#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w0n s HIS 2 N 0.00 -0.80 -0.44 1.61 -0.00 -1.26 -5.09 115.29 109.31 2w0n s HIS 2 Ca 0.00 1.06 0.06 0.00 -0.00 0.00 0.00 55.06 56.18 2w0n s HIS 2 Cb 0.00 0.11 0.18 0.00 -0.00 0.00 0.00 32.58 32.86 2w0n s HIS 2 CO 0.00 -0.63 0.56 -1.64 -0.00 0.00 0.00 174.74 173.04 2w0n s MET 3 N 2.56 0.88 0.00 -0.38 -1.94 -1.26 -4.99 119.30 114.17 2w0n s MET 3 Ca 0.08 -0.93 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2w0n s MET 3 Cb -0.14 -0.35 0.00 0.00 2.01 0.00 0.00 34.83 36.34 2w0n s MET 3 CO -0.14 -1.27 0.00 0.41 -0.01 0.00 0.00 175.02 174.01 2w0n n GLY 4 N 3.66 -1.01 3.33 -0.03 0.00 -1.26 -5.04 105.19 104.84 2w0n n GLY 4 Ca 0.16 0.44 -0.17 0.00 0.00 0.00 0.00 46.02 46.45 2w0n n GLY 4 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2w0n n LEU 5 N 0.00 -5.07 0.13 0.99 4.77 -1.26 -4.94 117.00 111.63 2w0n n LEU 5 Ca 0.00 -0.73 -0.14 0.00 -0.03 0.00 0.00 56.01 55.11 2w0n n LEU 5 Cb 0.00 -3.11 -0.08 0.00 -2.33 0.00 0.00 43.42 37.90 2w0n n LEU 5 CO 0.00 0.19 0.76 -0.33 -1.33 0.00 0.00 177.39 176.68 2w0n h GLU 6 N -1.31 -0.26 -0.58 3.23 5.08 -2.03 -2.63 114.58 116.09 2w0n h GLU 6 Ca -0.61 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 57.93 2w0n h GLU 6 Cb 1.32 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.61 2w0n h GLU 6 CO 0.46 -0.11 0.67 -1.35 -1.00 0.00 0.00 179.01 177.67 2w0n h PRO 7 N -0.35 0.00 0.26 2.33 0.11 -1.98 -1.98 132.00 130.39 2w0n h PRO 7 Ca -0.03 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.09 2w0n h PRO 7 Cb 0.27 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.35 2w0n h PRO 7 CO 0.05 0.00 -0.43 -0.92 -0.21 0.00 0.00 178.00 176.48 2w0n h TYR 8 N 0.00 -1.20 -0.21 0.65 3.20 -1.84 -1.75 116.97 115.82 2w0n h TYR 8 Ca 0.28 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 62.04 2w0n h TYR 8 Cb 1.61 0.49 -0.01 0.00 1.54 0.00 0.00 36.73 40.36 2w0n h TYR 8 CO 0.00 -0.56 -0.40 0.93 -1.64 0.00 0.00 178.16 176.49 2w0n h GLU 9 N -0.76 0.50 -0.04 1.82 5.08 -1.51 -2.76 114.58 116.90 2w0n h GLU 9 Ca -0.01 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2w0n h GLU 9 Cb 0.73 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2w0n h GLU 9 CO -0.16 0.82 0.10 0.82 -1.00 0.00 0.00 179.01 179.59 2w0n h ILE 10 N 0.41 0.18 -1.68 3.13 1.08 -1.24 -3.43 117.51 115.96 2w0n h ILE 10 Ca 0.04 0.00 -0.70 0.00 -0.39 0.00 0.00 64.86 63.80 2w0n h ILE 10 Cb 0.89 0.90 0.02 0.00 -3.07 0.00 0.00 36.82 35.56 2w0n h ILE 10 CO 0.08 0.00 0.91 -1.20 -0.69 0.00 0.00 178.15 177.24 2w0n n SER 11 N -3.31 2.58 0.13 1.72 7.64 -0.69 -4.85 113.62 116.84 2w0n n SER 11 Ca -0.02 1.06 -0.01 0.00 1.01 0.00 0.00 58.87 60.91 2w0n n SER 11 Cb 0.18 -1.20 0.11 0.00 -1.01 0.00 0.00 64.21 62.29 2w0n n SER 11 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2w0n h THR 12 N 5.07 1.37 -0.87 0.44 1.35 -1.91 -3.11 112.91 115.25 2w0n h THR 12 Ca -0.47 -2.36 0.08 0.00 -0.55 0.00 0.00 66.41 63.12 2w0n h THR 12 Cb 1.31 2.31 -0.07 0.00 -1.73 0.00 0.00 68.15 69.97 2w0n h THR 12 CO 0.94 0.65 0.53 -0.07 -0.25 0.00 0.00 175.52 177.32 2w0n h LEU 13 N 0.00 0.79 -0.31 3.87 3.38 -1.96 -1.15 115.31 119.93 2w0n h LEU 13 Ca -0.01 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 2w0n h LEU 13 Cb 1.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 2w0n h LEU 13 CO 0.09 0.47 -0.73 -0.26 0.09 0.00 0.00 178.44 178.10 2w0n h PHE 14 N 0.91 0.00 -0.20 1.13 0.04 -1.93 -3.18 116.94 113.70 2w0n h PHE 14 Ca 0.41 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.23 2w0n h PHE 14 Cb 0.30 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.44 2w0n h PHE 14 CO -0.04 0.73 0.15 1.49 -0.60 0.00 0.00 178.31 180.04 2w0n h GLU 15 N 0.00 0.00 -0.38 1.51 4.22 -1.14 -1.87 114.58 116.92 2w0n h GLU 15 Ca -0.01 0.00 0.02 0.00 0.08 0.00 0.00 59.36 59.45 2w0n h GLU 15 Cb 1.42 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.64 2w0n h GLU 15 CO 0.09 0.00 0.22 1.96 -2.18 0.00 0.00 179.01 179.10 2w0n h GLN 16 N 0.00 0.43 -0.44 1.92 7.50 -1.49 0.23 115.11 123.26 2w0n h GLN 16 Ca 0.10 -0.03 -0.09 0.00 0.50 0.00 0.00 58.65 59.13 2w0n h GLN 16 Cb 0.40 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 27.82 2w0n h GLN 16 CO -0.00 0.28 -0.08 0.00 -1.50 0.00 0.00 178.83 177.53 2w0n h ARG 17 N 0.44 0.83 -0.13 1.46 2.47 -1.54 -2.85 114.38 115.07 2w0n h ARG 17 Ca 0.15 -0.31 -0.03 0.00 -1.26 0.00 0.00 59.98 58.54 2w0n h ARG 17 Cb 0.02 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.27 2w0n h ARG 17 CO -0.08 0.93 -0.06 1.96 0.56 0.00 0.00 179.97 183.28 2w0n h GLN 18 N 0.66 0.19 -0.05 0.04 4.20 -1.15 -1.79 115.11 117.20 2w0n h GLN 18 Ca 0.11 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.81 2w0n h GLN 18 Cb 0.61 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 2w0n h GLN 18 CO 0.04 0.26 0.13 0.00 -0.67 0.00 0.00 178.83 178.59 2w0n h ALA 19 N 1.76 1.34 -0.87 3.87 0.00 -0.70 -1.88 119.26 122.77 2w0n h ALA 19 Ca 0.04 -0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.18 2w0n h ALA 19 Cb 0.24 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 2w0n h ALA 19 CO 0.01 -0.15 0.60 1.98 0.00 0.00 0.00 179.25 181.69 2w0n h MET 20 N 0.00 0.16 0.00 0.00 -1.53 -1.41 0.41 114.93 112.56 2w0n h MET 20 Ca 0.02 -0.01 -0.03 0.00 -3.44 0.00 0.00 59.70 56.24 2w0n h MET 20 Cb 0.28 -0.04 -0.00 0.00 -0.55 0.00 0.00 31.60 31.29 2w0n h MET 20 CO -0.00 0.10 -0.16 -0.07 0.14 0.00 0.00 176.91 176.92 2w0n h LEU 21 N 0.16 0.00 -2.24 3.39 3.38 -1.56 -2.01 115.31 116.43 2w0n h LEU 21 Ca 0.43 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.45 2w0n h LEU 21 Cb 1.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.18 2w0n h LEU 21 CO -0.08 0.16 0.15 -0.61 0.09 0.00 0.00 178.44 178.16 2w0n h GLN 22 N 0.00 0.00 -2.75 1.13 5.75 -0.36 -3.48 115.11 115.40 2w0n h GLN 22 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2w0n h GLN 22 Cb 0.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.84 2w0n h GLN 22 CO 0.02 0.00 -0.70 0.43 -2.65 0.00 0.00 178.83 175.93 2w0n n SER 23 N -3.91 -6.33 -0.07 -0.69 7.64 -0.76 -4.77 113.62 104.73 2w0n n SER 23 Ca 0.01 1.26 -0.13 0.00 1.01 0.00 0.00 58.87 61.01 2w0n n SER 23 Cb 0.27 -3.42 -0.06 0.00 -1.01 0.00 0.00 64.21 59.99 2w0n n SER 23 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2w0n h ILE 24 N 0.43 1.32 -2.71 0.44 2.04 -1.93 -3.47 117.51 113.63 2w0n h ILE 24 Ca 0.00 -1.41 -0.37 0.00 1.00 0.00 0.00 64.86 64.07 2w0n h ILE 24 Cb 0.52 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.31 2w0n h ILE 24 CO 0.00 0.44 -0.48 1.17 0.00 0.00 0.00 178.15 179.27 2w0n n LYS 25 N -4.38 -1.57 -4.14 2.37 4.81 -1.26 -4.99 118.16 109.01 2w0n n LYS 25 Ca -0.05 0.91 -0.18 0.00 -0.87 0.00 0.00 58.31 58.12 2w0n n LYS 25 Cb 0.43 -5.45 -0.16 0.00 0.02 0.00 0.00 35.03 29.87 2w0n n LYS 25 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2w0n s GLU 26 N -4.95 0.63 0.00 1.64 0.41 -1.26 -5.11 118.70 110.06 2w0n s GLU 26 Ca 0.01 -0.11 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 2w0n s GLU 26 Cb -0.00 -0.66 0.00 0.00 -1.78 0.00 0.00 34.13 31.69 2w0n s GLU 26 CO 0.01 -0.02 0.00 0.41 -0.49 0.00 0.00 175.26 175.16 2w0n n GLY 27 N 3.72 -2.12 3.13 -1.39 0.00 -1.26 -4.96 105.19 102.31 2w0n n GLY 27 Ca -0.22 -1.07 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 2w0n n GLY 27 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w0n s VAL 28 N 0.00 3.36 -0.18 1.61 1.01 -1.26 -4.98 120.40 119.96 2w0n s VAL 28 Ca 0.00 -2.03 -0.01 0.00 0.00 0.00 0.00 61.98 59.94 2w0n s VAL 28 Cb 0.00 -3.30 -0.00 0.00 0.00 0.00 0.00 36.38 33.08 2w0n s VAL 28 CO 0.00 -0.70 -0.12 -0.69 0.00 0.00 0.00 175.10 173.59 2w0n s VAL 29 N 1.16 2.83 0.03 2.92 1.01 -1.26 -4.52 120.40 122.56 2w0n s VAL 29 Ca 0.08 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2w0n s VAL 29 Cb -0.23 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 2w0n s VAL 29 CO -0.04 0.49 -0.05 0.00 0.00 0.00 0.00 175.10 175.50 2w0n s ALA 30 N 1.07 0.34 0.05 5.51 0.00 -1.26 -3.59 121.76 123.88 2w0n s ALA 30 Ca -0.00 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.31 2w0n s ALA 30 Cb -0.15 0.10 -0.03 0.00 0.00 0.00 0.00 23.12 23.05 2w0n s ALA 30 CO -0.03 -0.10 -0.09 0.14 0.00 0.00 0.00 175.76 175.68 2w0n s VAL 31 N -1.44 0.68 0.00 0.00 -7.23 -1.10 -4.70 120.40 106.61 2w0n s VAL 31 Ca -0.13 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 2w0n s VAL 31 Cb -0.10 -0.73 0.00 0.00 0.56 0.00 0.00 36.38 36.11 2w0n s VAL 31 CO -0.00 -0.35 0.73 0.47 -0.31 0.00 0.00 175.10 175.64 2w0n n ASP 32 N 1.40 0.00 0.02 4.85 8.00 -0.98 -3.31 116.55 126.52 2w0n n ASP 32 Ca -0.22 0.73 0.00 0.00 0.71 0.00 0.00 54.79 56.01 2w0n n ASP 32 Cb 0.55 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2w0n n ASP 32 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2w0n n ASP 33 N -1.56 0.20 -0.10 -2.24 8.00 -1.26 -3.03 116.55 116.56 2w0n n ASP 33 Ca 0.00 0.05 -0.10 0.00 0.71 0.00 0.00 54.79 55.45 2w0n n ASP 33 Cb 0.00 -0.04 -0.14 0.00 -0.02 0.00 0.00 41.12 40.92 2w0n n ASP 33 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2w0n n ARG 34 N -2.74 0.88 0.00 -1.24 1.74 -1.26 -4.40 116.66 109.64 2w0n n ARG 34 Ca 0.00 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2w0n n ARG 34 Cb 0.00 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 2w0n n ARG 34 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w0n n GLY 35 N 1.92 2.56 1.98 -0.13 0.00 -1.26 -5.03 105.19 105.22 2w0n n GLY 35 Ca -0.32 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2w0n n GLY 35 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2w0n n GLU 36 N 0.00 -5.08 0.00 1.61 2.13 -1.26 -2.33 120.64 115.71 2w0n n GLU 36 Ca 0.00 3.65 -0.03 0.00 0.66 0.00 0.00 57.16 61.44 2w0n n GLU 36 Cb 0.00 -3.98 -0.01 0.00 0.27 0.00 0.00 31.44 27.72 2w0n n GLU 36 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2w0n n VAL 37 N 1.74 0.98 0.00 6.31 0.31 -1.26 -3.41 118.33 123.00 2w0n n VAL 37 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 2w0n n VAL 37 Cb 0.00 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.23 2w0n n VAL 37 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2w0n n THR 38 N -3.57 0.00 -4.12 2.52 -2.24 -1.26 -4.77 114.28 100.84 2w0n n THR 38 Ca -0.06 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.42 2w0n n THR 38 Cb 0.27 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 2w0n n THR 38 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2w0n s LEU 39 N 0.00 3.49 0.02 3.22 1.02 -1.26 -4.68 118.68 120.49 2w0n s LEU 39 Ca 0.00 -0.17 0.02 0.00 0.02 0.00 0.00 54.13 54.00 2w0n s LEU 39 Cb 0.00 -2.22 -0.01 0.00 0.02 0.00 0.00 46.19 43.98 2w0n s LEU 39 CO 0.00 0.17 -0.06 -0.51 0.02 0.00 0.00 176.35 175.98 2w0n s ILE 40 N -1.32 0.39 1.05 -0.59 2.07 -1.26 -4.99 121.20 116.56 2w0n s ILE 40 Ca 0.26 -0.63 -0.13 0.00 -1.41 0.00 0.00 60.65 58.74 2w0n s ILE 40 Cb -0.12 -0.42 0.22 0.00 0.13 0.00 0.00 42.46 42.28 2w0n s ILE 40 CO 0.19 -0.17 1.08 0.21 -1.91 0.00 0.00 174.94 174.33 2w0n s ASN 41 N -0.86 2.11 -0.02 4.50 2.47 -1.26 -4.91 114.94 116.97 2w0n s ASN 41 Ca -0.05 1.24 -0.22 0.00 0.42 0.00 0.00 52.86 54.25 2w0n s ASN 41 Cb -0.06 -1.94 -0.14 0.00 -1.45 0.00 0.00 41.25 37.66 2w0n s ASN 41 CO -0.00 -3.46 0.98 -0.78 -3.72 0.00 0.00 177.10 170.12 2w0n h ASP 42 N -2.12 -0.41 -0.03 -4.21 3.58 -2.01 -2.90 116.42 108.33 2w0n h ASP 42 Ca -0.57 -0.15 0.01 0.00 0.42 0.00 0.00 57.03 56.74 2w0n h ASP 42 Cb 1.33 0.10 -0.00 0.00 1.72 0.00 0.00 39.33 42.49 2w0n h ASP 42 CO 0.56 0.03 0.02 0.00 -2.88 0.00 0.00 179.24 176.97 2w0n h ALA 43 N -0.61 1.97 0.00 -0.78 0.00 -1.98 -1.07 119.26 116.79 2w0n h ALA 43 Ca -0.05 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2w0n h ALA 43 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2w0n h ALA 43 CO 0.08 -0.03 -0.39 0.00 0.00 0.00 0.00 179.25 178.91 2w0n h ALA 44 N 1.99 1.33 0.00 0.00 0.00 -1.85 -2.64 119.26 118.08 2w0n h ALA 44 Ca 0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 2w0n h ALA 44 Cb 0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2w0n h ALA 44 CO -0.00 0.48 -0.27 1.96 0.00 0.00 0.00 179.25 181.42 2w0n h GLN 45 N 0.00 0.00 -0.30 0.00 4.20 -0.98 -2.77 115.11 115.26 2w0n h GLN 45 Ca -0.00 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.79 2w0n h GLN 45 Cb 0.70 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2w0n h GLN 45 CO 0.05 0.27 0.27 0.93 -0.67 0.00 0.00 178.83 179.68 2w0n h GLU 46 N 0.00 0.00 0.42 1.46 4.39 -1.49 -0.61 114.58 118.75 2w0n h GLU 46 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2w0n h GLU 46 Cb 0.62 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 2w0n h GLU 46 CO 0.04 0.00 -0.39 -0.07 -1.16 0.00 0.00 179.01 177.43 2w0n h LEU 47 N 0.00 -1.03 0.02 1.33 3.38 -1.66 -3.34 115.31 114.01 2w0n h LEU 47 Ca 0.14 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 2w0n h LEU 47 Cb 0.68 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2w0n h LEU 47 CO -0.00 -0.54 -0.01 0.25 0.09 0.00 0.00 178.44 178.23 2w0n h LEU 48 N -0.82 -0.02 -7.02 1.67 5.85 -1.64 -3.50 115.31 109.83 2w0n h LEU 48 Ca -0.04 0.00 0.24 0.00 0.84 0.00 0.00 57.88 58.92 2w0n h LEU 48 Cb 0.72 0.01 -0.18 0.00 0.37 0.00 0.00 40.66 41.57 2w0n h LEU 48 CO -0.04 0.37 0.78 0.21 -0.34 0.00 0.00 178.44 179.41 2w0n s ASN 49 N -4.99 -0.16 -0.95 1.25 3.84 -0.28 -5.04 114.94 108.60 2w0n s ASN 49 Ca -0.00 -0.01 -0.15 0.00 0.21 0.00 0.00 52.86 52.91 2w0n s ASN 49 Cb 0.00 0.17 -0.09 0.00 -0.55 0.00 0.00 41.25 40.78 2w0n s ASN 49 CO 0.01 -0.28 2.08 0.00 -2.79 0.00 0.00 177.10 176.12 2w0n n TYR 50 N -0.13 1.94 -3.53 0.43 4.19 -1.26 -4.28 117.16 114.52 2w0n n TYR 50 Ca -0.01 -2.08 -0.11 0.00 3.31 0.00 0.00 57.90 59.01 2w0n n TYR 50 Cb 0.59 -1.84 -0.04 0.00 0.49 0.00 0.00 39.34 38.53 2w0n n TYR 50 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 2w0n s ARG 51 N 4.08 0.81 0.00 2.98 0.52 -1.26 -5.11 118.95 120.96 2w0n s ARG 51 Ca 0.51 -0.04 0.00 0.00 -0.52 0.00 0.00 55.73 55.67 2w0n s ARG 51 Cb 0.13 0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.98 2w0n s ARG 51 CO 0.03 -0.30 0.00 1.63 0.02 0.00 0.00 175.30 176.68 2w0n n LYS 52 N 0.32 2.32 0.00 3.54 5.02 -1.26 -4.49 118.16 123.62 2w0n n LYS 52 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2w0n n LYS 52 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.61 2w0n n LYS 52 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2w0n n SER 53 N -1.15 0.00 0.07 4.39 2.88 -1.26 -4.02 113.62 114.53 2w0n n SER 53 Ca 0.00 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.58 2w0n n SER 53 Cb 0.00 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 63.91 2w0n n SER 53 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2w0n h GLN 54 N 0.00 0.39 -0.71 -1.46 4.15 -2.00 -2.15 115.11 113.33 2w0n h GLN 54 Ca 0.00 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.32 2w0n h GLN 54 Cb 0.00 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 2w0n h GLN 54 CO 0.00 0.31 0.18 0.22 -1.93 0.00 0.00 178.83 177.61 2w0n h ASP 55 N 0.40 1.07 -4.11 -0.69 1.82 -1.79 -3.44 116.42 109.68 2w0n h ASP 55 Ca 0.10 -0.23 -0.52 0.00 -0.39 0.00 0.00 57.03 55.99 2w0n h ASP 55 Cb 0.05 -0.28 0.11 0.00 0.68 0.00 0.00 39.33 39.89 2w0n h ASP 55 CO -0.01 1.02 0.46 -1.81 -1.61 0.00 0.00 179.24 177.28 2w0n s ASP 56 N -6.42 5.19 -1.04 2.28 1.01 -0.81 -3.72 116.67 113.15 2w0n s ASP 56 Ca -0.12 2.34 -0.02 0.00 0.71 0.00 0.00 52.55 55.45 2w0n s ASP 56 Cb 0.15 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.46 2w0n s ASP 56 CO 0.84 -1.59 0.88 -0.62 0.21 0.00 0.00 175.17 174.90 2w0n n GLU 57 N -1.67 -4.37 -0.99 8.23 1.02 -1.26 -4.96 120.64 116.63 2w0n n GLU 57 Ca 0.13 0.79 -0.06 0.00 -0.02 0.00 0.00 57.16 57.99 2w0n n GLU 57 Cb 0.50 -5.54 0.04 0.00 -0.02 0.00 0.00 31.44 26.42 2w0n n GLU 57 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2w0n n LYS 58 N -3.53 0.27 -3.26 3.49 4.81 -1.24 -5.04 118.16 113.65 2w0n n LYS 58 Ca -0.18 -0.67 -0.46 0.00 -0.87 0.00 0.00 58.31 56.13 2w0n n LYS 58 Cb 0.64 -0.21 -0.05 0.00 0.02 0.00 0.00 35.03 35.43 2w0n n LYS 58 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2w0n s LEU 59 N 0.00 6.01 -0.08 3.14 1.02 -1.26 -4.92 118.68 122.59 2w0n s LEU 59 Ca 0.18 -1.73 -0.04 0.00 0.02 0.00 0.00 54.13 52.56 2w0n s LEU 59 Cb -0.01 -2.23 -0.01 0.00 0.02 0.00 0.00 46.19 43.95 2w0n s LEU 59 CO 0.12 -0.92 -0.08 0.28 0.02 0.00 0.00 176.35 175.78 2w0n h SER 60 N 8.93 0.00 -4.00 2.29 0.02 -2.02 -3.48 113.55 115.30 2w0n h SER 60 Ca -0.29 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.17 2w0n h SER 60 Cb 1.09 0.00 0.06 0.00 0.14 0.00 0.00 62.40 63.69 2w0n h SER 60 CO 1.05 0.42 0.27 0.42 -1.14 0.00 0.00 176.83 177.86 2w0n s THR 61 N -1.65 4.16 0.75 -2.27 -4.23 -1.26 -5.09 115.64 106.05 2w0n s THR 61 Ca -0.06 0.37 -0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2w0n s THR 61 Cb 0.01 -3.65 0.15 0.00 1.34 0.00 0.00 72.50 70.34 2w0n s THR 61 CO 0.10 -0.76 1.02 -0.76 -0.54 0.00 0.00 174.62 173.68 2w0n s LEU 62 N -5.06 2.93 -0.51 4.79 1.43 -1.26 -5.08 118.68 115.92 2w0n s LEU 62 Ca 0.54 -0.49 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 2w0n s LEU 62 Cb -0.11 -1.75 0.13 0.00 0.03 0.00 0.00 46.19 44.50 2w0n s LEU 62 CO 0.49 -1.98 0.26 -0.44 0.23 0.00 0.00 176.35 174.91 2w0n s SER 63 N -4.80 4.15 -0.22 2.29 0.01 -1.26 -5.06 113.70 108.81 2w0n s SER 63 Ca 0.68 -2.95 -0.30 0.00 1.31 0.00 0.00 55.95 54.69 2w0n s SER 63 Cb -0.04 -1.48 0.16 0.00 0.21 0.00 0.00 66.02 64.87 2w0n s SER 63 CO 0.45 -0.23 1.18 -2.28 0.41 0.00 0.00 173.24 172.77 2w0n s HIS 64 N -0.18 -0.20 -0.87 2.43 5.04 -1.26 -5.08 115.29 115.17 2w0n s HIS 64 Ca 0.18 0.35 0.01 0.00 -1.54 0.00 0.00 55.06 54.05 2w0n s HIS 64 Cb -0.25 0.47 0.29 0.00 0.04 0.00 0.00 32.58 33.14 2w0n s HIS 64 CO -0.01 -0.19 1.19 0.45 -2.34 0.00 0.00 174.74 173.85 2w0n n SER 65 N 0.65 5.35 -2.32 9.88 2.88 -1.26 -4.60 113.62 124.20 2w0n n SER 65 Ca -0.05 -3.47 -0.02 0.00 -1.33 0.00 0.00 58.87 54.00 2w0n n SER 65 Cb 0.58 -0.98 0.09 0.00 -0.75 0.00 0.00 64.21 63.15 2w0n n SER 65 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 2w0n n TRP 66 N 0.93 -1.44 -4.63 0.66 -0.00 -1.26 -5.14 117.44 106.55 2w0n n TRP 66 Ca 0.29 -1.20 -0.26 0.00 -0.00 0.00 0.00 57.50 56.34 2w0n n TRP 66 Cb 0.36 1.26 -0.14 0.00 -0.00 0.00 0.00 31.31 32.79 2w0n n TRP 66 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 2w0n s SER 67 N -0.78 2.52 -1.18 5.87 1.04 -1.26 -4.91 113.70 115.00 2w0n s SER 67 Ca 0.07 -0.54 -0.19 0.00 0.48 0.00 0.00 55.95 55.76 2w0n s SER 67 Cb 0.31 -0.21 0.07 0.00 0.10 0.00 0.00 66.02 66.30 2w0n s SER 67 CO -0.09 0.16 1.59 -1.10 0.98 0.00 0.00 173.24 174.78 2w0n s GLN 68 N -1.23 3.84 0.35 4.02 -0.21 -1.26 -4.79 119.66 120.39 2w0n s GLN 68 Ca 0.08 -1.73 0.06 0.00 0.02 0.00 0.00 55.36 53.80 2w0n s GLN 68 Cb -0.09 -5.41 0.67 0.00 1.00 0.00 0.00 33.01 29.17 2w0n s GLN 68 CO 0.02 -2.18 1.88 0.28 -2.12 0.00 0.00 175.29 173.17 2w0n h VAL 69 N 5.94 1.19 -0.08 1.09 2.07 -2.01 -2.41 116.25 122.05 2w0n h VAL 69 Ca 0.34 -0.81 -0.11 0.00 0.82 0.00 0.00 66.70 66.94 2w0n h VAL 69 Cb 0.93 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2w0n h VAL 69 CO 1.42 0.27 -0.45 0.58 0.02 0.00 0.00 177.57 179.40 2w0n h VAL 70 N 0.38 1.33 0.47 2.57 2.07 -1.97 -1.67 116.25 119.43 2w0n h VAL 70 Ca 0.08 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 2w0n h VAL 70 Cb 0.37 1.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2w0n h VAL 70 CO 0.02 0.47 -0.23 -0.78 0.02 0.00 0.00 177.57 177.07 2w0n h ASP 71 N 0.15 -0.53 0.57 0.57 1.82 -1.83 0.18 116.42 117.34 2w0n h ASP 71 Ca 0.01 0.01 -0.10 0.00 -0.39 0.00 0.00 57.03 56.56 2w0n h ASP 71 Cb 0.86 0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.99 2w0n h ASP 71 CO 0.07 -0.37 -0.46 -0.37 -1.61 0.00 0.00 179.24 176.50 2w0n h VAL 72 N -0.65 1.22 -0.01 2.25 -1.51 -1.56 -2.86 116.25 113.13 2w0n h VAL 72 Ca -0.06 -1.62 -0.14 0.00 -1.23 0.00 0.00 66.70 63.64 2w0n h VAL 72 Cb 0.49 1.90 -0.02 0.00 -2.13 0.00 0.00 31.29 31.54 2w0n h VAL 72 CO 0.11 0.45 -0.65 0.28 -1.23 0.00 0.00 177.57 176.52 2w0n h SER 73 N 0.00 0.06 0.08 4.19 0.02 -1.06 -2.80 113.55 114.05 2w0n h SER 73 Ca -0.00 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2w0n h SER 73 Cb 0.86 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.39 2w0n h SER 73 CO 0.06 0.69 -0.04 -0.33 -1.14 0.00 0.00 176.83 176.07 2w0n h GLU 74 N 0.04 -0.11 -0.31 3.45 5.08 -0.42 -2.15 114.58 120.16 2w0n h GLU 74 Ca -0.01 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2w0n h GLU 74 Cb 1.15 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 2w0n h GLU 74 CO 0.09 0.30 0.11 0.28 -1.00 0.00 0.00 179.01 178.79 2w0n h VAL 75 N -0.55 0.92 -0.49 3.13 2.07 -1.58 0.58 116.25 120.32 2w0n h VAL 75 Ca -0.01 -0.08 0.01 0.00 0.82 0.00 0.00 66.70 67.44 2w0n h VAL 75 Cb 0.46 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 2w0n h VAL 75 CO 0.02 0.04 0.33 -0.07 0.02 0.00 0.00 177.57 177.91 2w0n h LEU 76 N 0.24 0.55 0.05 2.57 3.38 -1.54 0.32 115.31 120.88 2w0n h LEU 76 Ca 0.14 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 2w0n h LEU 76 Cb 0.11 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.74 2w0n h LEU 76 CO -0.14 0.39 -0.62 -0.09 0.09 0.00 0.00 178.44 178.07 2w0n h ARG 77 N 0.64 0.33 -0.33 1.13 1.12 -0.63 -3.27 114.38 113.38 2w0n h ARG 77 Ca 0.18 -0.42 -0.01 0.00 -1.11 0.00 0.00 59.98 58.62 2w0n h ARG 77 Cb -0.04 0.14 -0.02 0.00 -0.01 0.00 0.00 29.97 30.04 2w0n h ARG 77 CO -0.04 1.13 0.15 -0.44 -3.11 0.00 0.00 179.97 177.66 2w0n h ASP 78 N -0.27 0.40 -2.13 -3.80 5.19 0.47 -3.47 116.42 112.82 2w0n h ASP 78 Ca -0.09 -0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.29 2w0n h ASP 78 Cb 1.39 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.79 2w0n h ASP 78 CO 0.12 0.36 0.00 0.61 -3.12 0.00 0.00 179.24 177.21 2w0n n GLY 79 N -1.30 0.61 3.04 2.75 0.00 0.07 -5.08 105.19 105.29 2w0n n GLY 79 Ca 0.02 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 2w0n n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w0n s THR 80 N -2.84 -0.00 -0.76 2.61 2.01 -1.19 -5.00 115.64 110.47 2w0n s THR 80 Ca 0.00 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 61.75 2w0n s THR 80 Cb 0.00 -0.23 -0.01 0.00 0.01 0.00 0.00 72.50 72.27 2w0n s THR 80 CO 0.00 0.00 1.71 -2.16 -0.69 0.00 0.00 174.62 173.49 2w0n s PRO 81 N 0.12 2.84 -0.02 4.92 0.04 -1.26 -4.75 135.00 136.87 2w0n s PRO 81 Ca -0.00 0.01 0.02 0.00 0.04 0.00 0.00 61.00 61.07 2w0n s PRO 81 Cb -0.01 -4.62 0.01 0.00 0.04 0.00 0.00 34.50 29.91 2w0n s PRO 81 CO 0.00 -2.71 -0.07 1.03 0.04 0.00 0.00 177.00 175.29 2w0n s ARG 82 N 6.53 0.75 -0.35 4.56 0.52 -1.26 -5.12 118.95 124.58 2w0n s ARG 82 Ca 0.59 -0.22 0.03 0.00 -0.52 0.00 0.00 55.73 55.61 2w0n s ARG 82 Cb -0.09 -0.73 0.10 0.00 0.52 0.00 0.00 34.95 34.76 2w0n s ARG 82 CO 0.11 0.07 0.07 -0.98 0.02 0.00 0.00 175.30 174.59 2w0n s ARG 83 N 0.25 1.40 -0.30 3.54 3.03 -1.26 -4.79 118.95 120.82 2w0n s ARG 83 Ca -0.03 -1.81 0.02 0.00 2.03 0.00 0.00 55.73 55.93 2w0n s ARG 83 Cb -0.08 -3.03 0.15 0.00 -1.03 0.00 0.00 34.95 30.96 2w0n s ARG 83 CO 0.00 -0.96 0.38 -0.51 -1.13 0.00 0.00 175.30 173.08 2w0n s ASP 84 N 0.93 0.77 -0.02 -2.89 1.01 -1.26 -5.04 116.67 110.17 2w0n s ASP 84 Ca 0.11 -0.59 -0.17 0.00 0.71 0.00 0.00 52.55 52.62 2w0n s ASP 84 Cb -0.19 0.91 0.03 0.00 1.01 0.00 0.00 42.92 44.68 2w0n s ASP 84 CO -0.10 -0.35 0.36 -1.61 0.21 0.00 0.00 175.17 173.68 2w0n s GLU 85 N 2.40 0.73 -0.35 8.23 2.02 -1.26 -4.83 118.70 125.64 2w0n s GLU 85 Ca 0.10 -0.14 0.00 0.00 0.02 0.00 0.00 54.97 54.95 2w0n s GLU 85 Cb -0.13 0.33 0.11 0.00 0.10 0.00 0.00 34.13 34.54 2w0n s GLU 85 CO -0.29 -0.21 0.15 -2.00 0.02 0.00 0.00 175.26 172.93 2w0n s GLU 86 N -1.37 0.86 -0.39 1.61 2.12 -1.26 -3.70 118.70 116.56 2w0n s GLU 86 Ca -0.13 -1.37 0.02 0.00 0.36 0.00 0.00 54.97 53.85 2w0n s GLU 86 Cb -0.04 -2.01 0.12 0.00 0.26 0.00 0.00 34.13 32.46 2w0n s GLU 86 CO 0.05 -1.06 0.17 0.42 -0.54 0.00 0.00 175.26 174.30 2w0n s ILE 87 N 1.20 1.46 -0.20 -3.70 1.01 -1.25 -4.76 121.20 114.96 2w0n s ILE 87 Ca 0.13 -2.23 -0.06 0.00 0.00 0.00 0.00 60.65 58.48 2w0n s ILE 87 Cb -0.20 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 2w0n s ILE 87 CO -0.15 -0.78 0.04 0.28 0.00 0.00 0.00 174.94 174.32 2w0n s THR 88 N 0.76 4.36 -0.04 2.92 -1.32 -1.26 0.11 115.64 121.17 2w0n s THR 88 Ca 0.14 -0.18 0.02 0.00 -1.21 0.00 0.00 61.69 60.47 2w0n s THR 88 Cb -0.22 -2.98 -0.25 0.00 -1.51 0.00 0.00 72.50 67.54 2w0n s THR 88 CO -0.09 0.43 0.69 0.16 -2.21 0.00 0.00 174.62 173.60 2w0n h ILE 89 N 5.18 0.94 -1.59 5.08 3.07 -1.95 -3.42 117.51 124.82 2w0n h ILE 89 Ca -0.36 -2.68 -0.45 0.00 1.55 0.00 0.00 64.86 62.92 2w0n h ILE 89 Cb 1.18 2.57 -0.35 0.00 -0.27 0.00 0.00 36.82 39.96 2w0n h ILE 89 CO 0.64 0.72 -1.02 1.17 -1.05 0.00 0.00 178.15 178.61 2w0n n LYS 90 N -3.30 0.89 -1.56 0.16 0.00 -1.26 -4.91 118.16 108.17 2w0n n LYS 90 Ca -0.20 -3.03 -0.19 0.00 0.00 0.00 0.00 58.31 54.90 2w0n n LYS 90 Cb 1.04 -1.46 -0.08 0.00 0.00 0.00 0.00 35.03 34.53 2w0n n LYS 90 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2w0n n ASP 91 N 0.71 -5.45 -3.72 3.14 -0.08 -1.26 -4.92 116.55 104.98 2w0n n ASP 91 Ca 0.20 0.48 -0.29 0.00 -1.51 0.00 0.00 54.79 53.67 2w0n n ASP 91 Cb 0.63 -4.65 -0.13 0.00 2.34 0.00 0.00 41.12 39.31 2w0n n ASP 91 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2w0n s ARG 92 N -3.63 1.46 0.15 -0.67 0.52 -1.26 -5.08 118.95 110.43 2w0n s ARG 92 Ca 0.00 -2.25 -0.32 0.00 -0.52 0.00 0.00 55.73 52.63 2w0n s ARG 92 Cb 0.00 -2.45 -0.17 0.00 0.52 0.00 0.00 34.95 32.84 2w0n s ARG 92 CO 0.00 -1.20 0.81 1.47 0.02 0.00 0.00 175.30 176.39 2w0n n LEU 93 N 3.20 -0.27 -4.31 2.53 -0.00 -1.26 -4.03 117.00 112.86 2w0n n LEU 93 Ca 0.12 1.14 -0.46 0.00 -0.00 0.00 0.00 56.01 56.82 2w0n n LEU 93 Cb 0.36 -1.01 -0.05 0.00 -0.00 0.00 0.00 43.42 42.72 2w0n n LEU 93 CO 0.23 -2.32 0.17 -0.76 -0.00 0.00 0.00 177.39 174.71 2w0n s LEU 94 N 1.63 6.17 -0.38 1.47 1.43 0.29 -4.77 118.68 124.52 2w0n s LEU 94 Ca 0.73 -1.81 -0.14 0.00 -1.03 0.00 0.00 54.13 51.88 2w0n s LEU 94 Cb -1.00 -2.21 0.01 0.00 0.03 0.00 0.00 46.19 43.02 2w0n s LEU 94 CO 0.56 -0.86 0.27 -1.48 0.23 0.00 0.00 176.35 175.07 2w0n s LEU 95 N 1.60 4.88 0.09 1.79 0.05 -1.24 -3.89 118.68 121.96 2w0n s LEU 95 Ca 0.04 -0.73 -0.01 0.00 0.05 0.00 0.00 54.13 53.48 2w0n s LEU 95 Cb -0.29 -2.15 -0.04 0.00 -2.05 0.00 0.00 46.19 41.66 2w0n s LEU 95 CO 0.03 -0.37 0.26 -0.63 -0.55 0.00 0.00 176.35 175.08 2w0n s ILE 96 N 1.69 5.33 -0.20 1.48 1.09 -1.26 -4.95 121.20 124.38 2w0n s ILE 96 Ca 0.05 -0.29 -0.11 0.00 -1.10 0.00 0.00 60.65 59.20 2w0n s ILE 96 Cb -0.18 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.53 2w0n s ILE 96 CO 0.10 0.10 0.17 0.20 -0.10 0.00 0.00 174.94 175.41 2w0n s ASN 97 N -2.52 6.23 -0.29 3.58 -0.87 -1.24 -4.79 114.94 115.03 2w0n s ASN 97 Ca 0.37 0.26 -0.00 0.00 -1.57 0.00 0.00 52.86 51.91 2w0n s ASN 97 Cb -0.13 -2.11 0.14 0.00 -0.02 0.00 0.00 41.25 39.13 2w0n s ASN 97 CO 0.27 0.14 0.30 0.42 -2.57 0.00 0.00 177.10 175.66 2w0n s THR 98 N 0.54 -0.40 -0.03 1.60 -4.23 -1.26 -1.30 115.64 110.56 2w0n s THR 98 Ca 0.09 -0.49 -0.04 0.00 -1.18 0.00 0.00 61.69 60.07 2w0n s THR 98 Cb -0.12 -0.98 -0.04 0.00 1.34 0.00 0.00 72.50 72.70 2w0n s THR 98 CO 0.00 -0.47 0.18 -0.69 -0.54 0.00 0.00 174.62 173.10 2w0n s VAL 99 N 2.35 5.44 0.08 2.29 1.01 -1.24 -4.69 120.40 125.66 2w0n s VAL 99 Ca 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 2w0n s VAL 99 Cb -0.14 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 2w0n s VAL 99 CO -0.33 0.39 0.28 -2.16 0.00 0.00 0.00 175.10 173.27 2w0n s PRO 100 N -1.75 3.52 0.45 2.72 0.04 -1.26 -2.84 135.00 135.88 2w0n s PRO 100 Ca 0.25 -0.27 -0.23 0.00 0.04 0.00 0.00 61.00 60.78 2w0n s PRO 100 Cb -0.13 -2.97 -0.10 0.00 0.04 0.00 0.00 34.50 31.35 2w0n s PRO 100 CO 0.16 0.56 0.98 0.28 0.04 0.00 0.00 177.00 179.02 2w0n n VAL 101 N 0.30 2.60 0.00 -0.36 0.31 -1.24 -4.93 118.33 115.00 2w0n n VAL 101 Ca -0.05 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 2w0n n VAL 101 Cb 0.51 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.31 2w0n n VAL 101 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2w0n n ARG 102 N -0.02 0.00 -1.27 5.55 1.74 -1.26 -4.82 116.66 116.59 2w0n n ARG 102 Ca 0.10 0.12 0.16 0.00 -0.77 0.00 0.00 57.85 57.46 2w0n n ARG 102 Cb 0.41 -1.04 -0.05 0.00 -1.02 0.00 0.00 32.46 30.76 2w0n n ARG 102 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2w0n n SER 103 N -0.71 -7.37 -4.29 0.55 2.88 -1.26 -4.45 113.62 98.98 2w0n n SER 103 Ca 0.00 0.65 -0.44 0.00 -1.33 0.00 0.00 58.87 57.75 2w0n n SER 103 Cb 0.00 -3.99 -0.02 0.00 -0.75 0.00 0.00 64.21 59.45 2w0n n SER 103 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2w0n s ASN 104 N -6.38 6.87 0.00 -3.46 3.84 -1.26 -4.89 114.94 109.66 2w0n s ASN 104 Ca 0.00 -3.36 0.00 0.00 0.21 0.00 0.00 52.86 49.71 2w0n s ASN 104 Cb 0.00 -2.14 0.00 0.00 -0.55 0.00 0.00 41.25 38.56 2w0n s ASN 104 CO 0.00 -0.34 0.00 0.61 -2.79 0.00 0.00 177.10 174.58 2w0n n GLY 105 N 2.99 1.11 3.73 1.21 0.00 -1.26 -4.96 105.19 108.02 2w0n n GLY 105 Ca 0.20 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 2w0n n GLY 105 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w0n s VAL 106 N 0.00 2.47 -0.18 1.61 -7.23 -1.26 -5.00 120.40 110.82 2w0n s VAL 106 Ca 0.00 0.36 -0.07 0.00 -1.81 0.00 0.00 61.98 60.46 2w0n s VAL 106 Cb 0.00 -3.23 -0.04 0.00 0.56 0.00 0.00 36.38 33.67 2w0n s VAL 106 CO 0.00 0.04 0.06 -0.63 -0.31 0.00 0.00 175.10 174.26 2w0n s ILE 107 N 0.64 4.74 -0.31 -0.62 1.01 -1.26 -4.80 121.20 120.59 2w0n s ILE 107 Ca 0.66 -0.05 0.04 0.00 0.00 0.00 0.00 60.65 61.30 2w0n s ILE 107 Cb -0.45 -3.13 0.09 0.00 0.01 0.00 0.00 42.46 38.98 2w0n s ILE 107 CO 0.37 0.47 -0.00 0.27 0.00 0.00 0.00 174.94 176.05 2w0n s ILE 108 N 0.34 2.25 0.00 2.92 -4.36 -1.26 -4.98 121.20 116.10 2w0n s ILE 108 Ca 0.03 -2.12 0.00 0.00 -0.26 0.00 0.00 60.65 58.30 2w0n s ILE 108 Cb -0.12 -2.56 0.00 0.00 1.25 0.00 0.00 42.46 41.03 2w0n s ILE 108 CO 0.00 -0.42 0.00 0.61 0.24 0.00 0.00 174.94 175.37 2w0n n GLY 109 N 4.31 1.25 3.58 6.27 0.00 -1.26 -4.88 105.19 114.47 2w0n n GLY 109 Ca -0.02 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.46 2w0n n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w0n s ALA 110 N -0.01 2.98 0.05 4.61 0.00 -1.17 -3.73 121.76 124.50 2w0n s ALA 110 Ca 0.00 -1.13 0.02 0.00 0.00 0.00 0.00 51.96 50.85 2w0n s ALA 110 Cb 0.00 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 2w0n s ALA 110 CO 0.00 0.63 0.07 0.42 0.00 0.00 0.00 175.76 176.88 2w0n s ILE 111 N -1.11 4.56 0.02 0.00 1.09 -1.13 -2.73 121.20 121.90 2w0n s ILE 111 Ca 0.19 -0.67 0.08 0.00 -1.10 0.00 0.00 60.65 59.16 2w0n s ILE 111 Cb -0.11 -3.16 -0.03 0.00 -1.06 0.00 0.00 42.46 38.11 2w0n s ILE 111 CO 0.11 0.20 -0.24 -0.55 -0.10 0.00 0.00 174.94 174.35 2w0n s SER 112 N -2.18 3.31 -0.31 3.58 0.15 -1.24 -3.59 113.70 113.42 2w0n s SER 112 Ca 0.27 -0.50 0.01 0.00 0.70 0.00 0.00 55.95 56.43 2w0n s SER 112 Cb -0.12 -0.40 0.10 0.00 -1.71 0.00 0.00 66.02 63.89 2w0n s SER 112 CO 0.19 0.28 0.08 -0.89 1.20 0.00 0.00 173.24 174.10 2w0n s THR 113 N -0.77 1.28 -0.16 6.45 2.01 -0.42 -4.62 115.64 119.42 2w0n s THR 113 Ca 0.12 -1.63 -0.05 0.00 0.31 0.00 0.00 61.69 60.44 2w0n s THR 113 Cb -0.10 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 2w0n s THR 113 CO 0.02 -0.62 0.02 -0.36 -0.69 0.00 0.00 174.62 172.99 2w0n s PHE 114 N 1.42 3.18 -0.29 4.92 0.40 -1.26 -3.69 117.98 122.66 2w0n s PHE 114 Ca 0.09 -0.01 -0.02 0.00 -0.60 0.00 0.00 56.93 56.40 2w0n s PHE 114 Cb -0.18 -1.99 0.12 0.00 0.51 0.00 0.00 43.02 41.49 2w0n s PHE 114 CO -0.19 0.17 0.22 1.03 0.70 0.00 0.00 175.22 177.15 2w0n s ARG 115 N 0.10 0.27 -0.17 0.44 0.52 -1.26 -5.03 118.95 113.81 2w0n s ARG 115 Ca 0.03 -0.33 -0.08 0.00 -0.52 0.00 0.00 55.73 54.83 2w0n s ARG 115 Cb -0.13 -0.89 -0.04 0.00 0.52 0.00 0.00 34.95 34.41 2w0n s ARG 115 CO 0.01 -1.03 0.09 0.16 0.02 0.00 0.00 175.30 174.55 2w0n s ASP 116 N 2.23 5.85 -1.33 0.23 1.47 -1.26 -4.43 116.67 119.43 2w0n s ASP 116 Ca 0.09 0.17 -0.07 0.00 1.18 0.00 0.00 52.55 53.92 2w0n s ASP 116 Cb -0.15 -1.98 0.02 0.00 -0.34 0.00 0.00 42.92 40.46 2w0n s ASP 116 CO -0.34 0.21 1.09 1.17 0.68 0.00 0.00 175.17 177.98 2w0n n LYS 117 N 3.29 -7.18 0.00 2.11 4.81 -1.26 -5.29 118.16 114.64 2w0n n LYS 117 Ca -0.17 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.07 2w0n n LYS 117 Cb 0.52 -5.80 0.00 0.00 0.02 0.00 0.00 35.03 29.78 2w0n n LYS 117 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98