#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w0k n PHE 2 N 0.00 -1.24 -3.58 1.20 1.16 -1.26 -4.88 117.46 108.86 2w0k n PHE 2 Ca 0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 57.45 55.52 2w0k n PHE 2 Cb 0.00 0.09 -0.02 0.00 -1.61 0.00 0.00 39.48 37.94 2w0k n PHE 2 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 2w0k s MET 3 N 0.00 0.76 -0.10 3.97 1.75 -1.26 -4.95 119.30 119.46 2w0k s MET 3 Ca 0.00 -0.33 0.00 0.00 -1.25 0.00 0.00 55.69 54.11 2w0k s MET 3 Cb 0.00 0.32 0.02 0.00 2.84 0.00 0.00 34.83 38.01 2w0k s MET 3 CO 0.00 -0.34 -0.08 -0.51 -0.65 0.00 0.00 175.02 173.44 2w0k s LEU 4 N -2.56 1.25 -0.22 4.11 1.43 -1.26 -1.00 118.68 120.44 2w0k s LEU 4 Ca 0.08 -0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 52.73 2w0k s LEU 4 Cb -0.01 -0.81 -0.12 0.00 0.03 0.00 0.00 46.19 45.28 2w0k s LEU 4 CO -0.05 -0.09 -0.14 0.35 0.23 0.00 0.00 176.35 176.65 2w0k n THR 5 N 4.73 1.51 -1.34 5.49 -2.24 0.40 -3.55 114.28 119.29 2w0k n THR 5 Ca -0.14 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2w0k n THR 5 Cb 0.50 -2.09 0.00 0.00 -2.10 0.00 0.00 70.33 66.64 2w0k n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w0k n GLN 6 N -4.40 -2.26 -2.55 -0.78 10.64 -1.21 -3.87 117.38 112.95 2w0k n GLN 6 Ca -0.33 1.69 -0.41 0.00 -1.83 0.00 0.00 57.00 56.12 2w0k n GLN 6 Cb 0.66 -2.21 -0.04 0.00 -0.86 0.00 0.00 30.24 27.79 2w0k n GLN 6 CO 0.00 0.00 0.00 -2.14 -1.83 0.00 0.00 177.06 173.09 2w0k s PRO 7 N -3.53 4.60 0.36 2.61 0.02 -1.26 -4.81 135.00 132.98 2w0k s PRO 7 Ca 0.00 1.66 0.14 0.00 0.02 0.00 0.00 61.00 62.82 2w0k s PRO 7 Cb 0.00 -3.31 0.67 0.00 0.02 0.00 0.00 34.50 31.88 2w0k s PRO 7 CO 0.00 0.07 1.78 0.45 -0.33 0.00 0.00 177.00 178.96 2w0k h HIS 8 N 5.40 0.00 -4.30 6.54 3.86 -1.92 -3.40 115.15 121.33 2w0k h HIS 8 Ca -0.44 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 58.58 2w0k h HIS 8 Cb 1.21 0.00 -0.15 0.00 1.06 0.00 0.00 27.41 29.53 2w0k h HIS 8 CO 0.64 0.42 -0.65 -1.54 0.86 0.00 0.00 177.93 177.65 2w0k s SER 9 N -6.79 0.47 0.03 2.45 1.04 -1.26 -0.75 113.70 108.88 2w0k s SER 9 Ca -0.02 -1.18 -0.16 0.00 0.48 0.00 0.00 55.95 55.07 2w0k s SER 9 Cb 0.13 0.26 0.03 0.00 0.10 0.00 0.00 66.02 66.54 2w0k s SER 9 CO 0.72 -0.69 0.36 0.54 0.98 0.00 0.00 173.24 175.15 2w0k s VAL 10 N -3.97 0.07 0.06 5.02 0.11 -0.58 -4.93 120.40 116.18 2w0k s VAL 10 Ca 0.22 -0.54 0.04 0.00 -2.93 0.00 0.00 61.98 58.77 2w0k s VAL 10 Cb 0.07 -0.89 -0.03 0.00 -1.53 0.00 0.00 36.38 34.00 2w0k s VAL 10 CO 0.01 -0.30 -0.13 -0.94 -3.33 0.00 0.00 175.10 170.41 2w0k s SER 11 N -1.90 1.50 0.02 3.54 1.04 -1.26 -0.84 113.70 115.81 2w0k s SER 11 Ca -0.07 -0.58 -0.18 0.00 0.48 0.00 0.00 55.95 55.61 2w0k s SER 11 Cb -0.01 -0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.10 2w0k s SER 11 CO -0.01 -0.08 0.39 -0.70 0.98 0.00 0.00 173.24 173.81 2w0k s GLU 12 N -1.61 0.86 0.50 4.02 2.56 -0.77 -4.93 118.70 119.33 2w0k s GLU 12 Ca -0.03 -0.30 -0.22 0.00 0.00 0.00 0.00 54.97 54.42 2w0k s GLU 12 Cb -0.10 0.38 -0.06 0.00 2.00 0.00 0.00 34.13 36.35 2w0k s GLU 12 CO 0.02 -0.28 1.21 -1.12 -0.56 0.00 0.00 175.26 174.53 2w0k s SER 13 N -1.80 5.80 0.52 -1.70 0.01 -1.26 0.58 113.70 115.85 2w0k s SER 13 Ca -0.08 2.41 -0.23 0.00 1.31 0.00 0.00 55.95 59.37 2w0k s SER 13 Cb -0.02 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.55 2w0k s SER 13 CO -0.00 -1.18 1.39 -2.65 0.41 0.00 0.00 173.24 171.21 2w0k n PRO 14 N -0.82 1.87 0.00 12.44 -0.02 -1.26 -1.85 135.00 145.36 2w0k n PRO 14 Ca 0.09 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2w0k n PRO 14 Cb 0.48 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 2w0k n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w0k n GLY 15 N 0.69 2.10 3.96 -1.23 0.00 0.10 -4.94 105.19 105.87 2w0k n GLY 15 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 2w0k n GLY 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2w0k s LYS 16 N -0.77 2.24 -0.15 1.61 2.47 -0.77 -3.64 119.74 120.74 2w0k s LYS 16 Ca 0.00 -0.58 -0.05 0.00 -1.56 0.00 0.00 55.97 53.78 2w0k s LYS 16 Cb 0.00 -2.32 -0.03 0.00 -1.46 0.00 0.00 37.83 34.02 2w0k s LYS 16 CO 0.00 -1.07 0.02 0.99 0.16 0.00 0.00 175.35 175.45 2w0k s THR 17 N -3.04 4.43 0.03 3.43 2.01 -1.26 -0.85 115.64 120.39 2w0k s THR 17 Ca 0.60 -0.17 0.01 0.00 0.31 0.00 0.00 61.69 62.44 2w0k s THR 17 Cb -0.10 -2.95 -0.02 0.00 0.01 0.00 0.00 72.50 69.44 2w0k s THR 17 CO 0.42 0.50 -0.05 0.54 -0.69 0.00 0.00 174.62 175.35 2w0k s VAL 18 N 0.08 0.28 -0.02 3.82 0.11 -0.73 -4.97 120.40 118.97 2w0k s VAL 18 Ca 0.03 -1.02 0.02 0.00 -2.93 0.00 0.00 61.98 58.08 2w0k s VAL 18 Cb -0.13 -0.45 0.00 0.00 -1.53 0.00 0.00 36.38 34.27 2w0k s VAL 18 CO 0.02 -0.48 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.34 2w0k s THR 19 N -1.55 0.68 -0.11 5.04 2.01 -1.26 0.61 115.64 121.07 2w0k s THR 19 Ca -0.13 -0.31 0.01 0.00 0.31 0.00 0.00 61.69 61.58 2w0k s THR 19 Cb -0.09 -0.61 0.02 0.00 0.01 0.00 0.00 72.50 71.82 2w0k s THR 19 CO -0.01 0.22 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.38 2w0k s ILE 20 N 0.20 1.35 0.37 1.82 1.01 -0.10 -4.95 121.20 120.90 2w0k s ILE 20 Ca -0.03 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.10 2w0k s ILE 20 Cb -0.08 -1.26 -0.02 0.00 0.01 0.00 0.00 42.46 41.12 2w0k s ILE 20 CO 0.00 0.41 0.56 -0.44 0.00 0.00 0.00 174.94 175.48 2w0k s SER 21 N 1.11 6.07 -0.25 3.58 0.01 -1.26 0.11 113.70 123.07 2w0k s SER 21 Ca -0.05 0.24 -0.02 0.00 1.31 0.00 0.00 55.95 57.43 2w0k s SER 21 Cb -0.14 -1.69 0.14 0.00 0.21 0.00 0.00 66.02 64.53 2w0k s SER 21 CO -0.03 -0.45 0.38 0.00 0.41 0.00 0.00 173.24 173.55 2w0k s THR 23 N 2.54 4.37 0.13 0.00 2.01 -1.26 -0.48 115.64 122.96 2w0k s THR 23 Ca 0.12 -0.19 -0.15 0.00 0.31 0.00 0.00 61.69 61.79 2w0k s THR 23 Cb -0.15 -2.94 -0.07 0.00 0.01 0.00 0.00 72.50 69.36 2w0k s THR 23 CO -0.18 0.49 0.54 -0.60 -0.69 0.00 0.00 174.62 174.18 2w0k s ARG 24 N 0.23 3.99 -0.01 4.92 3.52 -0.86 -0.45 118.95 130.30 2w0k s ARG 24 Ca 0.01 0.50 -0.21 0.00 -0.13 0.00 0.00 55.73 55.90 2w0k s ARG 24 Cb -0.13 -2.97 -0.22 0.00 -1.56 0.00 0.00 34.95 30.07 2w0k s ARG 24 CO 0.02 0.50 1.11 0.77 -0.81 0.00 0.00 175.30 176.89 2w0k h SER 25 N 3.69 0.41 -0.87 -2.12 0.02 -1.40 -3.47 113.55 109.80 2w0k h SER 25 Ca -0.49 -0.72 0.00 0.00 -0.84 0.00 0.00 61.79 59.74 2w0k h SER 25 Cb 1.20 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.61 2w0k h SER 25 CO 0.65 1.07 0.00 -1.20 -1.14 0.00 0.00 176.83 176.21 2w0k n SER 26 N -4.37 0.95 -2.69 3.07 7.64 -1.26 -4.89 113.62 112.07 2w0k n SER 26 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.79 2w0k n SER 26 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2w0k n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w0k n GLY 27 N 5.00 0.00 0.63 0.23 0.00 -1.26 -4.59 105.19 105.20 2w0k n GLY 27 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 2w0k n GLY 27 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2w0k n SER 28 N 2.18 -3.42 -0.04 1.61 2.88 -1.26 -4.67 113.62 110.90 2w0k n SER 28 Ca 0.00 0.74 0.01 0.00 -1.33 0.00 0.00 58.87 58.29 2w0k n SER 28 Cb 0.10 -1.59 -0.15 0.00 -0.75 0.00 0.00 64.21 61.82 2w0k n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2w0k n ILE 29 N -2.14 0.75 1.23 2.46 0.13 -1.26 -3.54 119.36 117.00 2w0k n ILE 29 Ca -0.01 -0.67 0.14 0.00 -1.10 0.00 0.00 62.75 61.11 2w0k n ILE 29 Cb 0.21 -0.31 0.54 0.00 -0.84 0.00 0.00 39.64 39.24 2w0k n ILE 29 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2w0k n ALA 30 N -2.47 2.83 0.03 1.51 0.00 -1.26 -4.10 120.51 117.05 2w0k n ALA 30 Ca -0.16 -0.25 0.02 0.00 0.00 0.00 0.00 53.44 53.04 2w0k n ALA 30 Cb 0.84 -1.32 0.35 0.00 0.00 0.00 0.00 19.45 19.33 2w0k n ALA 30 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2w0k h SER 31 N 0.35 0.42 -4.63 0.00 0.02 -1.83 -3.45 113.55 104.43 2w0k h SER 31 Ca 0.00 -0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 60.71 2w0k h SER 31 Cb 0.42 -0.11 -0.23 0.00 0.14 0.00 0.00 62.40 62.62 2w0k h SER 31 CO 0.00 0.46 -0.67 0.20 -1.14 0.00 0.00 176.83 175.68 2w0k s ASN 32 N -6.76 0.13 0.32 3.07 -0.87 -1.26 -5.12 114.94 104.45 2w0k s ASN 32 Ca -0.07 -0.30 -0.29 0.00 -1.57 0.00 0.00 52.86 50.63 2w0k s ASN 32 Cb 0.16 0.10 -0.12 0.00 -0.02 0.00 0.00 41.25 41.37 2w0k s ASN 32 CO 0.75 -0.23 1.46 -1.22 -2.57 0.00 0.00 177.10 175.29 2w0k n TYR 33 N 1.99 2.64 -4.25 2.20 4.01 -1.26 -4.81 117.16 117.68 2w0k n TYR 33 Ca -0.20 0.40 -0.34 0.00 -0.16 0.00 0.00 57.90 57.60 2w0k n TYR 33 Cb 0.56 -2.51 -0.11 0.00 -0.31 0.00 0.00 39.34 36.97 2w0k n TYR 33 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2w0k s VAL 34 N -0.56 4.30 0.09 -0.72 1.01 -1.26 -4.09 120.40 119.17 2w0k s VAL 34 Ca 0.60 -0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.40 2w0k s VAL 34 Cb -0.53 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2w0k s VAL 34 CO 0.56 0.50 0.03 -1.10 0.00 0.00 0.00 175.10 175.09 2w0k s GLN 35 N 0.16 2.66 -0.11 2.72 1.11 0.28 -0.24 119.66 126.24 2w0k s GLN 35 Ca 0.01 -0.79 0.04 0.00 0.01 0.00 0.00 55.36 54.63 2w0k s GLN 35 Cb -0.13 -2.60 0.00 0.00 -1.01 0.00 0.00 33.01 29.27 2w0k s GLN 35 CO 0.02 0.55 -0.23 -1.58 0.01 0.00 0.00 175.29 174.06 2w0k s TRP 36 N -1.33 2.59 -0.08 0.91 0.52 0.07 -1.25 118.94 120.36 2w0k s TRP 36 Ca 0.27 -1.07 0.01 0.00 0.02 0.00 0.00 56.10 55.32 2w0k s TRP 36 Cb -0.12 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.44 2w0k s TRP 36 CO 0.19 -0.44 -0.09 0.71 0.02 0.00 0.00 176.95 177.34 2w0k s TYR 37 N 0.41 2.87 -0.10 -1.98 2.02 0.26 -0.80 117.35 120.03 2w0k s TYR 37 Ca -0.17 -0.14 -0.10 0.00 -0.37 0.00 0.00 57.07 56.29 2w0k s TYR 37 Cb -0.18 -1.73 -0.05 0.00 -0.40 0.00 0.00 41.96 39.61 2w0k s TYR 37 CO 0.07 0.19 0.23 -1.14 -1.57 0.00 0.00 175.55 173.34 2w0k s GLN 38 N -0.52 3.73 -0.05 -0.62 0.74 -0.11 -0.99 119.66 121.84 2w0k s GLN 38 Ca 0.07 0.04 -0.01 0.00 0.05 0.00 0.00 55.36 55.52 2w0k s GLN 38 Cb -0.12 -3.25 0.03 0.00 1.10 0.00 0.00 33.01 30.78 2w0k s GLN 38 CO 0.02 0.65 0.03 -1.14 -0.55 0.00 0.00 175.29 174.30 2w0k s GLN 39 N -0.75 0.21 0.33 1.67 0.74 0.38 -0.05 119.66 122.18 2w0k s GLN 39 Ca 0.17 0.24 -0.03 0.00 0.05 0.00 0.00 55.36 55.79 2w0k s GLN 39 Cb -0.13 -0.65 -0.04 0.00 1.10 0.00 0.00 33.01 33.29 2w0k s GLN 39 CO 0.06 -0.28 0.57 1.03 -0.55 0.00 0.00 175.29 176.12 2w0k s ARG 40 N 1.88 3.57 0.14 1.67 0.52 -1.26 -1.76 118.95 123.71 2w0k s ARG 40 Ca 0.02 -0.09 -0.35 0.00 -0.52 0.00 0.00 55.73 54.80 2w0k s ARG 40 Cb -0.12 -2.63 -0.15 0.00 0.52 0.00 0.00 34.95 32.57 2w0k s ARG 40 CO -0.04 0.15 1.51 -2.30 0.02 0.00 0.00 175.30 174.64 2w0k n PRO 41 N -1.35 1.86 -0.45 3.54 -0.02 -1.26 -1.62 135.00 135.70 2w0k n PRO 41 Ca -0.02 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 2w0k n PRO 41 Cb 0.55 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2w0k n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w0k n GLY 42 N 3.16 1.75 3.58 -1.23 0.00 -1.26 -5.00 105.19 106.19 2w0k n GLY 42 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2w0k n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2w0k s SER 43 N -3.36 4.40 0.53 1.61 0.01 -0.64 -5.12 113.70 111.14 2w0k s SER 43 Ca 0.00 -0.39 -0.21 0.00 1.31 0.00 0.00 55.95 56.66 2w0k s SER 43 Cb 0.00 -0.84 -0.07 0.00 0.21 0.00 0.00 66.02 65.32 2w0k s SER 43 CO 0.00 0.18 1.07 -0.24 0.41 0.00 0.00 173.24 174.66 2w0k n SER 44 N 0.69 1.38 -4.76 2.44 2.88 -1.26 -4.49 113.62 110.49 2w0k n SER 44 Ca -0.13 0.92 -0.41 0.00 -1.33 0.00 0.00 58.87 57.91 2w0k n SER 44 Cb 0.52 -1.42 -0.02 0.00 -0.75 0.00 0.00 64.21 62.54 2w0k n SER 44 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 2w0k s PRO 45 N -2.55 4.32 -0.24 -1.46 0.02 -1.26 -4.67 135.00 129.16 2w0k s PRO 45 Ca 0.71 2.25 -0.04 0.00 0.02 0.00 0.00 61.00 63.93 2w0k s PRO 45 Cb -0.46 -3.09 -0.00 0.00 0.02 0.00 0.00 34.50 30.97 2w0k s PRO 45 CO 0.51 -0.29 -0.01 0.99 -0.33 0.00 0.00 177.00 177.86 2w0k s THR 46 N -0.61 3.51 -0.18 0.99 2.01 0.93 -4.94 115.64 117.34 2w0k s THR 46 Ca 0.54 -0.55 -0.34 0.00 0.31 0.00 0.00 61.69 61.64 2w0k s THR 46 Cb -0.40 -2.66 -0.11 0.00 0.01 0.00 0.00 72.50 69.33 2w0k s THR 46 CO 0.48 0.33 2.00 0.41 -0.69 0.00 0.00 174.62 177.15 2w0k n THR 47 N 4.81 0.44 -0.05 -0.82 -1.04 -1.26 -0.94 114.28 115.41 2w0k n THR 47 Ca -0.17 -0.19 -0.02 0.00 -2.04 0.00 0.00 64.05 61.63 2w0k n THR 47 Cb 0.50 -1.88 -0.15 0.00 -1.82 0.00 0.00 70.33 66.98 2w0k n THR 47 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2w0k n VAL 48 N 5.99 0.93 -3.71 12.58 0.24 0.02 -4.72 118.33 129.66 2w0k n VAL 48 Ca 0.28 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.34 61.75 2w0k n VAL 48 Cb 0.29 -0.36 -0.10 0.00 -1.47 0.00 0.00 33.84 32.19 2w0k n VAL 48 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2w0k s ILE 49 N -2.87 -0.02 0.11 1.34 -1.09 -0.90 -4.28 121.20 113.49 2w0k s ILE 49 Ca -0.08 0.06 0.04 0.00 -2.23 0.00 0.00 60.65 58.43 2w0k s ILE 49 Cb 0.09 -0.61 -0.04 0.00 -1.58 0.00 0.00 42.46 40.33 2w0k s ILE 49 CO 0.85 0.02 -0.10 -0.72 -1.23 0.00 0.00 174.94 173.77 2w0k s TYR 50 N 1.00 1.10 -1.32 3.97 -0.85 0.28 -0.75 117.35 120.78 2w0k s TYR 50 Ca -0.06 -0.69 -0.06 0.00 -0.52 0.00 0.00 57.07 55.74 2w0k s TYR 50 Cb -0.06 -0.59 0.01 0.00 0.38 0.00 0.00 41.96 41.70 2w0k s TYR 50 CO -0.08 0.01 1.07 0.39 -1.52 0.00 0.00 175.55 175.42 2w0k n GLU 51 N 0.38 -7.11 0.00 -3.49 1.02 -1.21 -0.94 120.64 109.28 2w0k n GLU 51 Ca -0.15 0.80 0.00 0.00 -0.02 0.00 0.00 57.16 57.80 2w0k n GLU 51 Cb 0.58 -5.80 0.00 0.00 -0.02 0.00 0.00 31.44 26.20 2w0k n GLU 51 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2w0k n ASP 52 N -3.04 0.00 0.00 1.62 8.00 0.67 -4.27 116.55 119.53 2w0k n ASP 52 Ca -0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.39 2w0k n ASP 52 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.70 2w0k n ASP 52 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2w0k n ASN 53 N 2.62 0.00 -4.72 -2.24 2.04 -1.16 -4.13 115.26 107.67 2w0k n ASN 53 Ca 0.00 -1.00 -0.38 0.00 -0.44 0.00 0.00 54.58 52.76 2w0k n ASN 53 Cb 0.00 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.19 2w0k n ASN 53 CO 0.00 0.00 0.00 -1.10 -0.44 0.00 0.00 177.26 175.72 2w0k s GLN 54 N 0.00 4.32 -0.28 -3.83 -1.52 -0.12 -4.48 119.66 113.75 2w0k s GLN 54 Ca 0.00 0.41 -0.16 0.00 -1.95 0.00 0.00 55.36 53.65 2w0k s GLN 54 Cb 0.00 -3.45 -0.03 0.00 -0.22 0.00 0.00 33.01 29.32 2w0k s GLN 54 CO 0.00 0.14 0.45 1.03 -0.25 0.00 0.00 175.29 176.66 2w0k s ARG 55 N 0.69 3.96 0.87 2.91 0.52 -1.26 -0.56 118.95 126.08 2w0k s ARG 55 Ca 0.25 0.10 -0.10 0.00 -0.52 0.00 0.00 55.73 55.45 2w0k s ARG 55 Cb -0.15 -3.68 0.12 0.00 0.52 0.00 0.00 34.95 31.76 2w0k s ARG 55 CO 0.09 -0.37 1.12 -1.25 0.02 0.00 0.00 175.30 174.92 2w0k s PRO 56 N 2.21 1.38 0.26 3.54 0.04 -1.26 -4.93 135.00 136.23 2w0k s PRO 56 Ca 0.18 1.37 -0.31 0.00 0.04 0.00 0.00 61.00 62.28 2w0k s PRO 56 Cb -0.16 -1.78 -0.13 0.00 0.04 0.00 0.00 34.50 32.47 2w0k s PRO 56 CO 0.10 -2.32 1.36 0.45 0.04 0.00 0.00 177.00 176.63 2w0k n SER 57 N -4.01 2.62 0.00 6.66 2.88 -1.26 -2.63 113.62 117.88 2w0k n SER 57 Ca 0.10 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 2w0k n SER 57 Cb 0.53 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2w0k n SER 57 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2w0k n GLY 58 N 1.88 0.75 3.60 0.46 0.00 -1.26 -5.05 105.19 105.57 2w0k n GLY 58 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2w0k n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w0k s VAL 59 N -2.75 4.89 0.55 1.61 1.01 -1.08 -5.08 120.40 119.55 2w0k s VAL 59 Ca 0.00 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.80 2w0k s VAL 59 Cb 0.00 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2w0k s VAL 59 CO 0.00 0.38 1.17 -2.84 0.00 0.00 0.00 175.10 173.81 2w0k s PRO 60 N 0.96 3.25 0.00 2.72 0.02 -1.26 -4.88 135.00 135.80 2w0k s PRO 60 Ca 0.05 1.73 0.07 0.00 0.02 0.00 0.00 61.00 62.88 2w0k s PRO 60 Cb -0.14 -2.03 0.32 0.00 0.02 0.00 0.00 34.50 32.68 2w0k s PRO 60 CO 0.03 -0.96 1.14 -0.40 -0.33 0.00 0.00 177.00 176.49 2w0k n ASP 61 N -1.30 0.00 0.00 2.53 5.68 -1.26 -2.30 116.55 119.89 2w0k n ASP 61 Ca 0.12 0.33 0.08 0.00 -0.50 0.00 0.00 54.79 54.82 2w0k n ASP 61 Cb 0.50 -0.38 0.36 0.00 -1.14 0.00 0.00 41.12 40.45 2w0k n ASP 61 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2w0k n ARG 62 N -1.38 0.09 -3.47 0.11 1.85 -1.26 -4.47 116.66 108.14 2w0k n ARG 62 Ca 0.03 0.19 -0.37 0.00 -1.00 0.00 0.00 57.85 56.70 2w0k n ARG 62 Cb 0.07 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.91 2w0k n ARG 62 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2w0k s PHE 63 N -2.82 3.44 -0.00 2.89 0.40 -0.97 -2.03 117.98 118.88 2w0k s PHE 63 Ca 0.11 0.63 -0.01 0.00 -0.60 0.00 0.00 56.93 57.05 2w0k s PHE 63 Cb 0.10 -2.42 -0.00 0.00 0.51 0.00 0.00 43.02 41.21 2w0k s PHE 63 CO 0.27 0.15 0.02 -1.54 0.70 0.00 0.00 175.22 174.82 2w0k s SER 64 N 0.69 0.06 -0.09 1.36 1.04 -0.88 -4.97 113.70 110.92 2w0k s SER 64 Ca 0.18 -0.15 -0.00 0.00 0.48 0.00 0.00 55.95 56.46 2w0k s SER 64 Cb -0.14 0.10 -0.03 0.00 0.10 0.00 0.00 66.02 66.05 2w0k s SER 64 CO 0.06 -0.15 -0.06 -0.83 0.98 0.00 0.00 173.24 173.24 2w0k s GLY 65 N -0.64 1.71 0.22 7.32 0.00 -1.26 -0.27 107.32 114.40 2w0k s GLY 65 Ca -0.07 -0.87 0.06 0.00 0.00 0.00 0.00 44.72 43.85 2w0k s GLY 65 CO -0.00 -0.53 -0.10 -1.35 0.00 0.00 0.00 173.10 171.12 2w0k s SER 66 N -0.57 2.41 -0.12 1.64 1.04 -0.40 -4.55 113.70 113.15 2w0k s SER 66 Ca 0.09 -1.08 0.03 0.00 0.48 0.00 0.00 55.95 55.47 2w0k s SER 66 Cb -0.12 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.90 2w0k s SER 66 CO 0.02 -0.28 -0.23 -0.63 0.98 0.00 0.00 173.24 173.10 2w0k s ILE 67 N -3.09 2.07 -0.38 -1.02 -1.09 -1.26 -1.32 121.20 115.10 2w0k s ILE 67 Ca 0.24 -1.00 0.04 0.00 -2.23 0.00 0.00 60.65 57.69 2w0k s ILE 67 Cb 0.02 -1.80 0.11 0.00 -1.58 0.00 0.00 42.46 39.20 2w0k s ILE 67 CO 0.07 0.56 0.10 -0.62 -1.23 0.00 0.00 174.94 173.82 2w0k s ASP 68 N 0.52 4.70 0.28 3.58 2.15 0.85 -4.94 116.67 123.82 2w0k s ASP 68 Ca -0.14 -2.33 0.24 0.00 0.43 0.00 0.00 52.55 50.74 2w0k s ASP 68 Cb -0.17 -1.64 1.02 0.00 -0.30 0.00 0.00 42.92 41.83 2w0k s ASP 68 CO 0.05 -0.36 1.72 -0.24 -0.17 0.00 0.00 175.17 176.17 2w0k n SER 69 N 4.03 0.69 0.17 -0.34 2.88 -1.26 -1.47 113.62 118.31 2w0k n SER 69 Ca 0.04 0.68 0.03 0.00 -1.33 0.00 0.00 58.87 58.29 2w0k n SER 69 Cb 0.40 -0.82 0.30 0.00 -0.75 0.00 0.00 64.21 63.34 2w0k n SER 69 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2w0k h SER 70 N 0.00 0.00 -0.01 -3.46 0.87 -1.92 -3.07 113.55 105.95 2w0k h SER 70 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2w0k h SER 70 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2w0k h SER 70 CO 0.00 0.45 -0.12 -1.54 -0.53 0.00 0.00 176.83 175.09 2w0k n SER 71 N -3.76 1.64 -1.40 6.23 3.41 -0.89 -5.01 113.62 113.86 2w0k n SER 71 Ca -0.01 -1.32 -0.13 0.00 -0.26 0.00 0.00 58.87 57.15 2w0k n SER 71 Cb 0.51 0.24 -0.01 0.00 -0.26 0.00 0.00 64.21 64.69 2w0k n SER 71 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2w0k n ASN 72 N 0.22 -4.08 -4.32 4.04 5.15 -0.54 -4.87 115.26 110.86 2w0k n ASN 72 Ca 0.06 0.03 -0.23 0.00 -0.60 0.00 0.00 54.58 53.84 2w0k n ASN 72 Cb 0.27 -3.20 -0.12 0.00 -0.53 0.00 0.00 39.78 36.20 2w0k n ASN 72 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2w0k s SER 73 N -2.48 2.66 0.07 1.20 1.04 -0.97 -2.02 113.70 113.20 2w0k s SER 73 Ca 0.00 -0.78 0.02 0.00 0.48 0.00 0.00 55.95 55.66 2w0k s SER 73 Cb 0.00 -0.15 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 2w0k s SER 73 CO 0.00 0.01 0.14 0.00 0.98 0.00 0.00 173.24 174.38 2w0k s ALA 74 N -1.64 3.77 0.04 5.32 0.00 0.37 -0.11 121.76 129.52 2w0k s ALA 74 Ca 0.12 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 51.18 2w0k s ALA 74 Cb -0.08 -1.62 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2w0k s ALA 74 CO 0.06 0.78 -0.12 -1.12 0.00 0.00 0.00 175.76 175.35 2w0k s SER 75 N -2.47 1.46 -0.14 0.00 0.01 -0.44 -0.76 113.70 111.36 2w0k s SER 75 Ca 0.32 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 57.12 2w0k s SER 75 Cb -0.12 -0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 2w0k s SER 75 CO 0.25 -0.01 -0.12 -0.22 0.41 0.00 0.00 173.24 173.56 2w0k s LEU 76 N -1.17 2.75 -0.18 2.44 2.96 0.12 -1.28 118.68 124.32 2w0k s LEU 76 Ca -0.00 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.55 2w0k s LEU 76 Cb -0.08 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.97 2w0k s LEU 76 CO 0.01 0.14 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.21 2w0k s THR 77 N 0.53 3.23 -0.45 3.68 2.01 0.63 -0.92 115.64 124.35 2w0k s THR 77 Ca -0.08 -0.56 -0.08 0.00 0.31 0.00 0.00 61.69 61.28 2w0k s THR 77 Cb -0.15 -2.43 0.11 0.00 0.01 0.00 0.00 72.50 70.04 2w0k s THR 77 CO 0.04 0.47 0.30 -0.63 -0.69 0.00 0.00 174.62 174.10 2w0k s ILE 78 N 1.03 4.03 0.27 1.82 1.01 0.20 -2.06 121.20 127.50 2w0k s ILE 78 Ca -0.00 -1.76 -0.15 0.00 0.00 0.00 0.00 60.65 58.74 2w0k s ILE 78 Cb -0.15 -3.63 -0.08 0.00 0.01 0.00 0.00 42.46 38.61 2w0k s ILE 78 CO -0.01 -0.70 0.69 -0.94 0.00 0.00 0.00 174.94 173.99 2w0k s SER 79 N 2.40 6.82 -1.40 3.58 1.04 -0.86 -1.77 113.70 123.52 2w0k s SER 79 Ca 0.05 1.25 -0.09 0.00 0.48 0.00 0.00 55.95 57.64 2w0k s SER 79 Cb -0.25 -2.36 0.06 0.00 0.10 0.00 0.00 66.02 63.57 2w0k s SER 79 CO -0.01 -0.11 0.61 0.61 0.98 0.00 0.00 173.24 175.33 2w0k n GLY 80 N 0.00 -0.50 0.23 7.32 0.00 -0.93 -4.78 105.19 106.54 2w0k n GLY 80 Ca 0.01 0.12 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 2w0k n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2w0k n LEU 81 N -3.99 0.01 -4.77 0.99 4.77 -0.03 -4.28 117.00 109.70 2w0k n LEU 81 Ca -0.02 0.08 -0.24 0.00 -0.03 0.00 0.00 56.01 55.80 2w0k n LEU 81 Cb 0.56 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 2w0k n LEU 81 CO 0.55 -0.11 -0.23 -0.54 -1.33 0.00 0.00 177.39 175.73 2w0k s LYS 82 N 0.03 2.75 0.46 3.23 3.01 -1.26 0.03 119.74 127.99 2w0k s LYS 82 Ca 0.06 -1.08 0.16 0.00 -1.01 0.00 0.00 55.97 54.10 2w0k s LYS 82 Cb -0.09 -2.49 1.06 0.00 -1.01 0.00 0.00 37.83 35.31 2w0k s LYS 82 CO 0.04 0.42 2.01 1.79 0.51 0.00 0.00 175.35 180.12 2w0k h THR 83 N 1.81 1.07 0.00 2.17 1.35 -1.94 -2.46 112.91 114.92 2w0k h THR 83 Ca -0.47 -0.58 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 2w0k h THR 83 Cb 1.23 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.96 2w0k h THR 83 CO 0.61 0.16 0.00 1.05 -0.25 0.00 0.00 175.52 177.09 2w0k h GLU 84 N 0.00 0.00 0.00 4.72 4.11 -2.00 -2.81 114.58 118.60 2w0k h GLU 84 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2w0k h GLU 84 Cb 0.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2w0k h GLU 84 CO 0.02 0.00 -0.09 -0.44 0.07 0.00 0.00 179.01 178.57 2w0k h ASP 85 N 0.00 0.00 -1.43 3.06 3.32 -1.84 -3.44 116.42 116.09 2w0k h ASP 85 Ca 0.00 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.34 2w0k h ASP 85 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2w0k h ASP 85 CO 0.00 0.04 1.09 1.21 -1.72 0.00 0.00 179.24 179.86 2w0k n GLU 86 N -3.09 1.23 -3.11 3.56 2.13 -1.06 -4.81 120.64 115.49 2w0k n GLU 86 Ca 0.04 0.42 0.02 0.00 0.66 0.00 0.00 57.16 58.30 2w0k n GLU 86 Cb 0.55 -2.25 0.01 0.00 0.27 0.00 0.00 31.44 30.01 2w0k n GLU 86 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2w0k n ALA 87 N 6.85 -2.15 -2.86 4.31 0.00 -0.97 -4.99 120.51 120.71 2w0k n ALA 87 Ca 0.31 -0.44 -0.33 0.00 0.00 0.00 0.00 53.44 52.98 2w0k n ALA 87 Cb 0.17 0.05 -0.06 0.00 0.00 0.00 0.00 19.45 19.62 2w0k n ALA 87 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2w0k s ASP 88 N -2.66 6.09 -0.02 0.00 1.11 -0.72 -0.60 116.67 119.87 2w0k s ASP 88 Ca 0.18 0.26 0.05 0.00 0.18 0.00 0.00 52.55 53.21 2w0k s ASP 88 Cb -0.00 -1.84 -0.01 0.00 1.07 0.00 0.00 42.92 42.13 2w0k s ASP 88 CO -0.01 0.26 -0.17 -0.31 1.18 0.00 0.00 175.17 176.12 2w0k s TYR 89 N -1.29 1.59 -0.16 4.23 1.51 -0.66 -0.47 117.35 122.10 2w0k s TYR 89 Ca 0.26 -0.34 -0.01 0.00 -1.01 0.00 0.00 57.07 55.97 2w0k s TYR 89 Cb -0.12 -1.04 0.04 0.00 -0.11 0.00 0.00 41.96 40.73 2w0k s TYR 89 CO 0.18 -0.06 -0.05 0.71 -1.11 0.00 0.00 175.55 175.21 2w0k s TYR 90 N -0.29 1.61 0.96 2.71 1.51 -0.16 -0.45 117.35 123.24 2w0k s TYR 90 Ca 0.04 -1.00 -0.12 0.00 -1.01 0.00 0.00 57.07 54.98 2w0k s TYR 90 Cb -0.08 -1.27 0.16 0.00 -0.11 0.00 0.00 41.96 40.66 2w0k s TYR 90 CO 0.00 -0.59 1.09 0.00 -1.11 0.00 0.00 175.55 174.94 2w0k s GLN 92 N -4.97 0.39 0.00 0.00 -0.44 -0.38 -0.95 119.66 113.30 2w0k s GLN 92 Ca 0.64 0.53 0.00 0.00 -2.50 0.00 0.00 55.36 54.03 2w0k s GLN 92 Cb -0.18 0.15 0.00 0.00 -1.64 0.00 0.00 33.01 31.34 2w0k s GLN 92 CO 0.57 -0.06 0.00 0.45 0.50 0.00 0.00 175.29 176.75 2w0k n SER 93 N 2.64 0.00 -4.45 6.67 2.88 -0.44 0.98 113.62 121.90 2w0k n SER 93 Ca -0.14 -0.73 -0.32 0.00 -1.33 0.00 0.00 58.87 56.35 2w0k n SER 93 Cb 0.57 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.89 2w0k n SER 93 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2w0k s TYR 94 N -2.40 2.59 0.96 0.66 1.51 -1.26 -0.50 117.35 118.91 2w0k s TYR 94 Ca 0.00 -0.24 -0.15 0.00 -1.01 0.00 0.00 57.07 55.67 2w0k s TYR 94 Cb 0.00 -1.54 0.18 0.00 -0.11 0.00 0.00 41.96 40.49 2w0k s TYR 94 CO 0.00 0.19 1.24 0.16 -1.11 0.00 0.00 175.55 176.03 2w0k s ASP 95 N -1.05 3.13 0.42 2.29 3.84 -0.39 -4.75 116.67 120.14 2w0k s ASP 95 Ca 0.13 0.52 0.17 0.00 -0.00 0.00 0.00 52.55 53.37 2w0k s ASP 95 Cb -0.10 -0.75 1.08 0.00 -1.38 0.00 0.00 42.92 41.76 2w0k s ASP 95 CO 0.03 -2.74 1.85 0.77 -0.00 0.00 0.00 175.17 175.08 2w0k h SER 96 N -1.64 0.42 -0.30 2.11 4.64 -1.95 -0.56 113.55 116.27 2w0k h SER 96 Ca -0.46 0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 60.84 2w0k h SER 96 Cb 1.28 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 63.29 2w0k h SER 96 CO 0.46 0.17 0.08 -1.20 -0.87 0.00 0.00 176.83 175.47 2w0k n SER 97 N -4.52 3.13 -1.34 4.97 7.64 -1.26 -4.85 113.62 117.40 2w0k n SER 97 Ca 0.19 -2.49 -0.17 0.00 1.01 0.00 0.00 58.87 57.41 2w0k n SER 97 Cb 0.69 -0.60 -0.07 0.00 -1.01 0.00 0.00 64.21 63.22 2w0k n SER 97 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2w0k n ASN 98 N 0.13 -5.42 -4.81 6.43 2.85 -0.22 -4.95 115.26 109.27 2w0k n ASN 98 Ca 0.16 0.43 -0.34 0.00 -0.11 0.00 0.00 54.58 54.72 2w0k n ASN 98 Cb 0.76 -4.46 -0.07 0.00 1.24 0.00 0.00 39.78 37.26 2w0k n ASN 98 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2w0k s HIS 99 N -2.55 3.39 0.30 1.20 3.76 -1.26 -4.82 115.29 115.32 2w0k s HIS 99 Ca 0.00 1.65 -0.07 0.00 -0.15 0.00 0.00 55.06 56.48 2w0k s HIS 99 Cb 0.00 -2.87 -0.06 0.00 1.11 0.00 0.00 32.58 30.76 2w0k s HIS 99 CO 0.00 -0.06 0.60 0.14 -0.85 0.00 0.00 174.74 174.57 2w0k s VAL 100 N -2.05 4.95 -0.06 -0.90 -7.23 -1.26 -1.27 120.40 112.57 2w0k s VAL 100 Ca 0.60 0.28 -0.02 0.00 -1.81 0.00 0.00 61.98 61.02 2w0k s VAL 100 Cb -0.11 -3.71 0.03 0.00 0.56 0.00 0.00 36.38 33.15 2w0k s VAL 100 CO 0.16 -0.31 0.05 -0.69 -0.31 0.00 0.00 175.10 173.99 2w0k s VAL 101 N -2.09 0.01 -0.11 1.32 1.01 0.34 -4.86 120.40 116.02 2w0k s VAL 101 Ca 0.46 0.30 -0.06 0.00 0.00 0.00 0.00 61.98 62.68 2w0k s VAL 101 Cb -0.11 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 2w0k s VAL 101 CO 0.28 0.15 0.14 -0.36 0.00 0.00 0.00 175.10 175.31 2w0k s PHE 102 N 2.12 3.57 1.12 5.22 0.40 -1.26 -1.33 117.98 127.82 2w0k s PHE 102 Ca 0.05 0.49 -0.12 0.00 -0.60 0.00 0.00 56.93 56.75 2w0k s PHE 102 Cb -0.12 -1.92 0.26 0.00 0.51 0.00 0.00 43.02 41.74 2w0k s PHE 102 CO -0.04 0.72 1.05 0.20 0.70 0.00 0.00 175.22 177.84 2w0k s GLY 103 N -1.11 1.57 0.03 4.36 0.00 -0.13 -4.59 107.32 107.46 2w0k s GLY 103 Ca 0.16 -0.01 0.04 0.00 0.00 0.00 0.00 44.72 44.90 2w0k s GLY 103 CO 0.05 0.65 1.12 0.61 0.00 0.00 0.00 173.10 175.53 2w0k n GLY 104 N 0.63 -0.60 0.00 0.20 0.00 -1.23 -4.84 105.19 99.34 2w0k n GLY 104 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2w0k n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w0k n GLY 105 N -1.30 -1.05 2.75 -0.02 0.00 -1.26 -5.01 105.19 99.29 2w0k n GLY 105 Ca 0.00 -1.52 -0.19 0.00 0.00 0.00 0.00 46.02 44.32 2w0k n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w0k s THR 106 N -3.18 -0.19 -0.56 2.61 2.01 0.40 -4.40 115.64 112.34 2w0k s THR 106 Ca 0.00 0.31 -0.27 0.00 0.31 0.00 0.00 61.69 62.04 2w0k s THR 106 Cb 0.00 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 2w0k s THR 106 CO 0.00 0.10 1.74 -0.75 -0.69 0.00 0.00 174.62 175.02 2w0k s LYS 107 N 2.23 2.90 -0.45 4.92 2.36 0.07 -1.66 119.74 130.12 2w0k s LYS 107 Ca 0.04 0.69 -0.24 0.00 -2.55 0.00 0.00 55.97 53.91 2w0k s LYS 107 Cb -0.13 -4.30 0.03 0.00 -1.05 0.00 0.00 37.83 32.39 2w0k s LYS 107 CO -0.05 -2.40 0.84 -1.17 1.55 0.00 0.00 175.35 174.11 2w0k s LEU 108 N 7.98 4.16 -0.13 5.43 2.96 0.24 -1.52 118.68 137.80 2w0k s LEU 108 Ca 0.65 -0.02 -0.10 0.00 -0.22 0.00 0.00 54.13 54.44 2w0k s LEU 108 Cb -0.14 -3.05 -0.05 0.00 0.50 0.00 0.00 46.19 43.46 2w0k s LEU 108 CO 0.24 -0.96 0.19 -0.89 -1.32 0.00 0.00 176.35 173.60 2w0k s THR 109 N 3.45 5.40 -0.32 3.68 2.01 -0.02 -2.29 115.64 127.57 2w0k s THR 109 Ca 0.32 0.32 -0.09 0.00 0.31 0.00 0.00 61.69 62.55 2w0k s THR 109 Cb -0.11 -3.48 -0.00 0.00 0.01 0.00 0.00 72.50 68.91 2w0k s THR 109 CO 0.24 0.54 0.15 -0.69 -0.69 0.00 0.00 174.62 174.17 2w0k s VAL 110 N -0.47 4.53 0.00 3.82 1.01 -1.26 -1.85 120.40 126.18 2w0k s VAL 110 Ca 0.14 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.63 2w0k s VAL 110 Cb -0.12 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2w0k s VAL 110 CO 0.03 0.04 0.00 -0.11 0.00 0.00 0.00 175.10 175.06