#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ab0 s ALA 3 N 0.00 3.15 0.01 -1.46 0.00 -1.26 -4.92 121.76 117.27 2ab0 s ALA 3 Ca 0.00 0.21 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 2ab0 s ALA 3 Cb 0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 2ab0 s ALA 3 CO 0.00 0.11 0.07 -1.12 0.00 0.00 0.00 175.76 174.83 2ab0 s SER 4 N -2.45 0.10 -0.01 0.00 0.01 -1.26 -1.21 113.70 108.88 2ab0 s SER 4 Ca 0.58 -0.31 0.02 0.00 1.31 0.00 0.00 55.95 57.56 2ab0 s SER 4 Cb -0.10 0.17 -0.00 0.00 0.21 0.00 0.00 66.02 66.30 2ab0 s SER 4 CO 0.19 -0.33 -0.08 0.00 0.41 0.00 0.00 173.24 173.43 2ab0 s ALA 5 N -1.37 0.68 -0.39 1.44 0.00 0.18 -0.43 121.76 121.87 2ab0 s ALA 5 Ca -0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 51.96 51.38 2ab0 s ALA 5 Cb -0.08 -0.20 0.04 0.00 0.00 0.00 0.00 23.12 22.88 2ab0 s ALA 5 CO 0.01 0.15 0.23 -1.17 0.00 0.00 0.00 175.76 174.98 2ab0 s LEU 6 N -0.08 4.86 -0.30 0.00 2.96 -0.45 -1.28 118.68 124.39 2ab0 s LEU 6 Ca 0.02 -1.08 -0.10 0.00 -0.22 0.00 0.00 54.13 52.75 2ab0 s LEU 6 Cb -0.04 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.59 2ab0 s LEU 6 CO -0.00 -0.43 0.16 -0.69 -1.32 0.00 0.00 176.35 174.07 2ab0 s VAL 7 N 1.55 4.79 0.21 1.68 1.01 0.01 -0.71 120.40 128.95 2ab0 s VAL 7 Ca 0.02 -0.21 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 2ab0 s VAL 7 Cb -0.20 -3.37 -0.08 0.00 0.00 0.00 0.00 36.38 32.73 2ab0 s VAL 7 CO 0.06 0.15 0.65 0.00 0.00 0.00 0.00 175.10 175.96 2ab0 s LEU 9 N -2.22 2.12 0.10 0.00 1.43 0.20 -4.28 118.68 116.02 2ab0 s LEU 9 Ca 0.43 -0.30 -0.06 0.00 -1.03 0.00 0.00 54.13 53.18 2ab0 s LEU 9 Cb -0.14 -0.26 -0.02 0.00 0.03 0.00 0.00 46.19 45.80 2ab0 s LEU 9 CO 0.20 -0.04 0.14 0.00 0.23 0.00 0.00 176.35 176.87 2ab0 s ALA 10 N -0.66 0.13 0.08 4.21 0.00 -1.26 -0.14 121.76 124.13 2ab0 s ALA 10 Ca -0.03 -0.92 -0.35 0.00 0.00 0.00 0.00 51.96 50.66 2ab0 s ALA 10 Cb -0.06 0.55 -0.14 0.00 0.00 0.00 0.00 23.12 23.47 2ab0 s ALA 10 CO 0.00 -0.50 1.56 -2.30 0.00 0.00 0.00 175.76 174.53 2ab0 n PRO 11 N -0.05 1.83 -0.62 0.00 -0.02 -1.26 -0.86 135.00 134.02 2ab0 n PRO 11 Ca -0.12 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2ab0 n PRO 11 Cb 0.62 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2ab0 n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ab0 n GLY 12 N 3.35 0.78 3.73 -1.23 0.00 -0.44 -2.89 105.19 108.49 2ab0 n GLY 12 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2ab0 n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ab0 n SER 13 N 0.00 2.05 -4.63 1.61 7.64 -0.04 -2.81 113.62 117.44 2ab0 n SER 13 Ca 0.00 0.82 -0.43 0.00 1.01 0.00 0.00 58.87 60.27 2ab0 n SER 13 Cb 0.00 -1.56 -0.02 0.00 -1.01 0.00 0.00 64.21 61.62 2ab0 n SER 13 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ab0 s GLU 14 N -3.40 3.98 0.18 1.43 -6.30 -0.14 -0.72 118.70 113.73 2ab0 s GLU 14 Ca 0.83 0.94 -0.07 0.00 -2.50 0.00 0.00 54.97 54.17 2ab0 s GLU 14 Cb -0.38 -3.78 0.08 0.00 0.00 0.00 0.00 34.13 30.05 2ab0 s GLU 14 CO 0.40 -1.02 1.53 1.05 0.02 0.00 0.00 175.26 177.25 2ab0 h GLU 15 N 8.37 0.78 -0.46 4.30 9.09 -1.91 -1.28 114.58 133.47 2ab0 h GLU 15 Ca -0.21 -0.40 -0.02 0.00 0.05 0.00 0.00 59.36 58.79 2ab0 h GLU 15 Cb 1.06 0.01 -0.02 0.00 -1.65 0.00 0.00 28.75 28.15 2ab0 h GLU 15 CO 1.05 1.02 0.22 1.15 0.05 0.00 0.00 179.01 182.51 2ab0 h THR 16 N 0.64 1.18 -0.13 -1.06 2.02 -1.97 -0.15 112.91 113.44 2ab0 h THR 16 Ca 0.06 -0.50 -0.00 0.00 0.77 0.00 0.00 66.41 66.73 2ab0 h THR 16 Cb 0.93 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 2ab0 h THR 16 CO 0.09 0.20 0.08 -0.33 0.37 0.00 0.00 175.52 175.92 2ab0 h GLU 17 N 0.59 0.18 0.18 6.66 5.08 -1.79 -1.08 114.58 124.40 2ab0 h GLU 17 Ca 0.16 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2ab0 h GLU 17 Cb 0.11 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2ab0 h GLU 17 CO -0.02 0.17 -0.09 0.00 -1.00 0.00 0.00 179.01 178.08 2ab0 h ALA 18 N 0.99 -0.24 -0.33 3.43 0.00 -1.14 -2.77 119.26 119.20 2ab0 h ALA 18 Ca 0.05 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 2ab0 h ALA 18 Cb 0.04 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ab0 h ALA 18 CO -0.01 -0.53 -0.38 0.28 0.00 0.00 0.00 179.25 178.62 2ab0 h VAL 19 N -0.46 1.28 -0.63 0.00 2.07 -1.05 -1.17 116.25 116.30 2ab0 h VAL 19 Ca -0.02 -1.56 0.02 0.00 0.82 0.00 0.00 66.70 65.96 2ab0 h VAL 19 Cb 0.35 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 2ab0 h VAL 19 CO 0.04 0.51 0.40 0.74 0.02 0.00 0.00 177.57 179.28 2ab0 h THR 20 N 0.63 1.10 0.01 2.57 2.02 -1.28 -0.47 112.91 117.50 2ab0 h THR 20 Ca 0.05 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 2ab0 h THR 20 Cb 0.97 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2ab0 h THR 20 CO 0.09 0.14 -0.01 0.74 0.37 0.00 0.00 175.52 176.86 2ab0 h THR 21 N 0.79 1.09 -0.40 3.16 2.02 -1.30 -1.58 112.91 116.70 2ab0 h THR 21 Ca 0.25 -0.31 0.05 0.00 0.77 0.00 0.00 66.41 67.16 2ab0 h THR 21 Cb -0.01 1.30 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2ab0 h THR 21 CO -0.09 0.08 0.13 0.40 0.37 0.00 0.00 175.52 176.42 2ab0 h ILE 22 N -0.15 0.87 -0.08 3.11 2.04 -0.91 -0.70 117.51 121.69 2ab0 h ILE 22 Ca -0.00 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.77 2ab0 h ILE 22 Cb 0.15 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2ab0 h ILE 22 CO 0.00 0.05 -0.02 -0.78 0.00 0.00 0.00 178.15 177.40 2ab0 h ASP 23 N 0.29 -0.08 -0.62 1.72 1.82 -0.95 -0.93 116.42 117.68 2ab0 h ASP 23 Ca 0.18 0.02 -0.04 0.00 -0.39 0.00 0.00 57.03 56.80 2ab0 h ASP 23 Cb 0.17 0.05 -0.03 0.00 0.68 0.00 0.00 39.33 40.20 2ab0 h ASP 23 CO -0.19 -0.03 0.22 -0.07 -1.61 0.00 0.00 179.24 177.56 2ab0 h LEU 24 N -0.00 0.87 -0.71 2.28 4.07 -1.03 -0.54 115.31 120.25 2ab0 h LEU 24 Ca 0.04 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2ab0 h LEU 24 Cb 0.06 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.54 2ab0 h LEU 24 CO -0.08 0.83 0.44 -0.07 -1.08 0.00 0.00 178.44 178.48 2ab0 h LEU 25 N 0.87 0.84 -0.45 1.67 3.38 -0.70 0.15 115.31 121.07 2ab0 h LEU 25 Ca 0.20 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2ab0 h LEU 25 Cb 0.25 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2ab0 h LEU 25 CO -0.01 0.64 0.19 0.58 0.09 0.00 0.00 178.44 179.93 2ab0 h VAL 26 N 0.97 1.20 -0.67 1.22 2.07 -0.76 -1.19 116.25 119.09 2ab0 h VAL 26 Ca 0.26 -0.60 0.10 0.00 0.82 0.00 0.00 66.70 67.27 2ab0 h VAL 26 Cb -0.06 0.75 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 2ab0 h VAL 26 CO -0.05 0.23 0.45 0.03 0.02 0.00 0.00 177.57 178.24 2ab0 h ARG 27 N 0.59 0.50 0.00 1.57 3.08 -0.67 -0.62 114.38 118.83 2ab0 h ARG 27 Ca 0.15 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2ab0 h ARG 27 Cb 0.17 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2ab0 h ARG 27 CO -0.01 0.33 0.00 0.41 -1.07 0.00 0.00 179.97 179.63 2ab0 n GLY 28 N -1.49 -0.80 1.98 0.04 0.00 0.00 -4.89 105.19 100.03 2ab0 n GLY 28 Ca 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2ab0 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ab0 n GLY 29 N 0.48 0.41 3.75 -0.02 0.00 -0.24 -4.98 105.19 104.59 2ab0 n GLY 29 Ca 0.16 -0.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 2ab0 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ab0 s ILE 30 N -2.00 5.08 -0.12 -0.61 1.01 -0.55 -4.64 121.20 119.37 2ab0 s ILE 30 Ca 0.00 1.06 -0.29 0.00 0.00 0.00 0.00 60.65 61.41 2ab0 s ILE 30 Cb 0.00 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 2ab0 s ILE 30 CO 0.00 0.38 1.32 -0.75 0.00 0.00 0.00 174.94 175.89 2ab0 s LYS 31 N 0.20 4.25 -0.14 2.79 2.20 -0.35 -4.06 119.74 124.63 2ab0 s LYS 31 Ca 0.28 1.76 -0.03 0.00 -0.36 0.00 0.00 55.97 57.62 2ab0 s LYS 31 Cb -0.16 -3.75 -0.03 0.00 -1.51 0.00 0.00 37.83 32.38 2ab0 s LYS 31 CO 0.13 -0.68 -0.03 0.08 -0.36 0.00 0.00 175.35 174.50 2ab0 s VAL 32 N 3.29 3.97 -0.14 4.02 1.01 -1.26 -0.64 120.40 130.65 2ab0 s VAL 32 Ca 0.58 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 62.22 2ab0 s VAL 32 Cb -0.25 -2.73 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2ab0 s VAL 32 CO 0.19 0.51 -0.14 -0.89 0.00 0.00 0.00 175.10 174.77 2ab0 s THR 33 N 0.12 2.94 -0.13 3.92 2.01 -0.41 -4.98 115.64 119.11 2ab0 s THR 33 Ca -0.00 -0.69 -0.13 0.00 0.31 0.00 0.00 61.69 61.17 2ab0 s THR 33 Cb -0.13 -2.24 -0.05 0.00 0.01 0.00 0.00 72.50 70.09 2ab0 s THR 33 CO 0.03 0.52 0.30 0.42 -0.69 0.00 0.00 174.62 175.19 2ab0 s THR 34 N 0.50 5.28 -0.14 -0.82 -4.23 -1.26 -0.81 115.64 114.17 2ab0 s THR 34 Ca -0.09 0.56 0.02 0.00 -1.18 0.00 0.00 61.69 61.00 2ab0 s THR 34 Cb -0.16 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.06 2ab0 s THR 34 CO 0.04 0.44 -0.20 0.00 -0.54 0.00 0.00 174.62 174.37 2ab0 s ALA 35 N 0.07 2.32 0.00 3.99 0.00 -0.20 -1.81 121.76 126.14 2ab0 s ALA 35 Ca 0.18 -1.04 -0.30 0.00 0.00 0.00 0.00 51.96 50.79 2ab0 s ALA 35 Cb -0.13 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 2ab0 s ALA 35 CO 0.05 0.05 1.03 0.45 0.00 0.00 0.00 175.76 177.34 2ab0 s SER 36 N 0.70 7.30 0.00 0.00 0.15 0.05 -0.63 113.70 121.26 2ab0 s SER 36 Ca -0.09 1.73 0.21 0.00 0.70 0.00 0.00 55.95 58.50 2ab0 s SER 36 Cb -0.16 -2.57 0.54 0.00 -1.71 0.00 0.00 66.02 62.12 2ab0 s SER 36 CO 0.01 -0.32 1.46 0.52 1.20 0.00 0.00 173.24 176.10 2ab0 n VAL 37 N 3.96 0.86 -1.64 4.45 0.31 0.80 -1.19 118.33 125.89 2ab0 n VAL 37 Ca 0.07 -0.93 -0.47 0.00 -0.01 0.00 0.00 64.34 62.99 2ab0 n VAL 37 Cb 0.50 0.63 -0.04 0.00 -0.91 0.00 0.00 33.84 34.02 2ab0 n VAL 37 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ab0 n ALA 38 N 1.45 0.42 0.27 3.52 0.00 -1.26 -4.83 120.51 120.09 2ab0 n ALA 38 Ca 0.21 0.45 0.12 0.00 0.00 0.00 0.00 53.44 54.23 2ab0 n ALA 38 Cb 0.59 -2.21 0.77 0.00 0.00 0.00 0.00 19.45 18.59 2ab0 n ALA 38 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2ab0 h SER 39 N 4.63 0.00 0.12 0.00 4.64 -1.94 -1.14 113.55 119.87 2ab0 h SER 39 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2ab0 h SER 39 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2ab0 h SER 39 CO 0.79 0.06 -0.16 -0.90 -0.87 0.00 0.00 176.83 175.75 2ab0 n ASP 40 N -3.94 1.32 0.00 4.97 5.75 -1.26 -4.95 116.55 118.44 2ab0 n ASP 40 Ca -0.03 -1.19 0.00 0.00 -0.01 0.00 0.00 54.79 53.57 2ab0 n ASP 40 Cb 0.15 0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 2ab0 n ASP 40 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ab0 n GLY 41 N 1.28 0.82 3.71 6.12 0.00 -0.43 -5.03 105.19 111.67 2ab0 n GLY 41 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2ab0 n GLY 41 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ab0 n ASN 42 N 0.00 3.33 0.02 1.61 5.15 -1.26 -4.66 115.26 119.45 2ab0 n ASN 42 Ca 0.00 1.15 0.11 0.00 -0.60 0.00 0.00 54.58 55.24 2ab0 n ASN 42 Cb 0.00 -1.52 -0.03 0.00 -0.53 0.00 0.00 39.78 37.70 2ab0 n ASN 42 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2ab0 n LEU 43 N 1.98 0.60 -4.40 1.20 4.77 -1.26 -4.58 117.00 115.31 2ab0 n LEU 43 Ca 0.09 -0.12 -0.45 0.00 -0.03 0.00 0.00 56.01 55.50 2ab0 n LEU 43 Cb 0.35 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2ab0 n LEU 43 CO 0.63 0.08 0.64 0.00 -1.33 0.00 0.00 177.39 177.41 2ab0 s ALA 44 N -3.20 3.54 -0.20 -1.18 0.00 -1.26 -0.97 121.76 118.49 2ab0 s ALA 44 Ca 0.03 -2.65 -0.15 0.00 0.00 0.00 0.00 51.96 49.19 2ab0 s ALA 44 Cb 0.15 -3.73 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 2ab0 s ALA 44 CO 0.83 -2.58 0.34 0.42 0.00 0.00 0.00 175.76 174.77 2ab0 s ILE 45 N 2.18 5.24 -0.35 0.00 -1.09 0.74 -4.93 121.20 122.99 2ab0 s ILE 45 Ca 0.21 0.60 -0.20 0.00 -2.23 0.00 0.00 60.65 59.03 2ab0 s ILE 45 Cb -0.14 -3.68 -0.00 0.00 -1.58 0.00 0.00 42.46 37.07 2ab0 s ILE 45 CO -0.03 0.29 0.60 -0.89 -1.23 0.00 0.00 174.94 173.68 2ab0 s THR 46 N 1.12 4.93 0.97 2.92 2.01 -1.26 -1.18 115.64 125.15 2ab0 s THR 46 Ca 0.17 0.55 -0.16 0.00 0.31 0.00 0.00 61.69 62.55 2ab0 s THR 46 Cb -0.14 -4.04 0.21 0.00 0.01 0.00 0.00 72.50 68.54 2ab0 s THR 46 CO 0.07 -0.27 1.33 0.00 -0.69 0.00 0.00 174.62 175.06 2ab0 h SER 48 N -1.68 0.01 -0.25 0.00 4.64 -1.04 -1.14 113.55 114.09 2ab0 h SER 48 Ca -0.44 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ab0 h SER 48 Cb 1.23 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2ab0 h SER 48 CO 0.36 0.06 0.00 0.54 -0.87 0.00 0.00 176.83 176.92 2ab0 n ARG 49 N -4.47 2.83 -0.15 4.77 3.00 -1.26 -4.97 116.66 116.40 2ab0 n ARG 49 Ca -0.03 -2.77 0.00 0.00 -0.01 0.00 0.00 57.85 55.04 2ab0 n ARG 49 Cb 0.14 -1.78 0.00 0.00 0.00 0.00 0.00 32.46 30.81 2ab0 n ARG 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2ab0 n GLY 50 N -0.50 0.66 3.75 -0.13 0.00 -0.43 -5.05 105.19 103.49 2ab0 n GLY 50 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2ab0 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ab0 s VAL 51 N -2.39 2.80 -0.39 1.61 1.01 -1.26 -4.66 120.40 117.11 2ab0 s VAL 51 Ca 0.00 0.68 -0.12 0.00 0.00 0.00 0.00 61.98 62.54 2ab0 s VAL 51 Cb 0.00 -3.44 0.03 0.00 0.00 0.00 0.00 36.38 32.98 2ab0 s VAL 51 CO 0.00 0.12 0.24 -0.54 0.00 0.00 0.00 175.10 174.92 2ab0 s LYS 52 N -0.52 2.84 0.03 2.72 1.02 -1.26 -0.44 119.74 124.14 2ab0 s LYS 52 Ca 0.57 -1.11 0.01 0.00 0.02 0.00 0.00 55.97 55.47 2ab0 s LYS 52 Cb -0.40 -3.82 -0.04 0.00 -0.52 0.00 0.00 37.83 33.05 2ab0 s LYS 52 CO 0.43 -0.75 0.07 -0.51 -0.92 0.00 0.00 175.35 173.68 2ab0 s LEU 53 N 1.58 3.81 -0.25 3.17 1.43 -0.33 -4.94 118.68 123.16 2ab0 s LEU 53 Ca 0.03 0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.11 2ab0 s LEU 53 Cb -0.20 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 2ab0 s LEU 53 CO 0.07 0.23 0.07 -0.76 0.23 0.00 0.00 176.35 176.19 2ab0 s LEU 54 N -2.02 3.48 0.40 1.79 1.43 -1.26 -0.19 118.68 122.32 2ab0 s LEU 54 Ca 0.25 -0.18 -0.24 0.00 -1.03 0.00 0.00 54.13 52.94 2ab0 s LEU 54 Cb -0.12 -1.93 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 2ab0 s LEU 54 CO 0.17 -0.02 1.01 0.00 0.23 0.00 0.00 176.35 177.74 2ab0 s ALA 55 N 1.55 3.08 0.24 4.21 0.00 -0.15 -4.98 121.76 125.71 2ab0 s ALA 55 Ca 0.06 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 2ab0 s ALA 55 Cb -0.15 -3.24 0.25 0.00 0.00 0.00 0.00 23.12 19.99 2ab0 s ALA 55 CO 0.04 -0.10 1.70 -0.44 0.00 0.00 0.00 175.76 176.96 2ab0 h ASP 56 N 2.46 0.79 -5.01 0.00 3.32 -1.69 -3.47 116.42 112.82 2ab0 h ASP 56 Ca -0.48 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.28 2ab0 h ASP 56 Cb 1.21 -0.21 -0.17 0.00 0.22 0.00 0.00 39.33 40.37 2ab0 h ASP 56 CO 0.62 0.91 0.06 0.00 -1.72 0.00 0.00 179.24 179.11 2ab0 s ALA 57 N -4.83 -1.41 0.40 3.45 0.00 -0.99 -5.03 121.76 113.35 2ab0 s ALA 57 Ca -0.10 0.74 -0.25 0.00 0.00 0.00 0.00 51.96 52.35 2ab0 s ALA 57 Cb 0.14 0.30 -0.09 0.00 0.00 0.00 0.00 23.12 23.48 2ab0 s ALA 57 CO 0.82 -0.47 1.13 -1.25 0.00 0.00 0.00 175.76 175.99 2ab0 s PRO 58 N -2.15 4.10 0.31 0.00 0.04 -1.26 -0.77 135.00 135.26 2ab0 s PRO 58 Ca -0.07 1.74 0.07 0.00 0.04 0.00 0.00 61.00 62.78 2ab0 s PRO 58 Cb -0.01 -2.65 0.78 0.00 0.04 0.00 0.00 34.50 32.67 2ab0 s PRO 58 CO 0.01 -0.26 1.77 1.25 0.04 0.00 0.00 177.00 179.81 2ab0 h LEU 59 N 2.62 0.75 -2.02 -3.56 5.85 -1.45 -0.78 115.31 116.71 2ab0 h LEU 59 Ca -0.48 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.40 2ab0 h LEU 59 Cb 1.23 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2ab0 h LEU 59 CO 0.62 0.24 0.15 1.62 -0.34 0.00 0.00 178.44 180.74 2ab0 h VAL 60 N 0.72 0.86 0.00 1.05 3.04 -1.91 0.80 116.25 120.80 2ab0 h VAL 60 Ca 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.28 2ab0 h VAL 60 Cb 0.98 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2ab0 h VAL 60 CO -0.39 0.00 -0.22 -0.33 -1.01 0.00 0.00 177.57 175.63 2ab0 h GLU 61 N 0.00 0.00 0.00 4.17 4.39 -1.51 -3.38 114.58 118.25 2ab0 h GLU 61 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2ab0 h GLU 61 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2ab0 h GLU 61 CO -0.00 0.00 0.00 1.33 -1.16 0.00 0.00 179.01 179.18 2ab0 n VAL 62 N -2.98 0.00 0.24 3.13 0.24 -0.59 -4.81 118.33 113.55 2ab0 n VAL 62 Ca 0.03 -0.34 0.07 0.00 -2.04 0.00 0.00 64.34 62.06 2ab0 n VAL 62 Cb 0.53 1.24 0.59 0.00 -1.47 0.00 0.00 33.84 34.73 2ab0 n VAL 62 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ab0 h ALA 63 N 0.00 1.90 -0.06 2.33 0.00 -1.07 -1.50 119.26 120.87 2ab0 h ALA 63 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ab0 h ALA 63 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2ab0 h ALA 63 CO 0.00 0.08 0.00 -0.40 0.00 0.00 0.00 179.25 178.93 2ab0 n ASP 64 N -4.48 0.81 -4.40 0.00 5.75 -1.26 -4.95 116.55 108.02 2ab0 n ASP 64 Ca -0.03 -1.45 -0.29 0.00 -0.01 0.00 0.00 54.79 53.02 2ab0 n ASP 64 Cb 0.13 -0.03 0.21 0.00 -1.03 0.00 0.00 41.12 40.40 2ab0 n ASP 64 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2ab0 s GLY 65 N -1.73 1.55 -0.92 6.12 0.00 -0.57 -4.95 107.32 106.83 2ab0 s GLY 65 Ca 0.35 -0.50 -0.22 0.00 0.00 0.00 0.00 44.72 44.35 2ab0 s GLY 65 CO 0.28 0.22 1.26 -0.54 0.00 0.00 0.00 173.10 174.32 2ab0 s GLU 66 N -4.99 3.49 0.03 2.90 2.02 -1.26 -4.99 118.70 115.90 2ab0 s GLU 66 Ca 0.67 -1.22 0.05 0.00 0.02 0.00 0.00 54.97 54.49 2ab0 s GLU 66 Cb -0.17 -4.94 -0.02 0.00 0.10 0.00 0.00 34.13 29.09 2ab0 s GLU 66 CO 0.58 -2.00 -0.15 0.71 0.02 0.00 0.00 175.26 174.43 2ab0 s TYR 67 N 4.13 1.27 -0.33 1.61 2.02 -1.26 -4.80 117.35 119.99 2ab0 s TYR 67 Ca 0.37 -0.33 0.21 0.00 -0.37 0.00 0.00 57.07 56.95 2ab0 s TYR 67 Cb -0.05 -0.77 0.21 0.00 -0.40 0.00 0.00 41.96 40.96 2ab0 s TYR 67 CO -0.05 0.03 1.46 -0.44 -1.57 0.00 0.00 175.55 174.98 2ab0 h ASP 68 N 5.09 0.00 -4.29 2.29 3.32 -1.13 -3.47 116.42 118.23 2ab0 h ASP 68 Ca -0.38 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.54 2ab0 h ASP 68 Cb 1.17 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.50 2ab0 h ASP 68 CO 0.45 0.14 -0.31 0.54 -1.72 0.00 0.00 179.24 178.34 2ab0 s VAL 69 N -3.16 0.02 -0.16 -1.35 0.11 -1.22 -2.07 120.40 112.58 2ab0 s VAL 69 Ca 0.05 -0.18 -0.03 0.00 -2.93 0.00 0.00 61.98 58.88 2ab0 s VAL 69 Cb 0.06 -0.53 -0.03 0.00 -1.53 0.00 0.00 36.38 34.36 2ab0 s VAL 69 CO 0.71 -0.10 -0.04 -0.51 -3.33 0.00 0.00 175.10 171.82 2ab0 s ILE 70 N -0.40 3.82 -0.16 7.04 2.07 -0.58 -1.34 121.20 131.65 2ab0 s ILE 70 Ca -0.05 -0.38 -0.01 0.00 -1.41 0.00 0.00 60.65 58.80 2ab0 s ILE 70 Cb -0.03 -2.67 -0.01 0.00 0.13 0.00 0.00 42.46 39.88 2ab0 s ILE 70 CO 0.02 0.49 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.73 2ab0 s VAL 71 N 0.40 2.98 -0.45 4.00 1.01 0.12 -0.98 120.40 127.47 2ab0 s VAL 71 Ca -0.04 -0.66 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 2ab0 s VAL 71 Cb -0.14 -2.28 0.12 0.00 0.00 0.00 0.00 36.38 34.08 2ab0 s VAL 71 CO 0.03 0.50 0.27 -0.76 0.00 0.00 0.00 175.10 175.14 2ab0 s LEU 72 N 0.73 5.40 0.93 3.92 1.43 0.43 -1.32 118.68 130.20 2ab0 s LEU 72 Ca -0.05 -2.08 -0.11 0.00 -1.03 0.00 0.00 54.13 50.86 2ab0 s LEU 72 Cb -0.15 -1.89 0.16 0.00 0.03 0.00 0.00 46.19 44.34 2ab0 s LEU 72 CO 0.02 -0.57 1.12 -2.84 0.23 0.00 0.00 176.35 174.30 2ab0 s PRO 73 N 1.09 0.88 0.00 1.29 0.02 -1.26 -1.88 135.00 135.13 2ab0 s PRO 73 Ca 0.08 1.38 0.00 0.00 0.02 0.00 0.00 61.00 62.48 2ab0 s PRO 73 Cb -0.23 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.56 2ab0 s PRO 73 CO -0.03 -2.67 0.00 0.41 -0.33 0.00 0.00 177.00 174.38 2ab0 n GLY 74 N 0.08 1.38 0.14 0.52 0.00 -1.09 -4.54 105.19 101.68 2ab0 n GLY 74 Ca 0.10 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2ab0 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ab0 n GLY 75 N 5.00 -0.81 0.11 -0.02 0.00 -1.26 -0.96 105.19 107.24 2ab0 n GLY 75 Ca 0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 2ab0 n GLY 75 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2ab0 h ILE 76 N 0.00 0.87 0.00 -0.61 2.04 -1.97 0.22 117.51 118.07 2ab0 h ILE 76 Ca 0.00 -0.03 -0.15 0.00 1.00 0.00 0.00 64.86 65.68 2ab0 h ILE 76 Cb 0.00 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2ab0 h ILE 76 CO 0.00 0.02 -0.72 0.11 0.00 0.00 0.00 178.15 177.55 2ab0 h LYS 77 N 0.08 0.00 -0.37 2.37 1.57 -1.87 -1.61 116.57 116.74 2ab0 h LYS 77 Ca 0.09 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.72 2ab0 h LYS 77 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2ab0 h LYS 77 CO -0.15 0.72 -0.37 0.78 -0.57 0.00 0.00 179.45 179.87 2ab0 h GLY 78 N 2.63 0.99 1.63 3.86 0.00 -1.28 -1.88 103.07 109.02 2ab0 h GLY 78 Ca -0.01 -1.01 -0.07 0.00 0.00 0.00 0.00 47.33 46.25 2ab0 h GLY 78 CO 0.09 0.91 -0.13 0.00 0.00 0.00 0.00 176.54 177.41 2ab0 h ALA 79 N 0.76 1.28 -0.58 3.60 0.00 -0.81 -1.43 119.26 122.08 2ab0 h ALA 79 Ca 0.06 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2ab0 h ALA 79 Cb 0.96 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2ab0 h ALA 79 CO 0.09 0.48 0.19 0.93 0.00 0.00 0.00 179.25 180.94 2ab0 h GLU 80 N 0.42 0.90 -0.46 0.00 5.08 -1.15 0.13 114.58 119.50 2ab0 h GLU 80 Ca 0.08 -0.19 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2ab0 h GLU 80 Cb 0.48 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 2ab0 h GLU 80 CO 0.03 0.80 0.21 0.00 -1.00 0.00 0.00 179.01 179.05 2ab0 h PHE 82 N 0.42 0.04 -0.95 0.00 0.04 -0.88 -1.78 116.94 113.83 2ab0 h PHE 82 Ca 0.20 0.01 0.12 0.00 2.80 0.00 0.00 57.97 61.10 2ab0 h PHE 82 Cb 0.14 -0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.21 2ab0 h PHE 82 CO -0.12 0.02 0.60 -0.09 -0.60 0.00 0.00 178.31 178.12 2ab0 h ARG 83 N 0.07 0.86 -0.06 1.51 2.43 -0.58 -2.47 114.38 116.14 2ab0 h ARG 83 Ca 0.05 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2ab0 h ARG 83 Cb 0.04 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2ab0 h ARG 83 CO -0.06 0.57 0.00 -0.25 -1.51 0.00 0.00 179.97 178.72 2ab0 n ASP 84 N -4.58 2.04 -4.52 -3.80 8.00 -0.46 -4.77 116.55 108.46 2ab0 n ASP 84 Ca 0.18 -1.69 -0.42 0.00 0.71 0.00 0.00 54.79 53.56 2ab0 n ASP 84 Cb 0.37 -0.03 -0.08 0.00 -0.02 0.00 0.00 41.12 41.37 2ab0 n ASP 84 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2ab0 s SER 85 N -1.91 6.27 0.28 -2.24 0.15 -0.70 -4.95 113.70 110.59 2ab0 s SER 85 Ca 0.35 -0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.62 2ab0 s SER 85 Cb 0.20 -2.27 0.37 0.00 -1.71 0.00 0.00 66.02 62.62 2ab0 s SER 85 CO 0.31 -0.60 1.91 0.71 1.20 0.00 0.00 173.24 176.77 2ab0 h THR 86 N 5.73 1.23 -0.55 6.45 1.35 -1.86 -1.71 112.91 123.55 2ab0 h THR 86 Ca -0.27 -0.55 -0.09 0.00 -0.55 0.00 0.00 66.41 64.96 2ab0 h THR 86 Cb 1.11 0.14 -0.02 0.00 -1.73 0.00 0.00 68.15 67.66 2ab0 h THR 86 CO 0.81 0.25 -0.01 0.25 -0.25 0.00 0.00 175.52 176.58 2ab0 h LEU 87 N 1.10 0.96 -0.05 3.87 5.85 -1.94 -0.98 115.31 124.12 2ab0 h LEU 87 Ca 0.28 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.72 2ab0 h LEU 87 Cb 0.00 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 2ab0 h LEU 87 CO -0.05 1.04 -0.12 0.25 -0.34 0.00 0.00 178.44 179.22 2ab0 h LEU 88 N 0.86 -0.35 -0.57 2.25 7.12 -1.75 -0.60 115.31 122.27 2ab0 h LEU 88 Ca 0.15 0.06 -0.03 0.00 0.13 0.00 0.00 57.88 58.20 2ab0 h LEU 88 Cb 0.55 0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 40.81 2ab0 h LEU 88 CO 0.03 -0.16 0.25 0.58 -0.13 0.00 0.00 178.44 179.01 2ab0 h VAL 89 N -0.18 1.22 -0.48 1.05 2.07 -1.17 -0.53 116.25 118.24 2ab0 h VAL 89 Ca 0.06 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 66.99 2ab0 h VAL 89 Cb 0.25 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 2ab0 h VAL 89 CO -0.15 0.25 0.17 -0.33 0.02 0.00 0.00 177.57 177.53 2ab0 h GLU 90 N 0.78 0.33 -0.28 1.57 5.08 -1.00 -0.94 114.58 120.11 2ab0 h GLU 90 Ca 0.19 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2ab0 h GLU 90 Cb 0.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2ab0 h GLU 90 CO -0.02 0.22 0.02 1.15 -1.00 0.00 0.00 179.01 179.37 2ab0 h THR 91 N 0.34 1.25 -0.76 1.13 2.02 -0.51 -0.08 112.91 116.29 2ab0 h THR 91 Ca 0.23 -0.88 0.02 0.00 0.77 0.00 0.00 66.41 66.54 2ab0 h THR 91 Cb 0.24 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 2ab0 h THR 91 CO -0.23 0.28 0.49 0.58 0.37 0.00 0.00 175.52 177.01 2ab0 h VAL 92 N 0.28 1.15 -0.75 3.16 2.07 -0.91 0.12 116.25 121.38 2ab0 h VAL 92 Ca 0.08 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 2ab0 h VAL 92 Cb 0.40 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2ab0 h VAL 92 CO 0.01 0.18 0.26 0.11 0.02 0.00 0.00 177.57 178.15 2ab0 h LYS 93 N 0.99 1.15 -0.54 1.57 1.57 -0.61 -1.66 116.57 119.03 2ab0 h LYS 93 Ca 0.29 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 2ab0 h LYS 93 Cb -0.05 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 2ab0 h LYS 93 CO -0.09 0.96 -0.02 0.37 -0.57 0.00 0.00 179.45 180.11 2ab0 h GLN 94 N 1.11 0.97 -0.35 3.15 5.75 -0.45 0.44 115.11 125.73 2ab0 h GLN 94 Ca 0.25 -0.32 0.04 0.00 -0.15 0.00 0.00 58.65 58.47 2ab0 h GLN 94 Cb 0.28 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.70 2ab0 h GLN 94 CO -0.01 0.99 0.11 0.74 -2.65 0.00 0.00 178.83 178.01 2ab0 h PHE 95 N 0.85 0.20 -0.18 3.99 0.04 -0.71 -1.15 116.94 119.98 2ab0 h PHE 95 Ca 0.15 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.94 2ab0 h PHE 95 Cb 0.56 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.66 2ab0 h PHE 95 CO 0.04 0.08 0.12 1.25 -0.60 0.00 0.00 178.31 179.20 2ab0 h HIS 96 N 0.25 0.23 0.00 -0.55 2.76 -1.03 -1.14 115.15 115.67 2ab0 h HIS 96 Ca 0.16 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.27 2ab0 h HIS 96 Cb 0.15 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 2ab0 h HIS 96 CO -0.15 0.14 -0.33 0.07 -1.30 0.00 0.00 177.93 176.36 2ab0 h ARG 97 N 0.24 0.00 -0.43 5.26 0.11 -0.66 -2.41 114.38 116.50 2ab0 h ARG 97 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 2ab0 h ARG 97 Cb -0.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.05 2ab0 h ARG 97 CO -0.02 0.33 0.00 -1.13 0.10 0.00 0.00 179.97 179.26 2ab0 n SER 98 N -3.56 2.14 0.00 0.08 3.41 -0.46 -4.91 113.62 110.33 2ab0 n SER 98 Ca -0.00 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.54 2ab0 n SER 98 Cb 0.47 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 2ab0 n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ab0 n GLY 99 N 0.97 0.38 3.97 5.00 0.00 -0.91 -5.05 105.19 109.56 2ab0 n GLY 99 Ca 0.12 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 2ab0 n GLY 99 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ab0 s ARG 100 N -2.43 2.51 -0.06 1.61 0.52 -0.44 -5.05 118.95 115.61 2ab0 s ARG 100 Ca 0.00 -1.55 -0.11 0.00 -0.52 0.00 0.00 55.73 53.55 2ab0 s ARG 100 Cb 0.00 -2.54 -0.05 0.00 0.52 0.00 0.00 34.95 32.88 2ab0 s ARG 100 CO 0.00 -0.50 0.28 0.42 0.02 0.00 0.00 175.30 175.52 2ab0 s ILE 101 N -2.54 5.26 -0.20 1.52 1.01 -0.88 -4.32 121.20 121.06 2ab0 s ILE 101 Ca 0.53 0.52 -0.05 0.00 0.00 0.00 0.00 60.65 61.65 2ab0 s ILE 101 Cb -0.06 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 2ab0 s ILE 101 CO 0.32 0.59 -0.00 -0.69 0.00 0.00 0.00 174.94 175.16 2ab0 s VAL 102 N -1.07 3.96 -0.13 2.92 1.01 -0.94 -1.52 120.40 124.63 2ab0 s VAL 102 Ca 0.20 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.88 2ab0 s VAL 102 Cb -0.14 -2.78 0.01 0.00 0.00 0.00 0.00 36.38 33.47 2ab0 s VAL 102 CO 0.09 0.43 -0.19 0.00 0.00 0.00 0.00 175.10 175.44 2ab0 s ALA 103 N 0.93 2.03 -0.01 5.51 0.00 -0.15 -0.89 121.76 129.18 2ab0 s ALA 103 Ca 0.01 -0.97 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 2ab0 s ALA 103 Cb -0.14 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.02 2ab0 s ALA 103 CO 0.02 -0.11 0.03 0.00 0.00 0.00 0.00 175.76 175.69 2ab0 s ALA 104 N 0.98 -0.06 0.06 0.00 0.00 0.10 -0.43 121.76 122.41 2ab0 s ALA 104 Ca -0.05 0.05 0.07 0.00 0.00 0.00 0.00 51.96 52.03 2ab0 s ALA 104 Cb -0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 2ab0 s ALA 104 CO -0.04 -0.02 -0.19 -1.50 0.00 0.00 0.00 175.76 174.01 2ab0 s ILE 105 N -0.06 1.52 0.00 0.00 2.07 -0.79 -1.99 121.20 121.95 2ab0 s ILE 105 Ca -0.01 -1.28 0.00 0.00 -1.41 0.00 0.00 60.65 57.96 2ab0 s ILE 105 Cb -0.01 -1.36 0.00 0.00 0.13 0.00 0.00 42.46 41.22 2ab0 s ILE 105 CO 0.00 0.04 0.00 0.00 -1.91 0.00 0.00 174.94 173.07 2ab0 h ALA 107 N -0.92 1.00 -0.49 0.00 0.00 -1.89 -2.37 119.26 114.60 2ab0 h ALA 107 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2ab0 h ALA 107 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2ab0 h ALA 107 CO 0.00 0.00 0.16 0.00 0.00 0.00 0.00 179.25 179.41 2ab0 h ALA 108 N 2.18 0.64 0.12 0.00 0.00 -1.62 -1.32 119.26 119.26 2ab0 h ALA 108 Ca 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2ab0 h ALA 108 Cb 0.63 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2ab0 h ALA 108 CO 0.00 0.29 -0.22 -1.35 0.00 0.00 0.00 179.25 177.97 2ab0 h PRO 109 N 0.65 -0.40 -0.11 0.00 0.11 -1.78 -0.01 132.00 130.45 2ab0 h PRO 109 Ca 0.16 0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.17 2ab0 h PRO 109 Cb 0.26 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2ab0 h PRO 109 CO -0.01 -0.27 -0.47 0.00 -0.21 0.00 0.00 178.00 177.05 2ab0 h ALA 110 N 0.37 1.00 0.06 -0.75 0.00 -1.79 -1.28 119.26 116.87 2ab0 h ALA 110 Ca 0.02 -0.45 -0.30 0.00 0.00 0.00 0.00 54.91 54.18 2ab0 h ALA 110 Cb 0.43 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2ab0 h ALA 110 CO -0.11 0.64 -1.64 1.15 0.00 0.00 0.00 179.25 179.28 2ab0 h THR 111 N 0.22 0.98 0.00 0.00 2.02 -1.11 -3.38 112.91 111.64 2ab0 h THR 111 Ca 0.01 -2.72 -0.29 0.00 0.77 0.00 0.00 66.41 64.18 2ab0 h THR 111 Cb 0.91 2.59 -0.04 0.00 -1.74 0.00 0.00 68.15 69.86 2ab0 h THR 111 CO 0.07 0.72 -1.93 0.52 0.37 0.00 0.00 175.52 175.28 2ab0 n VAL 112 N -3.29 1.34 -0.03 3.16 0.31 -0.03 -4.53 118.33 115.26 2ab0 n VAL 112 Ca -0.18 -0.19 -0.15 0.00 -0.01 0.00 0.00 64.34 63.80 2ab0 n VAL 112 Cb 1.04 -1.93 -0.09 0.00 -0.91 0.00 0.00 33.84 31.94 2ab0 n VAL 112 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2ab0 h LEU 113 N -0.85 0.46 -0.05 7.52 3.38 -1.23 -3.24 115.31 121.31 2ab0 h LEU 113 Ca -0.44 -0.65 -0.02 0.00 0.09 0.00 0.00 57.88 56.86 2ab0 h LEU 113 Cb 1.34 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2ab0 h LEU 113 CO -0.27 1.03 -0.05 0.58 0.09 0.00 0.00 178.44 179.83 2ab0 h VAL 114 N -0.08 1.38 -0.12 1.22 2.07 -1.54 -2.01 116.25 117.17 2ab0 h VAL 114 Ca -0.02 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 2ab0 h VAL 114 Cb 1.02 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2ab0 h VAL 114 CO 0.08 0.33 0.04 -0.65 0.02 0.00 0.00 177.57 177.38 2ab0 h PRO 115 N -0.33 0.16 -0.03 1.57 0.11 -1.74 -1.45 132.00 130.30 2ab0 h PRO 115 Ca 0.01 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2ab0 h PRO 115 Cb 0.55 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2ab0 h PRO 115 CO 0.01 0.15 0.00 0.72 -0.21 0.00 0.00 178.00 178.67 2ab0 n HIS 116 N -4.47 0.01 -3.95 0.65 8.25 -1.21 -4.95 115.22 109.56 2ab0 n HIS 116 Ca -0.01 -0.01 -0.30 0.00 -0.26 0.00 0.00 57.72 57.14 2ab0 n HIS 116 Cb 0.12 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.24 2ab0 n HIS 116 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2ab0 n ASP 117 N 0.38 -3.95 0.16 0.41 2.03 -0.55 -4.86 116.55 110.18 2ab0 n ASP 117 Ca 0.18 -0.84 0.02 0.00 0.52 0.00 0.00 54.79 54.67 2ab0 n ASP 117 Cb 0.40 -3.66 0.27 0.00 -0.72 0.00 0.00 41.12 37.40 2ab0 n ASP 117 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2ab0 h ILE 118 N -1.96 1.22 -2.23 5.18 2.04 -1.72 -3.35 117.51 116.70 2ab0 h ILE 118 Ca -0.59 -1.74 -0.59 0.00 1.00 0.00 0.00 64.86 62.94 2ab0 h ILE 118 Cb 1.38 1.97 -0.41 0.00 -0.74 0.00 0.00 36.82 39.02 2ab0 h ILE 118 CO 0.68 0.48 -0.80 0.49 0.00 0.00 0.00 178.15 178.99 2ab0 n PHE 119 N -3.77 1.83 0.25 1.37 3.72 -1.26 -4.94 117.46 114.65 2ab0 n PHE 119 Ca -0.01 -3.90 0.10 0.00 -0.05 0.00 0.00 57.45 53.60 2ab0 n PHE 119 Cb 0.53 -0.43 0.67 0.00 -0.94 0.00 0.00 39.48 39.32 2ab0 n PHE 119 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2ab0 h PRO 120 N 4.35 0.00 -6.14 -1.08 0.13 -1.95 -3.39 132.00 123.91 2ab0 h PRO 120 Ca 0.15 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.59 2ab0 h PRO 120 Cb 0.77 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.60 2ab0 h PRO 120 CO 0.66 0.13 -0.87 0.42 -0.23 0.00 0.00 178.00 178.11 2ab0 s ILE 121 N -4.41 2.22 0.00 -3.56 1.01 -1.26 -5.06 121.20 110.14 2ab0 s ILE 121 Ca -0.03 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 59.60 2ab0 s ILE 121 Cb 0.14 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.80 2ab0 s ILE 121 CO 0.62 0.57 0.00 0.61 0.00 0.00 0.00 174.94 176.74 2ab0 n GLY 122 N 2.79 4.77 3.77 6.18 0.00 -1.26 -4.91 105.19 116.53 2ab0 n GLY 122 Ca -0.17 -1.05 -0.38 0.00 0.00 0.00 0.00 46.02 44.42 2ab0 n GLY 122 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ab0 s ASN 123 N 0.00 7.08 0.05 1.61 0.02 -1.26 -4.63 114.94 117.81 2ab0 s ASN 123 Ca 0.00 2.03 -0.19 0.00 -1.02 0.00 0.00 52.86 53.68 2ab0 s ASN 123 Cb 0.00 -2.59 0.04 0.00 0.02 0.00 0.00 41.25 38.72 2ab0 s ASN 123 CO 0.00 -0.26 0.44 0.00 0.02 0.00 0.00 177.10 177.30 2ab0 s MET 124 N -2.06 0.97 0.43 -0.60 0.23 -0.18 -4.66 119.30 113.44 2ab0 s MET 124 Ca 0.52 -0.35 0.02 0.00 -1.03 0.00 0.00 55.69 54.84 2ab0 s MET 124 Cb -0.24 0.43 -0.01 0.00 -1.53 0.00 0.00 34.83 33.49 2ab0 s MET 124 CO 0.30 -0.34 0.08 -2.37 -2.03 0.00 0.00 175.02 170.65 2ab0 n THR 125 N 0.41 0.00 -3.08 3.16 5.66 -1.26 -2.04 114.28 117.13 2ab0 n THR 125 Ca -0.18 -2.28 0.00 0.00 -3.05 0.00 0.00 64.05 58.54 2ab0 n THR 125 Cb 0.60 0.65 0.00 0.00 -1.55 0.00 0.00 70.33 70.03 2ab0 n THR 125 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ab0 n GLY 126 N -0.71 -1.13 3.70 1.09 0.00 -1.26 -4.43 105.19 102.46 2ab0 n GLY 126 Ca -0.12 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 2ab0 n GLY 126 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2ab0 s PHE 127 N -3.00 2.37 0.51 1.61 5.36 -0.89 -4.54 117.98 119.39 2ab0 s PHE 127 Ca 0.00 0.09 0.20 0.00 -0.96 0.00 0.00 56.93 56.27 2ab0 s PHE 127 Cb 0.00 -4.16 1.35 0.00 -0.34 0.00 0.00 43.02 39.87 2ab0 s PHE 127 CO 0.00 -4.67 2.12 -1.35 -1.46 0.00 0.00 175.22 169.86 2ab0 h PRO 128 N 8.08 0.00 0.00 10.12 0.11 -1.94 -0.84 132.00 147.53 2ab0 h PRO 128 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2ab0 h PRO 128 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2ab0 h PRO 128 CO 0.95 0.06 0.00 0.25 -0.21 0.00 0.00 178.00 179.05 2ab0 n THR 129 N -4.22 0.78 -0.42 -1.15 -2.24 -1.26 -1.82 114.28 103.95 2ab0 n THR 129 Ca -0.03 0.14 0.09 0.00 -2.27 0.00 0.00 64.05 61.98 2ab0 n THR 129 Cb 0.15 -1.06 0.33 0.00 -2.10 0.00 0.00 70.33 67.65 2ab0 n THR 129 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ab0 n LEU 130 N -2.23 4.41 -0.22 3.22 4.77 -0.32 -4.64 117.00 121.99 2ab0 n LEU 130 Ca 0.03 -2.22 0.08 0.00 -0.03 0.00 0.00 56.01 53.86 2ab0 n LEU 130 Cb 0.26 -0.55 0.35 0.00 -2.33 0.00 0.00 43.42 41.15 2ab0 n LEU 130 CO 0.22 0.77 1.22 0.50 -1.33 0.00 0.00 177.39 178.76 2ab0 h LYS 131 N 3.83 0.74 0.00 3.23 3.64 -1.35 -1.02 116.57 125.64 2ab0 h LYS 131 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2ab0 h LYS 131 Cb 1.34 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2ab0 h LYS 131 CO 0.21 0.49 0.00 -0.44 -2.27 0.00 0.00 179.45 177.43 2ab0 h ASP 132 N 0.76 0.00 0.04 4.20 3.45 -1.84 -1.99 116.42 121.04 2ab0 h ASP 132 Ca 0.36 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.82 2ab0 h ASP 132 Cb 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 2ab0 h ASP 132 CO -0.14 0.00 -0.03 0.29 -1.57 0.00 0.00 179.24 177.79 2ab0 n LYS 133 N -2.41 1.33 -4.47 3.56 5.02 -0.39 -4.76 118.16 116.05 2ab0 n LYS 133 Ca 0.00 -0.60 -0.34 0.00 -2.02 0.00 0.00 58.31 55.36 2ab0 n LYS 133 Cb 0.14 -1.49 -0.14 0.00 -0.02 0.00 0.00 35.03 33.52 2ab0 n LYS 133 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ab0 s ILE 134 N -2.08 3.10 0.26 -0.18 1.01 -0.75 -4.79 121.20 117.78 2ab0 s ILE 134 Ca 0.39 -0.62 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 2ab0 s ILE 134 Cb 0.21 -2.34 -0.14 0.00 0.01 0.00 0.00 42.46 40.21 2ab0 s ILE 134 CO 0.37 0.50 1.26 -2.65 0.00 0.00 0.00 174.94 174.41 2ab0 n PRO 135 N 3.96 1.78 0.11 2.79 -0.02 -1.26 -4.69 135.00 137.67 2ab0 n PRO 135 Ca -0.18 0.63 0.06 0.00 -2.02 0.00 0.00 63.50 61.99 2ab0 n PRO 135 Cb 0.52 -2.18 0.53 0.00 -0.02 0.00 0.00 33.50 32.35 2ab0 n PRO 135 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ab0 h ALA 136 N 3.20 1.87 0.00 3.55 0.00 -1.93 0.77 119.26 126.72 2ab0 h ALA 136 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2ab0 h ALA 136 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2ab0 h ALA 136 CO 0.68 0.11 0.00 1.05 0.00 0.00 0.00 179.25 181.10 2ab0 h GLU 137 N 0.29 0.00 0.00 0.00 9.09 -1.99 -3.15 114.58 118.81 2ab0 h GLU 137 Ca 0.09 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 59.22 2ab0 h GLU 137 Cb 0.01 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.06 2ab0 h GLU 137 CO -0.02 0.00 -2.18 1.04 0.05 0.00 0.00 179.01 177.90 2ab0 n GLN 138 N -2.30 1.01 -1.93 1.06 6.02 0.16 -4.91 117.38 116.49 2ab0 n GLN 138 Ca 0.03 -0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 2ab0 n GLN 138 Cb 0.29 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 2ab0 n GLN 138 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2ab0 s TRP 139 N -2.56 2.95 0.02 1.08 -0.11 -0.56 -1.01 118.94 118.76 2ab0 s TRP 139 Ca -0.09 0.88 0.04 0.00 1.22 0.00 0.00 56.10 58.15 2ab0 s TRP 139 Cb 0.06 -3.91 -0.02 0.00 -1.50 0.00 0.00 33.47 28.10 2ab0 s TRP 139 CO 0.74 -3.09 -0.11 -0.51 -4.62 0.00 0.00 176.95 169.36 2ab0 s LEU 140 N -0.12 2.12 -1.06 5.86 1.43 -0.87 -4.89 118.68 121.17 2ab0 s LEU 140 Ca 0.63 -0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.34 2ab0 s LEU 140 Cb -0.44 -0.48 0.31 0.00 0.03 0.00 0.00 46.19 45.60 2ab0 s LEU 140 CO 0.42 0.03 1.47 -0.67 0.23 0.00 0.00 176.35 177.83 2ab0 n ASP 141 N 2.23 6.37 -4.24 2.29 2.03 -1.26 -4.30 116.55 119.66 2ab0 n ASP 141 Ca -0.17 -3.43 -0.24 0.00 0.52 0.00 0.00 54.79 51.47 2ab0 n ASP 141 Cb 0.56 -1.24 -0.13 0.00 -0.72 0.00 0.00 41.12 39.58 2ab0 n ASP 141 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2ab0 s LYS 142 N -2.87 1.20 0.29 -0.67 1.02 -1.26 -5.05 119.74 112.41 2ab0 s LYS 142 Ca 0.32 -0.98 0.01 0.00 0.02 0.00 0.00 55.97 55.33 2ab0 s LYS 142 Cb 0.06 -1.34 0.52 0.00 -0.52 0.00 0.00 37.83 36.55 2ab0 s LYS 142 CO 0.09 0.33 1.89 0.00 -0.92 0.00 0.00 175.35 176.74 2ab0 h ARG 143 N 4.60 1.01 -4.23 1.68 3.08 -1.94 -3.41 114.38 115.16 2ab0 h ARG 143 Ca -0.43 -0.06 -0.34 0.00 0.07 0.00 0.00 59.98 59.22 2ab0 h ARG 143 Cb 1.17 -0.23 -0.30 0.00 0.08 0.00 0.00 29.97 30.70 2ab0 h ARG 143 CO 0.42 0.67 -0.76 0.08 -1.07 0.00 0.00 179.97 179.31 2ab0 s VAL 144 N -5.93 0.43 -0.16 2.04 1.01 -1.26 -3.03 120.40 113.50 2ab0 s VAL 144 Ca -0.12 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2ab0 s VAL 144 Cb 0.20 -0.39 0.01 0.00 0.00 0.00 0.00 36.38 36.21 2ab0 s VAL 144 CO 0.80 0.14 -0.20 -0.69 0.00 0.00 0.00 175.10 175.16 2ab0 s VAL 145 N 0.14 2.19 -0.21 2.92 1.01 0.12 -5.00 120.40 121.57 2ab0 s VAL 145 Ca -0.01 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 2ab0 s VAL 145 Cb -0.05 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2ab0 s VAL 145 CO -0.00 0.54 -0.11 0.86 0.00 0.00 0.00 175.10 176.39 2ab0 s TRP 146 N 1.00 2.91 -0.41 5.22 -0.00 -1.26 -0.62 118.94 125.79 2ab0 s TRP 146 Ca -0.02 -1.33 0.00 0.00 -0.00 0.00 0.00 56.10 54.75 2ab0 s TRP 146 Cb -0.15 -2.02 0.11 0.00 -0.00 0.00 0.00 33.47 31.41 2ab0 s TRP 146 CO -0.06 -0.68 0.17 0.34 -0.00 0.00 0.00 176.95 176.72 2ab0 s ASP 147 N 1.38 4.99 0.57 5.86 -1.08 -0.29 -4.96 116.67 123.13 2ab0 s ASP 147 Ca 0.04 -2.24 0.33 0.00 -0.52 0.00 0.00 52.55 50.17 2ab0 s ASP 147 Cb -0.14 -1.74 1.74 0.00 -1.46 0.00 0.00 42.92 41.32 2ab0 s ASP 147 CO -0.07 -0.44 2.16 0.00 0.52 0.00 0.00 175.17 177.34 2ab0 h ALA 148 N 7.66 1.20 -0.40 3.66 0.00 -1.96 -0.42 119.26 129.00 2ab0 h ALA 148 Ca -0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2ab0 h ALA 148 Cb 1.02 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2ab0 h ALA 148 CO 0.63 0.07 0.21 0.00 0.00 0.00 0.00 179.25 180.16 2ab0 h ARG 149 N 0.00 0.55 0.00 0.00 3.08 -1.96 -3.05 114.38 113.01 2ab0 h ARG 149 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.00 2ab0 h ARG 149 Cb 0.23 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2ab0 h ARG 149 CO 0.01 0.41 0.00 1.33 -1.07 0.00 0.00 179.97 180.65 2ab0 n VAL 150 N -4.43 0.69 -3.84 2.04 0.24 -1.06 -5.01 118.33 106.96 2ab0 n VAL 150 Ca 0.03 -0.71 -0.25 0.00 -2.04 0.00 0.00 64.34 61.37 2ab0 n VAL 150 Cb 0.10 0.66 0.00 0.00 -1.47 0.00 0.00 33.84 33.14 2ab0 n VAL 150 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2ab0 n LYS 151 N -0.35 -3.42 -4.01 7.34 5.02 -0.23 -4.86 118.16 117.66 2ab0 n LYS 151 Ca 0.00 0.47 -0.34 0.00 -2.02 0.00 0.00 58.31 56.42 2ab0 n LYS 151 Cb 0.31 -4.65 -0.15 0.00 -0.02 0.00 0.00 35.03 30.53 2ab0 n LYS 151 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2ab0 s LEU 152 N -6.80 2.60 -0.21 -0.35 2.96 -0.83 -2.20 118.68 113.84 2ab0 s LEU 152 Ca 0.07 -0.58 -0.05 0.00 -0.22 0.00 0.00 54.13 53.36 2ab0 s LEU 152 Cb -0.03 -1.61 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 2ab0 s LEU 152 CO 0.86 -0.03 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.64 2ab0 s LEU 153 N 1.37 3.17 0.22 -0.68 2.96 -0.07 -1.14 118.68 124.50 2ab0 s LEU 153 Ca 0.05 -0.26 0.06 0.00 -0.22 0.00 0.00 54.13 53.75 2ab0 s LEU 153 Cb -0.14 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 2ab0 s LEU 153 CO -0.08 0.03 -0.08 0.42 -1.32 0.00 0.00 176.35 175.33 2ab0 s THR 154 N 1.19 1.40 0.26 3.68 -4.23 0.21 -0.73 115.64 117.42 2ab0 s THR 154 Ca 0.03 -2.11 -0.15 0.00 -1.18 0.00 0.00 61.69 58.28 2ab0 s THR 154 Cb -0.15 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.52 2ab0 s THR 154 CO 0.01 -0.48 0.55 -0.55 -0.54 0.00 0.00 174.62 173.61 2ab0 s SER 155 N -3.31 -0.15 -0.23 3.99 0.15 -0.84 -0.70 113.70 112.61 2ab0 s SER 155 Ca 0.24 -0.82 0.02 0.00 0.70 0.00 0.00 55.95 56.10 2ab0 s SER 155 Cb 0.03 0.63 -0.19 0.00 -1.71 0.00 0.00 66.02 64.78 2ab0 s SER 155 CO 0.07 -1.20 -0.12 0.00 1.20 0.00 0.00 173.24 173.19 2ab0 n GLN 156 N -0.40 0.67 -3.61 5.44 6.02 -1.17 -0.84 117.38 123.49 2ab0 n GLN 156 Ca -0.03 0.15 -0.03 0.00 -0.01 0.00 0.00 57.00 57.09 2ab0 n GLN 156 Cb 0.61 -1.55 0.02 0.00 1.02 0.00 0.00 30.24 30.34 2ab0 n GLN 156 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ab0 n GLY 157 N 2.18 0.69 0.33 1.08 0.00 -1.26 -2.92 105.19 105.29 2ab0 n GLY 157 Ca -0.43 -1.13 0.09 0.00 0.00 0.00 0.00 46.02 44.55 2ab0 n GLY 157 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2ab0 h PRO 158 N 0.00 0.74 0.00 1.61 0.11 -1.98 -0.60 132.00 131.88 2ab0 h PRO 158 Ca -0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2ab0 h PRO 158 Cb 1.08 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2ab0 h PRO 158 CO 0.33 0.49 0.00 0.41 -0.21 0.00 0.00 178.00 179.02 2ab0 n GLY 159 N -1.33 -1.10 0.99 -0.55 0.00 -1.26 -2.25 105.19 99.69 2ab0 n GLY 159 Ca 0.19 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2ab0 n GLY 159 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ab0 n THR 160 N -1.43 1.29 -0.00 2.61 -2.24 -0.24 -4.62 114.28 109.64 2ab0 n THR 160 Ca 0.06 -1.14 -0.02 0.00 -2.27 0.00 0.00 64.05 60.69 2ab0 n THR 160 Cb 0.21 0.35 0.25 0.00 -2.10 0.00 0.00 70.33 69.04 2ab0 n THR 160 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ab0 h ALA 161 N 2.85 1.25 -0.13 6.98 0.00 -1.35 -0.93 119.26 127.93 2ab0 h ALA 161 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2ab0 h ALA 161 Cb 0.99 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2ab0 h ALA 161 CO 0.06 0.49 0.05 0.82 0.00 0.00 0.00 179.25 180.68 2ab0 h ILE 162 N 0.49 1.16 -0.66 0.00 2.04 -1.82 -0.63 117.51 118.09 2ab0 h ILE 162 Ca 0.09 -0.47 0.09 0.00 1.00 0.00 0.00 64.86 65.57 2ab0 h ILE 162 Cb 0.47 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.70 2ab0 h ILE 162 CO 0.03 0.14 0.31 0.44 0.00 0.00 0.00 178.15 179.07 2ab0 h ASP 163 N 0.05 0.39 0.43 1.72 3.45 -1.75 -0.34 116.42 120.36 2ab0 h ASP 163 Ca 0.04 0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.54 2ab0 h ASP 163 Cb 0.18 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.95 2ab0 h ASP 163 CO -0.00 0.23 -0.20 0.15 -1.57 0.00 0.00 179.24 177.84 2ab0 h PHE 164 N 0.54 -0.53 -0.99 4.55 3.57 -1.03 -1.73 116.94 121.33 2ab0 h PHE 164 Ca 0.32 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.82 2ab0 h PHE 164 Cb 0.34 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.21 2ab0 h PHE 164 CO -0.12 -0.31 0.64 0.78 -2.23 0.00 0.00 178.31 177.07 2ab0 h GLY 165 N -0.61 1.40 1.26 2.40 0.00 -0.76 -1.77 103.07 105.00 2ab0 h GLY 165 Ca -0.06 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.68 2ab0 h GLY 165 CO 0.10 0.52 0.17 1.41 0.00 0.00 0.00 176.54 178.74 2ab0 h LEU 166 N 1.34 0.86 -0.79 3.11 3.38 -0.98 -1.67 115.31 120.57 2ab0 h LEU 166 Ca 0.36 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 2ab0 h LEU 166 Cb -0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.38 2ab0 h LEU 166 CO -0.08 0.82 -0.37 0.50 0.09 0.00 0.00 178.44 179.41 2ab0 h LYS 167 N 0.89 0.47 -0.48 1.13 1.63 -0.82 -0.01 116.57 119.38 2ab0 h LYS 167 Ca 0.20 -0.22 0.01 0.00 -0.85 0.00 0.00 60.65 59.78 2ab0 h LYS 167 Cb 0.29 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.89 2ab0 h LYS 167 CO -0.00 0.78 0.31 0.82 -3.45 0.00 0.00 179.45 177.90 2ab0 h ILE 168 N 0.40 1.10 -0.36 2.00 2.04 -0.90 -1.11 117.51 120.67 2ab0 h ILE 168 Ca 0.04 -0.22 0.01 0.00 1.00 0.00 0.00 64.86 65.69 2ab0 h ILE 168 Cb 0.83 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2ab0 h ILE 168 CO 0.07 0.12 0.23 0.40 0.00 0.00 0.00 178.15 178.97 2ab0 h ILE 169 N 0.63 1.08 -0.76 -0.67 2.04 -0.83 -0.75 117.51 118.24 2ab0 h ILE 169 Ca 0.18 -0.16 0.12 0.00 1.00 0.00 0.00 64.86 66.00 2ab0 h ILE 169 Cb -0.05 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 36.51 2ab0 h ILE 169 CO -0.05 0.09 0.37 -0.78 0.00 0.00 0.00 178.15 177.78 2ab0 h ASP 170 N 0.48 0.46 0.36 1.72 3.58 -0.62 0.16 116.42 122.55 2ab0 h ASP 170 Ca 0.14 0.08 -0.22 0.00 0.42 0.00 0.00 57.03 57.44 2ab0 h ASP 170 Cb -0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.01 2ab0 h ASP 170 CO -0.04 0.23 -0.93 -0.07 -2.88 0.00 0.00 179.24 175.55 2ab0 h LEU 171 N 0.59 0.51 0.00 2.28 3.38 -0.86 -2.37 115.31 118.84 2ab0 h LEU 171 Ca 0.39 -0.41 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 2ab0 h LEU 171 Cb 0.49 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2ab0 h LEU 171 CO -0.32 1.20 -1.65 -0.07 0.09 0.00 0.00 178.44 177.70 2ab0 h LEU 172 N 0.22 0.02 0.00 1.67 3.38 -0.94 -3.43 115.31 116.22 2ab0 h LEU 172 Ca -0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2ab0 h LEU 172 Cb 1.57 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 2ab0 h LEU 172 CO 0.16 1.03 -0.69 0.52 0.09 0.00 0.00 178.44 179.55 2ab0 n VAL 173 N -3.09 0.00 0.00 1.22 0.31 0.45 -4.85 118.33 112.37 2ab0 n VAL 173 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2ab0 n VAL 173 Cb 1.04 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 2ab0 n VAL 173 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ab0 n GLY 174 N 2.69 2.19 0.33 2.92 0.00 -0.61 -4.86 105.19 107.85 2ab0 n GLY 174 Ca 0.00 -1.94 -0.05 0.00 0.00 0.00 0.00 46.02 44.04 2ab0 n GLY 174 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2ab0 h ARG 175 N 0.00 1.12 -0.35 1.61 2.43 -1.87 -1.92 114.38 115.41 2ab0 h ARG 175 Ca 0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2ab0 h ARG 175 Cb 0.00 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 2ab0 h ARG 175 CO 0.00 0.81 0.23 1.49 -1.51 0.00 0.00 179.97 180.99 2ab0 h GLU 176 N 1.13 0.46 -0.33 0.20 4.81 -1.91 -0.37 114.58 118.56 2ab0 h GLU 176 Ca 0.29 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.34 2ab0 h GLU 176 Cb -0.00 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2ab0 h GLU 176 CO -0.05 0.31 -0.39 -0.22 -0.73 0.00 0.00 179.01 177.93 2ab0 h LYS 177 N 0.47 0.78 -0.31 1.92 1.63 -1.84 -0.83 116.57 118.39 2ab0 h LYS 177 Ca 0.13 -0.40 0.00 0.00 -0.85 0.00 0.00 60.65 59.53 2ab0 h LYS 177 Cb -0.05 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.57 2ab0 h LYS 177 CO -0.03 1.03 0.21 0.00 -3.45 0.00 0.00 179.45 177.21 2ab0 h ALA 178 N 0.92 0.40 -0.79 5.00 0.00 -1.15 -0.48 119.26 123.16 2ab0 h ALA 178 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2ab0 h ALA 178 Cb 0.95 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2ab0 h ALA 178 CO 0.09 -0.13 0.50 1.25 0.00 0.00 0.00 179.25 180.96 2ab0 h HIS 179 N 0.42 1.01 -0.18 0.00 -0.00 -0.87 -0.44 115.15 115.09 2ab0 h HIS 179 Ca 0.11 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.52 2ab0 h HIS 179 Cb -0.04 -0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.00 2ab0 h HIS 179 CO -0.05 0.65 0.02 1.49 -0.00 0.00 0.00 177.93 180.04 2ab0 h GLU 180 N 1.07 0.08 -0.22 5.26 4.81 -0.74 -0.45 114.58 124.39 2ab0 h GLU 180 Ca 0.29 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.49 2ab0 h GLU 180 Cb -0.09 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 2ab0 h GLU 180 CO -0.06 0.05 0.03 0.28 -0.73 0.00 0.00 179.01 178.59 2ab0 h VAL 181 N 0.08 1.23 -0.71 0.32 2.07 -0.95 -2.92 116.25 115.37 2ab0 h VAL 181 Ca 0.08 -0.75 0.11 0.00 0.82 0.00 0.00 66.70 66.96 2ab0 h VAL 181 Cb 0.09 1.31 -0.08 0.00 -1.52 0.00 0.00 31.29 31.09 2ab0 h VAL 181 CO -0.13 0.23 0.33 0.00 0.02 0.00 0.00 177.57 178.02 2ab0 h ALA 182 N 0.84 0.98 0.00 1.67 0.00 -0.83 -1.53 119.26 120.39 2ab0 h ALA 182 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ab0 h ALA 182 Cb 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2ab0 h ALA 182 CO 0.00 -0.10 0.00 0.66 0.00 0.00 0.00 179.25 179.81 2ab0 h SER 183 N 0.54 0.00 0.27 0.00 4.64 -0.88 -2.02 113.55 116.10 2ab0 h SER 183 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2ab0 h SER 183 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2ab0 h SER 183 CO -0.30 0.00 -0.36 0.00 -0.87 0.00 0.00 176.83 175.29 2ab0 n GLN 184 N -2.41 0.64 0.05 4.77 6.02 -0.58 -4.53 117.38 121.34 2ab0 n GLN 184 Ca -0.00 -0.40 0.10 0.00 -0.01 0.00 0.00 57.00 56.69 2ab0 n GLN 184 Cb 0.12 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 29.80 2ab0 n GLN 184 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2ab0 n LEU 185 N -0.83 0.46 -3.13 1.08 4.77 -0.76 -4.97 117.00 113.62 2ab0 n LEU 185 Ca 0.10 0.18 -0.15 0.00 -0.03 0.00 0.00 56.01 56.11 2ab0 n LEU 185 Cb 0.35 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.51 2ab0 n LEU 185 CO 0.29 -0.07 0.09 0.52 -1.33 0.00 0.00 177.39 176.89 2ab0 n VAL 186 N -2.51 -5.39 -2.38 4.08 0.31 -1.26 -4.98 118.33 106.21 2ab0 n VAL 186 Ca -0.03 -0.47 -0.29 0.00 -0.01 0.00 0.00 64.34 63.54 2ab0 n VAL 186 Cb 0.59 -4.75 -0.00 0.00 -0.91 0.00 0.00 33.84 28.77 2ab0 n VAL 186 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ab0 s MET 187 N -5.15 3.60 0.63 5.55 0.00 -1.26 -5.02 119.30 117.64 2ab0 s MET 187 Ca 0.02 0.45 -0.16 0.00 0.00 0.00 0.00 55.69 55.99 2ab0 s MET 187 Cb -0.00 -2.26 -0.02 0.00 0.00 0.00 0.00 34.83 32.55 2ab0 s MET 187 CO 0.64 -0.32 1.12 0.00 0.00 0.00 0.00 175.02 176.46 2ab0 s ALA 188 N -2.86 2.53 0.52 3.16 0.00 -1.26 -4.92 121.76 118.92 2ab0 s ALA 188 Ca 0.51 0.64 0.18 0.00 0.00 0.00 0.00 51.96 53.28 2ab0 s ALA 188 Cb -0.11 -3.34 1.28 0.00 0.00 0.00 0.00 23.12 20.96 2ab0 s ALA 188 CO 0.46 -1.15 2.11 0.00 0.00 0.00 0.00 175.76 177.19 2ab0 h ALA 189 N 0.36 2.10 -0.07 0.00 0.00 -2.04 -2.71 119.26 116.90 2ab0 h ALA 189 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2ab0 h ALA 189 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2ab0 h ALA 189 CO 0.55 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.08 2ab0 n GLY 190 N -1.56 1.21 3.45 0.00 0.00 -1.26 -4.75 105.19 102.28 2ab0 n GLY 190 Ca -0.00 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 2ab0 n GLY 190 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ab0 s ILE 191 N -1.35 3.77 0.20 -0.61 1.01 -1.02 -5.07 121.20 118.13 2ab0 s ILE 191 Ca 0.06 -0.39 -0.31 0.00 0.00 0.00 0.00 60.65 60.01 2ab0 s ILE 191 Cb 0.05 -2.67 -0.11 0.00 0.01 0.00 0.00 42.46 39.74 2ab0 s ILE 191 CO 0.02 0.47 1.60 -0.47 0.00 0.00 0.00 174.94 176.56 2ab0 s TYR 192 N 0.69 2.98 -1.08 3.97 5.04 -1.26 -4.91 117.35 122.77 2ab0 s TYR 192 Ca -0.02 0.61 0.15 0.00 -2.44 0.00 0.00 57.07 55.37 2ab0 s TYR 192 Cb -0.14 -3.99 0.46 0.00 0.35 0.00 0.00 41.96 38.63 2ab0 s TYR 192 CO 0.02 -3.60 1.38 0.27 -1.34 0.00 0.00 175.55 172.29 2ab0 n ASN 193 N 3.57 3.49 -1.47 4.32 6.94 -1.26 -4.98 115.26 125.86 2ab0 n ASN 193 Ca 0.13 -2.18 -0.15 0.00 -0.02 0.00 0.00 54.58 52.37 2ab0 n ASN 193 Cb 0.38 -0.37 -0.03 0.00 -2.36 0.00 0.00 39.78 37.40 2ab0 n ASN 193 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2ab0 n TYR 194 N 0.71 -0.46 0.00 -2.53 4.02 -1.26 -4.36 117.16 113.28 2ab0 n TYR 194 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.06 2ab0 n TYR 194 Cb 0.58 -2.90 0.00 0.00 -0.02 0.00 0.00 39.34 37.00 2ab0 n TYR 194 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 2ab0 n TYR 195 N -3.53 0.00 0.00 -0.72 -0.00 -1.26 -4.59 117.16 107.06 2ab0 n TYR 195 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.74 2ab0 n TYR 195 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.92 2ab0 n TYR 195 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25