CO 0.12 -0.67 -0.22 0.42 -0.33 0.00 0.00 177.00 176.33 1zru s ILE 253 N -1.25 1.89 0.15 2.83 1.01 -0.47 -4.88 121.20 120.47 1zru s ILE 253 Ca 0.60 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 1zru s ILE 253 Cb -0.40 -1.64 -0.08 0.00 0.01 0.00 0.00 42.46 40.35 1zru s ILE 253 CO 0.51 0.52 1.29 0.00 0.00 0.00 0.00 174.94 177.27 1zru s ALA 254 N 0.35 3.51 -0.17 9.38 0.00 -1.26 -1.17 121.76 132.39 1zru s ALA 254 Ca -0.17 1.04 -0.01 0.00 0.00 0.00 0.00 51.96 52.82 1zru s ALA 254 Cb -0.17 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.46 1zru s ALA 254 CO 0.08 -0.51 -0.11 0.95 0.00 0.00 0.00 175.76 176.17 1zru s THR 255 N 0.54 3.04 0.19 0.00 -4.23 -0.70 -1.65 115.64 112.84 1zru s THR 255 Ca 0.59 -0.64 -0.01 0.00 -1.18 0.00 0.00 61.69 60.45 1zru s THR 255 Cb -0.35 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 1zru s THR 255 CO 0.34 0.49 0.11 -0.13 -0.54 0.00 0.00 174.62 174.89 1zru s ARG 256 N 0.87 1.14 0.00 3.99 1.81 -0.26 -3.07 118.95 123.43 1zru s ARG 256 Ca -0.03 -1.59 0.00 0.00 -1.72 0.00 0.00 55.73 52.39 1zru s ARG 256 Cb -0.15 0.23 0.00 0.00 -0.45 0.00 0.00 34.95 34.58 1zru s ARG 256 CO 0.00 -0.35 0.00 0.41 -0.68 0.00 0.00 175.30 174.68 1zru n GLY 257 N -0.24 3.70 3.57 -3.53 0.00 -1.25 -0.52 105.19 106.92 1zru n GLY 257 Ca -0.00 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.90 1zru n GLY 257 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zru s ASN 258 N 0.00 5.05 0.05 1.61 -0.87 -1.26 -1.04 114.94 118.49 1zru s ASN 258 Ca 0.00 -0.02 0.05 0.00 -1.57 0.00 0.00 52.86 51.32 1zru s ASN 258 Cb 0.00 -1.72 -0.02 0.00 -0.02 0.00 0.00 41.25 39.48 1zru s ASN 258 CO 0.00 0.23 -0.14 -0.83 -2.57 0.00 0.00 177.10 173.79 1zru s GLY 259 N 0.03 0.80 0.08 0.66 0.00 -0.49 -4.89 107.32 103.51 1zru s GLY 259 Ca 0.02 -0.86 0.09 0.00 0.00 0.00 0.00 44.72 43.97 1zru s GLY 259 CO 0.02 -0.85 -0.23 -0.56 0.00 0.00 0.00 173.10 171.48 1zru s SER 260 N -1.30 3.49 0.14 1.64 0.01 -1.26 -0.11 113.70 116.31 1zru s SER 260 Ca 0.00 -0.59 -0.11 0.00 1.31 0.00 0.00 55.95 56.56 1zru s SER 260 Cb -0.08 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.76 1zru s SER 260 CO 0.01 0.22 0.29 -0.72 0.41 0.00 0.00 173.24 173.45 1zru s TYR 261 N -0.97 0.19 -0.13 2.43 -0.85 -0.36 -5.01 117.35 112.65 1zru s TYR 261 Ca 0.14 -0.57 -0.10 0.00 -0.52 0.00 0.00 57.07 56.02 1zru s TYR 261 Cb -0.10 0.02 -0.05 0.00 0.38 0.00 0.00 41.96 42.22 1zru s TYR 261 CO 0.05 -0.68 0.20 -0.06 -1.52 0.00 0.00 175.55 173.55 1zru s PHE 262 N -3.90 3.54 0.11 -3.49 0.08 -1.26 -0.76 117.98 112.30 1zru s PHE 262 Ca 0.11 0.55 -0.13 0.00 0.12 0.00 0.00 56.93 57.58 1zru s PHE 262 Cb 0.03 -2.12 -0.09 0.00 -0.57 0.00 0.00 43.02 40.27 1zru s PHE 262 CO -0.05 0.51 1.40 0.82 -0.10 0.00 0.00 175.22 177.80 1zru h ILE 263 N 4.26 1.29 -0.03 0.64 2.04 -1.26 -3.43 117.51 121.02 1zru h ILE 263 Ca -0.48 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 63.73 1zru h ILE 263 Cb 1.19 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 1zru h ILE 263 CO 0.67 0.53 0.00 0.29 0.00 0.00 0.00 178.15 179.64