#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9v s ALA 3 N 0.00 -1.43 0.15 2.33 0.00 -1.26 -5.05 121.76 116.50 1s9v s ALA 3 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 51.96 52.14 1s9v s ALA 3 Cb 0.00 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 1s9v s ALA 3 CO 0.00 -0.80 1.47 -0.44 0.00 0.00 0.00 175.76 175.99 1s9v h ASP 4 N 2.05 0.95 -3.94 0.00 3.45 -2.09 -3.44 116.42 113.40 1s9v h ASP 4 Ca -0.32 -0.46 -0.27 0.00 0.43 0.00 0.00 57.03 56.42 1s9v h ASP 4 Cb 1.29 -0.27 -0.27 0.00 -0.56 0.00 0.00 39.33 39.52 1s9v h ASP 4 CO 0.37 1.24 -0.73 -1.00 -1.57 0.00 0.00 179.24 177.55 1s9v s HIS 5 N -4.30 0.26 -0.05 4.55 3.76 -1.26 -5.07 115.29 113.18 1s9v s HIS 5 Ca -0.10 -0.10 0.03 0.00 -0.15 0.00 0.00 55.06 54.74 1s9v s HIS 5 Cb 0.11 -0.17 0.01 0.00 1.11 0.00 0.00 32.58 33.64 1s9v s HIS 5 CO 0.88 -0.02 -0.13 0.08 -0.85 0.00 0.00 174.74 174.70 1s9v s VAL 6 N -0.21 1.10 0.04 -0.90 1.01 -1.26 -5.01 120.40 115.16 1s9v s VAL 6 Ca -0.01 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1s9v s VAL 6 Cb -0.02 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1s9v s VAL 6 CO -0.00 0.34 -0.08 0.00 0.00 0.00 0.00 175.10 175.36 1s9v s ALA 7 N 0.34 0.57 -0.36 5.51 0.00 -1.26 -0.25 121.76 126.31 1s9v s ALA 7 Ca -0.08 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.20 1s9v s ALA 7 Cb -0.12 0.02 0.10 0.00 0.00 0.00 0.00 23.12 23.12 1s9v s ALA 7 CO 0.02 0.00 0.09 -1.12 0.00 0.00 0.00 175.76 174.75 1s9v s SER 8 N -1.41 4.80 -1.25 0.00 0.01 -0.13 -4.96 113.70 110.76 1s9v s SER 8 Ca -0.08 -2.21 -0.06 0.00 1.31 0.00 0.00 55.95 54.91 1s9v s SER 8 Cb -0.09 -1.66 0.18 0.00 0.21 0.00 0.00 66.02 64.66 1s9v s SER 8 CO 0.00 -0.39 2.03 -1.22 0.41 0.00 0.00 173.24 174.07 1s9v n TYR 9 N 4.21 2.69 0.00 2.43 4.01 -1.26 -1.13 117.16 128.11 1s9v n TYR 9 Ca 0.03 -2.75 0.00 0.00 -0.16 0.00 0.00 57.90 55.02 1s9v n TYR 9 Cb 0.41 -1.75 0.00 0.00 -0.31 0.00 0.00 39.34 37.69 1s9v n TYR 9 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1s9v n GLY 9 N 1.95 1.38 3.38 2.72 0.00 -1.25 -5.06 105.19 108.31 1s9v n GLY 9 Ca 0.48 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1s9v n GLY 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s9v s VAL 10 N 0.00 4.60 -0.13 1.61 1.01 -0.60 -5.00 120.40 121.89 1s9v s VAL 10 Ca 0.00 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 1s9v s VAL 10 Cb 0.00 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 1s9v s VAL 10 CO 0.00 -0.21 -0.05 0.20 0.00 0.00 0.00 175.10 175.03 1s9v s ASN 11 N 1.56 4.70 -0.03 3.32 0.01 -1.26 -2.43 114.94 120.81 1s9v s ASN 11 Ca 0.02 -0.12 0.01 0.00 -0.71 0.00 0.00 52.86 52.06 1s9v s ASN 11 Cb -0.19 -1.64 0.02 0.00 0.41 0.00 0.00 41.25 39.85 1s9v s ASN 11 CO 0.07 0.21 -0.03 -0.22 -1.51 0.00 0.00 177.10 175.62 1s9v s LEU 12 N 0.09 1.51 -0.08 0.60 2.96 -0.23 -5.00 118.68 118.53 1s9v s LEU 12 Ca -0.01 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.77 1s9v s LEU 12 Cb -0.14 -0.31 0.04 0.00 0.50 0.00 0.00 46.19 46.28 1s9v s LEU 12 CO 0.03 -0.03 0.18 -0.47 -1.32 0.00 0.00 176.35 174.74 1s9v s TYR 13 N 0.60 -0.22 0.05 5.38 5.04 -1.26 -0.72 117.35 126.21 1s9v s TYR 13 Ca -0.07 0.58 0.03 0.00 -2.44 0.00 0.00 57.07 55.17 1s9v s TYR 13 Cb -0.10 -0.01 -0.03 0.00 0.35 0.00 0.00 41.96 42.17 1s9v s TYR 13 CO -0.00 -0.18 -0.09 1.14 -1.34 0.00 0.00 175.55 175.08 1s9v s GLN 14 N 1.01 0.60 0.28 4.97 -2.07 -0.41 -5.01 119.66 119.02 1s9v s GLN 14 Ca -0.08 -0.81 0.01 0.00 -1.82 0.00 0.00 55.36 52.67 1s9v s GLN 14 Cb -0.09 -0.42 0.41 0.00 -1.09 0.00 0.00 33.01 31.81 1s9v s GLN 14 CO -0.06 0.08 1.76 0.66 -1.32 0.00 0.00 175.29 176.42 1s9v h SER 15 N 4.44 0.61 -2.66 12.60 4.64 -1.97 -2.82 113.55 128.40 1s9v h SER 15 Ca -0.37 -0.16 -0.54 0.00 -0.47 0.00 0.00 61.79 60.25 1s9v h SER 15 Cb 1.20 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1s9v h SER 15 CO 0.41 0.75 1.03 -0.47 -0.87 0.00 0.00 176.83 177.67 1s9v s TYR 16 N -4.79 2.25 0.00 4.77 5.04 -1.26 -3.56 117.35 119.80 1s9v s TYR 16 Ca -0.08 0.26 0.00 0.00 -2.44 0.00 0.00 57.07 54.81 1s9v s TYR 16 Cb 0.14 -3.95 0.00 0.00 0.35 0.00 0.00 41.96 38.50 1s9v s TYR 16 CO 0.80 -3.90 0.00 0.41 -1.34 0.00 0.00 175.55 171.52 1s9v n GLY 17 N 4.05 2.38 3.85 8.97 0.00 -1.26 -2.41 105.19 120.76 1s9v n GLY 17 Ca 0.16 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 1s9v n GLY 17 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1s9v s PRO 18 N 0.00 3.81 0.12 1.61 0.04 -1.23 -5.20 135.00 134.14 1s9v s PRO 18 Ca 0.00 0.85 0.01 0.00 0.04 0.00 0.00 61.00 61.89 1s9v s PRO 18 Cb 0.00 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 1s9v s PRO 18 CO 0.00 -0.37 -0.02 -1.54 0.04 0.00 0.00 177.00 175.11 1s9v s SER 19 N -3.50 0.87 0.27 6.66 1.04 -1.01 -5.02 113.70 113.01 1s9v s SER 19 Ca 0.57 -1.09 -0.05 0.00 0.48 0.00 0.00 55.95 55.86 1s9v s SER 19 Cb -0.10 0.16 -0.01 0.00 0.10 0.00 0.00 66.02 66.16 1s9v s SER 19 CO 0.40 -0.57 0.36 -0.83 0.98 0.00 0.00 173.24 173.58 1s9v s GLY 20 N -3.06 1.21 -0.17 7.32 0.00 -1.26 -1.28 107.32 110.08 1s9v s GLY 20 Ca 0.17 -1.40 -0.22 0.00 0.00 0.00 0.00 44.72 43.27 1s9v s GLY 20 CO -0.02 -1.02 0.58 1.62 0.00 0.00 0.00 173.10 174.26 1s9v s GLN 21 N -3.73 0.75 -0.05 2.90 0.74 0.10 -4.97 119.66 115.40 1s9v s GLN 21 Ca 0.31 0.63 -0.02 0.00 0.05 0.00 0.00 55.36 56.34 1s9v s GLN 21 Cb 0.02 0.36 0.03 0.00 1.10 0.00 0.00 33.01 34.52 1s9v s GLN 21 CO 0.15 -0.13 0.04 -0.47 -0.55 0.00 0.00 175.29 174.32 1s9v s TYR 22 N -0.09 0.27 0.22 1.67 5.04 -1.26 -1.07 117.35 122.13 1s9v s TYR 22 Ca -0.03 0.10 -0.05 0.00 -2.44 0.00 0.00 57.07 54.65 1s9v s TYR 22 Cb -0.04 -0.57 -0.03 0.00 0.35 0.00 0.00 41.96 41.67 1s9v s TYR 22 CO 0.03 -0.23 0.26 0.95 -1.34 0.00 0.00 175.55 175.22 1s9v s THR 23 N 2.01 0.00 -0.04 4.34 -4.23 -1.02 -1.49 115.64 115.21 1s9v s THR 23 Ca 0.04 -1.79 0.04 0.00 -1.18 0.00 0.00 61.69 58.80 1s9v s THR 23 Cb -0.12 -2.40 -0.00 0.00 1.34 0.00 0.00 72.50 71.31 1s9v s THR 23 CO -0.04 0.00 -0.17 -1.00 -0.54 0.00 0.00 174.62 172.87 1s9v s HIS 24 N -4.07 1.67 0.14 3.99 3.76 -0.70 -1.55 115.29 118.53 1s9v s HIS 24 Ca 0.33 -0.45 0.10 0.00 -0.15 0.00 0.00 55.06 54.89 1s9v s HIS 24 Cb 0.04 -1.12 -0.04 0.00 1.11 0.00 0.00 32.58 32.58 1s9v s HIS 24 CO 0.12 -0.14 -0.23 -1.21 -0.85 0.00 0.00 174.74 172.43 1s9v s GLU 25 N -0.04 1.30 -0.10 1.40 2.02 -0.28 -0.15 118.70 122.84 1s9v s GLU 25 Ca -0.02 -1.32 -0.04 0.00 0.02 0.00 0.00 54.97 53.62 1s9v s GLU 25 Cb -0.11 -1.61 0.05 0.00 0.10 0.00 0.00 34.13 32.57 1s9v s GLU 25 CO 0.02 0.37 0.20 0.12 0.02 0.00 0.00 175.26 175.98 1s9v s PHE 26 N -1.35 -0.27 -1.56 1.61 5.36 -0.42 -0.95 117.98 120.40 1s9v s PHE 26 Ca 0.12 0.74 -0.14 0.00 -0.96 0.00 0.00 56.93 56.70 1s9v s PHE 26 Cb -0.09 -0.16 0.10 0.00 -0.34 0.00 0.00 43.02 42.53 1s9v s PHE 26 CO 0.06 -0.29 0.95 -0.25 -1.46 0.00 0.00 175.22 174.23 1s9v n ASP 27 N 5.24 -4.51 0.00 6.13 8.00 0.65 -1.68 116.55 130.37 1s9v n ASP 27 Ca -0.07 -0.82 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1s9v n ASP 27 Cb 0.50 -3.72 0.00 0.00 -0.02 0.00 0.00 41.12 37.88 1s9v n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s9v n GLY 28 N -1.65 0.92 3.49 0.44 0.00 -1.26 -5.03 105.19 102.09 1s9v n GLY 28 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1s9v n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1s9v s ASP 29 N -2.97 4.02 -0.22 1.61 1.01 -0.68 -5.01 116.67 114.43 1s9v s ASP 29 Ca 0.00 -0.32 -0.29 0.00 0.71 0.00 0.00 52.55 52.65 1s9v s ASP 29 Cb 0.00 -0.76 -0.01 0.00 1.01 0.00 0.00 42.92 43.16 1s9v s ASP 29 CO 0.00 0.28 1.27 -0.70 0.21 0.00 0.00 175.17 176.23 1s9v s GLU 30 N -1.28 4.10 0.01 8.23 2.12 -1.26 -1.30 118.70 129.32 1s9v s GLU 30 Ca 0.15 1.49 -0.14 0.00 0.36 0.00 0.00 54.97 56.82 1s9v s GLU 30 Cb -0.11 -3.81 -0.34 0.00 0.26 0.00 0.00 34.13 30.13 1s9v s GLU 30 CO 0.05 -0.88 0.92 1.96 -0.54 0.00 0.00 175.26 176.77 1s9v h GLN 31 N 8.65 0.49 -1.71 4.30 4.20 -0.90 -3.42 115.11 126.71 1s9v h GLN 31 Ca -0.26 -0.84 0.23 0.00 0.06 0.00 0.00 58.65 57.84 1s9v h GLN 31 Cb 1.10 0.31 -0.16 0.00 0.30 0.00 0.00 27.48 29.03 1s9v h GLN 31 CO 1.00 1.40 0.72 -0.59 -0.67 0.00 0.00 178.83 180.69 1s9v s PHE 32 N -2.60 -0.16 0.09 2.96 -0.12 -1.24 -1.12 117.98 115.80 1s9v s PHE 32 Ca -0.10 0.06 0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1s9v s PHE 32 Cb 0.05 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1s9v s PHE 32 CO 0.92 -0.34 -0.06 1.52 -0.05 0.00 0.00 175.22 177.21 1s9v s TYR 33 N -2.63 0.82 -0.19 3.49 -0.85 -0.80 -1.71 117.35 115.47 1s9v s TYR 33 Ca 0.10 -0.94 -0.03 0.00 -0.52 0.00 0.00 57.07 55.67 1s9v s TYR 33 Cb 0.00 -0.49 -0.01 0.00 0.38 0.00 0.00 41.96 41.83 1s9v s TYR 33 CO -0.05 -0.19 -0.05 0.08 -1.52 0.00 0.00 175.55 173.82 1s9v s VAL 34 N -3.68 3.46 -0.45 -3.49 1.01 -0.56 -0.62 120.40 116.08 1s9v s VAL 34 Ca 0.11 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.32 1s9v s VAL 34 Cb 0.06 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.90 1s9v s VAL 34 CO -0.06 0.45 1.40 -0.62 0.00 0.00 0.00 175.10 176.27 1s9v s ASP 35 N 1.09 6.30 0.25 3.32 -1.08 0.12 -4.51 116.67 122.16 1s9v s ASP 35 Ca 0.01 0.69 -0.03 0.00 -0.52 0.00 0.00 52.55 52.70 1s9v s ASP 35 Cb -0.15 -2.54 0.30 0.00 -1.46 0.00 0.00 42.92 39.08 1s9v s ASP 35 CO -0.00 -1.49 1.75 -0.07 0.52 0.00 0.00 175.17 175.88 1s9v h LEU 36 N 12.35 0.80 -0.43 -1.34 3.38 -1.94 0.57 115.31 128.70 1s9v h LEU 36 Ca -0.27 -0.19 -0.18 0.00 0.09 0.00 0.00 57.88 57.33 1s9v h LEU 36 Cb 1.10 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1s9v h LEU 36 CO 1.11 0.86 -0.66 1.23 0.09 0.00 0.00 178.44 181.07 1s9v h GLY 37 N 0.98 0.55 -0.84 0.83 0.00 -1.98 -3.19 103.07 99.43 1s9v h GLY 37 Ca 0.15 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1s9v h GLY 37 CO 0.02 0.64 -0.36 0.54 0.00 0.00 0.00 176.54 177.38 1s9v n ARG 38 N -3.90 1.29 -3.76 4.80 1.74 -1.16 -4.98 116.66 110.68 1s9v n ARG 38 Ca -0.04 -1.01 -0.23 0.00 -0.77 0.00 0.00 57.85 55.81 1s9v n ARG 38 Cb 0.67 -1.48 0.02 0.00 -1.02 0.00 0.00 32.46 30.65 1s9v n ARG 38 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1s9v n LYS 39 N 0.02 -4.24 -4.15 5.56 4.81 0.19 -4.99 118.16 115.37 1s9v n LYS 39 Ca 0.11 0.56 -0.15 0.00 -0.87 0.00 0.00 58.31 57.95 1s9v n LYS 39 Cb 0.46 -4.96 -0.13 0.00 0.02 0.00 0.00 35.03 30.42 1s9v n LYS 39 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1s9v s GLU 40 N -6.11 0.49 -0.10 1.64 -1.05 -0.92 -4.80 118.70 107.86 1s9v s GLU 40 Ca 0.03 -0.40 -0.24 0.00 -0.15 0.00 0.00 54.97 54.21 1s9v s GLU 40 Cb -0.01 -0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 33.24 1s9v s GLU 40 CO 0.83 0.10 0.75 0.99 0.95 0.00 0.00 175.26 178.88 1s9v s THR 41 N -0.57 4.99 -0.23 1.83 2.01 -1.26 0.10 115.64 122.51 1s9v s THR 41 Ca -0.02 1.51 0.02 0.00 0.31 0.00 0.00 61.69 63.52 1s9v s THR 41 Cb -0.05 -4.08 0.05 0.00 0.01 0.00 0.00 72.50 68.43 1s9v s THR 41 CO 0.00 0.18 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.29 1s9v s VAL 42 N 1.21 2.10 0.15 3.82 1.01 0.21 -4.97 120.40 123.93 1s9v s VAL 42 Ca 0.38 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 1s9v s VAL 42 Cb -0.18 -2.12 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 1s9v s VAL 42 CO 0.17 0.15 0.96 0.26 0.00 0.00 0.00 175.10 176.64 1s9v s TRP 43 N 1.18 3.86 -0.37 5.22 0.52 -1.26 -1.90 118.94 126.19 1s9v s TRP 43 Ca -0.04 1.83 0.22 0.00 0.02 0.00 0.00 56.10 58.13 1s9v s TRP 43 Cb -0.18 -3.04 -0.21 0.00 -1.15 0.00 0.00 33.47 28.90 1s9v s TRP 43 CO -0.08 0.26 0.73 0.00 0.02 0.00 0.00 176.95 177.88 1s9v s LEU 45 N -4.16 3.36 0.24 0.00 0.20 -1.23 -5.02 118.68 112.06 1s9v s LEU 45 Ca -0.02 -1.05 -0.14 0.00 0.69 0.00 0.00 54.13 53.61 1s9v s LEU 45 Cb 0.14 -1.65 0.31 0.00 -0.43 0.00 0.00 46.19 44.56 1s9v s LEU 45 CO 0.87 -0.17 1.56 -0.65 -0.29 0.00 0.00 176.35 177.67 1s9v h PRO 46 N 7.97 -0.01 -0.12 0.98 0.11 -1.94 -0.78 132.00 138.20 1s9v h PRO 46 Ca -0.28 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.86 1s9v h PRO 46 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1s9v h PRO 46 CO 0.55 -0.01 0.21 -0.39 -0.21 0.00 0.00 178.00 178.15 1s9v h VAL 47 N -0.01 0.26 -0.00 3.15 -1.51 -2.00 -1.27 116.25 114.87 1s9v h VAL 47 Ca 0.38 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.85 1s9v h VAL 47 Cb 0.63 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 1s9v h VAL 47 CO -0.97 0.00 -0.00 0.18 -1.23 0.00 0.00 177.57 175.55 1s9v n LEU 48 N -3.43 0.02 0.08 4.19 4.32 -0.30 -3.45 117.00 118.42 1s9v n LEU 48 Ca 0.00 0.22 0.09 0.00 -0.02 0.00 0.00 56.01 56.31 1s9v n LEU 48 Cb 0.31 -0.23 0.41 0.00 -1.62 0.00 0.00 43.42 42.29 1s9v n LEU 48 CO 0.23 0.00 0.79 0.54 -1.22 0.00 0.00 177.39 177.73 1s9v n ARG 49 N -1.22 0.11 0.24 3.23 1.74 -0.48 -1.66 116.66 118.63 1s9v n ARG 49 Ca 0.16 0.40 0.13 0.00 -0.77 0.00 0.00 57.85 57.77 1s9v n ARG 49 Cb 0.22 -1.74 0.46 0.00 -1.02 0.00 0.00 32.46 30.38 1s9v n ARG 49 CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 1s9v h GLN 50 N 0.00 0.00 -7.11 5.56 3.07 -1.79 -3.44 115.11 111.40 1s9v h GLN 50 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 58.65 58.29 1s9v h GLN 50 Cb 0.26 0.00 0.07 0.00 0.08 0.00 0.00 27.48 27.90 1s9v h GLN 50 CO 0.00 0.08 0.11 -0.06 0.09 0.00 0.00 178.83 179.05 1s9v s PHE 51 N -3.50 2.42 0.03 0.06 0.08 -0.66 -5.12 117.98 111.29 1s9v s PHE 51 Ca 0.03 0.06 0.04 0.00 0.12 0.00 0.00 56.93 57.17 1s9v s PHE 51 Cb 0.08 -3.04 -0.02 0.00 -0.57 0.00 0.00 43.02 39.48 1s9v s PHE 51 CO 0.61 -1.38 -0.11 1.03 -0.10 0.00 0.00 175.22 175.27 1s9v s ARG 52 N -5.08 0.74 -0.14 0.44 0.52 -1.26 -5.08 118.95 109.09 1s9v s ARG 52 Ca 0.62 -0.63 -0.04 0.00 -0.52 0.00 0.00 55.73 55.16 1s9v s ARG 52 Cb -0.09 -0.69 0.07 0.00 0.52 0.00 0.00 34.95 34.77 1s9v s ARG 52 CO 0.43 0.17 0.17 0.12 0.02 0.00 0.00 175.30 176.21 1s9v s PHE 54 N -0.80 -0.16 -0.26 -0.53 5.36 -1.26 -5.10 117.98 115.23 1s9v s PHE 54 Ca -0.01 0.31 -0.28 0.00 -0.96 0.00 0.00 56.93 55.99 1s9v s PHE 54 Cb -0.07 -0.37 -0.03 0.00 -0.34 0.00 0.00 43.02 42.21 1s9v s PHE 54 CO 0.01 -0.44 1.89 0.34 -1.46 0.00 0.00 175.22 175.56 1s9v s ASP 55 N 2.28 5.88 0.37 6.13 -1.08 -1.26 -4.72 116.67 124.28 1s9v s ASP 55 Ca 0.04 1.59 0.25 0.00 -0.52 0.00 0.00 52.55 53.91 1s9v s ASP 55 Cb -0.14 -2.52 1.34 0.00 -1.46 0.00 0.00 42.92 40.14 1s9v s ASP 55 CO -0.09 -1.67 1.76 1.55 0.52 0.00 0.00 175.17 177.25 1s9v h PRO 56 N 12.99 0.00 0.00 4.34 0.13 -1.95 -1.86 132.00 145.65 1s9v h PRO 56 Ca -0.37 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.73 1s9v h PRO 56 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1s9v h PRO 56 CO 1.00 0.00 -0.18 0.37 -0.23 0.00 0.00 178.00 178.96 1s9v h GLN 57 N 0.00 0.00 -0.65 0.86 5.75 -1.91 -2.50 115.11 116.66 1s9v h GLN 57 Ca 0.00 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 1s9v h GLN 57 Cb 0.02 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 1s9v h GLN 57 CO 0.00 0.18 0.26 0.35 -2.65 0.00 0.00 178.83 176.98 1s9v h PHE 58 N 0.00 0.99 -0.13 3.99 3.04 -1.73 -1.02 116.94 122.07 1s9v h PHE 58 Ca -0.00 -0.07 -0.02 0.00 3.98 0.00 0.00 57.97 61.85 1s9v h PHE 58 Cb 0.69 -0.30 -0.00 0.00 2.56 0.00 0.00 35.95 38.90 1s9v h PHE 58 CO 0.00 0.78 -0.01 0.00 -2.02 0.00 0.00 178.31 177.05 1s9v h ALA 59 N 1.11 0.18 -0.39 2.41 0.00 -1.64 0.11 119.26 121.04 1s9v h ALA 59 Ca 0.22 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1s9v h ALA 59 Cb 0.20 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1s9v h ALA 59 CO -0.02 -0.10 0.13 -0.07 0.00 0.00 0.00 179.25 179.19 1s9v h LEU 60 N -0.04 0.12 -0.44 0.00 -0.00 -1.31 0.60 115.31 114.23 1s9v h LEU 60 Ca 0.04 0.05 -0.07 0.00 -0.00 0.00 0.00 57.88 57.90 1s9v h LEU 60 Cb 0.41 0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.09 1s9v h LEU 60 CO 0.01 0.10 0.01 0.74 -0.00 0.00 0.00 178.44 179.31 1s9v h THR 61 N 0.28 1.26 -0.71 0.22 2.02 -1.15 -2.14 112.91 112.69 1s9v h THR 61 Ca 0.18 -1.01 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 1s9v h THR 61 Cb 0.17 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 1s9v h THR 61 CO -0.19 0.35 0.29 -1.13 0.37 0.00 0.00 175.52 175.21 1s9v h ASN 62 N 0.61 0.97 0.12 4.18 -1.24 -0.53 -1.92 115.58 117.77 1s9v h ASN 62 Ca 0.13 -0.17 -0.09 0.00 0.71 0.00 0.00 56.30 56.88 1s9v h ASN 62 Cb 0.47 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.26 1s9v h ASN 62 CO 0.02 0.87 -0.31 0.40 -1.29 0.00 0.00 177.43 177.12 1s9v h ILE 63 N 1.01 1.27 -0.37 2.57 1.08 -0.81 -2.12 117.51 120.14 1s9v h ILE 63 Ca 0.24 -1.28 -0.06 0.00 -0.39 0.00 0.00 64.86 63.37 1s9v h ILE 63 Cb 0.20 1.49 -0.02 0.00 -3.07 0.00 0.00 36.82 35.42 1s9v h ILE 63 CO -0.02 0.39 -0.02 0.00 -0.69 0.00 0.00 178.15 177.81 1s9v h ALA 64 N 1.43 1.29 -0.48 1.87 0.00 -0.72 -0.75 119.26 121.90 1s9v h ALA 64 Ca 0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 1s9v h ALA 64 Cb 0.67 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1s9v h ALA 64 CO 0.05 0.48 -0.00 0.28 0.00 0.00 0.00 179.25 180.06 1s9v h VAL 65 N 0.55 1.26 -0.51 0.00 2.07 -0.74 -0.78 116.25 118.11 1s9v h VAL 65 Ca 0.11 -1.07 -0.05 0.00 0.82 0.00 0.00 66.70 66.52 1s9v h VAL 65 Cb 0.38 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1s9v h VAL 65 CO 0.01 0.37 0.13 -0.07 0.02 0.00 0.00 177.57 178.04 1s9v h LEU 66 N 0.70 0.72 0.13 2.57 3.38 -0.87 0.12 115.31 122.06 1s9v h LEU 66 Ca 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1s9v h LEU 66 Cb 0.51 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1s9v h LEU 66 CO 0.03 0.70 -0.06 0.50 0.09 0.00 0.00 178.44 179.69 1s9v h LYS 67 N 0.75 -0.17 -0.35 1.13 3.64 -0.74 0.42 116.57 121.25 1s9v h LYS 67 Ca 0.17 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 1s9v h LYS 67 Cb 0.26 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1s9v h LYS 67 CO -0.00 -0.10 0.15 1.25 -2.27 0.00 0.00 179.45 178.48 1s9v h HIS 68 N -0.19 0.27 -0.58 1.91 2.76 -0.52 -2.06 115.15 116.74 1s9v h HIS 68 Ca -0.02 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 1s9v h HIS 68 Cb 0.15 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.01 1s9v h HIS 68 CO -0.07 0.13 0.09 -0.91 -1.30 0.00 0.00 177.93 175.88 1s9v h ASN 69 N 0.31 0.93 -1.01 3.26 4.21 -0.50 -2.86 115.58 119.92 1s9v h ASN 69 Ca 0.16 -0.26 0.03 0.00 1.21 0.00 0.00 56.30 57.43 1s9v h ASN 69 Cb 0.10 -0.25 -0.06 0.00 -1.12 0.00 0.00 38.32 37.00 1s9v h ASN 69 CO -0.14 0.95 0.66 0.25 -1.29 0.00 0.00 177.43 177.87 1s9v h LEU 70 N 0.87 1.12 -1.24 1.61 5.85 0.17 -1.68 115.31 122.00 1s9v h LEU 70 Ca 0.18 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.90 1s9v h LEU 70 Cb 0.42 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 1s9v h LEU 70 CO 0.01 0.78 0.52 0.78 -0.34 0.00 0.00 178.44 180.19 1s9v h ASN 71 N 1.30 0.86 -0.05 1.25 -0.26 -1.16 0.54 115.58 118.07 1s9v h ASN 71 Ca 0.39 -0.02 -0.15 0.00 -0.56 0.00 0.00 56.30 55.96 1s9v h ASN 71 Cb -0.04 -0.21 0.01 0.00 -1.06 0.00 0.00 38.32 37.02 1s9v h ASN 71 CO -0.11 0.61 -0.57 -1.28 -1.06 0.00 0.00 177.43 175.02 1s9v h SER 72 N 1.01 0.58 -0.74 5.81 0.87 -1.31 -3.21 113.55 116.56 1s9v h SER 72 Ca 0.30 -0.70 -0.04 0.00 -1.23 0.00 0.00 61.79 60.12 1s9v h SER 72 Cb -0.03 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 1s9v h SER 72 CO -0.08 1.20 0.31 -0.07 -0.53 0.00 0.00 176.83 177.66 1s9v h LEU 73 N 0.02 1.02 -0.56 2.23 4.07 -0.93 -0.61 115.31 120.56 1s9v h LEU 73 Ca -0.06 -0.15 0.06 0.00 0.08 0.00 0.00 57.88 57.82 1s9v h LEU 73 Cb 1.24 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 42.66 1s9v h LEU 73 CO 0.11 0.90 0.26 0.40 -1.08 0.00 0.00 178.44 179.03 1s9v h ILE 74 N 1.09 0.90 0.56 1.22 2.04 -0.97 -0.42 117.51 121.93 1s9v h ILE 74 Ca 0.25 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 1s9v h ILE 74 Cb 0.19 0.36 0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1s9v h ILE 74 CO -0.02 0.09 -0.27 0.11 0.00 0.00 0.00 178.15 178.05 1s9v h LYS 75 N 0.49 -0.73 0.00 2.37 1.57 -1.47 0.25 116.57 119.05 1s9v h LYS 75 Ca 0.26 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1s9v h LYS 75 Cb 0.22 0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1s9v h LYS 75 CO -0.21 -0.45 0.00 0.54 -0.57 0.00 0.00 179.45 178.77 1s9v n ARG 76 N -5.29 0.22 -0.17 3.15 1.74 -0.27 -1.11 116.66 114.93 1s9v n ARG 76 Ca -0.10 0.05 0.06 0.00 -0.77 0.00 0.00 57.85 57.08 1s9v n ARG 76 Cb 0.32 -1.50 0.15 0.00 -1.02 0.00 0.00 32.46 30.41 1s9v n ARG 76 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1s9v n SER 77 N -1.07 2.87 -3.63 0.55 3.41 -0.18 -4.94 113.62 110.64 1s9v n SER 77 Ca 0.06 -1.95 -0.22 0.00 -0.26 0.00 0.00 58.87 56.50 1s9v n SER 77 Cb 0.04 -0.22 0.06 0.00 -0.26 0.00 0.00 64.21 63.83 1s9v n SER 77 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1s9v n ASN 78 N 0.58 -3.55 -3.92 4.04 5.15 -0.27 -2.94 115.26 114.36 1s9v n ASN 78 Ca 0.12 -0.67 -0.35 0.00 -0.60 0.00 0.00 54.58 53.08 1s9v n ASN 78 Cb 0.42 -4.63 0.01 0.00 -0.53 0.00 0.00 39.78 35.05 1s9v n ASN 78 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1s9v n SER 79 N -3.03 -3.30 -4.59 1.20 3.41 0.87 -4.92 113.62 103.26 1s9v n SER 79 Ca -0.15 -1.12 -0.43 0.00 -0.26 0.00 0.00 58.87 56.91 1s9v n SER 79 Cb 0.62 -2.64 -0.04 0.00 -0.26 0.00 0.00 64.21 61.89 1s9v n SER 79 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1s9v s THR 80 N -3.68 4.49 0.71 6.66 2.01 -1.15 -5.03 115.64 119.66 1s9v s THR 80 Ca 0.34 1.03 -0.11 0.00 0.31 0.00 0.00 61.69 63.25 1s9v s THR 80 Cb -0.15 -4.41 0.02 0.00 0.01 0.00 0.00 72.50 67.98 1s9v s THR 80 CO 0.91 -0.71 1.09 0.00 -0.69 0.00 0.00 174.62 175.22 1s9v s ALA 81 N 3.71 2.90 0.55 7.40 0.00 -1.26 -5.02 121.76 130.04 1s9v s ALA 81 Ca 0.39 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.74 1s9v s ALA 81 Cb -0.11 -2.98 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 1s9v s ALA 81 CO 0.23 -1.19 1.11 0.00 0.00 0.00 0.00 175.76 175.91 1s9v s ALA 82 N -3.36 2.71 -0.21 0.00 0.00 -1.26 -5.03 121.76 114.62 1s9v s ALA 82 Ca 0.58 0.74 -0.13 0.00 0.00 0.00 0.00 51.96 53.15 1s9v s ALA 82 Cb -0.11 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1s9v s ALA 82 CO 0.51 -0.73 0.26 0.99 0.00 0.00 0.00 175.76 176.79 1s9v s THR 83 N -1.90 5.30 -0.05 0.00 2.01 -1.26 -4.98 115.64 114.76 1s9v s THR 83 Ca 0.71 0.43 -0.30 0.00 0.31 0.00 0.00 61.69 62.84 1s9v s THR 83 Cb -0.22 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 1s9v s THR 83 CO 0.27 0.33 1.42 0.20 -0.69 0.00 0.00 174.62 176.16 1s9v s ASN 84 N 0.86 6.84 0.49 3.53 0.01 -1.26 -4.36 114.94 121.06 1s9v s ASN 84 Ca 0.13 2.03 -0.01 0.00 -0.71 0.00 0.00 52.86 54.31 1s9v s ASN 84 Cb -0.14 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 38.98 1s9v s ASN 84 CO 0.05 -0.77 0.73 -1.61 -1.51 0.00 0.00 177.10 173.99 1s9v s GLU 85 N 3.00 2.95 -0.27 -0.60 0.41 0.49 -4.80 118.70 119.88 1s9v s GLU 85 Ca 0.64 -0.44 -0.14 0.00 -0.41 0.00 0.00 54.97 54.61 1s9v s GLU 85 Cb -0.29 -2.49 -0.04 0.00 -1.78 0.00 0.00 34.13 29.52 1s9v s GLU 85 CO 0.24 -0.43 0.33 0.08 -0.49 0.00 0.00 175.26 175.00 1s9v s VAL 86 N -2.67 5.21 0.61 2.63 1.01 -1.26 -4.03 120.40 121.90 1s9v s VAL 86 Ca 0.51 0.48 -0.17 0.00 0.00 0.00 0.00 61.98 62.80 1s9v s VAL 86 Cb -0.10 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1s9v s VAL 86 CO 0.39 0.18 1.12 -2.84 0.00 0.00 0.00 175.10 173.96 1s9v s PRO 87 N 1.96 3.04 -0.18 2.72 0.02 -1.26 -4.85 135.00 136.46 1s9v s PRO 87 Ca 0.13 1.51 0.01 0.00 0.02 0.00 0.00 61.00 62.67 1s9v s PRO 87 Cb -0.16 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.41 1s9v s PRO 87 CO 0.10 -1.08 -0.20 -2.00 -0.33 0.00 0.00 177.00 173.49 1s9v s GLU 88 N -3.71 3.01 -0.09 5.54 2.12 -0.56 -4.98 118.70 120.03 1s9v s GLU 88 Ca 0.70 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 55.21 1s9v s GLU 88 Cb -0.22 -2.57 -0.03 0.00 0.26 0.00 0.00 34.13 31.57 1s9v s GLU 88 CO 0.35 -0.19 -0.08 0.08 -0.54 0.00 0.00 175.26 174.88 1s9v s VAL 89 N 1.24 3.54 -0.02 3.70 1.01 -1.26 -0.18 120.40 128.44 1s9v s VAL 89 Ca 0.04 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1s9v s VAL 89 Cb -0.13 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.81 1s9v s VAL 89 CO -0.11 0.57 0.01 -0.89 0.00 0.00 0.00 175.10 174.67 1s9v s THR 90 N -0.42 0.10 -0.07 3.92 2.01 -0.09 -4.99 115.64 116.10 1s9v s THR 90 Ca 0.06 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.20 1s9v s THR 90 Cb -0.12 -0.19 -0.01 0.00 0.01 0.00 0.00 72.50 72.18 1s9v s THR 90 CO 0.02 0.11 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.17 1s9v s VAL 91 N 0.88 2.44 0.23 3.82 1.01 -1.26 -0.24 120.40 127.27 1s9v s VAL 91 Ca -0.08 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.78 1s9v s VAL 91 Cb -0.12 -1.93 0.03 0.00 0.00 0.00 0.00 36.38 34.36 1s9v s VAL 91 CO -0.02 0.57 0.62 0.72 0.00 0.00 0.00 175.10 176.99 1s9v s PHE 92 N -0.16 -0.22 0.24 5.22 -0.12 -0.71 -4.97 117.98 117.26 1s9v s PHE 92 Ca -0.03 -0.14 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 1s9v s PHE 92 Cb -0.14 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.77 1s9v s PHE 92 CO 0.04 -1.04 0.41 -1.54 -0.05 0.00 0.00 175.22 173.04 1s9v s SER 93 N -2.87 6.35 0.14 1.98 1.04 -1.26 0.20 113.70 119.27 1s9v s SER 93 Ca 0.09 0.33 -0.05 0.00 0.48 0.00 0.00 55.95 56.79 1s9v s SER 93 Cb -0.03 -1.98 -0.07 0.00 0.10 0.00 0.00 66.02 64.05 1s9v s SER 93 CO -0.00 -0.10 1.33 0.50 0.98 0.00 0.00 173.24 175.95 1s9v h LYS 94 N 1.56 0.48 -5.18 4.02 3.64 -0.94 -3.46 116.57 116.68 1s9v h LYS 94 Ca -0.49 -0.46 -0.51 0.00 -1.27 0.00 0.00 60.65 57.91 1s9v h LYS 94 Cb 1.21 0.12 -0.14 0.00 -0.41 0.00 0.00 32.23 33.01 1s9v h LYS 94 CO 0.65 1.10 -0.58 -1.12 -2.27 0.00 0.00 179.45 177.24 1s9v s SER 95 N -7.07 2.63 0.49 4.20 0.01 -1.26 -5.04 113.70 107.67 1s9v s SER 95 Ca -0.07 -1.48 -0.22 0.00 1.31 0.00 0.00 55.95 55.50 1s9v s SER 95 Cb 0.09 0.11 -0.07 0.00 0.21 0.00 0.00 66.02 66.37 1s9v s SER 95 CO 0.87 -0.71 1.18 -2.84 0.41 0.00 0.00 173.24 172.15 1s9v s PRO 96 N -3.84 3.57 -0.13 12.44 0.02 -1.26 -4.95 135.00 140.85 1s9v s PRO 96 Ca 0.31 1.79 -0.26 0.00 0.02 0.00 0.00 61.00 62.86 1s9v s PRO 96 Cb 0.07 -2.28 -0.02 0.00 0.02 0.00 0.00 34.50 32.29 1s9v s PRO 96 CO 0.14 -0.72 0.87 0.08 -0.33 0.00 0.00 177.00 177.05 1s9v s VAL 97 N -1.57 4.87 -0.05 3.83 1.01 -1.26 -5.02 120.40 122.22 1s9v s VAL 97 Ca 0.67 1.75 -0.02 0.00 0.00 0.00 0.00 61.98 64.38 1s9v s VAL 97 Cb -0.29 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 31.93 1s9v s VAL 97 CO 0.34 0.06 0.04 0.42 0.00 0.00 0.00 175.10 175.96 1s9v s THR 98 N 1.88 0.03 -0.02 3.92 -4.23 -1.26 -5.11 115.64 110.86 1s9v s THR 98 Ca 0.42 0.32 -0.38 0.00 -1.18 0.00 0.00 61.69 60.86 1s9v s THR 98 Cb -0.17 -0.25 -0.17 0.00 1.34 0.00 0.00 72.50 73.25 1s9v s THR 98 CO 0.15 0.19 1.42 0.18 -0.54 0.00 0.00 174.62 176.02 1s9v n LEU 99 N 5.09 1.67 0.00 4.79 4.77 -1.26 -1.05 117.00 131.02 1s9v n LEU 99 Ca -0.08 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 1s9v n LEU 99 Cb 0.50 -1.15 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 1s9v n LEU 99 CO 0.09 -0.97 0.00 0.61 -1.33 0.00 0.00 177.39 175.79 1s9v n GLY 100 N 2.85 1.37 3.60 -0.72 0.00 -0.93 -5.02 105.19 106.35 1s9v n GLY 100 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1s9v n GLY 100 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1s9v s GLN 101 N -0.55 3.94 0.24 1.61 0.74 -0.21 -4.94 119.66 120.48 1s9v s GLN 101 Ca 0.00 0.16 -0.31 0.00 0.05 0.00 0.00 55.36 55.25 1s9v s GLN 101 Cb 0.00 -3.70 -0.13 0.00 1.10 0.00 0.00 33.01 30.28 1s9v s GLN 101 CO 0.00 -0.43 1.50 -2.30 -0.55 0.00 0.00 175.29 173.51 1s9v n PRO 102 N 5.58 2.25 -3.50 1.67 -0.02 -1.26 -4.20 135.00 135.53 1s9v n PRO 102 Ca -0.05 0.80 -0.14 0.00 -2.02 0.00 0.00 63.50 62.10 1s9v n PRO 102 Cb 0.50 -2.52 -0.05 0.00 -0.02 0.00 0.00 33.50 31.40 1s9v n PRO 102 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1s9v n ASN 103 N 2.48 0.16 -3.72 2.55 2.85 0.04 -5.01 115.26 114.61 1s9v n ASN 103 Ca 0.12 -2.42 -0.18 0.00 -0.11 0.00 0.00 54.58 51.98 1s9v n ASN 103 Cb 0.32 0.93 -0.17 0.00 1.24 0.00 0.00 39.78 42.10 1s9v n ASN 103 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1s9v s ILE 104 N -2.75 -0.04 -0.04 -1.44 1.01 -1.26 -2.06 121.20 114.62 1s9v s ILE 104 Ca 0.21 0.32 -0.18 0.00 0.00 0.00 0.00 60.65 61.00 1s9v s ILE 104 Cb 0.01 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.27 1s9v s ILE 104 CO 0.15 0.15 0.50 -0.76 0.00 0.00 0.00 174.94 174.98 1s9v s LEU 105 N 1.73 4.39 -0.16 2.97 1.43 -0.06 -0.19 118.68 128.79 1s9v s LEU 105 Ca -0.01 0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 54.07 1s9v s LEU 105 Cb -0.12 -2.75 -0.01 0.00 0.03 0.00 0.00 46.19 43.33 1s9v s LEU 105 CO -0.03 0.14 -0.09 -0.63 0.23 0.00 0.00 176.35 175.96 1s9v s ILE 106 N -0.20 3.23 -0.32 -0.59 1.01 0.13 -1.35 121.20 123.10 1s9v s ILE 106 Ca 0.27 -0.58 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1s9v s ILE 106 Cb -0.17 -2.40 0.05 0.00 0.01 0.00 0.00 42.46 39.96 1s9v s ILE 106 CO 0.14 0.49 0.05 0.00 0.00 0.00 0.00 174.94 175.62 1s9v s LEU 108 N 1.28 4.05 -0.37 0.00 1.98 0.66 -1.30 118.68 124.98 1s9v s LEU 108 Ca -0.03 0.23 -0.05 0.00 -2.89 0.00 0.00 54.13 51.39 1s9v s LEU 108 Cb -0.20 -2.34 0.08 0.00 0.66 0.00 0.00 46.19 44.38 1s9v s LEU 108 CO -0.00 -0.13 0.15 -0.69 -1.89 0.00 0.00 176.35 173.79 1s9v s VAL 109 N 1.88 3.53 0.38 1.68 1.01 -0.39 -0.92 120.40 127.57 1s9v s VAL 109 Ca 0.13 -1.57 0.07 0.00 0.00 0.00 0.00 61.98 60.61 1s9v s VAL 109 Cb -0.16 -3.18 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 1s9v s VAL 109 CO 0.10 -0.41 0.50 -0.62 0.00 0.00 0.00 175.10 174.67 1s9v s ASP 110 N 1.68 5.73 -1.25 3.32 -1.08 0.75 -0.94 116.67 124.89 1s9v s ASP 110 Ca 0.02 -0.35 -0.09 0.00 -0.52 0.00 0.00 52.55 51.61 1s9v s ASP 110 Cb -0.22 -0.90 -0.01 0.00 -1.46 0.00 0.00 42.92 40.34 1s9v s ASP 110 CO -0.01 -0.60 0.68 -3.20 0.52 0.00 0.00 175.17 172.57 1s9v n ASN 111 N -1.72 -2.98 -4.69 -0.34 4.05 -1.05 -1.50 115.26 107.02 1s9v n ASN 111 Ca 0.04 -0.94 -0.37 0.00 0.45 0.00 0.00 54.58 53.76 1s9v n ASN 111 Cb 0.59 -3.62 -0.08 0.00 1.23 0.00 0.00 39.78 37.90 1s9v n ASN 111 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1s9v s ILE 112 N -3.64 5.28 -0.29 -1.44 1.01 0.26 -3.98 121.20 118.40 1s9v s ILE 112 Ca 0.22 0.53 -0.16 0.00 0.00 0.00 0.00 60.65 61.25 1s9v s ILE 112 Cb -0.07 -3.64 0.18 0.00 0.01 0.00 0.00 42.46 38.93 1s9v s ILE 112 CO 0.85 0.33 1.12 0.12 0.00 0.00 0.00 174.94 177.35 1s9v s PHE 113 N 0.88 -0.32 0.88 3.97 5.36 -1.26 -0.86 117.98 126.63 1s9v s PHE 113 Ca 0.16 0.64 -0.11 0.00 -0.96 0.00 0.00 56.93 56.66 1s9v s PHE 113 Cb -0.14 0.19 0.12 0.00 -0.34 0.00 0.00 43.02 42.86 1s9v s PHE 113 CO 0.05 -0.16 1.10 -1.25 -1.46 0.00 0.00 175.22 173.50 1s9v s PRO 114 N 1.24 1.35 -0.63 10.12 0.04 -1.26 -0.38 135.00 145.47 1s9v s PRO 114 Ca -0.08 1.10 -0.18 0.00 0.04 0.00 0.00 61.00 61.88 1s9v s PRO 114 Cb -0.03 -1.80 -0.16 0.00 0.04 0.00 0.00 34.50 32.56 1s9v s PRO 114 CO -0.12 -2.26 1.85 -0.35 0.04 0.00 0.00 177.00 176.16 1s9v n PRO 115 N -3.93 1.29 -3.66 0.56 -0.04 -1.26 -4.73 135.00 123.23 1s9v n PRO 115 Ca 0.08 -1.54 -0.18 0.00 -0.04 0.00 0.00 63.50 61.82 1s9v n PRO 115 Cb 0.54 -2.69 -0.16 0.00 -0.04 0.00 0.00 33.50 31.14 1s9v n PRO 115 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s9v s VAL 116 N 4.97 -0.23 0.11 0.52 1.01 -1.26 -5.11 120.40 120.41 1s9v s VAL 116 Ca 0.51 0.34 -0.20 0.00 0.00 0.00 0.00 61.98 62.64 1s9v s VAL 116 Cb 0.13 -0.28 0.05 0.00 0.00 0.00 0.00 36.38 36.27 1s9v s VAL 116 CO 0.11 0.13 0.50 0.54 0.00 0.00 0.00 175.10 176.39 1s9v s VAL 117 N 2.26 0.04 -0.25 2.92 0.11 -1.26 -4.72 120.40 119.50 1s9v s VAL 117 Ca 0.04 -0.29 0.02 0.00 -2.93 0.00 0.00 61.98 58.81 1s9v s VAL 117 Cb -0.12 -1.06 0.07 0.00 -1.53 0.00 0.00 36.38 33.74 1s9v s VAL 117 CO -0.05 -0.16 -0.05 0.21 -3.33 0.00 0.00 175.10 171.72 1s9v s ASN 118 N -2.55 4.10 -0.17 3.54 3.84 -0.47 -4.99 114.94 118.24 1s9v s ASN 118 Ca -0.00 -1.35 -0.02 0.00 0.21 0.00 0.00 52.86 51.71 1s9v s ASN 118 Cb 0.00 -1.30 -0.01 0.00 -0.55 0.00 0.00 41.25 39.39 1s9v s ASN 118 CO -0.09 -0.25 -0.10 -0.63 -2.79 0.00 0.00 177.10 173.24 1s9v s ILE 119 N 1.28 3.14 0.00 -5.21 1.01 -1.26 -0.58 121.20 119.57 1s9v s ILE 119 Ca -0.04 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 1s9v s ILE 119 Cb -0.19 -2.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 1s9v s ILE 119 CO -0.07 0.49 0.03 0.42 0.00 0.00 0.00 174.94 175.81 1s9v s THR 120 N 0.86 0.06 -0.07 2.92 -4.23 -0.53 -4.99 115.64 109.66 1s9v s THR 120 Ca -0.03 -0.47 -0.09 0.00 -1.18 0.00 0.00 61.69 59.92 1s9v s THR 120 Cb -0.15 -0.21 -0.05 0.00 1.34 0.00 0.00 72.50 73.44 1s9v s THR 120 CO 0.00 -0.26 0.23 0.26 -0.54 0.00 0.00 174.62 174.32 1s9v s TRP 121 N -0.79 3.63 -0.10 3.99 0.52 -1.26 -0.37 118.94 124.57 1s9v s TRP 121 Ca -0.09 0.67 0.04 0.00 0.02 0.00 0.00 56.10 56.74 1s9v s TRP 121 Cb -0.05 -2.04 -0.00 0.00 -1.15 0.00 0.00 33.47 30.22 1s9v s TRP 121 CO -0.00 0.70 -0.24 -0.51 0.02 0.00 0.00 176.95 176.91 1s9v s LEU 122 N -1.15 2.09 -0.27 2.99 2.01 0.57 -0.57 118.68 124.35 1s9v s LEU 122 Ca 0.19 -0.55 0.01 0.00 0.01 0.00 0.00 54.13 53.78 1s9v s LEU 122 Cb -0.13 -1.40 0.05 0.00 0.01 0.00 0.00 46.19 44.71 1s9v s LEU 122 CO 0.08 0.17 -0.07 -0.55 1.01 0.00 0.00 176.35 176.99 1s9v s SER 123 N 0.29 4.49 -1.36 2.29 0.15 0.19 -0.99 113.70 118.76 1s9v s SER 123 Ca -0.17 -1.22 -0.04 0.00 0.70 0.00 0.00 55.95 55.21 1s9v s SER 123 Cb -0.18 -1.62 0.02 0.00 -1.71 0.00 0.00 66.02 62.54 1s9v s SER 123 CO 0.08 -0.19 0.82 0.59 1.20 0.00 0.00 173.24 175.75 1s9v n ASN 124 N 4.55 -2.49 0.00 5.45 3.02 -0.35 -1.10 115.26 124.33 1s9v n ASN 124 Ca -0.15 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.63 1s9v n ASN 124 Cb 0.44 -4.14 0.00 0.00 -0.61 0.00 0.00 39.78 35.46 1s9v n ASN 124 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s9v n GLY 125 N -1.60 2.68 3.85 7.41 0.00 -1.26 -5.00 105.19 111.28 1s9v n GLY 125 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1s9v n GLY 125 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s9v s HIS 126 N -2.61 3.62 0.31 1.61 3.76 -0.26 -5.00 115.29 116.72 1s9v s HIS 126 Ca 0.00 0.64 -0.29 0.00 -0.15 0.00 0.00 55.06 55.26 1s9v s HIS 126 Cb 0.00 -2.06 -0.10 0.00 1.11 0.00 0.00 32.58 31.53 1s9v s HIS 126 CO 0.00 0.67 1.33 -1.12 -0.85 0.00 0.00 174.74 174.77 1s9v s SER 127 N -0.91 6.76 -0.21 1.40 0.01 -1.26 0.55 113.70 120.04 1s9v s SER 127 Ca 0.17 2.67 -0.08 0.00 1.31 0.00 0.00 55.95 60.02 1s9v s SER 127 Cb -0.13 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.41 1s9v s SER 127 CO 0.06 -0.56 0.09 -0.69 0.41 0.00 0.00 173.24 172.54 1s9v s VAL 128 N -0.86 4.87 -0.18 3.43 1.01 0.27 -4.85 120.40 124.09 1s9v s VAL 128 Ca 0.51 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.57 1s9v s VAL 128 Cb -0.40 -3.23 -0.16 0.00 0.00 0.00 0.00 36.38 32.60 1s9v s VAL 128 CO 0.50 0.41 -0.07 1.07 0.00 0.00 0.00 175.10 177.02 1s9v n THR 129 N 3.92 1.10 -3.76 3.92 5.66 -1.26 -4.57 114.28 119.28 1s9v n THR 129 Ca -0.16 -0.54 -0.29 0.00 -3.05 0.00 0.00 64.05 60.00 1s9v n THR 129 Cb 0.52 -0.91 -0.04 0.00 -1.55 0.00 0.00 70.33 68.35 1s9v n THR 129 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1s9v s GLU 130 N -2.39 3.53 -0.20 1.09 0.41 -1.26 -4.36 118.70 115.52 1s9v s GLU 130 Ca -0.18 -0.30 0.00 0.00 -0.41 0.00 0.00 54.97 54.08 1s9v s GLU 130 Cb 0.06 -2.90 0.00 0.00 -1.78 0.00 0.00 34.13 29.51 1s9v s GLU 130 CO 0.54 0.48 0.00 0.41 -0.49 0.00 0.00 175.26 176.20 1s9v n GLY 131 N -0.18 0.54 3.47 -1.39 0.00 -1.26 -4.83 105.19 101.55 1s9v n GLY 131 Ca -0.04 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 1s9v n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s9v s VAL 132 N -2.04 3.01 0.23 1.61 1.01 -1.26 -1.10 120.40 121.85 1s9v s VAL 132 Ca 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 1s9v s VAL 132 Cb 0.00 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.20 1s9v s VAL 132 CO 0.00 0.55 0.50 -0.94 0.00 0.00 0.00 175.10 175.21 1s9v s SER 133 N -0.85 -0.15 0.15 3.32 1.04 -0.92 -4.99 113.70 111.30 1s9v s SER 133 Ca 0.12 -0.75 -0.19 0.00 0.48 0.00 0.00 55.95 55.61 1s9v s SER 133 Cb -0.11 0.58 0.04 0.00 0.10 0.00 0.00 66.02 66.64 1s9v s SER 133 CO 0.01 -1.11 0.50 -1.83 0.98 0.00 0.00 173.24 171.79 1s9v s GLU 134 N -3.96 1.21 0.92 4.02 -1.05 -1.26 0.13 118.70 118.71 1s9v s GLU 134 Ca 0.17 -0.67 -0.12 0.00 -0.15 0.00 0.00 54.97 54.19 1s9v s GLU 134 Cb -0.01 0.52 0.20 0.00 -0.44 0.00 0.00 34.13 34.40 1s9v s GLU 134 CO 0.04 -0.51 1.26 0.95 0.95 0.00 0.00 175.26 177.96 1s9v s THR 135 N -3.80 2.02 0.87 1.83 -4.23 -0.31 -5.01 115.64 107.00 1s9v s THR 135 Ca 0.04 -0.16 -0.10 0.00 -1.18 0.00 0.00 61.69 60.29 1s9v s THR 135 Cb 0.00 -2.86 0.19 0.00 1.34 0.00 0.00 72.50 71.17 1s9v s THR 135 CO -0.10 0.00 1.18 -1.20 -0.54 0.00 0.00 174.62 173.96 1s9v n SER 136 N -3.58 0.55 -4.66 3.99 7.64 -1.26 -4.74 113.62 111.56 1s9v n SER 136 Ca 0.16 -1.71 -0.43 0.00 1.01 0.00 0.00 58.87 57.90 1s9v n SER 136 Cb 0.60 -0.86 -0.02 0.00 -1.01 0.00 0.00 64.21 62.91 1s9v n SER 136 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1s9v s PHE 137 N -3.54 2.78 -0.08 1.43 0.08 -1.26 -4.66 117.98 112.73 1s9v s PHE 137 Ca 0.70 0.94 -0.16 0.00 0.12 0.00 0.00 56.93 58.53 1s9v s PHE 137 Cb -0.03 -3.54 -0.05 0.00 -0.57 0.00 0.00 43.02 38.84 1s9v s PHE 137 CO 0.49 -1.87 0.43 -0.51 -0.10 0.00 0.00 175.22 173.65 1s9v s LEU 138 N 3.53 4.35 0.89 -0.37 2.01 0.03 -4.91 118.68 124.21 1s9v s LEU 138 Ca 0.56 0.83 -0.11 0.00 0.01 0.00 0.00 54.13 55.42 1s9v s LEU 138 Cb -0.23 -2.61 0.12 0.00 0.01 0.00 0.00 46.19 43.49 1s9v s LEU 138 CO 0.16 0.14 1.09 -0.94 1.01 0.00 0.00 176.35 177.81 1s9v s SER 139 N -0.05 3.49 0.03 2.29 1.04 -1.26 -1.89 113.70 117.35 1s9v s SER 139 Ca 0.24 1.63 0.00 0.00 0.48 0.00 0.00 55.95 58.30 1s9v s SER 139 Cb -0.15 -2.29 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 1s9v s SER 139 CO 0.11 -2.65 -0.04 -0.54 0.98 0.00 0.00 173.24 171.10 1s9v s LYS 140 N -4.87 0.37 0.66 4.02 1.02 -1.04 -4.81 119.74 115.09 1s9v s LYS 140 Ca 0.64 -0.67 0.40 0.00 0.02 0.00 0.00 55.97 56.35 1s9v s LYS 140 Cb -0.19 0.03 2.22 0.00 -0.52 0.00 0.00 37.83 39.38 1s9v s LYS 140 CO 0.57 -0.03 2.29 0.66 -0.92 0.00 0.00 175.35 177.92 1s9v h SER 141 N 4.54 0.00 -0.32 2.83 4.64 -1.98 0.13 113.55 123.39 1s9v h SER 141 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1s9v h SER 141 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1s9v h SER 141 CO 0.42 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.48 1s9v n ASP 142 N -3.19 1.93 -0.16 4.97 5.75 -1.26 -4.89 116.55 119.70 1s9v n ASP 142 Ca -0.03 -1.92 -0.02 0.00 -0.01 0.00 0.00 54.79 52.81 1s9v n ASP 142 Cb 0.13 -0.21 -0.01 0.00 -1.03 0.00 0.00 41.12 40.00 1s9v n ASP 142 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1s9v n HIS 143 N 0.54 0.00 -2.62 2.11 8.25 0.47 -5.02 115.22 118.95 1s9v n HIS 143 Ca 0.14 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.58 1s9v n HIS 143 Cb 0.32 -1.00 0.01 0.00 1.12 0.00 0.00 29.99 30.44 1s9v n HIS 143 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1s9v n SER 144 N -0.10 0.11 -4.26 0.41 3.41 -1.26 -4.87 113.62 107.06 1s9v n SER 144 Ca -0.02 -1.09 -0.14 0.00 -0.26 0.00 0.00 58.87 57.36 1s9v n SER 144 Cb 0.21 -0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 64.02 1s9v n SER 144 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1s9v s PHE 145 N 0.38 1.33 0.04 7.33 0.40 -0.04 -2.48 117.98 124.95 1s9v s PHE 145 Ca 0.04 -1.25 -0.02 0.00 -0.60 0.00 0.00 56.93 55.11 1s9v s PHE 145 Cb -0.00 -0.73 -0.03 0.00 0.51 0.00 0.00 43.02 42.76 1s9v s PHE 145 CO 0.03 -0.45 -0.01 -0.59 0.70 0.00 0.00 175.22 174.90 1s9v s PHE 146 N -3.92 0.41 -0.08 0.36 -0.12 -0.79 0.90 117.98 114.74 1s9v s PHE 146 Ca 0.36 -0.86 -0.09 0.00 -0.05 0.00 0.00 56.93 56.29 1s9v s PHE 146 Cb 0.07 -0.30 0.02 0.00 -0.63 0.00 0.00 43.02 42.18 1s9v s PHE 146 CO 0.12 -0.34 0.26 0.21 -0.05 0.00 0.00 175.22 175.41 1s9v s LYS 147 N -3.19 0.35 -0.12 1.99 2.20 -0.11 -0.79 119.74 120.06 1s9v s LYS 147 Ca 0.00 0.26 0.00 0.00 -0.36 0.00 0.00 55.97 55.87 1s9v s LYS 147 Cb 0.03 0.17 -0.01 0.00 -1.51 0.00 0.00 37.83 36.50 1s9v s LYS 147 CO -0.07 -0.05 -0.14 0.42 -0.36 0.00 0.00 175.35 175.15 1s9v s ILE 148 N -0.10 3.00 -0.06 5.43 1.01 -1.26 -1.26 121.20 127.96 1s9v s ILE 148 Ca -0.02 -0.68 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1s9v s ILE 148 Cb -0.03 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.17 1s9v s ILE 148 CO 0.01 0.53 -0.14 -0.55 0.00 0.00 0.00 174.94 174.78 1s9v s SER 149 N 0.30 4.01 0.03 3.58 0.15 -0.42 -1.16 113.70 120.18 1s9v s SER 149 Ca -0.10 -0.22 0.07 0.00 0.70 0.00 0.00 55.95 56.40 1s9v s SER 149 Cb -0.16 -0.95 -0.03 0.00 -1.71 0.00 0.00 66.02 63.18 1s9v s SER 149 CO 0.06 0.32 -0.20 -0.31 1.20 0.00 0.00 173.24 174.31 1s9v s TYR 150 N -0.58 2.51 -0.08 3.44 2.02 0.12 -0.48 117.35 124.30 1s9v s TYR 150 Ca 0.08 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.48 1s9v s TYR 150 Cb -0.11 -1.47 0.03 0.00 -0.40 0.00 0.00 41.96 40.01 1s9v s TYR 150 CO 0.01 0.20 -0.00 -1.17 -1.57 0.00 0.00 175.55 173.02 1s9v s LEU 151 N -1.27 0.64 0.28 -1.29 2.96 -0.46 -2.16 118.68 117.38 1s9v s LEU 151 Ca 0.13 -0.11 -0.26 0.00 -0.22 0.00 0.00 54.13 53.67 1s9v s LEU 151 Cb -0.10 -0.47 -0.09 0.00 0.50 0.00 0.00 46.19 46.02 1s9v s LEU 151 CO 0.04 -0.19 0.90 0.42 -1.32 0.00 0.00 176.35 176.20 1s9v s THR 152 N 1.95 4.23 0.22 3.68 -4.23 -0.26 -0.88 115.64 120.35 1s9v s THR 152 Ca 0.05 1.81 -0.19 0.00 -1.18 0.00 0.00 61.69 62.18 1s9v s THR 152 Cb -0.12 -4.08 0.03 0.00 1.34 0.00 0.00 72.50 69.67 1s9v s THR 152 CO -0.06 0.27 0.59 -1.48 -0.54 0.00 0.00 174.62 173.41 1s9v s LEU 153 N -1.75 -0.11 -0.29 4.79 -0.00 -0.87 -4.94 118.68 115.50 1s9v s LEU 153 Ca 0.46 -0.47 0.03 0.00 -0.00 0.00 0.00 54.13 54.15 1s9v s LEU 153 Cb -0.21 2.36 0.08 0.00 -0.00 0.00 0.00 46.19 48.43 1s9v s LEU 153 CO 0.26 -1.13 -0.02 -0.22 -0.00 0.00 0.00 176.35 175.23 1s9v s LEU 154 N -2.88 3.73 -0.06 1.48 2.96 -1.26 -0.78 118.68 121.88 1s9v s LEU 154 Ca 0.09 -1.68 -0.35 0.00 -0.22 0.00 0.00 54.13 51.98 1s9v s LEU 154 Cb -0.02 -1.47 -0.12 0.00 0.50 0.00 0.00 46.19 45.07 1s9v s LEU 154 CO -0.01 -0.29 1.82 -2.65 -1.32 0.00 0.00 176.35 173.90 1s9v n PRO 155 N 4.43 2.08 -1.85 0.98 -0.02 -1.26 -4.87 135.00 134.49 1s9v n PRO 155 Ca -0.06 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1s9v n PRO 155 Cb 0.42 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 1s9v n PRO 155 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1s9v n SER 156 N 5.99 0.23 -0.22 2.55 7.64 -1.26 -2.19 113.62 126.36 1s9v n SER 156 Ca 0.22 -0.93 0.08 0.00 1.01 0.00 0.00 58.87 59.25 1s9v n SER 156 Cb 0.28 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.44 1s9v n SER 156 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s9v n ALA 157 N -3.00 3.48 -1.53 -0.43 0.00 -1.26 -4.55 120.51 113.22 1s9v n ALA 157 Ca 0.00 -0.49 -0.26 0.00 0.00 0.00 0.00 53.44 52.69 1s9v n ALA 157 Cb 0.00 -0.56 0.09 0.00 0.00 0.00 0.00 19.45 18.99 1s9v n ALA 157 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1s9v n GLU 158 N -0.61 2.75 -3.67 0.00 0.00 -1.26 -4.94 120.64 112.92 1s9v n GLU 158 Ca 0.05 -3.49 -0.12 0.00 0.00 0.00 0.00 57.16 53.60 1s9v n GLU 158 Cb 0.30 -2.20 -0.12 0.00 0.00 0.00 0.00 31.44 29.42 1s9v n GLU 158 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1s9v s GLU 159 N -3.61 0.22 0.02 3.44 2.02 -1.26 -5.01 118.70 114.52 1s9v s GLU 159 Ca 0.57 0.79 0.05 0.00 0.02 0.00 0.00 54.97 56.41 1s9v s GLU 159 Cb 0.46 0.04 -0.03 0.00 0.10 0.00 0.00 34.13 34.70 1s9v s GLU 159 CO 0.02 -0.25 -0.13 -1.54 0.02 0.00 0.00 175.26 173.37 1s9v s SER 160 N 2.24 4.14 0.19 -0.19 1.04 -1.26 -4.92 113.70 114.94 1s9v s SER 160 Ca -0.02 -0.31 0.08 0.00 0.48 0.00 0.00 55.95 56.19 1s9v s SER 160 Cb -0.12 -0.81 -0.04 0.00 0.10 0.00 0.00 66.02 65.15 1s9v s SER 160 CO -0.10 0.27 -0.16 -0.31 0.98 0.00 0.00 173.24 173.91 1s9v s TYR 161 N -0.95 1.80 -0.03 5.02 1.51 -1.26 -1.22 117.35 122.21 1s9v s TYR 161 Ca 0.16 -0.51 -0.07 0.00 -1.01 0.00 0.00 57.07 55.64 1s9v s TYR 161 Cb -0.11 -0.86 0.01 0.00 -0.11 0.00 0.00 41.96 40.90 1s9v s TYR 161 CO 0.06 0.37 0.17 -0.51 -1.11 0.00 0.00 175.55 174.54 1s9v s ASP 162 N -3.03 -0.09 -0.23 2.29 1.01 -0.16 -1.63 116.67 114.83 1s9v s ASP 162 Ca 0.20 0.09 -0.09 0.00 0.71 0.00 0.00 52.55 53.46 1s9v s ASP 162 Cb -0.03 0.30 -0.04 0.00 1.01 0.00 0.00 42.92 44.15 1s9v s ASP 162 CO 0.07 -0.23 0.10 0.00 0.21 0.00 0.00 175.17 175.33 1s9v s LYS 164 N 1.14 3.18 -0.19 0.00 2.20 0.50 -1.23 119.74 125.33 1s9v s LYS 164 Ca 0.05 -0.80 -0.03 0.00 -0.36 0.00 0.00 55.97 54.84 1s9v s LYS 164 Cb -0.14 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 1s9v s LYS 164 CO 0.04 -0.40 -0.06 0.08 -0.36 0.00 0.00 175.35 174.65 1s9v s VAL 165 N 1.51 3.36 -0.14 4.02 1.01 0.30 -1.45 120.40 129.01 1s9v s VAL 165 Ca 0.03 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 1s9v s VAL 165 Cb -0.17 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1s9v s VAL 165 CO 0.02 0.45 -0.08 -1.61 0.00 0.00 0.00 175.10 173.89 1s9v s GLU 166 N 1.10 3.54 -0.06 2.72 2.02 0.25 -1.16 118.70 127.11 1s9v s GLU 166 Ca 0.01 -0.59 -0.22 0.00 0.02 0.00 0.00 54.97 54.19 1s9v s GLU 166 Cb -0.15 -2.79 0.05 0.00 0.10 0.00 0.00 34.13 31.35 1s9v s GLU 166 CO -0.01 0.24 0.51 -1.58 0.02 0.00 0.00 175.26 174.44 1s9v s HIS 167 N 0.33 -0.45 0.56 1.61 2.46 -1.26 -1.37 115.29 117.18 1s9v s HIS 167 Ca -0.07 0.82 0.25 0.00 0.47 0.00 0.00 55.06 56.52 1s9v s HIS 167 Cb -0.15 0.25 1.59 0.00 -0.13 0.00 0.00 32.58 34.15 1s9v s HIS 167 CO 0.04 -0.47 2.20 -1.49 -2.47 0.00 0.00 174.74 172.54 1s9v h TRP 168 N 3.69 0.00 -0.01 3.88 6.55 -1.92 -0.64 115.95 127.50 1s9v h TRP 168 Ca -0.28 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.56 1s9v h TRP 168 Cb 1.16 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.46 1s9v h TRP 168 CO 0.44 0.00 0.00 0.41 -1.05 0.00 0.00 178.44 178.24 1s9v n GLY 169 N -1.42 -0.74 3.14 1.49 0.00 -1.26 -4.71 105.19 101.69 1s9v n GLY 169 Ca -0.02 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 1s9v n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s9v s LEU 170 N -0.92 1.92 0.06 0.99 1.43 -0.25 -4.43 118.68 117.47 1s9v s LEU 170 Ca 0.01 -0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 52.54 1s9v s LEU 170 Cb 0.00 -1.01 -0.12 0.00 0.03 0.00 0.00 46.19 45.09 1s9v s LEU 170 CO 0.01 0.15 1.42 -2.24 0.23 0.00 0.00 176.35 175.92 1s9v h ASP 171 N 6.31 0.36 -3.09 2.29 3.04 -1.84 -3.45 116.42 120.04 1s9v h ASP 171 Ca -0.32 -0.39 -0.47 0.00 -3.24 0.00 0.00 57.03 52.61 1s9v h ASP 171 Cb 1.18 -0.10 -0.14 0.00 -1.04 0.00 0.00 39.33 39.23 1s9v h ASP 171 CO 0.48 0.68 -0.69 -0.54 -2.04 0.00 0.00 179.24 177.12 1s9v s LYS 172 N -4.64 1.47 0.43 4.15 3.01 -1.26 -5.11 119.74 117.78 1s9v s LYS 172 Ca -0.14 -1.72 -0.26 0.00 -1.01 0.00 0.00 55.97 52.84 1s9v s LYS 172 Cb 0.06 -1.09 -0.08 0.00 -1.01 0.00 0.00 37.83 35.70 1s9v s LYS 172 CO 0.74 0.07 1.37 -2.14 0.51 0.00 0.00 175.35 175.90 1s9v s PRO 173 N -3.72 3.82 -0.05 -1.68 0.02 -1.26 -4.90 135.00 127.23 1s9v s PRO 173 Ca 0.27 2.29 -0.13 0.00 0.02 0.00 0.00 61.00 63.45 1s9v s PRO 173 Cb 0.03 -2.71 -0.05 0.00 0.02 0.00 0.00 34.50 31.79 1s9v s PRO 173 CO 0.10 -0.66 0.34 -1.17 -0.33 0.00 0.00 177.00 175.29 1s9v s LEU 174 N -2.58 4.41 -0.28 -5.54 0.20 -0.31 -4.93 118.68 109.67 1s9v s LEU 174 Ca 0.59 0.79 0.01 0.00 0.69 0.00 0.00 54.13 56.21 1s9v s LEU 174 Cb -0.41 -2.46 0.08 0.00 -0.43 0.00 0.00 46.19 42.97 1s9v s LEU 174 CO 0.53 0.29 0.02 -0.76 -0.29 0.00 0.00 176.35 176.13 1s9v s LEU 175 N -0.72 2.82 -0.39 -0.68 2.01 -1.26 -0.54 118.68 119.93 1s9v s LEU 175 Ca 0.21 -1.49 -0.15 0.00 0.01 0.00 0.00 54.13 52.71 1s9v s LEU 175 Cb -0.15 -1.14 0.01 0.00 0.01 0.00 0.00 46.19 44.92 1s9v s LEU 175 CO 0.10 -0.32 0.35 -0.75 1.01 0.00 0.00 176.35 176.74 1s9v s LYS 176 N 1.39 3.23 0.22 1.70 2.47 -0.37 -4.90 119.74 123.49 1s9v s LYS 176 Ca 0.03 -0.74 -0.26 0.00 -1.56 0.00 0.00 55.97 53.44 1s9v s LYS 176 Cb -0.18 -3.91 -0.09 0.00 -1.46 0.00 0.00 37.83 32.19 1s9v s LYS 176 CO -0.12 -0.69 0.84 -1.58 0.16 0.00 0.00 175.35 173.97 1s9v s HIS 177 N 1.92 3.87 -2.93 4.03 5.65 -1.26 -1.34 115.29 125.23 1s9v s HIS 177 Ca 0.09 1.71 0.25 0.00 0.25 0.00 0.00 55.06 57.36 1s9v s HIS 177 Cb -0.18 -2.84 0.31 0.00 -1.18 0.00 0.00 32.58 28.70 1s9v s HIS 177 CO 0.12 0.43 1.33 1.87 -0.65 0.00 0.00 174.74 177.84