#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rz1 h ASP 3 N 0.00 0.22 -0.24 1.67 3.45 -2.05 -2.23 116.42 117.25 1rz1 h ASP 3 Ca 0.00 -0.03 -0.12 0.00 0.43 0.00 0.00 57.03 57.32 1rz1 h ASP 3 Cb 0.00 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 38.71 1rz1 h ASP 3 CO 0.00 0.27 -0.31 -0.09 -1.57 0.00 0.00 179.24 177.54 1rz1 h ARG 4 N 0.25 0.63 -0.70 3.56 2.43 -2.05 -1.61 114.38 116.89 1rz1 h ARG 4 Ca 0.06 -0.36 0.04 0.00 -0.81 0.00 0.00 59.98 58.91 1rz1 h ARG 4 Cb 0.17 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 1rz1 h ARG 4 CO 0.00 0.97 0.42 1.25 -1.51 0.00 0.00 179.97 181.11 1rz1 h LEU 5 N 0.34 0.67 -0.28 3.80 5.85 -1.93 0.80 115.31 124.57 1rz1 h LEU 5 Ca 0.03 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1rz1 h LEU 5 Cb 0.89 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1rz1 h LEU 5 CO 0.07 0.46 0.03 0.15 -0.34 0.00 0.00 178.44 178.81 1rz1 h PHE 6 N 0.81 0.50 -0.65 1.25 3.57 -1.41 -1.21 116.94 119.80 1rz1 h PHE 6 Ca 0.29 -0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 1rz1 h PHE 6 Cb 0.08 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 1rz1 h PHE 6 CO -0.05 0.58 0.13 0.00 -2.23 0.00 0.00 178.31 176.74 1rz1 h ARG 7 N 0.28 1.05 -0.44 1.11 3.08 -1.05 -2.58 114.38 115.83 1rz1 h ARG 7 Ca 0.08 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1rz1 h ARG 7 Cb 0.36 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 1rz1 h ARG 7 CO 0.01 0.94 0.28 -0.91 -1.07 0.00 0.00 179.97 179.22 1rz1 h ASN 8 N 0.99 0.52 0.00 7.04 2.35 -0.77 -0.62 115.58 125.08 1rz1 h ASN 8 Ca 0.20 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1rz1 h ASN 8 Cb 0.39 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1rz1 h ASN 8 CO 0.01 0.40 0.00 0.00 -1.65 0.00 0.00 177.43 176.19 1rz1 n ALA 9 N -2.23 1.24 0.00 -0.83 0.00 -0.46 -2.86 120.51 115.36 1rz1 n ALA 9 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1rz1 n ALA 9 Cb 0.04 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1rz1 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rz1 n GLY 11 N 0.56 0.00 0.09 0.00 0.00 -0.24 -3.91 105.19 101.68 1rz1 n GLY 11 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1rz1 n GLY 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rz1 n LYS 12 N 0.00 0.18 -2.95 1.61 4.76 -1.14 -0.39 118.16 120.23 1rz1 n LYS 12 Ca 0.00 0.24 -0.43 0.00 -2.87 0.00 0.00 58.31 55.25 1rz1 n LYS 12 Cb 0.00 -1.75 -0.05 0.00 -1.84 0.00 0.00 35.03 31.39 1rz1 n LYS 12 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1rz1 s PHE 13 N -3.14 2.91 0.44 2.13 5.36 -1.25 -4.93 117.98 119.51 1rz1 s PHE 13 Ca 0.09 -0.08 -0.24 0.00 -0.96 0.00 0.00 56.93 55.74 1rz1 s PHE 13 Cb 0.12 -3.82 -0.08 0.00 -0.34 0.00 0.00 43.02 38.91 1rz1 s PHE 13 CO 0.50 -1.17 1.20 0.00 -1.46 0.00 0.00 175.22 174.30 1rz1 s ALA 14 N 3.45 3.06 0.10 11.12 0.00 -1.26 -4.87 121.76 133.35 1rz1 s ALA 14 Ca 0.27 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 53.21 1rz1 s ALA 14 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 1rz1 s ALA 14 CO 0.19 -0.70 0.08 0.95 0.00 0.00 0.00 175.76 176.27 1rz1 s THR 15 N -1.44 0.14 0.53 0.00 -4.23 -0.90 -5.00 115.64 104.73 1rz1 s THR 15 Ca 0.61 -1.69 -0.09 0.00 -1.18 0.00 0.00 61.69 59.34 1rz1 s THR 15 Cb -0.32 -1.72 0.13 0.00 1.34 0.00 0.00 72.50 71.93 1rz1 s THR 15 CO 0.39 -0.66 0.49 0.61 -0.54 0.00 0.00 174.62 174.92 1rz1 n GLY 16 N -0.03 -2.45 2.94 3.99 0.00 -1.26 -0.65 105.19 107.73 1rz1 n GLY 16 Ca -0.10 -1.49 -0.20 0.00 0.00 0.00 0.00 46.02 44.23 1rz1 n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rz1 s VAL 17 N -1.92 0.65 0.28 1.61 1.01 -1.20 -4.61 120.40 116.23 1rz1 s VAL 17 Ca 0.32 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 62.15 1rz1 s VAL 17 Cb -0.03 -0.62 -0.06 0.00 0.00 0.00 0.00 36.38 35.67 1rz1 s VAL 17 CO 0.24 0.23 -0.13 0.42 0.00 0.00 0.00 175.10 175.86 1rz1 s THR 18 N 0.56 2.09 -0.13 3.92 -4.23 -0.51 -0.61 115.64 116.72 1rz1 s THR 18 Ca -0.08 -2.25 0.00 0.00 -1.18 0.00 0.00 61.69 58.18 1rz1 s THR 18 Cb -0.12 -2.39 -0.01 0.00 1.34 0.00 0.00 72.50 71.32 1rz1 s THR 18 CO 0.01 -0.36 -0.14 -0.69 -0.54 0.00 0.00 174.62 172.90 1rz1 s VAL 19 N -2.74 2.91 -0.12 2.29 1.01 0.59 -1.06 120.40 123.28 1rz1 s VAL 19 Ca 0.29 -0.71 -0.21 0.00 0.00 0.00 0.00 61.98 61.36 1rz1 s VAL 19 Cb -0.00 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 1rz1 s VAL 19 CO 0.13 0.53 0.59 -0.63 0.00 0.00 0.00 175.10 175.72 1rz1 s ILE 20 N 0.42 5.10 0.17 2.22 -1.09 -1.26 -0.04 121.20 126.72 1rz1 s ILE 20 Ca -0.11 1.18 0.10 0.00 -2.23 0.00 0.00 60.65 59.59 1rz1 s ILE 20 Cb -0.16 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.75 1rz1 s ILE 20 CO 0.05 0.25 -0.22 0.42 -1.23 0.00 0.00 174.94 174.21 1rz1 s THR 21 N 1.01 2.09 0.29 2.92 -4.23 0.23 -4.17 115.64 113.77 1rz1 s THR 21 Ca 0.31 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.77 1rz1 s THR 21 Cb -0.16 -1.96 0.01 0.00 1.34 0.00 0.00 72.50 71.72 1rz1 s THR 21 CO 0.13 -0.17 0.53 0.28 -0.54 0.00 0.00 174.62 174.85 1rz1 s THR 22 N -1.72 0.00 -0.09 3.99 -1.32 -0.41 -0.48 115.64 115.61 1rz1 s THR 22 Ca 0.17 -1.38 0.01 0.00 -1.21 0.00 0.00 61.69 59.29 1rz1 s THR 22 Cb -0.07 -2.36 0.02 0.00 -1.51 0.00 0.00 72.50 68.57 1rz1 s THR 22 CO 0.08 0.00 -0.12 -0.70 -2.21 0.00 0.00 174.62 171.67 1rz1 s GLU 23 N -3.61 1.82 -0.03 7.08 2.12 -1.26 -1.30 118.70 123.51 1rz1 s GLU 23 Ca 0.23 -0.41 0.03 0.00 0.36 0.00 0.00 54.97 55.17 1rz1 s GLU 23 Cb -0.01 -1.61 0.00 0.00 0.26 0.00 0.00 34.13 32.77 1rz1 s GLU 23 CO 0.12 -0.09 -0.10 -1.17 -0.54 0.00 0.00 175.26 173.48 1rz1 s LEU 24 N 1.07 1.78 -1.44 2.70 2.96 -0.26 -4.80 118.68 120.68 1rz1 s LEU 24 Ca -0.06 -0.21 -0.02 0.00 -0.22 0.00 0.00 54.13 53.62 1rz1 s LEU 24 Cb -0.15 -0.60 0.02 0.00 0.50 0.00 0.00 46.19 45.96 1rz1 s LEU 24 CO -0.02 0.07 0.47 0.59 -1.32 0.00 0.00 176.35 176.15 1rz1 n ASN 25 N 3.32 -0.74 0.00 3.68 3.02 -1.26 -0.48 115.26 122.80 1rz1 n ASN 25 Ca -0.19 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.36 1rz1 n ASN 25 Cb 0.54 -3.05 0.00 0.00 -0.61 0.00 0.00 39.78 36.66 1rz1 n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rz1 n GLY 26 N -1.92 2.57 3.90 7.41 0.00 -1.26 -5.02 105.19 110.87 1rz1 n GLY 26 Ca -0.26 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 1rz1 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rz1 s ALA 27 N -0.75 3.90 -0.21 4.61 0.00 0.36 -5.09 121.76 124.58 1rz1 s ALA 27 Ca 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 51.96 51.17 1rz1 s ALA 27 Cb 0.00 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.09 1rz1 s ALA 27 CO 0.00 0.72 0.20 0.08 0.00 0.00 0.00 175.76 176.76 1rz1 s VAL 28 N -1.43 5.35 -0.00 0.00 1.01 -1.26 -1.11 120.40 122.96 1rz1 s VAL 28 Ca 0.32 0.29 0.08 0.00 0.00 0.00 0.00 61.98 62.68 1rz1 s VAL 28 Cb -0.13 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 1rz1 s VAL 28 CO 0.21 0.37 -0.26 -1.00 0.00 0.00 0.00 175.10 174.42 1rz1 s HIS 29 N 0.79 2.31 0.16 5.22 3.76 -0.42 -5.00 115.29 122.10 1rz1 s HIS 29 Ca 0.10 -0.43 0.02 0.00 -0.15 0.00 0.00 55.06 54.61 1rz1 s HIS 29 Cb -0.13 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 1rz1 s HIS 29 CO 0.03 0.01 0.09 0.41 -0.85 0.00 0.00 174.74 174.42 1rz1 n GLY 30 N 2.25 3.66 3.27 -2.22 0.00 -1.26 -1.28 105.19 109.61 1rz1 n GLY 30 Ca -0.16 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.62 1rz1 n GLY 30 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rz1 s THR 32 N -2.35 2.86 0.01 2.61 2.01 -0.14 -4.92 115.64 115.71 1rz1 s THR 32 Ca 0.12 -0.69 0.02 0.00 0.31 0.00 0.00 61.69 61.45 1rz1 s THR 32 Cb 0.01 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.26 1rz1 s THR 32 CO 0.09 0.49 -0.05 0.00 -0.69 0.00 0.00 174.62 174.45 1rz1 s ALA 33 N 1.08 0.43 0.00 7.40 0.00 -0.22 -4.87 121.76 125.58 1rz1 s ALA 33 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.64 1rz1 s ALA 33 Cb -0.15 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1rz1 s ALA 33 CO -0.03 0.07 0.20 0.27 0.00 0.00 0.00 175.76 176.28 1rz1 n ASN 34 N 2.67 0.41 -4.26 0.00 6.94 -1.26 -1.43 115.26 118.32 1rz1 n ASN 34 Ca -0.15 -0.70 -0.43 0.00 -0.02 0.00 0.00 54.58 53.28 1rz1 n ASN 34 Cb 0.58 0.56 0.00 0.00 -2.36 0.00 0.00 39.78 38.55 1rz1 n ASN 34 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rz1 n ALA 35 N -0.56 4.36 -2.40 -2.53 0.00 -1.26 -4.92 120.51 113.20 1rz1 n ALA 35 Ca 0.00 -4.09 -0.22 0.00 0.00 0.00 0.00 53.44 49.13 1rz1 n ALA 35 Cb 0.00 -3.28 -0.08 0.00 0.00 0.00 0.00 19.45 16.09 1rz1 n ALA 35 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1rz1 s PHE 36 N 2.37 1.74 0.09 0.00 5.36 -1.26 -1.67 117.98 124.60 1rz1 s PHE 36 Ca 0.46 -1.45 -0.24 0.00 -0.96 0.00 0.00 56.93 54.74 1rz1 s PHE 36 Cb 0.04 -0.94 -0.07 0.00 -0.34 0.00 0.00 43.02 41.72 1rz1 s PHE 36 CO 0.01 -0.56 0.73 0.45 -1.46 0.00 0.00 175.22 174.39 1rz1 s SER 38 N -3.48 7.24 0.01 6.13 0.15 -1.26 -5.01 113.70 117.48 1rz1 s SER 38 Ca 0.32 1.48 -0.04 0.00 0.70 0.00 0.00 55.95 58.40 1rz1 s SER 38 Cb 0.03 -2.46 -0.01 0.00 -1.71 0.00 0.00 66.02 61.87 1rz1 s SER 38 CO 0.20 0.14 -0.08 0.52 1.20 0.00 0.00 173.24 175.22 1rz1 n VAL 39 N 2.16 0.96 -4.23 4.45 0.31 -0.41 -4.92 118.33 116.65 1rz1 n VAL 39 Ca -0.05 0.28 -0.18 0.00 -0.01 0.00 0.00 64.34 64.38 1rz1 n VAL 39 Cb 0.50 -1.65 -0.13 0.00 -0.91 0.00 0.00 33.84 31.65 1rz1 n VAL 39 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1rz1 s SER 40 N -5.62 1.42 -0.20 4.52 0.15 -0.76 -4.97 113.70 108.25 1rz1 s SER 40 Ca -0.07 -0.49 -0.13 0.00 0.70 0.00 0.00 55.95 55.97 1rz1 s SER 40 Cb 0.01 -0.06 -0.20 0.00 -1.71 0.00 0.00 66.02 64.06 1rz1 s SER 40 CO 0.10 -0.04 0.12 -0.11 1.20 0.00 0.00 173.24 174.51 1rz1 n LEU 41 N 1.74 2.27 -3.82 3.45 7.94 -1.26 -1.14 117.00 126.18 1rz1 n LEU 41 Ca -0.19 0.27 -0.30 0.00 -1.11 0.00 0.00 56.01 54.68 1rz1 n LEU 41 Cb 0.55 -0.99 -0.15 0.00 0.53 0.00 0.00 43.42 43.36 1rz1 n LEU 41 CO 0.22 0.60 -0.34 0.20 -1.11 0.00 0.00 177.39 176.96 1rz1 s ASN 42 N -6.98 4.11 0.99 1.96 0.01 -1.26 -2.98 114.94 110.79 1rz1 s ASN 42 Ca -0.29 -1.65 -0.16 0.00 -0.71 0.00 0.00 52.86 50.05 1rz1 s ASN 42 Cb 0.08 -1.05 0.20 0.00 0.41 0.00 0.00 41.25 40.89 1rz1 s ASN 42 CO 0.64 -0.38 1.26 -2.16 -1.51 0.00 0.00 177.10 174.95 1rz1 s PRO 43 N 1.45 0.44 -0.69 -0.60 0.04 -1.26 -5.05 135.00 129.32 1rz1 s PRO 43 Ca 0.08 -0.27 -0.27 0.00 0.04 0.00 0.00 61.00 60.57 1rz1 s PRO 43 Cb -0.18 -1.81 0.03 0.00 0.04 0.00 0.00 34.50 32.58 1rz1 s PRO 43 CO -0.18 -2.57 1.24 0.15 0.04 0.00 0.00 177.00 175.68 1rz1 s LYS 44 N -5.75 3.28 0.11 4.56 1.02 -1.16 -4.53 119.74 117.27 1rz1 s LYS 44 Ca 0.72 -0.12 0.09 0.00 0.02 0.00 0.00 55.97 56.68 1rz1 s LYS 44 Cb -0.06 -4.13 -0.04 0.00 -0.52 0.00 0.00 37.83 33.08 1rz1 s LYS 44 CO 0.53 -2.00 -0.22 -0.51 -0.92 0.00 0.00 175.35 172.23 1rz1 s LEU 45 N 5.45 2.30 0.08 3.17 1.43 -0.29 -1.50 118.68 129.33 1rz1 s LEU 45 Ca 0.37 -0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1rz1 s LEU 45 Cb -0.08 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 1rz1 s LEU 45 CO 0.18 0.08 -0.01 0.54 0.23 0.00 0.00 176.35 177.38 1rz1 s VAL 46 N -1.14 0.22 -0.01 -1.59 0.11 0.04 -1.28 120.40 116.75 1rz1 s VAL 46 Ca 0.08 -1.85 -0.04 0.00 -2.93 0.00 0.00 61.98 57.24 1rz1 s VAL 46 Cb -0.10 -1.68 0.00 0.00 -1.53 0.00 0.00 36.38 33.07 1rz1 s VAL 46 CO 0.05 -0.84 0.08 -0.22 -3.33 0.00 0.00 175.10 170.84 1rz1 s LEU 47 N -2.97 1.73 0.06 2.54 0.20 -1.26 -0.16 118.68 118.82 1rz1 s LEU 47 Ca 0.12 -0.06 0.02 0.00 0.69 0.00 0.00 54.13 54.91 1rz1 s LEU 47 Cb 0.08 0.38 -0.03 0.00 -0.43 0.00 0.00 46.19 46.19 1rz1 s LEU 47 CO -0.06 -0.18 -0.08 0.54 -0.29 0.00 0.00 176.35 176.28 1rz1 s VAL 48 N -0.65 0.61 -0.14 1.68 0.11 -0.84 -4.43 120.40 116.74 1rz1 s VAL 48 Ca -0.07 -1.33 0.01 0.00 -2.93 0.00 0.00 61.98 57.66 1rz1 s VAL 48 Cb -0.04 -0.93 0.02 0.00 -1.53 0.00 0.00 36.38 33.89 1rz1 s VAL 48 CO 0.00 -0.51 -0.16 -0.55 -3.33 0.00 0.00 175.10 170.55 1rz1 s SER 49 N -2.00 2.73 -0.08 3.54 0.15 -0.67 -1.13 113.70 116.24 1rz1 s SER 49 Ca -0.03 -0.51 0.04 0.00 0.70 0.00 0.00 55.95 56.14 1rz1 s SER 49 Cb -0.06 -1.23 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 1rz1 s SER 49 CO -0.01 -0.01 -0.21 -0.63 1.20 0.00 0.00 173.24 173.59 1rz1 s ILE 50 N 1.21 1.78 0.48 6.45 1.01 -0.48 -4.78 121.20 126.88 1rz1 s ILE 50 Ca -0.00 -0.87 -0.24 0.00 0.00 0.00 0.00 60.65 59.55 1rz1 s ILE 50 Cb -0.14 -1.55 -0.07 0.00 0.01 0.00 0.00 42.46 40.71 1rz1 s ILE 50 CO -0.07 0.50 1.33 -0.83 0.00 0.00 0.00 174.94 175.87 1rz1 s GLY 51 N 0.37 2.88 0.47 6.18 0.00 -1.26 -0.15 107.32 115.81 1rz1 s GLY 51 Ca -0.16 1.28 0.17 0.00 0.00 0.00 0.00 44.72 46.01 1rz1 s GLY 51 CO 0.07 1.82 2.01 1.05 0.00 0.00 0.00 173.10 178.05 1rz1 h GLU 52 N 2.01 0.23 -0.15 2.90 4.11 -1.41 -1.42 114.58 120.86 1rz1 h GLU 52 Ca -0.50 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.91 1rz1 h GLU 52 Cb 1.27 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1rz1 h GLU 52 CO 0.60 0.15 0.00 1.63 0.07 0.00 0.00 179.01 181.46 1rz1 n LYS 53 N -4.46 1.76 -3.00 1.06 5.02 -1.26 -4.92 118.16 112.36 1rz1 n LYS 53 Ca 0.08 -1.13 -0.40 0.00 -2.02 0.00 0.00 58.31 54.84 1rz1 n LYS 53 Cb 0.38 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 33.93 1rz1 n LYS 53 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rz1 s ALA 54 N -1.82 3.33 0.00 7.82 0.00 -0.53 -5.02 121.76 125.54 1rz1 s ALA 54 Ca 0.33 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1rz1 s ALA 54 Cb 0.18 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.30 1rz1 s ALA 54 CO 0.28 -0.05 0.00 1.63 0.00 0.00 0.00 175.76 177.61 1rz1 n LYS 55 N 3.46 0.00 0.00 0.00 5.02 -1.26 -4.19 118.16 121.19 1rz1 n LYS 55 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1rz1 n LYS 55 Cb 0.51 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 34.47 1rz1 n LYS 55 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1rz1 n LEU 57 N 1.36 0.00 -0.34 -0.35 0.00 -1.26 -3.12 117.00 113.29 1rz1 n LEU 57 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 56.01 56.02 1rz1 n LEU 57 Cb 0.00 0.00 0.15 0.00 0.00 0.00 0.00 43.42 43.57 1rz1 n LEU 57 CO 0.00 0.00 1.23 1.05 0.00 0.00 0.00 177.39 179.67 1rz1 h GLU 58 N 0.00 1.06 -0.87 1.96 9.09 -1.94 -1.49 114.58 122.38 1rz1 h GLU 58 Ca 0.00 -0.06 0.08 0.00 0.05 0.00 0.00 59.36 59.43 1rz1 h GLU 58 Cb 0.00 -0.24 -0.07 0.00 -1.65 0.00 0.00 28.75 26.79 1rz1 h GLU 58 CO 0.00 0.70 0.53 0.87 0.05 0.00 0.00 179.01 181.16 1rz1 h LYS 59 N 1.09 0.90 -0.02 1.06 1.79 -1.89 -1.11 116.57 118.39 1rz1 h LYS 59 Ca 0.40 -0.05 -0.25 0.00 -2.18 0.00 0.00 60.65 58.57 1rz1 h LYS 59 Cb 0.15 -0.20 0.01 0.00 -1.58 0.00 0.00 32.23 30.61 1rz1 h LYS 59 CO -0.17 0.59 -0.98 0.82 -1.08 0.00 0.00 179.45 178.63 1rz1 h ILE 60 N 0.92 1.32 -0.86 1.86 2.04 -1.75 -1.75 117.51 119.30 1rz1 h ILE 60 Ca 0.40 -2.28 0.14 0.00 1.00 0.00 0.00 64.86 64.13 1rz1 h ILE 60 Cb 0.28 2.35 -0.06 0.00 -0.74 0.00 0.00 36.82 38.64 1rz1 h ILE 60 CO -0.21 0.70 0.56 1.56 0.00 0.00 0.00 178.15 180.75 1rz1 h GLN 61 N 0.36 0.61 0.00 2.37 4.20 -0.57 0.26 115.11 122.33 1rz1 h GLN 61 Ca -0.11 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.52 1rz1 h GLN 61 Cb 1.63 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 29.26 1rz1 h GLN 61 CO 0.19 0.40 -0.25 1.96 -0.67 0.00 0.00 178.83 180.46 1rz1 h GLN 62 N 0.63 0.00 0.00 1.46 4.20 -1.21 -3.36 115.11 116.83 1rz1 h GLN 62 Ca 0.43 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 59.08 1rz1 h GLN 62 Cb 0.74 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1rz1 h GLN 62 CO -0.18 0.91 -0.27 0.66 -0.67 0.00 0.00 178.83 179.28 1rz1 h SER 63 N -1.00 0.00 -1.25 1.46 4.64 -1.22 -3.47 113.55 112.72 1rz1 h SER 63 Ca -0.07 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.87 1rz1 h SER 63 Cb 0.98 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.93 1rz1 h SER 63 CO -0.04 0.27 -0.36 0.29 -0.87 0.00 0.00 176.83 176.12 1rz1 n LYS 64 N -3.58 -1.44 -4.03 4.77 4.76 0.89 -4.95 118.16 114.58 1rz1 n LYS 64 Ca -0.01 1.10 -0.09 0.00 -2.87 0.00 0.00 58.31 56.44 1rz1 n LYS 64 Cb 0.41 -5.47 -0.08 0.00 -1.84 0.00 0.00 35.03 28.05 1rz1 n LYS 64 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1rz1 s LYS 65 N -3.69 1.03 -0.02 1.97 -2.85 -1.26 -0.76 119.74 114.16 1rz1 s LYS 65 Ca 0.00 -1.26 -0.28 0.00 -1.00 0.00 0.00 55.97 53.43 1rz1 s LYS 65 Cb 0.00 0.32 0.10 0.00 -2.06 0.00 0.00 37.83 36.18 1rz1 s LYS 65 CO 0.00 -0.34 0.82 1.52 0.10 0.00 0.00 175.35 177.45 1rz1 s TYR 66 N -3.99 -0.45 0.13 1.78 -0.85 -0.84 -4.77 117.35 108.37 1rz1 s TYR 66 Ca 0.18 0.50 0.09 0.00 -0.52 0.00 0.00 57.07 57.33 1rz1 s TYR 66 Cb 0.05 0.50 -0.04 0.00 0.38 0.00 0.00 41.96 42.85 1rz1 s TYR 66 CO -0.00 -0.57 -0.18 0.00 -1.52 0.00 0.00 175.55 173.28 1rz1 s ALA 67 N -2.42 2.69 -0.19 9.51 0.00 0.37 -0.03 121.76 131.69 1rz1 s ALA 67 Ca -0.00 -1.40 -0.03 0.00 0.00 0.00 0.00 51.96 50.52 1rz1 s ALA 67 Cb -0.01 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.48 1rz1 s ALA 67 CO -0.04 0.56 -0.05 0.08 0.00 0.00 0.00 175.76 176.31 1rz1 s VAL 68 N -1.27 3.56 -0.35 0.00 1.01 0.57 -0.60 120.40 123.32 1rz1 s VAL 68 Ca 0.19 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 1rz1 s VAL 68 Cb -0.10 -2.59 0.07 0.00 0.00 0.00 0.00 36.38 33.76 1rz1 s VAL 68 CO 0.11 0.45 0.11 0.20 0.00 0.00 0.00 175.10 175.97 1rz1 s ASN 69 N 0.97 5.16 -0.08 3.32 0.01 0.94 -1.48 114.94 123.77 1rz1 s ASN 69 Ca 0.00 -1.50 -0.30 0.00 -0.71 0.00 0.00 52.86 50.35 1rz1 s ASN 69 Cb -0.15 -1.80 -0.02 0.00 0.41 0.00 0.00 41.25 39.69 1rz1 s ASN 69 CO 0.01 -0.39 1.12 -0.63 -1.51 0.00 0.00 177.10 175.71 1rz1 s ILE 70 N 1.26 4.47 0.18 0.60 1.01 -0.16 -0.30 121.20 128.26 1rz1 s ILE 70 Ca 0.00 1.77 -0.22 0.00 0.00 0.00 0.00 60.65 62.20 1rz1 s ILE 70 Cb -0.21 -4.14 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 1rz1 s ILE 70 CO -0.01 -0.01 0.73 -0.76 0.00 0.00 0.00 174.94 174.89 1rz1 s LEU 71 N 2.22 4.48 0.64 2.97 1.43 0.22 0.01 118.68 130.64 1rz1 s LEU 71 Ca 0.53 1.51 -0.07 0.00 -1.03 0.00 0.00 54.13 55.07 1rz1 s LEU 71 Cb -0.22 -3.38 0.03 0.00 0.03 0.00 0.00 46.19 42.64 1rz1 s LEU 71 CO 0.20 0.14 0.95 -0.94 0.23 0.00 0.00 176.35 176.93 1rz1 s SER 72 N -1.36 5.33 0.55 2.29 1.04 -1.26 -1.96 113.70 118.33 1rz1 s SER 72 Ca 0.38 0.66 0.32 0.00 0.48 0.00 0.00 55.95 57.79 1rz1 s SER 72 Cb -0.20 -1.53 1.47 0.00 0.10 0.00 0.00 66.02 65.87 1rz1 s SER 72 CO 0.23 -1.26 1.86 -0.61 0.98 0.00 0.00 173.24 174.44 1rz1 h GLN 73 N -0.35 0.00 -0.06 4.02 4.15 -1.03 -1.61 115.11 120.23 1rz1 h GLN 73 Ca -0.45 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1rz1 h GLN 73 Cb 1.28 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.97 1rz1 h GLN 73 CO 0.61 0.00 0.00 -0.25 -1.93 0.00 0.00 178.83 177.26 1rz1 n ASP 74 N -4.08 0.99 -0.82 -0.69 8.00 -1.26 -4.30 116.55 114.39 1rz1 n ASP 74 Ca 0.17 -1.47 0.02 0.00 0.71 0.00 0.00 54.79 54.22 1rz1 n ASP 74 Cb 0.95 -0.04 0.20 0.00 -0.02 0.00 0.00 41.12 42.22 1rz1 n ASP 74 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rz1 n GLN 75 N -0.17 1.78 -0.36 -1.24 6.02 -0.61 -4.72 117.38 118.08 1rz1 n GLN 75 Ca 0.18 -3.14 0.03 0.00 -0.01 0.00 0.00 57.00 54.06 1rz1 n GLN 75 Cb 0.24 -1.71 0.18 0.00 1.02 0.00 0.00 30.24 29.97 1rz1 n GLN 75 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1rz1 h LYS 76 N 0.96 1.07 -0.49 -1.09 3.64 -1.76 -2.29 116.57 116.62 1rz1 h LYS 76 Ca 0.10 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1rz1 h LYS 76 Cb 1.33 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1rz1 h LYS 76 CO 0.19 0.71 0.09 0.28 -2.27 0.00 0.00 179.45 178.45 1rz1 h VAL 77 N 1.10 1.22 -0.72 2.00 2.07 -1.96 -2.68 116.25 117.29 1rz1 h VAL 77 Ca 0.43 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 67.07 1rz1 h VAL 77 Cb 0.22 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1rz1 h VAL 77 CO -0.19 0.30 0.19 -0.07 0.02 0.00 0.00 177.57 177.82 1rz1 h LEU 78 N 0.73 1.07 -0.63 2.57 3.38 -1.80 -0.66 115.31 119.96 1rz1 h LEU 78 Ca 0.16 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1rz1 h LEU 78 Cb 0.31 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1rz1 h LEU 78 CO 0.00 1.01 0.00 -0.24 0.09 0.00 0.00 178.44 179.30 1rz1 n SER 79 N -4.24 0.00 0.00 -0.43 2.88 -0.91 -0.94 113.62 109.98 1rz1 n SER 79 Ca 0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1rz1 n SER 79 Cb 0.25 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1rz1 n SER 79 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1rz1 n ASN 81 N 0.12 0.00 0.00 -3.46 5.15 -0.26 -2.11 115.26 114.70 1rz1 n ASN 81 Ca 0.00 0.00 0.12 0.00 -0.60 0.00 0.00 54.58 54.10 1rz1 n ASN 81 Cb 0.00 0.00 0.74 0.00 -0.53 0.00 0.00 39.78 39.99 1rz1 n ASN 81 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1rz1 n PHE 82 N 0.00 0.00 0.10 1.20 3.72 -0.11 -2.11 117.46 120.25 1rz1 n PHE 82 Ca 0.00 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.50 1rz1 n PHE 82 Cb 0.00 0.00 0.21 0.00 -0.94 0.00 0.00 39.48 38.75 1rz1 n PHE 82 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rz1 n ALA 83 N -0.92 2.37 -2.01 4.37 0.00 -0.90 -0.97 120.51 122.46 1rz1 n ALA 83 Ca 0.19 -1.04 -0.10 0.00 0.00 0.00 0.00 53.44 52.49 1rz1 n ALA 83 Cb 0.09 -0.75 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 1rz1 n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rz1 n GLY 84 N 1.26 0.19 0.61 0.00 0.00 -0.90 -4.93 105.19 101.43 1rz1 n GLY 84 Ca 0.18 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.81 1rz1 n GLY 84 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rz1 n GLN 85 N -2.08 1.50 -4.37 1.61 6.02 -1.26 -4.90 117.38 113.90 1rz1 n GLN 85 Ca -0.11 -1.23 -0.34 0.00 -0.01 0.00 0.00 57.00 55.30 1rz1 n GLN 85 Cb 0.54 -1.47 -0.11 0.00 1.02 0.00 0.00 30.24 30.22 1rz1 n GLN 85 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1rz1 s LEU 86 N -2.35 3.44 0.22 1.08 1.43 -1.26 -4.98 118.68 116.26 1rz1 s LEU 86 Ca 0.21 0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.26 1rz1 s LEU 86 Cb 0.19 -1.81 0.28 0.00 0.03 0.00 0.00 46.19 44.88 1rz1 s LEU 86 CO 0.50 0.28 1.82 -0.33 0.23 0.00 0.00 176.35 178.84 1rz1 h GLU 87 N 5.88 0.73 -5.23 1.70 4.39 -2.00 -3.40 114.58 116.64 1rz1 h GLU 87 Ca -0.42 -0.04 -0.66 0.00 0.34 0.00 0.00 59.36 58.57 1rz1 h GLU 87 Cb 1.19 -0.16 -0.30 0.00 -0.10 0.00 0.00 28.75 29.37 1rz1 h GLU 87 CO 0.59 0.48 -0.80 0.21 -1.16 0.00 0.00 179.01 178.33 1rz1 s LYS 88 N -6.08 3.24 0.52 2.33 2.20 -1.26 -5.11 119.74 115.58 1rz1 s LYS 88 Ca -0.13 -0.75 -0.22 0.00 -0.36 0.00 0.00 55.97 54.52 1rz1 s LYS 88 Cb 0.17 -2.60 -0.06 0.00 -1.51 0.00 0.00 37.83 33.83 1rz1 s LYS 88 CO 0.77 0.07 1.29 -2.14 -0.36 0.00 0.00 175.35 174.98 1rz1 s PRO 89 N 0.67 3.35 0.37 4.03 0.02 -1.26 -5.01 135.00 137.17 1rz1 s PRO 89 Ca -0.08 2.06 -0.06 0.00 0.02 0.00 0.00 61.00 62.95 1rz1 s PRO 89 Cb -0.16 -2.30 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 1rz1 s PRO 89 CO 0.02 -0.97 0.67 0.14 -0.33 0.00 0.00 177.00 176.53 1rz1 s VAL 90 N -1.39 4.94 -0.70 3.83 -7.23 -1.26 -5.01 120.40 113.57 1rz1 s VAL 90 Ca 0.69 0.19 -0.26 0.00 -1.81 0.00 0.00 61.98 60.79 1rz1 s VAL 90 Cb -0.36 -3.78 0.04 0.00 0.56 0.00 0.00 36.38 32.84 1rz1 s VAL 90 CO 0.43 -0.53 1.17 -0.62 -0.31 0.00 0.00 175.10 175.24 1rz1 s ASP 91 N -3.48 6.19 0.01 4.85 2.15 -1.26 -4.99 116.67 120.14 1rz1 s ASP 91 Ca 0.46 -0.56 -0.20 0.00 0.43 0.00 0.00 52.55 52.68 1rz1 s ASP 91 Cb -0.10 -2.51 -0.06 0.00 -0.30 0.00 0.00 42.92 39.95 1rz1 s ASP 91 CO 0.34 -1.68 0.57 -0.69 -0.17 0.00 0.00 175.17 173.54 1rz1 s VAL 92 N 5.15 4.88 -0.48 1.11 1.01 -1.26 -5.02 120.40 125.78 1rz1 s VAL 92 Ca 0.32 1.20 -0.24 0.00 0.00 0.00 0.00 61.98 63.26 1rz1 s VAL 92 Cb -0.11 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.40 1rz1 s VAL 92 CO 0.14 0.46 0.84 -1.10 0.00 0.00 0.00 175.10 175.45 1rz1 s GLN 93 N -0.44 3.39 0.11 2.72 -1.52 -1.26 -5.05 119.66 117.61 1rz1 s GLN 93 Ca 0.30 -0.15 -0.01 0.00 -1.95 0.00 0.00 55.36 53.55 1rz1 s GLN 93 Cb -0.18 -3.98 -0.04 0.00 -0.22 0.00 0.00 33.01 28.58 1rz1 s GLN 93 CO 0.17 -1.25 0.29 -0.06 -0.25 0.00 0.00 175.29 174.19 1rz1 s PHE 94 N 3.52 3.50 0.00 0.91 0.40 -1.26 -2.01 117.98 123.04 1rz1 s PHE 94 Ca 0.30 0.33 0.00 0.00 -0.60 0.00 0.00 56.93 56.96 1rz1 s PHE 94 Cb -0.12 -1.83 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1rz1 s PHE 94 CO 0.22 0.51 0.00 -0.85 0.70 0.00 0.00 175.22 175.79 1rz1 n GLU 95 N -0.01 0.99 -4.40 0.44 0.28 0.29 -4.84 120.64 113.40 1rz1 n GLU 95 Ca -0.04 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.76 1rz1 n GLU 95 Cb 0.52 0.00 -0.14 0.00 1.43 0.00 0.00 31.44 33.25 1rz1 n GLU 95 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1rz1 s GLU 96 N -0.37 0.90 -0.25 3.44 2.12 -1.26 -0.50 118.70 122.78 1rz1 s GLU 96 Ca 0.00 -0.59 -0.10 0.00 0.36 0.00 0.00 54.97 54.63 1rz1 s GLU 96 Cb 0.00 -0.87 0.10 0.00 0.26 0.00 0.00 34.13 33.61 1rz1 s GLU 96 CO 0.00 0.22 0.56 -1.17 -0.54 0.00 0.00 175.26 174.33 1rz1 s LEU 97 N -0.76 -0.78 -1.35 2.70 2.96 0.04 -4.88 118.68 116.61 1rz1 s LEU 97 Ca 0.02 1.29 -0.08 0.00 -0.22 0.00 0.00 54.13 55.14 1rz1 s LEU 97 Cb -0.06 1.91 0.05 0.00 0.50 0.00 0.00 46.19 48.59 1rz1 s LEU 97 CO 0.00 -0.22 0.51 0.61 -1.32 0.00 0.00 176.35 175.93 1rz1 n GLY 98 N 4.95 -0.50 2.32 7.98 0.00 -1.26 -0.95 105.19 117.75 1rz1 n GLY 98 Ca -0.15 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1rz1 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rz1 n GLY 99 N -1.26 0.69 3.62 -0.02 0.00 -1.26 -4.95 105.19 102.02 1rz1 n GLY 99 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1rz1 n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rz1 s LEU 100 N 0.00 3.23 0.12 0.99 1.43 -0.12 -4.95 118.68 119.37 1rz1 s LEU 100 Ca 0.00 -0.22 -0.31 0.00 -1.03 0.00 0.00 54.13 52.57 1rz1 s LEU 100 Cb 0.00 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.20 1rz1 s LEU 100 CO 0.00 0.22 1.35 -2.16 0.23 0.00 0.00 176.35 175.99 1rz1 s PRO 101 N -1.92 4.35 0.18 1.29 0.04 -1.26 -0.78 135.00 136.89 1rz1 s PRO 101 Ca 0.21 2.02 0.06 0.00 0.04 0.00 0.00 61.00 63.33 1rz1 s PRO 101 Cb -0.11 -3.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.12 1rz1 s PRO 101 CO 0.13 -0.38 -0.12 0.14 0.04 0.00 0.00 177.00 176.80 1rz1 s VAL 102 N 0.98 1.48 -0.22 -0.36 -7.23 0.35 -4.68 120.40 110.71 1rz1 s VAL 102 Ca 0.63 -2.14 -0.19 0.00 -1.81 0.00 0.00 61.98 58.46 1rz1 s VAL 102 Cb -0.36 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.59 1rz1 s VAL 102 CO 0.31 -0.65 0.55 -0.63 -0.31 0.00 0.00 175.10 174.37 1rz1 s ILE 103 N -3.13 5.06 0.28 -0.62 1.01 -1.26 -0.54 121.20 122.00 1rz1 s ILE 103 Ca 0.20 1.01 -0.30 0.00 0.00 0.00 0.00 60.65 61.56 1rz1 s ILE 103 Cb 0.01 -3.87 -0.12 0.00 0.01 0.00 0.00 42.46 38.49 1rz1 s ILE 103 CO 0.04 0.12 1.59 1.17 0.00 0.00 0.00 174.94 177.86 1rz1 n LYS 104 N 5.12 2.65 -1.01 2.79 4.81 -0.85 -2.38 118.16 129.30 1rz1 n LYS 104 Ca -0.03 0.94 -0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1rz1 n LYS 104 Cb 0.50 -2.72 -0.00 0.00 0.02 0.00 0.00 35.03 32.83 1rz1 n LYS 104 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1rz1 n ASP 105 N 2.28 -4.18 -4.64 3.14 8.00 -1.26 -4.98 116.55 114.92 1rz1 n ASP 105 Ca 0.09 0.01 -0.36 0.00 0.71 0.00 0.00 54.79 55.24 1rz1 n ASP 105 Cb 0.36 -1.70 0.08 0.00 -0.02 0.00 0.00 41.12 39.85 1rz1 n ASP 105 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rz1 n ALA 106 N 1.00 0.03 -0.35 2.24 0.00 -1.00 -4.73 120.51 117.69 1rz1 n ALA 106 Ca -0.00 -0.15 0.02 0.00 0.00 0.00 0.00 53.44 53.31 1rz1 n ALA 106 Cb 0.20 -2.16 0.17 0.00 0.00 0.00 0.00 19.45 17.66 1rz1 n ALA 106 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rz1 h LEU 107 N -0.12 0.98 -7.22 0.00 5.85 -0.69 -3.44 115.31 110.68 1rz1 h LEU 107 Ca -0.48 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.18 1rz1 h LEU 107 Cb 1.34 -0.20 -0.18 0.00 0.37 0.00 0.00 40.66 41.99 1rz1 h LEU 107 CO 0.48 0.62 0.01 0.00 -0.34 0.00 0.00 178.44 179.21 1rz1 s ALA 108 N -6.04 -1.31 -0.05 1.25 0.00 -1.14 -0.95 121.76 113.52 1rz1 s ALA 108 Ca -0.12 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.55 1rz1 s ALA 108 Cb 0.20 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.57 1rz1 s ALA 108 CO 0.81 -0.42 -0.06 -0.65 0.00 0.00 0.00 175.76 175.43 1rz1 s GLN 109 N -1.94 1.07 -0.12 0.00 -0.21 0.78 -0.99 119.66 118.25 1rz1 s GLN 109 Ca -0.08 -0.18 -0.02 0.00 0.02 0.00 0.00 55.36 55.10 1rz1 s GLN 109 Cb -0.01 -1.02 0.04 0.00 1.00 0.00 0.00 33.01 33.02 1rz1 s GLN 109 CO 0.02 -0.07 0.01 0.42 -2.12 0.00 0.00 175.29 173.56 1rz1 s ILE 110 N 0.93 0.43 -0.12 1.08 1.01 -0.55 -0.82 121.20 123.15 1rz1 s ILE 110 Ca -0.11 -0.13 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 1rz1 s ILE 110 Cb -0.15 -0.72 -0.05 0.00 0.01 0.00 0.00 42.46 41.56 1rz1 s ILE 110 CO 0.00 0.09 0.22 -0.44 0.00 0.00 0.00 174.94 174.81 1rz1 s SER 111 N 1.93 6.44 0.06 3.58 0.01 -0.13 -0.31 113.70 125.29 1rz1 s SER 111 Ca 0.03 0.52 0.03 0.00 1.31 0.00 0.00 55.95 57.85 1rz1 s SER 111 Cb -0.14 -2.13 -0.03 0.00 0.21 0.00 0.00 66.02 63.94 1rz1 s SER 111 CO -0.06 0.30 -0.10 0.00 0.41 0.00 0.00 173.24 173.78 1rz1 s GLN 113 N -1.80 3.72 0.10 0.00 -1.52 -0.33 -1.99 119.66 117.85 1rz1 s GLN 113 Ca -0.05 -0.49 -0.31 0.00 -1.95 0.00 0.00 55.36 52.56 1rz1 s GLN 113 Cb -0.09 -2.99 -0.09 0.00 -0.22 0.00 0.00 33.01 29.62 1rz1 s GLN 113 CO 0.01 0.22 1.58 0.08 -0.25 0.00 0.00 175.29 176.93 1rz1 s VAL 114 N 0.43 2.97 -0.12 1.09 1.01 0.06 -0.49 120.40 125.34 1rz1 s VAL 114 Ca -0.02 0.56 0.04 0.00 0.00 0.00 0.00 61.98 62.56 1rz1 s VAL 114 Cb -0.14 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 1rz1 s VAL 114 CO 0.02 0.02 0.14 1.33 0.00 0.00 0.00 175.10 176.61 1rz1 n VAL 115 N 4.38 0.00 -3.55 2.92 0.24 -0.09 -4.90 118.33 117.32 1rz1 n VAL 115 Ca 0.14 -0.32 -0.15 0.00 -2.04 0.00 0.00 64.34 61.98 1rz1 n VAL 115 Cb 0.40 0.83 -0.06 0.00 -1.47 0.00 0.00 33.84 33.54 1rz1 n VAL 115 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1rz1 s ASN 116 N -1.67 -0.52 -0.12 -1.34 3.04 -1.15 -5.02 114.94 108.15 1rz1 s ASN 116 Ca 0.01 0.38 -0.04 0.00 0.04 0.00 0.00 52.86 53.24 1rz1 s ASN 116 Cb 0.03 0.50 0.05 0.00 -1.54 0.00 0.00 41.25 40.30 1rz1 s ASN 116 CO 0.15 -0.67 0.12 -0.70 -3.04 0.00 0.00 177.10 172.96 1rz1 s GLU 117 N -1.94 0.04 -0.18 0.43 2.12 -1.26 -1.53 118.70 116.38 1rz1 s GLU 117 Ca -0.08 0.23 0.01 0.00 0.36 0.00 0.00 54.97 55.48 1rz1 s GLU 117 Cb -0.01 -1.04 0.03 0.00 0.26 0.00 0.00 34.13 33.37 1rz1 s GLU 117 CO 0.03 -0.50 -0.13 0.08 -0.54 0.00 0.00 175.26 174.20 1rz1 s VAL 118 N 2.21 1.67 0.27 3.70 1.01 -0.54 -4.96 120.40 123.76 1rz1 s VAL 118 Ca 0.04 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 60.87 1rz1 s VAL 118 Cb -0.14 -1.64 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 1rz1 s VAL 118 CO -0.07 0.33 1.17 -1.58 0.00 0.00 0.00 175.10 174.95 1rz1 s GLN 119 N 1.42 4.54 -0.28 2.72 0.74 -1.26 -0.71 119.66 126.82 1rz1 s GLN 119 Ca 0.02 1.92 -0.01 0.00 0.05 0.00 0.00 55.36 57.33 1rz1 s GLN 119 Cb -0.14 -3.17 0.12 0.00 1.10 0.00 0.00 33.01 30.92 1rz1 s GLN 119 CO -0.10 0.06 0.25 0.00 -0.55 0.00 0.00 175.29 174.95 1rz1 s ALA 120 N -0.93 -0.22 0.00 1.58 0.00 0.30 -4.93 121.76 117.57 1rz1 s ALA 120 Ca 0.47 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.99 1rz1 s ALA 120 Cb -0.34 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.10 1rz1 s ALA 120 CO 0.43 -1.66 0.00 0.41 0.00 0.00 0.00 175.76 174.94 1rz1 n GLY 121 N 5.30 2.86 0.02 0.00 0.00 -1.26 -1.63 105.19 110.48 1rz1 n GLY 121 Ca -0.03 0.12 0.01 0.00 0.00 0.00 0.00 46.02 46.12 1rz1 n GLY 121 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rz1 n ASP 122 N 3.18 0.07 -4.12 1.61 10.43 -1.26 -4.83 116.55 121.63 1rz1 n ASP 122 Ca 0.00 0.46 -0.08 0.00 2.57 0.00 0.00 54.79 57.74 1rz1 n ASP 122 Cb 0.00 -0.47 -0.10 0.00 1.84 0.00 0.00 41.12 42.39 1rz1 n ASP 122 CO 0.00 0.00 0.00 -1.00 -1.07 0.00 0.00 177.20 175.13 1rz1 s HIS 123 N -2.94 0.68 -0.07 1.24 3.76 -0.65 -1.00 115.29 116.30 1rz1 s HIS 123 Ca -0.00 -1.14 0.05 0.00 -0.15 0.00 0.00 55.06 53.82 1rz1 s HIS 123 Cb 0.01 -0.43 -0.00 0.00 1.11 0.00 0.00 32.58 33.26 1rz1 s HIS 123 CO 0.02 -0.44 -0.23 0.99 -0.85 0.00 0.00 174.74 174.23 1rz1 s THR 124 N -3.97 1.96 -0.31 1.30 2.01 0.79 -0.54 115.64 116.89 1rz1 s THR 124 Ca 0.14 -0.99 -0.17 0.00 0.31 0.00 0.00 61.69 60.98 1rz1 s THR 124 Cb 0.08 -1.68 -0.02 0.00 0.01 0.00 0.00 72.50 70.89 1rz1 s THR 124 CO -0.05 0.54 0.46 -0.76 -0.69 0.00 0.00 174.62 174.12 1rz1 s LEU 125 N 0.10 4.22 -0.39 4.42 1.43 0.11 -1.38 118.68 127.19 1rz1 s LEU 125 Ca -0.11 0.14 -0.14 0.00 -1.03 0.00 0.00 54.13 53.00 1rz1 s LEU 125 Cb -0.15 -2.53 0.02 0.00 0.03 0.00 0.00 46.19 43.55 1rz1 s LEU 125 CO 0.06 -0.35 0.27 -0.36 0.23 0.00 0.00 176.35 176.20 1rz1 s PHE 126 N 2.25 3.24 -0.09 0.29 0.08 -0.29 -1.47 117.98 121.99 1rz1 s PHE 126 Ca 0.17 -0.62 -0.22 0.00 0.12 0.00 0.00 56.93 56.38 1rz1 s PHE 126 Cb -0.16 -2.54 -0.04 0.00 -0.57 0.00 0.00 43.02 39.72 1rz1 s PHE 126 CO 0.11 -0.57 0.63 0.42 -0.10 0.00 0.00 175.22 175.71 1rz1 s ILE 127 N 1.66 5.09 -0.02 0.64 1.01 -0.58 -1.99 121.20 127.00 1rz1 s ILE 127 Ca 0.04 1.28 0.05 0.00 0.00 0.00 0.00 60.65 62.02 1rz1 s ILE 127 Cb -0.19 -3.97 -0.01 0.00 0.01 0.00 0.00 42.46 38.31 1rz1 s ILE 127 CO 0.09 0.26 -0.17 -0.83 0.00 0.00 0.00 174.94 174.29 1rz1 s GLY 128 N 0.78 0.86 -0.14 6.18 0.00 0.78 -0.92 107.32 114.87 1rz1 s GLY 128 Ca 0.33 -0.72 -0.19 0.00 0.00 0.00 0.00 44.72 44.14 1rz1 s GLY 128 CO 0.15 -0.53 0.53 1.85 0.00 0.00 0.00 173.10 175.09 1rz1 s GLU 129 N -0.27 4.31 -0.06 2.90 2.12 0.36 -0.78 118.70 127.28 1rz1 s GLU 129 Ca 0.04 0.51 -0.30 0.00 0.36 0.00 0.00 54.97 55.58 1rz1 s GLU 129 Cb -0.08 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 1rz1 s GLU 129 CO 0.00 0.04 1.04 0.08 -0.54 0.00 0.00 175.26 175.88 1rz1 s VAL 130 N 1.00 4.67 -0.16 3.70 1.01 -0.56 -1.18 120.40 128.88 1rz1 s VAL 130 Ca 0.27 1.94 0.12 0.00 0.00 0.00 0.00 61.98 64.31 1rz1 s VAL 130 Cb -0.16 -4.24 -0.18 0.00 0.00 0.00 0.00 36.38 31.80 1rz1 s VAL 130 CO 0.11 0.05 0.02 0.35 0.00 0.00 0.00 175.10 175.62 1rz1 n THR 131 N 4.38 1.08 -3.78 3.92 -2.24 0.41 -4.90 114.28 113.14 1rz1 n THR 131 Ca 0.08 -0.62 -0.13 0.00 -2.27 0.00 0.00 64.05 61.11 1rz1 n THR 131 Cb 0.49 -0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 67.94 1rz1 n THR 131 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1rz1 s ASP 132 N -5.06 -0.18 0.01 3.42 1.01 -1.21 -5.01 116.67 109.63 1rz1 s ASP 132 Ca -0.11 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.32 1rz1 s ASP 132 Cb 0.05 0.36 -0.01 0.00 1.01 0.00 0.00 42.92 44.34 1rz1 s ASP 132 CO 0.61 -0.36 -0.03 -0.63 0.21 0.00 0.00 175.17 174.97 1rz1 s ILE 133 N -0.99 0.22 -0.06 0.77 1.01 -1.26 -0.95 121.20 119.94 1rz1 s ILE 133 Ca -0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1rz1 s ILE 133 Cb -0.05 -0.24 0.04 0.00 0.01 0.00 0.00 42.46 42.21 1rz1 s ILE 133 CO 0.03 -0.11 0.12 -0.75 0.00 0.00 0.00 174.94 174.23 1rz1 s LYS 134 N -0.52 0.06 0.09 2.79 2.20 -0.00 -4.99 119.74 119.36 1rz1 s LYS 134 Ca -0.04 0.34 0.08 0.00 -0.36 0.00 0.00 55.97 55.99 1rz1 s LYS 134 Cb -0.04 -0.20 -0.03 0.00 -1.51 0.00 0.00 37.83 36.05 1rz1 s LYS 134 CO -0.00 -0.17 -0.21 0.42 -0.36 0.00 0.00 175.35 175.03 1rz1 s ILE 135 N 1.20 1.71 0.42 5.43 1.01 -1.26 -0.15 121.20 129.56 1rz1 s ILE 135 Ca -0.09 -1.45 0.03 0.00 0.00 0.00 0.00 60.65 59.14 1rz1 s ILE 135 Cb -0.12 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.78 1rz1 s ILE 135 CO -0.05 0.02 0.09 0.42 0.00 0.00 0.00 174.94 175.41 1rz1 s THR 136 N -1.06 0.85 -0.31 2.92 -4.23 -0.13 -4.99 115.64 108.70 1rz1 s THR 136 Ca 0.07 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.68 1rz1 s THR 136 Cb -0.10 -2.40 0.62 0.00 1.34 0.00 0.00 72.50 71.97 1rz1 s THR 136 CO 0.04 0.00 1.65 -0.62 -0.54 0.00 0.00 174.62 175.14 1rz1 n GLU 137 N -0.96 2.73 -1.21 3.99 -0.58 -1.26 -4.88 120.64 118.47 1rz1 n GLU 137 Ca -0.08 -3.06 -0.30 0.00 -0.42 0.00 0.00 57.16 53.30 1rz1 n GLU 137 Cb 0.66 -2.01 0.12 0.00 -0.57 0.00 0.00 31.44 29.64 1rz1 n GLU 137 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1rz1 s GLN 138 N -3.10 1.57 0.28 3.49 -0.21 -1.26 -5.04 119.66 115.39 1rz1 s GLN 138 Ca 0.50 0.94 -0.17 0.00 0.02 0.00 0.00 55.36 56.65 1rz1 s GLN 138 Cb 0.42 -1.83 -0.09 0.00 1.00 0.00 0.00 33.01 32.51 1rz1 s GLN 138 CO 0.08 -2.06 0.74 -0.51 -2.12 0.00 0.00 175.29 171.42 1rz1 s ASP 139 N -3.40 6.91 0.24 5.90 1.01 -1.26 -5.00 116.67 121.08 1rz1 s ASP 139 Ca 0.63 1.36 -0.17 0.00 0.71 0.00 0.00 52.55 55.07 1rz1 s ASP 139 Cb -0.18 -2.40 -0.08 0.00 1.01 0.00 0.00 42.92 41.27 1rz1 s ASP 139 CO 0.57 -0.10 0.70 -2.16 0.21 0.00 0.00 175.17 174.38 1rz1 s PRO 140 N -2.53 4.12 0.11 8.23 0.04 -1.26 -0.64 135.00 143.06 1rz1 s PRO 140 Ca 0.49 0.73 -0.31 0.00 0.04 0.00 0.00 61.00 61.96 1rz1 s PRO 140 Cb -0.13 -2.75 -0.07 0.00 0.04 0.00 0.00 34.50 31.59 1rz1 s PRO 140 CO 0.19 0.33 1.34 -1.17 0.04 0.00 0.00 177.00 177.73 1rz1 s LEU 141 N -2.30 4.37 0.19 -3.56 2.96 -0.83 -4.09 118.68 115.43 1rz1 s LEU 141 Ca 0.46 2.26 0.10 0.00 -0.22 0.00 0.00 54.13 56.72 1rz1 s LEU 141 Cb -0.14 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1rz1 s LEU 141 CO 0.20 -0.60 -0.13 -0.76 -1.32 0.00 0.00 176.35 173.73 1rz1 s LEU 142 N 1.02 2.82 -0.07 -0.68 1.43 -0.70 -3.22 118.68 119.29 1rz1 s LEU 142 Ca 0.63 -0.68 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1rz1 s LEU 142 Cb -0.35 -1.51 0.02 0.00 0.03 0.00 0.00 46.19 44.39 1rz1 s LEU 142 CO 0.30 0.10 -0.04 0.12 0.23 0.00 0.00 176.35 177.07 1rz1 s PHE 143 N -1.77 0.88 -0.20 0.29 5.36 0.18 -1.09 117.98 121.62 1rz1 s PHE 143 Ca 0.24 -0.30 -0.14 0.00 -0.96 0.00 0.00 56.93 55.78 1rz1 s PHE 143 Cb -0.08 -0.84 0.06 0.00 -0.34 0.00 0.00 43.02 41.82 1rz1 s PHE 143 CO 0.14 -0.31 0.51 0.12 -1.46 0.00 0.00 175.22 174.23 1rz1 s PHE 144 N 1.47 -0.70 -1.49 10.12 5.36 -0.20 -2.13 117.98 130.41 1rz1 s PHE 144 Ca -0.02 1.53 -0.13 0.00 -0.96 0.00 0.00 56.93 57.35 1rz1 s PHE 144 Cb -0.13 0.33 0.09 0.00 -0.34 0.00 0.00 43.02 42.97 1rz1 s PHE 144 CO -0.03 -0.37 0.76 0.43 -1.46 0.00 0.00 175.22 174.55 1rz1 n SER 145 N 3.80 -4.28 0.00 6.13 7.64 0.47 -1.62 113.62 125.76 1rz1 n SER 145 Ca -0.19 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.03 1rz1 n SER 145 Cb 0.56 -3.47 0.00 0.00 -1.01 0.00 0.00 64.21 60.30 1rz1 n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rz1 n GLY 146 N -1.45 0.50 3.24 0.23 0.00 -1.26 -5.01 105.19 101.44 1rz1 n GLY 146 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 1rz1 n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rz1 s LYS 147 N -0.15 1.02 0.27 1.61 1.02 -0.64 -5.14 119.74 117.73 1rz1 s LYS 147 Ca 0.00 -1.29 -0.29 0.00 0.02 0.00 0.00 55.97 54.41 1rz1 s LYS 147 Cb 0.00 -0.80 -0.09 0.00 -0.52 0.00 0.00 37.83 36.41 1rz1 s LYS 147 CO 0.00 0.14 0.96 0.71 -0.92 0.00 0.00 175.35 176.24 1rz1 s TYR 148 N -2.48 3.85 0.25 3.18 2.02 -1.26 -1.04 117.35 121.87 1rz1 s TYR 148 Ca 0.11 1.86 -0.02 0.00 -0.37 0.00 0.00 57.07 58.64 1rz1 s TYR 148 Cb -0.03 -3.00 -0.03 0.00 -0.40 0.00 0.00 41.96 38.51 1rz1 s TYR 148 CO 0.02 0.27 0.26 -1.01 -1.57 0.00 0.00 175.55 173.53 1rz1 s HIS 149 N -1.31 1.09 0.12 2.71 3.76 -0.25 -4.93 115.29 116.48 1rz1 s HIS 149 Ca 0.44 -1.29 0.05 0.00 -0.15 0.00 0.00 55.06 54.11 1rz1 s HIS 149 Cb -0.24 -0.38 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 1rz1 s HIS 149 CO 0.31 -0.81 -0.12 -0.65 -0.85 0.00 0.00 174.74 172.62 1rz1 s GLN 150 N -3.88 0.96 0.30 1.40 -0.21 -1.26 -1.72 119.66 115.24 1rz1 s GLN 150 Ca 0.35 -1.25 -0.29 0.00 0.02 0.00 0.00 55.36 54.18 1rz1 s GLN 150 Cb 0.04 -0.70 -0.10 0.00 1.00 0.00 0.00 33.01 33.25 1rz1 s GLN 150 CO 0.15 0.12 1.34 -0.51 -2.12 0.00 0.00 175.29 174.26 1rz1 s LEU 151 N -2.61 4.42 0.21 2.90 1.43 -1.26 -4.99 118.68 118.77 1rz1 s LEU 151 Ca 0.09 2.65 -0.32 0.00 -1.03 0.00 0.00 54.13 55.52 1rz1 s LEU 151 Cb -0.02 -3.64 -0.12 0.00 0.03 0.00 0.00 46.19 42.44 1rz1 s LEU 151 CO 0.01 -0.57 1.73 0.00 0.23 0.00 0.00 176.35 177.75 1rz1 s ALA 152 N -0.71 3.94 -2.96 4.21 0.00 -1.26 -5.12 121.76 119.87 1rz1 s ALA 152 Ca 0.52 1.59 0.24 0.00 0.00 0.00 0.00 51.96 54.31 1rz1 s ALA 152 Cb -0.40 -3.70 0.19 0.00 0.00 0.00 0.00 23.12 19.21 1rz1 s ALA 152 CO 0.49 -0.93 1.25 1.04 0.00 0.00 0.00 175.76 177.61