#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d9k s VAL 3 N 0.00 0.05 -0.02 1.69 1.01 -1.26 -4.14 120.40 117.74 1d9k s VAL 3 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.56 1d9k s VAL 3 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 1d9k s VAL 3 CO 0.00 -0.25 -0.12 -0.13 0.00 0.00 0.00 175.10 174.60 1d9k s ARG 4 N -0.77 1.05 -0.23 2.72 0.52 -0.18 -4.34 118.95 117.72 1d9k s ARG 4 Ca -0.09 -0.41 0.01 0.00 -0.52 0.00 0.00 55.73 54.72 1d9k s ARG 4 Cb -0.05 -0.99 0.06 0.00 0.52 0.00 0.00 34.95 34.48 1d9k s ARG 4 CO 0.00 0.22 -0.07 -0.65 0.02 0.00 0.00 175.30 174.82 1d9k s GLN 5 N -0.12 1.80 0.08 3.54 -0.21 -1.26 0.03 119.66 123.52 1d9k s GLN 5 Ca 0.02 -1.02 -0.21 0.00 0.02 0.00 0.00 55.36 54.16 1d9k s GLN 5 Cb -0.06 -2.61 -0.12 0.00 1.00 0.00 0.00 33.01 31.22 1d9k s GLN 5 CO 0.00 -0.56 1.62 0.77 -2.12 0.00 0.00 175.29 175.00 1d9k h SER 6 N 7.93 0.17 -0.44 5.90 0.02 -1.90 -3.35 113.55 121.87 1d9k h SER 6 Ca -0.20 -0.16 0.04 0.00 -0.84 0.00 0.00 61.79 60.63 1d9k h SER 6 Cb 1.07 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.51 1d9k h SER 6 CO 0.43 0.28 -0.26 -0.81 -1.14 0.00 0.00 176.83 175.33 1d9k n PRO 7 N -4.90 -0.19 -1.98 3.45 -0.04 -1.26 -4.93 135.00 125.15 1d9k n PRO 7 Ca -0.05 1.01 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 1d9k n PRO 7 Cb 0.11 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 1d9k n PRO 7 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d9k n GLN 8 N -4.02 -0.37 -1.90 0.54 10.64 -1.26 -4.72 117.38 116.29 1d9k n GLN 8 Ca 0.01 0.36 0.00 0.00 -1.83 0.00 0.00 57.00 55.53 1d9k n GLN 8 Cb 0.12 -0.51 0.00 0.00 -0.86 0.00 0.00 30.24 28.99 1d9k n GLN 8 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1d9k n SER 9 N 2.04 -7.75 -3.76 2.61 7.64 -1.14 -4.90 113.62 108.37 1d9k n SER 9 Ca 0.00 1.27 -0.11 0.00 1.01 0.00 0.00 58.87 61.04 1d9k n SER 9 Cb 0.00 -4.28 -0.07 0.00 -1.01 0.00 0.00 64.21 58.85 1d9k n SER 9 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1d9k s LEU 10 N -0.44 0.93 -0.09 -3.43 2.96 0.93 -4.94 118.68 114.60 1d9k s LEU 10 Ca 0.00 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.56 1d9k s LEU 10 Cb 0.00 1.35 0.03 0.00 0.50 0.00 0.00 46.19 48.07 1d9k s LEU 10 CO 0.00 -0.66 0.22 -0.89 -1.32 0.00 0.00 176.35 173.70 1d9k s THR 11 N -2.93 -0.02 0.08 3.68 2.01 -1.25 -0.97 115.64 116.23 1d9k s THR 11 Ca -0.02 0.08 -0.02 0.00 0.31 0.00 0.00 61.69 62.04 1d9k s THR 11 Cb 0.00 -0.34 -0.03 0.00 0.01 0.00 0.00 72.50 72.14 1d9k s THR 11 CO -0.06 0.03 0.03 -0.69 -0.69 0.00 0.00 174.62 173.25 1d9k s VAL 12 N 0.72 0.18 -0.20 3.82 1.01 -0.82 -4.97 120.40 120.14 1d9k s VAL 12 Ca -0.05 -1.73 -0.23 0.00 0.00 0.00 0.00 61.98 59.98 1d9k s VAL 12 Cb -0.06 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 1d9k s VAL 12 CO -0.04 -0.82 0.71 0.26 0.00 0.00 0.00 175.10 175.21 1d9k s TRP 13 N -3.94 3.38 0.00 5.22 0.51 -1.26 -0.77 118.94 122.07 1d9k s TRP 13 Ca 0.10 1.05 0.00 0.00 -2.12 0.00 0.00 56.10 55.13 1d9k s TRP 13 Cb 0.07 -2.90 0.00 0.00 -0.81 0.00 0.00 33.47 29.84 1d9k s TRP 13 CO -0.07 -0.23 0.52 -1.91 -0.51 0.00 0.00 176.95 174.74 1d9k n GLU 14 N 5.25 0.00 0.00 4.98 2.13 -0.24 -0.61 120.64 132.15 1d9k n GLU 14 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1d9k n GLU 14 Cb 0.49 -0.73 0.00 0.00 0.27 0.00 0.00 31.44 31.48 1d9k n GLU 14 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1d9k n GLY 15 N 2.85 -2.12 3.73 8.31 0.00 -0.69 -4.93 105.19 112.33 1d9k n GLY 15 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 46.02 46.41 1d9k n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d9k s GLU 16 N -0.92 0.42 0.16 1.61 2.02 0.22 -1.91 118.70 120.29 1d9k s GLU 16 Ca 0.00 0.23 -0.29 0.00 0.02 0.00 0.00 54.97 54.93 1d9k s GLU 16 Cb 0.00 -1.76 -0.07 0.00 0.10 0.00 0.00 34.13 32.40 1d9k s GLU 16 CO 0.00 -2.67 0.91 0.99 0.02 0.00 0.00 175.26 174.51 1d9k s THR 17 N -3.18 4.34 -0.24 3.63 2.01 -1.26 -3.02 115.64 117.92 1d9k s THR 17 Ca 0.66 2.00 -0.10 0.00 0.31 0.00 0.00 61.69 64.56 1d9k s THR 17 Cb -0.14 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 68.03 1d9k s THR 17 CO 0.55 0.41 0.16 -0.89 -0.69 0.00 0.00 174.62 174.17 1d9k s THR 18 N -0.58 5.33 -0.21 -0.82 2.01 0.39 -4.95 115.64 116.80 1d9k s THR 18 Ca 0.43 0.17 0.02 0.00 0.31 0.00 0.00 61.69 62.61 1d9k s THR 18 Cb -0.24 -3.49 0.03 0.00 0.01 0.00 0.00 72.50 68.81 1d9k s THR 18 CO 0.30 0.33 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.77 1d9k s ILE 19 N 1.16 2.16 -0.16 1.82 1.01 -1.26 -0.11 121.20 125.82 1d9k s ILE 19 Ca 0.07 -1.20 -0.02 0.00 0.00 0.00 0.00 60.65 59.51 1d9k s ILE 19 Cb -0.14 -2.06 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 1d9k s ILE 19 CO 0.05 0.31 -0.09 -0.76 0.00 0.00 0.00 174.94 174.45 1d9k s LEU 20 N 1.22 2.85 0.12 2.97 1.43 -0.79 -4.88 118.68 121.61 1d9k s LEU 20 Ca -0.00 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 1d9k s LEU 20 Cb -0.16 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 1d9k s LEU 20 CO -0.09 0.11 0.29 0.20 0.23 0.00 0.00 176.35 177.08 1d9k s ASN 21 N 0.68 6.37 0.12 2.29 0.01 -1.26 -1.53 114.94 121.62 1d9k s ASN 21 Ca -0.05 0.30 -0.02 0.00 -0.71 0.00 0.00 52.86 52.38 1d9k s ASN 21 Cb -0.15 -1.97 -0.04 0.00 0.41 0.00 0.00 41.25 39.50 1d9k s ASN 21 CO 0.02 0.08 0.07 0.00 -1.51 0.00 0.00 177.10 175.76 1d9k s SER 23 N -3.01 -0.61 0.26 0.00 1.04 0.10 -1.43 113.70 110.06 1d9k s SER 23 Ca 0.19 0.37 -0.13 0.00 0.48 0.00 0.00 55.95 56.85 1d9k s SER 23 Cb 0.07 0.56 -0.00 0.00 0.10 0.00 0.00 66.02 66.75 1d9k s SER 23 CO -0.01 -0.77 0.51 -0.72 0.98 0.00 0.00 173.24 173.23 1d9k s TYR 24 N -2.42 0.32 0.00 5.02 -0.85 -0.92 -1.01 117.35 117.49 1d9k s TYR 24 Ca -0.05 -0.70 0.00 0.00 -0.52 0.00 0.00 57.07 55.80 1d9k s TYR 24 Cb -0.00 0.25 0.00 0.00 0.38 0.00 0.00 41.96 42.59 1d9k s TYR 24 CO -0.01 -1.04 0.00 0.39 -1.52 0.00 0.00 175.55 173.37 1d9k n GLU 25 N -0.40 0.00 -1.48 -3.49 1.02 -1.26 -4.48 120.64 110.54 1d9k n GLU 25 Ca -0.02 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.67 1d9k n GLU 25 Cb 0.61 -0.63 -0.07 0.00 -0.02 0.00 0.00 31.44 31.33 1d9k n GLU 25 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1d9k n ASP 26 N -2.59 1.84 0.00 1.62 -0.08 -1.26 -4.75 116.55 111.33 1d9k n ASP 26 Ca 0.00 0.12 0.03 0.00 -1.51 0.00 0.00 54.79 53.43 1d9k n ASP 26 Cb 0.39 -1.29 0.17 0.00 2.34 0.00 0.00 41.12 42.73 1d9k n ASP 26 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1d9k n SER 27 N 11.58 0.00 0.16 1.67 7.64 -1.26 -0.41 113.62 133.00 1d9k n SER 27 Ca 0.45 -0.05 0.12 0.00 1.01 0.00 0.00 58.87 60.40 1d9k n SER 27 Cb 0.28 -0.10 0.21 0.00 -1.01 0.00 0.00 64.21 63.59 1d9k n SER 27 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1d9k h THR 28 N 0.00 0.00 -3.21 0.44 2.02 -1.94 -3.46 112.91 106.77 1d9k h THR 28 Ca 0.00 -0.82 -0.53 0.00 0.77 0.00 0.00 66.41 65.83 1d9k h THR 28 Cb 0.02 1.73 0.02 0.00 -1.74 0.00 0.00 68.15 68.18 1d9k h THR 28 CO 0.00 0.00 0.64 -0.36 0.37 0.00 0.00 175.52 176.17 1d9k s PHE 29 N -3.20 3.32 0.02 3.16 0.40 0.45 -4.66 117.98 117.47 1d9k s PHE 29 Ca 0.07 1.17 -0.02 0.00 -0.60 0.00 0.00 56.93 57.55 1d9k s PHE 29 Cb 0.08 -3.56 -0.02 0.00 0.51 0.00 0.00 43.02 40.03 1d9k s PHE 29 CO 0.67 -1.83 0.00 0.16 0.70 0.00 0.00 175.22 174.93 1d9k s ASP 30 N 0.77 0.22 0.11 1.36 1.47 0.22 -4.93 116.67 115.89 1d9k s ASP 30 Ca 0.60 -0.48 0.00 0.00 1.18 0.00 0.00 52.55 53.84 1d9k s ASP 30 Cb -0.34 0.13 0.00 0.00 -0.34 0.00 0.00 42.92 42.37 1d9k s ASP 30 CO 0.33 -0.34 0.00 0.00 0.68 0.00 0.00 175.17 175.84 1d9k n TYR 31 N 1.44 -5.03 -3.81 2.11 9.36 -1.25 -3.54 117.16 116.44 1d9k n TYR 31 Ca -0.23 3.01 -0.29 0.00 3.32 0.00 0.00 57.90 63.72 1d9k n TYR 31 Cb 0.56 -3.82 -0.16 0.00 -0.63 0.00 0.00 39.34 35.28 1d9k n TYR 31 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 1d9k s PHE 32 N -0.58 1.53 0.22 2.98 0.40 0.48 -2.74 117.98 120.27 1d9k s PHE 32 Ca 0.00 -1.18 0.03 0.00 -0.60 0.00 0.00 56.93 55.18 1d9k s PHE 32 Cb 0.00 -1.23 -0.03 0.00 0.51 0.00 0.00 43.02 42.27 1d9k s PHE 32 CO 0.00 -0.67 0.36 -1.25 0.70 0.00 0.00 175.22 174.37 1d9k s PRO 33 N 1.69 3.45 -0.00 0.24 0.04 -1.08 -1.60 135.00 137.75 1d9k s PRO 33 Ca -0.03 -0.63 0.06 0.00 0.04 0.00 0.00 61.00 60.45 1d9k s PRO 33 Cb -0.18 -2.88 -0.03 0.00 0.04 0.00 0.00 34.50 31.46 1d9k s PRO 33 CO -0.07 0.42 -0.19 -1.58 0.04 0.00 0.00 177.00 175.62 1d9k s TRP 34 N -1.94 2.55 0.15 0.56 0.52 -1.12 -0.93 118.94 118.71 1d9k s TRP 34 Ca 0.35 -0.27 0.11 0.00 0.02 0.00 0.00 56.10 56.31 1d9k s TRP 34 Cb -0.10 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.66 1d9k s TRP 34 CO 0.30 0.16 -0.26 0.71 0.02 0.00 0.00 176.95 177.88 1d9k s TYR 35 N -0.79 2.27 -0.11 -1.98 2.02 0.34 -0.19 117.35 118.92 1d9k s TYR 35 Ca 0.12 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.45 1d9k s TYR 35 Cb -0.10 -1.20 0.02 0.00 -0.40 0.00 0.00 41.96 40.28 1d9k s TYR 35 CO 0.02 0.38 -0.11 -0.98 -1.57 0.00 0.00 175.55 173.29 1d9k s ARG 36 N -2.23 1.79 -0.24 -0.62 1.70 -0.25 0.21 118.95 119.32 1d9k s ARG 36 Ca 0.15 -0.38 -0.11 0.00 -0.47 0.00 0.00 55.73 54.92 1d9k s ARG 36 Cb -0.09 -1.70 -0.05 0.00 -0.57 0.00 0.00 34.95 32.54 1d9k s ARG 36 CO 0.07 -0.19 0.20 -1.14 -1.08 0.00 0.00 175.30 173.16 1d9k s GLN 37 N 1.41 4.08 -0.13 3.89 0.74 -1.26 -3.24 119.66 125.15 1d9k s GLN 37 Ca 0.01 -0.19 -0.19 0.00 0.05 0.00 0.00 55.36 55.03 1d9k s GLN 37 Cb -0.13 -3.55 -0.04 0.00 1.10 0.00 0.00 33.01 30.39 1d9k s GLN 37 CO -0.06 0.02 0.54 -0.06 -0.55 0.00 0.00 175.29 175.18 1d9k s PHE 38 N 1.17 3.48 -0.25 1.67 2.99 -1.26 -0.90 117.98 124.88 1d9k s PHE 38 Ca 0.09 0.94 -0.23 0.00 0.00 0.00 0.00 56.93 57.73 1d9k s PHE 38 Cb -0.14 -2.64 -0.10 0.00 0.00 0.00 0.00 43.02 40.14 1d9k s PHE 38 CO 0.06 0.07 0.93 -2.30 -0.00 0.00 0.00 175.22 173.97 1d9k n PRO 39 N 4.04 0.00 -1.01 0.24 -0.01 -1.26 0.59 135.00 137.58 1d9k n PRO 39 Ca -0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 63.50 63.44 1d9k n PRO 39 Cb 0.51 -0.76 -0.00 0.00 -0.01 0.00 0.00 33.50 33.24 1d9k n PRO 39 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 1d9k n GLY 40 N 2.80 0.47 3.21 -1.23 0.00 -1.26 -5.03 105.19 104.15 1d9k n GLY 40 Ca 0.21 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1d9k n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d9k s LYS 41 N -0.91 1.09 0.57 1.61 1.02 0.20 -5.16 119.74 118.16 1d9k s LYS 41 Ca 0.00 -1.54 -0.16 0.00 0.02 0.00 0.00 55.97 54.29 1d9k s LYS 41 Cb 0.00 0.00 -0.05 0.00 -0.52 0.00 0.00 37.83 37.26 1d9k s LYS 41 CO 0.00 -0.24 1.03 -1.54 -0.92 0.00 0.00 175.35 173.68 1d9k s SER 42 N -3.14 6.08 0.54 2.83 1.04 -1.26 -4.20 113.70 115.59 1d9k s SER 42 Ca 0.28 1.71 -0.20 0.00 0.48 0.00 0.00 55.95 58.21 1d9k s SER 42 Cb 0.07 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.62 1d9k s SER 42 CO 0.05 -0.96 1.19 -2.84 0.98 0.00 0.00 173.24 171.67 1d9k s PRO 43 N -4.16 3.29 0.01 4.02 0.02 -1.26 -4.47 135.00 132.46 1d9k s PRO 43 Ca 0.61 1.80 -0.02 0.00 0.02 0.00 0.00 61.00 63.41 1d9k s PRO 43 Cb -0.14 -2.11 -0.01 0.00 0.02 0.00 0.00 34.50 32.26 1d9k s PRO 43 CO 0.36 -0.94 0.03 0.00 -0.33 0.00 0.00 177.00 176.12 1d9k s ALA 44 N -1.59 -0.03 1.19 -1.55 0.00 -1.20 -4.96 121.76 113.62 1d9k s ALA 44 Ca 0.72 -0.42 -0.14 0.00 0.00 0.00 0.00 51.96 52.12 1d9k s ALA 44 Cb -0.29 0.13 0.29 0.00 0.00 0.00 0.00 23.12 23.24 1d9k s ALA 44 CO 0.33 -0.17 1.02 -1.17 0.00 0.00 0.00 175.76 175.78 1d9k s LEU 45 N -1.38 0.59 0.00 0.00 2.96 -1.26 -1.08 118.68 118.50 1d9k s LEU 45 Ca -0.15 1.31 0.00 0.00 -0.22 0.00 0.00 54.13 55.07 1d9k s LEU 45 Cb -0.09 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.44 1d9k s LEU 45 CO -0.00 -4.26 0.00 -0.11 -1.32 0.00 0.00 176.35 170.66 1d9k n LEU 46 N -4.94 0.00 -2.35 -0.68 0.00 0.74 -4.59 117.00 105.19 1d9k n LEU 46 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.05 1d9k n LEU 46 Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.97 1d9k n LEU 46 CO 0.56 0.00 -0.22 -0.38 0.00 0.00 0.00 177.39 177.35 1d9k n ILE 47 N 0.00 -5.48 -4.38 1.96 5.41 -1.26 -3.44 119.36 112.17 1d9k n ILE 47 Ca 0.00 1.23 -0.27 0.00 1.00 0.00 0.00 62.75 64.71 1d9k n ILE 47 Cb 0.00 -3.54 -0.11 0.00 -0.71 0.00 0.00 39.64 35.27 1d9k n ILE 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1d9k s ALA 48 N -0.25 2.64 0.01 -1.39 0.00 -1.26 -2.80 121.76 118.71 1d9k s ALA 48 Ca -0.03 -1.56 -0.12 0.00 0.00 0.00 0.00 51.96 50.25 1d9k s ALA 48 Cb 0.00 -0.46 0.01 0.00 0.00 0.00 0.00 23.12 22.67 1d9k s ALA 48 CO 0.09 0.46 0.25 0.42 0.00 0.00 0.00 175.76 176.98 1d9k s ILE 49 N -1.58 0.08 0.06 0.00 1.01 -0.63 -4.95 121.20 115.20 1d9k s ILE 49 Ca 0.21 -0.62 0.08 0.00 0.00 0.00 0.00 60.65 60.31 1d9k s ILE 49 Cb -0.09 -0.67 -0.03 0.00 0.01 0.00 0.00 42.46 41.68 1d9k s ILE 49 CO 0.11 -0.34 -0.19 -0.94 0.00 0.00 0.00 174.94 173.58 1d9k s SER 50 N -1.58 3.79 0.53 3.58 1.04 -1.26 0.18 113.70 119.99 1d9k s SER 50 Ca -0.11 -0.47 0.20 0.00 0.48 0.00 0.00 55.95 56.05 1d9k s SER 50 Cb -0.04 -0.58 1.10 0.00 0.10 0.00 0.00 66.02 66.60 1d9k s SER 50 CO 0.01 0.23 1.57 0.17 0.98 0.00 0.00 173.24 176.21 1d9k h LEU 51 N 4.33 0.00 -0.55 2.42 -0.00 -1.92 -2.58 115.31 117.00 1d9k h LEU 51 Ca -0.48 0.00 0.11 0.00 -0.00 0.00 0.00 57.88 57.51 1d9k h LEU 51 Cb 1.16 0.00 -0.11 0.00 -0.00 0.00 0.00 40.66 41.71 1d9k h LEU 51 CO 0.47 0.00 -0.22 0.58 -0.00 0.00 0.00 178.44 179.27 1d9k h VAL 52 N 0.00 0.32 -5.31 0.15 2.07 -2.01 -3.42 116.25 108.04 1d9k h VAL 52 Ca 0.00 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 67.19 1d9k h VAL 52 Cb 0.79 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1d9k h VAL 52 CO 0.00 0.00 -0.11 -1.54 0.02 0.00 0.00 177.57 175.94 1d9k n SER 53 N -5.42 1.73 -0.29 0.57 3.41 -0.97 -5.07 113.62 107.57 1d9k n SER 53 Ca 0.05 -2.06 0.05 0.00 -0.26 0.00 0.00 58.87 56.66 1d9k n SER 53 Cb 0.33 -0.12 0.07 0.00 -0.26 0.00 0.00 64.21 64.23 1d9k n SER 53 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1d9k n ASN 54 N -2.20 1.22 -3.58 4.04 4.13 -1.26 -4.84 115.26 112.77 1d9k n ASN 54 Ca 0.03 -2.57 -0.06 0.00 1.68 0.00 0.00 54.58 53.67 1d9k n ASN 54 Cb 0.37 -0.32 -0.03 0.00 -1.54 0.00 0.00 39.78 38.26 1d9k n ASN 54 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1d9k s LYS 55 N -1.49 0.42 -0.28 3.52 2.20 -1.26 -3.20 119.74 119.65 1d9k s LYS 55 Ca 0.17 -0.07 -0.17 0.00 -0.36 0.00 0.00 55.97 55.53 1d9k s LYS 55 Cb 0.15 0.20 0.10 0.00 -1.51 0.00 0.00 37.83 36.76 1d9k s LYS 55 CO 0.01 -0.17 0.78 0.21 -0.36 0.00 0.00 175.35 175.83 1d9k s LYS 56 N -2.07 0.62 0.12 4.03 2.47 -1.00 -4.96 119.74 118.95 1d9k s LYS 56 Ca 0.06 1.03 0.10 0.00 -1.56 0.00 0.00 55.97 55.60 1d9k s LYS 56 Cb -0.01 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.47 1d9k s LYS 56 CO -0.05 -0.12 -0.25 -1.21 0.16 0.00 0.00 175.35 173.88 1d9k s GLU 57 N 1.40 1.31 -0.43 4.03 2.02 -1.26 -1.43 118.70 124.34 1d9k s GLU 57 Ca -0.08 -1.28 0.06 0.00 0.02 0.00 0.00 54.97 53.69 1d9k s GLU 57 Cb -0.05 -1.71 0.18 0.00 0.10 0.00 0.00 34.13 32.65 1d9k s GLU 57 CO -0.16 0.40 0.69 0.34 0.02 0.00 0.00 175.26 176.55 1d9k s ASP 58 N -1.99 -1.41 0.26 -0.19 2.15 -0.49 -5.02 116.67 109.99 1d9k s ASP 58 Ca 0.11 -0.99 0.00 0.00 0.43 0.00 0.00 52.55 52.10 1d9k s ASP 58 Cb -0.10 1.82 0.00 0.00 -0.30 0.00 0.00 42.92 44.34 1d9k s ASP 58 CO 0.05 -0.13 0.00 0.61 -0.17 0.00 0.00 175.17 175.54 1d9k n GLY 59 N 3.93 -0.16 0.04 2.66 0.00 -1.26 -2.81 105.19 107.59 1d9k n GLY 59 Ca 0.13 -1.01 0.09 0.00 0.00 0.00 0.00 46.02 45.22 1d9k n GLY 59 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1d9k n ARG 61 N 0.00 0.07 -2.62 1.61 1.85 -1.26 -4.66 116.66 111.65 1d9k n ARG 61 Ca 0.00 0.29 -0.43 0.00 -1.00 0.00 0.00 57.85 56.72 1d9k n ARG 61 Cb 0.00 -1.62 -0.02 0.00 -1.05 0.00 0.00 32.46 29.76 1d9k n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1d9k s PHE 62 N -3.10 3.37 -0.04 2.89 0.40 -1.12 -2.48 117.98 117.89 1d9k s PHE 62 Ca 0.06 1.45 -0.04 0.00 -0.60 0.00 0.00 56.93 57.81 1d9k s PHE 62 Cb 0.10 -3.28 0.01 0.00 0.51 0.00 0.00 43.02 40.37 1d9k s PHE 62 CO 0.32 -0.61 0.11 0.99 0.70 0.00 0.00 175.22 176.73 1d9k s THR 63 N 2.38 -0.00 -0.11 0.64 2.01 -0.59 -1.40 115.64 118.58 1d9k s THR 63 Ca 0.50 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.51 1d9k s THR 63 Cb -0.19 -0.16 -0.02 0.00 0.01 0.00 0.00 72.50 72.14 1d9k s THR 63 CO 0.16 0.00 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.35 1d9k s ILE 64 N 0.11 3.21 -0.17 1.82 1.01 -0.51 0.89 121.20 127.58 1d9k s ILE 64 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1d9k s ILE 64 Cb -0.01 -2.33 -0.00 0.00 0.01 0.00 0.00 42.46 40.12 1d9k s ILE 64 CO -0.00 0.54 -0.13 -0.36 0.00 0.00 0.00 174.94 174.99 1d9k s PHE 65 N -0.02 2.83 -0.02 3.97 0.40 0.14 -2.38 117.98 122.89 1d9k s PHE 65 Ca -0.03 -0.99 0.08 0.00 -0.60 0.00 0.00 56.93 55.39 1d9k s PHE 65 Cb -0.14 -1.93 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 1d9k s PHE 65 CO 0.04 -0.46 -0.25 0.12 0.70 0.00 0.00 175.22 175.37 1d9k s PHE 66 N 0.90 2.37 -0.14 0.36 5.36 -1.19 -1.02 117.98 124.62 1d9k s PHE 66 Ca -0.03 -0.41 0.01 0.00 -0.96 0.00 0.00 56.93 55.54 1d9k s PHE 66 Cb -0.15 -1.51 0.02 0.00 -0.34 0.00 0.00 43.02 41.04 1d9k s PHE 66 CO -0.01 -0.01 -0.15 1.21 -1.46 0.00 0.00 175.22 174.80 1d9k s ASN 67 N -0.63 2.68 0.00 6.13 3.04 -0.41 -4.74 114.94 121.01 1d9k s ASN 67 Ca 0.10 -0.49 0.00 0.00 0.04 0.00 0.00 52.86 52.51 1d9k s ASN 67 Cb -0.10 -1.19 0.00 0.00 -1.54 0.00 0.00 41.25 38.42 1d9k s ASN 67 CO -0.01 -0.03 0.00 1.17 -3.04 0.00 0.00 177.10 175.19 1d9k n LYS 68 N 4.59 0.00 -1.47 0.43 3.00 -1.26 -3.27 118.16 120.18 1d9k n LYS 68 Ca -0.18 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 57.84 1d9k n LYS 68 Cb 0.50 -0.20 0.15 0.00 0.00 0.00 0.00 35.03 35.48 1d9k n LYS 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1d9k s ARG 69 N 0.00 0.96 -0.95 1.64 3.52 -1.26 -3.29 118.95 119.57 1d9k s ARG 69 Ca 0.00 0.30 -0.05 0.00 -0.13 0.00 0.00 55.73 55.85 1d9k s ARG 69 Cb 0.00 -1.82 -0.06 0.00 -1.56 0.00 0.00 34.95 31.51 1d9k s ARG 69 CO 0.00 -2.32 0.83 -1.91 -0.81 0.00 0.00 175.30 171.09 1d9k n GLU 70 N -3.86 -2.01 -0.55 5.12 2.13 -1.26 -4.57 120.64 115.65 1d9k n GLU 70 Ca 0.06 0.85 -0.33 0.00 0.66 0.00 0.00 57.16 58.40 1d9k n GLU 70 Cb 0.59 -5.49 -0.09 0.00 0.27 0.00 0.00 31.44 26.72 1d9k n GLU 70 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1d9k n LYS 71 N -2.99 0.00 -4.10 5.31 5.02 -1.21 -4.80 118.16 115.39 1d9k n LYS 71 Ca -0.06 -0.78 -0.31 0.00 -2.02 0.00 0.00 58.31 55.15 1d9k n LYS 71 Cb 0.60 -2.19 -0.07 0.00 -0.02 0.00 0.00 35.03 33.35 1d9k n LYS 71 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1d9k s LYS 72 N 6.08 2.74 0.02 1.97 1.02 -1.20 -2.16 119.74 128.20 1d9k s LYS 72 Ca 0.51 -0.74 -0.06 0.00 0.02 0.00 0.00 55.97 55.70 1d9k s LYS 72 Cb 0.11 -2.65 -0.00 0.00 -0.52 0.00 0.00 37.83 34.77 1d9k s LYS 72 CO 0.26 0.56 0.11 -1.17 -0.92 0.00 0.00 175.35 174.19 1d9k s LEU 73 N -2.27 1.69 -0.29 3.17 2.96 -0.51 -1.28 118.68 122.15 1d9k s LEU 73 Ca 0.27 -0.37 -0.14 0.00 -0.22 0.00 0.00 54.13 53.67 1d9k s LEU 73 Cb -0.12 0.62 0.10 0.00 0.50 0.00 0.00 46.19 47.30 1d9k s LEU 73 CO 0.19 -0.43 0.70 -0.94 -1.32 0.00 0.00 176.35 174.56 1d9k s SER 74 N -1.73 -0.97 -0.17 3.68 1.04 -0.18 0.39 113.70 115.76 1d9k s SER 74 Ca -0.10 1.47 -0.10 0.00 0.48 0.00 0.00 55.95 57.70 1d9k s SER 74 Cb -0.05 1.67 -0.05 0.00 0.10 0.00 0.00 66.02 67.69 1d9k s SER 74 CO -0.01 -0.22 0.16 -0.22 0.98 0.00 0.00 173.24 173.93 1d9k s LEU 75 N 2.03 4.27 -0.19 2.42 2.96 -0.58 -0.68 118.68 128.90 1d9k s LEU 75 Ca -0.08 0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1d9k s LEU 75 Cb -0.07 -2.14 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 1d9k s LEU 75 CO -0.19 0.23 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.99 1d9k s HIS 76 N -0.00 2.91 -0.23 5.38 3.76 0.26 -1.88 115.29 125.48 1d9k s HIS 76 Ca 0.11 -0.85 -0.10 0.00 -0.15 0.00 0.00 55.06 54.07 1d9k s HIS 76 Cb -0.12 -2.01 -0.05 0.00 1.11 0.00 0.00 32.58 31.52 1d9k s HIS 76 CO 0.01 -0.43 0.16 0.42 -0.85 0.00 0.00 174.74 174.04 1d9k s ILE 77 N 1.05 5.36 0.20 0.60 1.01 0.84 -1.54 121.20 128.73 1d9k s ILE 77 Ca 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.82 1d9k s ILE 77 Cb -0.15 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1d9k s ILE 77 CO -0.01 0.36 0.39 -0.89 0.00 0.00 0.00 174.94 174.79 1d9k s THR 78 N 0.96 5.20 -1.08 2.92 2.01 -1.03 -0.46 115.64 124.16 1d9k s THR 78 Ca 0.08 -0.36 -0.03 0.00 0.31 0.00 0.00 61.69 61.68 1d9k s THR 78 Cb -0.13 -3.73 0.03 0.00 0.01 0.00 0.00 72.50 68.67 1d9k s THR 78 CO 0.04 -0.17 0.19 -0.67 -0.69 0.00 0.00 174.62 173.32 1d9k n ASP 79 N -0.65 -3.70 -2.38 3.53 -0.08 -1.00 -4.55 116.55 107.72 1d9k n ASP 79 Ca -0.05 -0.01 -0.24 0.00 -1.51 0.00 0.00 54.79 52.98 1d9k n ASP 79 Cb 0.54 -3.12 -0.08 0.00 2.34 0.00 0.00 41.12 40.80 1d9k n ASP 79 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1d9k n SER 80 N -1.98 0.22 -4.97 1.67 7.64 -0.80 -4.41 113.62 110.98 1d9k n SER 80 Ca -0.09 0.16 -0.22 0.00 1.01 0.00 0.00 58.87 59.74 1d9k n SER 80 Cb 0.58 -0.49 -0.02 0.00 -1.01 0.00 0.00 64.21 63.27 1d9k n SER 80 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1d9k s GLN 81 N 4.43 3.44 0.41 1.43 -0.21 -1.26 -1.71 119.66 126.20 1d9k s GLN 81 Ca 0.71 -0.72 -0.24 0.00 0.02 0.00 0.00 55.36 55.12 1d9k s GLN 81 Cb -0.71 -2.89 -0.08 0.00 1.00 0.00 0.00 33.01 30.33 1d9k s GLN 81 CO 0.28 0.42 1.13 -1.25 -2.12 0.00 0.00 175.29 173.76 1d9k s PRO 82 N -3.93 4.02 0.00 2.91 0.04 -1.26 -2.07 135.00 134.71 1d9k s PRO 82 Ca 0.34 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1d9k s PRO 82 Cb -0.09 -2.57 0.00 0.00 0.04 0.00 0.00 34.50 31.88 1d9k s PRO 82 CO 0.29 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1d9k n GLY 83 N 0.50 1.79 0.01 0.56 0.00 -1.26 -4.81 105.19 101.99 1d9k n GLY 83 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1d9k n GLY 83 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d9k n ASP 84 N 0.00 0.69 -4.65 1.61 8.00 -0.88 -4.84 116.55 116.47 1d9k n ASP 84 Ca 0.00 -0.52 -0.42 0.00 0.71 0.00 0.00 54.79 54.56 1d9k n ASP 84 Cb 0.00 0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 41.56 1d9k n ASP 84 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1d9k s SER 85 N -2.98 6.48 0.00 -2.24 1.04 -1.26 -4.87 113.70 109.87 1d9k s SER 85 Ca 0.10 2.28 0.00 0.00 0.48 0.00 0.00 55.95 58.81 1d9k s SER 85 Cb 0.17 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.76 1d9k s SER 85 CO 0.75 -1.07 0.00 0.00 0.98 0.00 0.00 173.24 173.90 1d9k n ALA 86 N 7.72 0.00 -0.01 5.32 0.00 -0.79 -4.68 120.51 128.07 1d9k n ALA 86 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.62 1d9k n ALA 86 Cb 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.76 1d9k n ALA 86 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1d9k n THR 87 N 0.00 1.05 -2.81 0.00 -1.04 -0.08 -0.40 114.28 110.99 1d9k n THR 87 Ca 0.00 -0.71 -0.03 0.00 -2.04 0.00 0.00 64.05 61.27 1d9k n THR 87 Cb 0.00 -0.55 -0.03 0.00 -1.82 0.00 0.00 70.33 67.94 1d9k n THR 87 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1d9k n TYR 88 N -2.75 -2.67 -4.01 -1.42 4.02 -1.26 -1.36 117.16 107.73 1d9k n TYR 88 Ca -0.15 1.51 -0.36 0.00 -0.01 0.00 0.00 57.90 58.89 1d9k n TYR 88 Cb 0.88 -2.76 -0.07 0.00 -0.02 0.00 0.00 39.34 37.37 1d9k n TYR 88 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1d9k s PHE 89 N -0.53 3.48 -0.26 -0.72 0.40 0.56 -1.61 117.98 119.29 1d9k s PHE 89 Ca -0.15 0.43 -0.08 0.00 -0.60 0.00 0.00 56.93 56.53 1d9k s PHE 89 Cb 0.01 -1.89 -0.03 0.00 0.51 0.00 0.00 43.02 41.62 1d9k s PHE 89 CO 0.48 0.66 0.08 0.00 0.70 0.00 0.00 175.22 177.14 1d9k s ALA 91 N 1.62 2.97 0.14 0.00 0.00 -0.11 -0.91 121.76 125.47 1d9k s ALA 91 Ca 0.06 -1.34 0.01 0.00 0.00 0.00 0.00 51.96 50.69 1d9k s ALA 91 Cb -0.15 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.08 1d9k s ALA 91 CO 0.04 0.57 0.01 0.00 0.00 0.00 0.00 175.76 176.38 1d9k s ALA 92 N -1.42 1.09 0.00 0.00 0.00 -0.88 -2.62 121.76 117.91 1d9k s ALA 92 Ca 0.23 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1d9k s ALA 92 Cb -0.10 0.60 0.00 0.00 0.00 0.00 0.00 23.12 23.62 1d9k s ALA 92 CO 0.15 -0.37 0.00 -2.37 0.00 0.00 0.00 175.76 173.16 1d9k n THR 93 N -0.15 0.00 0.00 0.00 5.66 -1.11 -2.00 114.28 116.69 1d9k n THR 93 Ca -0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1d9k n THR 93 Cb 0.63 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 1d9k n THR 93 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1d9k n GLY 99 N 0.00 -0.43 0.00 1.09 0.00 -1.23 0.73 105.19 105.35 1d9k n GLY 99 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1d9k n GLY 99 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1d9k n SER 100 N 0.00 0.00 -2.12 1.61 7.64 -1.26 -4.92 113.62 114.57 1d9k n SER 100 Ca 0.00 -1.00 -0.01 0.00 1.01 0.00 0.00 58.87 58.87 1d9k n SER 100 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1d9k n SER 100 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1d9k n PHE 101 N 0.00 -1.97 -2.22 1.43 7.35 -1.26 -4.82 117.46 115.97 1d9k n PHE 101 Ca 0.00 0.86 0.00 0.00 -0.76 0.00 0.00 57.45 57.55 1d9k n PHE 101 Cb 0.37 -2.77 0.00 0.00 0.35 0.00 0.00 39.48 37.42 1d9k n PHE 101 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1d9k n ASN 102 N 0.23 -6.98 0.00 -2.13 5.15 -1.26 -5.06 115.26 105.21 1d9k n ASN 102 Ca 0.01 1.60 0.00 0.00 -0.60 0.00 0.00 54.58 55.59 1d9k n ASN 102 Cb 0.04 -4.24 0.00 0.00 -0.53 0.00 0.00 39.78 35.05 1d9k n ASN 102 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1d9k n LYS 103 N 1.89 0.00 -4.96 1.20 4.81 -1.26 -5.12 118.16 114.72 1d9k n LYS 103 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.17 1d9k n LYS 103 Cb 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 34.90 1d9k n LYS 103 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1d9k s LEU 104 N 0.00 2.07 -0.30 3.14 1.43 -1.26 -4.67 118.68 119.09 1d9k s LEU 104 Ca 0.00 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 1d9k s LEU 104 Cb 0.00 -1.09 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 1d9k s LEU 104 CO 0.00 0.24 0.24 -0.89 0.23 0.00 0.00 176.35 176.17 1d9k s THR 105 N -0.58 5.28 0.16 5.49 2.01 -0.85 -4.99 115.64 122.17 1d9k s THR 105 Ca 0.08 0.08 -0.09 0.00 0.31 0.00 0.00 61.69 62.07 1d9k s THR 105 Cb -0.08 -3.63 -0.06 0.00 0.01 0.00 0.00 72.50 68.73 1d9k s THR 105 CO -0.00 0.13 0.48 -0.36 -0.69 0.00 0.00 174.62 174.18 1d9k s PHE 106 N 1.80 3.50 0.00 4.92 0.40 -1.26 -2.08 117.98 125.26 1d9k s PHE 106 Ca 0.08 0.82 0.00 0.00 -0.60 0.00 0.00 56.93 57.23 1d9k s PHE 106 Cb -0.16 -2.20 0.00 0.00 0.51 0.00 0.00 43.02 41.17 1d9k s PHE 106 CO 0.11 0.38 0.00 0.41 0.70 0.00 0.00 175.22 176.82 1d9k n GLY 107 N 0.29 -0.63 0.52 4.36 0.00 -0.08 -4.57 105.19 105.08 1d9k n GLY 107 Ca -0.03 -1.70 0.11 0.00 0.00 0.00 0.00 46.02 44.41 1d9k n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d9k n ALA 108 N -3.00 3.46 -0.34 4.61 0.00 -1.26 -4.84 120.51 119.14 1d9k n ALA 108 Ca 0.00 -0.64 0.03 0.00 0.00 0.00 0.00 53.44 52.83 1d9k n ALA 108 Cb 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 1d9k n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d9k n GLY 109 N 1.41 -2.90 2.67 0.00 0.00 -1.26 -4.96 105.19 100.15 1d9k n GLY 109 Ca 0.10 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1d9k n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d9k s THR 110 N -3.66 0.62 0.06 2.61 2.01 -0.46 -4.60 115.64 112.22 1d9k s THR 110 Ca 0.00 -1.27 -0.31 0.00 0.31 0.00 0.00 61.69 60.42 1d9k s THR 110 Cb 0.00 -1.48 -0.08 0.00 0.01 0.00 0.00 72.50 70.95 1d9k s THR 110 CO 0.00 -0.71 1.62 -0.60 -0.69 0.00 0.00 174.62 174.24 1d9k s ARG 111 N 1.69 4.21 0.14 4.92 3.52 -1.01 -4.14 118.95 128.29 1d9k s ARG 111 Ca 0.10 2.28 0.10 0.00 -0.13 0.00 0.00 55.73 58.08 1d9k s ARG 111 Cb -0.17 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.60 1d9k s ARG 111 CO -0.27 -0.71 -0.23 -1.17 -0.81 0.00 0.00 175.30 172.11 1d9k s LEU 112 N 2.55 2.36 -0.07 -0.88 2.96 0.46 -0.05 118.68 126.01 1d9k s LEU 112 Ca 0.72 -0.78 -0.03 0.00 -0.22 0.00 0.00 54.13 53.82 1d9k s LEU 112 Cb -0.39 -1.05 0.04 0.00 0.50 0.00 0.00 46.19 45.29 1d9k s LEU 112 CO 0.31 0.09 0.16 0.00 -1.32 0.00 0.00 176.35 175.60 1d9k s ALA 113 N -1.42 -0.30 -0.41 5.97 0.00 -0.14 -1.88 121.76 123.58 1d9k s ALA 113 Ca 0.14 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.70 1d9k s ALA 113 Cb -0.09 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.57 1d9k s ALA 113 CO 0.07 -0.20 0.26 0.08 0.00 0.00 0.00 175.76 175.96 1d9k s VAL 114 N 1.29 4.57 0.08 0.00 1.01 -1.26 -1.95 120.40 124.14 1d9k s VAL 114 Ca -0.08 -1.08 -0.31 0.00 0.00 0.00 0.00 61.98 60.51 1d9k s VAL 114 Cb -0.11 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.54 1d9k s VAL 114 CO -0.06 -0.39 1.27 -0.94 0.00 0.00 0.00 175.10 174.98 1d9k s SER 115 N 1.91 6.99 0.00 3.32 1.04 0.05 -4.18 113.70 122.83 1d9k s SER 115 Ca 0.03 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.59 1d9k s SER 115 Cb -0.21 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.33 1d9k s SER 115 CO 0.05 -0.53 0.00 -0.81 0.98 0.00 0.00 173.24 172.93 1d9k n PRO 116 N 3.89 3.32 -0.23 4.02 -0.04 -1.26 -1.08 135.00 143.62 1d9k n PRO 116 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1d9k n PRO 116 Cb 0.45 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.91 1d9k n PRO 116 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44