#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3abq s LEU 45 N 0.00 1.87 -0.27 0.00 2.96 -1.26 -5.10 118.68 116.88 3abq s LEU 45 Ca 0.00 -0.50 -0.23 0.00 -0.22 0.00 0.00 54.13 53.18 3abq s LEU 45 Cb 0.00 -1.23 -0.01 0.00 0.50 0.00 0.00 46.19 45.45 3abq s LEU 45 CO 0.00 0.04 0.75 -0.62 -1.32 0.00 0.00 176.35 175.20 3abq s ASP 46 N 0.95 6.69 0.21 3.68 3.68 -1.26 -4.93 116.67 125.70 3abq s ASP 46 Ca -0.06 0.79 0.18 0.00 2.13 0.00 0.00 52.55 55.59 3abq s ASP 46 Cb -0.15 -2.39 0.87 0.00 -1.45 0.00 0.00 42.92 39.79 3abq s ASP 46 CO -0.02 -0.51 1.56 0.18 0.13 0.00 0.00 175.17 176.51 3abq n LEU 47 N 5.99 0.45 -0.60 -1.34 4.77 -1.26 -0.63 117.00 124.38 3abq n LEU 47 Ca 0.03 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 56.79 3abq n LEU 47 Cb 0.48 -0.65 0.27 0.00 -2.33 0.00 0.00 43.42 41.19 3abq n LEU 47 CO 0.47 -0.66 0.66 0.61 -1.33 0.00 0.00 177.39 177.14 3abq n GLY 48 N -0.70 0.24 3.81 -0.72 0.00 -1.26 -4.72 105.19 101.84 3abq n GLY 48 Ca 0.01 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.18 3abq n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3abq s SER 49 N -2.17 3.97 0.30 1.61 1.04 0.20 -4.94 113.70 113.71 3abq s SER 49 Ca 0.29 1.01 0.11 0.00 0.48 0.00 0.00 55.95 57.84 3abq s SER 49 Cb 0.20 -1.61 0.44 0.00 0.10 0.00 0.00 66.02 65.15 3abq s SER 49 CO 0.39 -2.27 1.66 0.00 0.98 0.00 0.00 173.24 174.01 3abq h ALA 50 N -1.30 1.06 -0.50 5.32 0.00 -1.94 -2.73 119.26 119.17 3abq h ALA 50 Ca -0.49 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 53.88 3abq h ALA 50 Cb 1.32 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3abq h ALA 50 CO 0.62 0.70 0.17 1.49 0.00 0.00 0.00 179.25 182.23 3abq h GLU 51 N 0.00 0.76 -0.32 0.00 4.81 -1.93 -2.04 114.58 115.86 3abq h GLU 51 Ca -0.01 -0.15 -0.08 0.00 -0.13 0.00 0.00 59.36 58.99 3abq h GLU 51 Cb 1.00 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.25 3abq h GLU 51 CO 0.07 0.70 -0.15 0.00 -0.73 0.00 0.00 179.01 178.89 3abq h ALA 52 N 1.03 1.13 -0.08 2.92 0.00 -1.76 -2.34 119.26 120.16 3abq h ALA 52 Ca 0.16 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 3abq h ALA 52 Cb 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3abq h ALA 52 CO -0.01 0.54 -0.41 0.87 0.00 0.00 0.00 179.25 180.25 3abq h LYS 53 N 0.52 0.18 -0.01 0.00 1.57 -1.26 -2.99 116.57 114.59 3abq h LYS 53 Ca 0.09 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3abq h LYS 53 Cb 0.57 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3abq h LYS 53 CO 0.04 0.57 -0.27 0.00 -0.57 0.00 0.00 179.45 179.21 3abq n ALA 54 N -2.47 3.12 -1.69 3.86 0.00 -0.79 -4.96 120.51 117.59 3abq n ALA 54 Ca -0.02 -0.46 -0.44 0.00 0.00 0.00 0.00 53.44 52.52 3abq n ALA 54 Cb 0.47 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 18.82 3abq n ALA 54 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 3abq n TRP 55 N -0.42 2.50 -3.88 0.00 -0.00 -0.90 -4.98 117.44 109.75 3abq n TRP 55 Ca 0.12 0.04 -0.36 0.00 -0.00 0.00 0.00 57.50 57.30 3abq n TRP 55 Cb 0.38 -2.65 -0.11 0.00 -0.00 0.00 0.00 31.31 28.92 3abq n TRP 55 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 3abq s ILE 56 N 2.04 4.65 -0.74 5.87 1.01 -1.26 -4.65 121.20 128.12 3abq s ILE 56 Ca 0.81 -0.07 0.10 0.00 0.00 0.00 0.00 60.65 61.49 3abq s ILE 56 Cb -0.58 -3.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 3abq s ILE 56 CO 0.38 0.39 0.54 0.61 0.00 0.00 0.00 174.94 176.87 3abq n GLY 57 N 4.21 -0.05 3.69 6.18 0.00 0.68 -4.97 105.19 114.93 3abq n GLY 57 Ca -0.16 -0.28 -0.44 0.00 0.00 0.00 0.00 46.02 45.14 3abq n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3abq n VAL 58 N -0.65 0.29 -3.32 1.61 0.31 -1.19 -4.36 118.33 111.03 3abq n VAL 58 Ca 0.03 -0.05 -0.38 0.00 -0.01 0.00 0.00 64.34 63.93 3abq n VAL 58 Cb 0.19 -1.96 -0.06 0.00 -0.91 0.00 0.00 33.84 31.10 3abq n VAL 58 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3abq s GLU 59 N 2.42 4.18 -1.31 5.55 2.02 -1.26 -4.30 118.70 126.00 3abq s GLU 59 Ca 0.82 0.62 -0.03 0.00 0.02 0.00 0.00 54.97 56.39 3abq s GLU 59 Cb -0.55 -3.29 -0.00 0.00 0.10 0.00 0.00 34.13 30.39 3abq s GLU 59 CO 0.39 0.52 0.62 0.09 0.02 0.00 0.00 175.26 176.90 3abq n ASN 60 N 2.26 -1.65 -4.75 -0.19 3.02 -1.26 -4.90 115.26 107.79 3abq n ASN 60 Ca -0.10 -0.91 -0.37 0.00 -0.03 0.00 0.00 54.58 53.17 3abq n ASN 60 Cb 0.51 -3.63 0.04 0.00 -0.61 0.00 0.00 39.78 36.09 3abq n ASN 60 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3abq s PRO 61 N -6.13 2.93 0.16 3.52 0.04 -1.26 -4.93 135.00 129.33 3abq s PRO 61 Ca 0.09 1.97 -0.13 0.00 0.04 0.00 0.00 61.00 62.97 3abq s PRO 61 Cb -0.03 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.56 3abq s PRO 61 CO 0.84 -1.27 1.68 1.25 0.04 0.00 0.00 177.00 179.55 3abq h HIS 62 N 0.97 0.83 -2.23 0.56 2.76 -1.98 -3.41 115.15 112.66 3abq h HIS 62 Ca -0.51 -0.08 -0.33 0.00 -2.20 0.00 0.00 60.37 57.25 3abq h HIS 62 Cb 1.31 -0.24 -0.34 0.00 1.55 0.00 0.00 27.41 29.69 3abq h HIS 62 CO 0.45 0.71 -0.64 1.03 -1.30 0.00 0.00 177.93 178.19 3abq s ARG 63 N -5.42 0.30 0.34 5.26 0.52 -1.26 -5.04 118.95 113.65 3abq s ARG 63 Ca -0.13 -0.08 0.15 0.00 -0.52 0.00 0.00 55.73 55.15 3abq s ARG 63 Cb 0.12 -0.76 0.60 0.00 0.52 0.00 0.00 34.95 35.43 3abq s ARG 63 CO 0.79 -0.95 1.72 0.00 0.02 0.00 0.00 175.30 176.87 3abq h ALA 64 N 8.28 1.06 -0.50 2.13 0.00 -2.00 -2.54 119.26 125.70 3abq h ALA 64 Ca -0.14 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 3abq h ALA 64 Cb 1.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 3abq h ALA 64 CO 0.33 0.56 -0.07 0.38 0.00 0.00 0.00 179.25 180.45 3abq h ASP 65 N 0.00 0.92 -0.62 0.00 -0.00 -1.99 -1.72 116.42 113.02 3abq h ASP 65 Ca -0.00 -0.34 0.04 0.00 -0.00 0.00 0.00 57.03 56.73 3abq h ASP 65 Cb 0.91 -0.25 -0.05 0.00 -0.00 0.00 0.00 39.33 39.94 3abq h ASP 65 CO 0.06 1.05 0.35 0.58 -0.00 0.00 0.00 179.24 181.28 3abq h VAL 66 N 0.78 1.01 -0.81 4.15 2.07 -1.92 -1.07 116.25 120.47 3abq h VAL 66 Ca 0.13 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 3abq h VAL 66 Cb 0.62 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3abq h VAL 66 CO 0.04 0.12 0.50 -0.07 0.02 0.00 0.00 177.57 178.18 3abq h LEU 67 N 0.67 0.96 -0.68 2.57 3.38 -1.21 0.15 115.31 121.15 3abq h LEU 67 Ca 0.26 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 3abq h LEU 67 Cb 0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3abq h LEU 67 CO -0.14 0.72 -0.04 0.74 0.09 0.00 0.00 178.44 179.81 3abq h THR 68 N 1.11 1.26 -0.28 0.22 2.02 -0.79 -0.02 112.91 116.44 3abq h THR 68 Ca 0.29 -1.17 -0.13 0.00 0.77 0.00 0.00 66.41 66.18 3abq h THR 68 Cb -0.07 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3abq h THR 68 CO -0.06 0.42 -0.36 -0.08 0.37 0.00 0.00 175.52 175.81 3abq h GLU 69 N 0.90 0.62 -0.27 6.66 4.81 -0.61 -2.15 114.58 124.54 3abq h GLU 69 Ca 0.16 -0.30 -0.07 0.00 -0.13 0.00 0.00 59.36 59.02 3abq h GLU 69 Cb 0.58 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 3abq h GLU 69 CO 0.03 0.89 -0.11 -0.07 -0.73 0.00 0.00 179.01 179.02 3abq h LEU 70 N 0.52 0.56 -0.96 1.64 3.38 -0.47 -1.93 115.31 118.04 3abq h LEU 70 Ca 0.05 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.67 3abq h LEU 70 Cb 0.86 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.40 3abq h LEU 70 CO 0.07 0.83 0.62 -0.09 0.09 0.00 0.00 178.44 179.96 3abq h ARG 71 N 0.28 1.17 0.00 1.13 9.65 -0.97 -2.22 114.38 123.42 3abq h ARG 71 Ca 0.06 -0.07 -0.03 0.00 -1.10 0.00 0.00 59.98 58.84 3abq h ARG 71 Cb 0.61 -0.26 -0.00 0.00 -1.39 0.00 0.00 29.97 28.92 3abq h ARG 71 CO 0.03 0.77 -0.14 -0.09 2.80 0.00 0.00 179.97 183.34 3abq h ARG 72 N 1.20 0.00 0.00 0.20 2.43 -1.29 -3.22 114.38 113.70 3abq h ARG 72 Ca 0.39 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.56 3abq h ARG 72 Cb 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3abq h ARG 72 CO -0.13 0.14 -0.03 0.43 -1.51 0.00 0.00 179.97 178.88 3abq n SER 73 N -3.21 0.24 -3.85 -3.80 7.64 -0.74 -4.88 113.62 105.02 3abq n SER 73 Ca 0.02 0.49 -0.10 0.00 1.01 0.00 0.00 58.87 60.28 3abq n SER 73 Cb 0.47 -0.54 -0.08 0.00 -1.01 0.00 0.00 64.21 63.04 3abq n SER 73 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3abq s THR 74 N -3.03 0.11 -0.65 0.44 -1.32 -1.22 -5.01 115.64 104.97 3abq s THR 74 Ca 0.13 -0.91 0.25 0.00 -1.21 0.00 0.00 61.69 59.94 3abq s THR 74 Cb 0.17 -0.92 0.13 0.00 -1.51 0.00 0.00 72.50 70.37 3abq s THR 74 CO 0.56 -0.50 1.46 0.58 -2.21 0.00 0.00 174.62 174.50 3abq h VAL 75 N 3.46 0.00 -4.13 5.08 2.07 -1.90 -3.47 116.25 117.37 3abq h VAL 75 Ca -0.32 -0.52 -0.54 0.00 0.82 0.00 0.00 66.70 66.14 3abq h VAL 75 Cb 1.19 1.24 0.15 0.00 -1.52 0.00 0.00 31.29 32.34 3abq h VAL 75 CO 0.48 0.00 0.47 0.00 0.02 0.00 0.00 177.57 178.54 3abq s ALA 76 N -3.15 2.33 -1.46 1.67 0.00 -1.26 -4.87 121.76 115.02 3abq s ALA 76 Ca 0.07 1.06 -0.10 0.00 0.00 0.00 0.00 51.96 52.99 3abq s ALA 76 Cb 0.13 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.78 3abq s ALA 76 CO 0.68 -1.58 2.49 0.54 0.00 0.00 0.00 175.76 177.89 3abq n ARG 77 N -2.09 3.75 -2.78 0.00 1.74 -1.26 -4.94 116.66 111.08 3abq n ARG 77 Ca 0.15 -2.83 -0.25 0.00 -0.77 0.00 0.00 57.85 54.15 3abq n ARG 77 Cb 0.49 -2.88 0.02 0.00 -1.02 0.00 0.00 32.46 29.07 3abq n ARG 77 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3abq s VAL 78 N 1.22 4.04 -1.07 1.55 -7.23 -1.26 -4.53 120.40 113.12 3abq s VAL 78 Ca 0.56 -0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.46 3abq s VAL 78 Cb 0.16 -3.53 0.00 0.00 0.56 0.00 0.00 36.38 33.57 3abq s VAL 78 CO -0.06 -0.44 0.00 0.00 -0.31 0.00 0.00 175.10 174.29 3abq n THR 80 N -2.87 0.00 -4.42 0.00 -2.24 -1.26 -0.23 114.28 103.27 3abq n THR 80 Ca -0.11 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 3abq n THR 80 Cb 0.37 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3abq n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3abq n GLY 81 N 1.31 0.08 3.57 3.38 0.00 -1.26 -3.94 105.19 108.34 3abq n GLY 81 Ca 0.13 -0.94 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 3abq n GLY 81 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3abq s ARG 82 N 0.00 1.31 -0.25 1.61 1.70 -1.26 -4.43 118.95 117.64 3abq s ARG 82 Ca 0.00 -0.58 0.01 0.00 -0.47 0.00 0.00 55.73 54.69 3abq s ARG 82 Cb 0.00 0.54 0.06 0.00 -0.57 0.00 0.00 34.95 34.98 3abq s ARG 82 CO 0.00 -0.59 -0.05 0.00 -1.08 0.00 0.00 175.30 173.58 3abq s ALA 83 N -3.63 2.12 0.00 7.88 0.00 0.21 -4.70 121.76 123.64 3abq s ALA 83 Ca 0.05 -1.51 0.00 0.00 0.00 0.00 0.00 51.96 50.50 3abq s ALA 83 Cb -0.02 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.60 3abq s ALA 83 CO -0.06 -1.24 0.00 0.41 0.00 0.00 0.00 175.76 174.87 3abq n GLY 84 N 4.61 3.46 0.93 0.00 0.00 -1.26 -1.10 105.19 111.83 3abq n GLY 84 Ca -0.11 0.04 0.10 0.00 0.00 0.00 0.00 46.02 46.04 3abq n GLY 84 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3abq n PRO 85 N 14.00 2.19 -4.00 1.61 -0.04 -1.26 -4.96 135.00 142.55 3abq n PRO 85 Ca 0.00 -1.83 -0.25 0.00 -0.04 0.00 0.00 63.50 61.39 3abq n PRO 85 Cb 0.00 -1.44 -0.04 0.00 -0.04 0.00 0.00 33.50 31.98 3abq n PRO 85 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3abq s ARG 86 N -1.48 3.27 0.62 0.54 1.81 -0.26 -5.08 118.95 118.37 3abq s ARG 86 Ca 0.36 -0.73 -0.19 0.00 -1.72 0.00 0.00 55.73 53.46 3abq s ARG 86 Cb 0.20 -2.84 -0.03 0.00 -0.45 0.00 0.00 34.95 31.82 3abq s ARG 86 CO 0.27 0.49 1.16 -2.30 -0.68 0.00 0.00 175.30 174.24 3abq n PRO 87 N -0.70 1.09 -1.95 3.54 -0.02 -1.26 0.67 135.00 136.37 3abq n PRO 87 Ca -0.08 0.42 -0.34 0.00 -2.02 0.00 0.00 63.50 61.49 3abq n PRO 87 Cb 0.55 -2.38 0.03 0.00 -0.02 0.00 0.00 33.50 31.68 3abq n PRO 87 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3abq s ARG 88 N -3.04 3.04 0.15 -0.52 0.52 -1.26 -4.26 118.95 113.57 3abq s ARG 88 Ca 0.78 1.42 -0.17 0.00 -0.52 0.00 0.00 55.73 57.25 3abq s ARG 88 Cb -0.40 -1.98 0.05 0.00 0.52 0.00 0.00 34.95 33.14 3abq s ARG 88 CO 0.44 -1.07 1.73 1.15 0.02 0.00 0.00 175.30 177.58 3abq h THR 89 N 0.43 0.85 -0.85 0.02 2.02 -1.95 -1.27 112.91 112.16 3abq h THR 89 Ca -0.48 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 3abq h THR 89 Cb 1.25 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 3abq h THR 89 CO 0.55 0.04 0.48 -0.61 0.37 0.00 0.00 175.52 176.35 3abq h GLN 90 N 0.19 1.18 -0.43 6.66 4.15 -1.97 0.17 115.11 125.05 3abq h GLN 90 Ca 0.15 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 3abq h GLN 90 Cb 0.16 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 3abq h GLN 90 CO -0.19 0.85 0.16 0.00 -1.93 0.00 0.00 178.83 177.72 3abq h ALA 91 N 1.26 0.56 -0.65 3.38 0.00 -1.79 -0.50 119.26 121.52 3abq h ALA 91 Ca 0.30 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3abq h ALA 91 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3abq h ALA 91 CO -0.05 0.18 0.42 1.25 0.00 0.00 0.00 179.25 181.05 3abq h LEU 92 N 0.55 0.72 -0.60 0.00 5.85 -0.84 -1.74 115.31 119.26 3abq h LEU 92 Ca 0.14 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 3abq h LEU 92 Cb 0.21 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3abq h LEU 92 CO -0.01 0.52 0.27 -0.07 -0.34 0.00 0.00 178.44 178.81 3abq h LEU 93 N 0.86 0.79 -0.65 2.25 3.38 -0.30 -1.09 115.31 120.55 3abq h LEU 93 Ca 0.24 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 3abq h LEU 93 Cb -0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3abq h LEU 93 CO -0.07 0.72 -0.49 -0.09 0.09 0.00 0.00 178.44 178.61 3abq h ARG 94 N 0.82 0.46 -0.08 1.13 2.43 -1.00 -0.60 114.38 117.54 3abq h ARG 94 Ca 0.20 -0.26 0.01 0.00 -0.81 0.00 0.00 59.98 59.12 3abq h ARG 94 Cb 0.15 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3abq h ARG 94 CO -0.02 0.85 -0.00 0.35 -1.51 0.00 0.00 179.97 179.63 3abq h PHE 95 N 0.37 -0.01 -0.57 2.20 3.04 -1.07 -0.49 116.94 120.42 3abq h PHE 95 Ca 0.02 0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.89 3abq h PHE 95 Cb 0.99 0.02 -0.02 0.00 2.56 0.00 0.00 35.95 39.49 3abq h PHE 95 CO 0.03 -0.01 0.03 -0.07 -2.02 0.00 0.00 178.31 176.27 3abq h LEU 96 N 0.02 0.92 -0.58 0.59 3.38 -1.01 -1.41 115.31 117.22 3abq h LEU 96 Ca 0.04 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 3abq h LEU 96 Cb 0.04 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3abq h LEU 96 CO -0.06 0.96 0.24 0.00 0.09 0.00 0.00 178.44 179.67 3abq h ALA 97 N 1.14 0.75 -0.45 1.53 0.00 -0.97 -1.95 119.26 119.31 3abq h ALA 97 Ca 0.17 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3abq h ALA 97 Cb 0.48 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3abq h ALA 97 CO 0.02 0.36 -0.03 -0.44 0.00 0.00 0.00 179.25 179.15 3abq h ASP 98 N 0.80 0.73 0.15 0.00 3.32 -0.86 -2.91 116.42 117.64 3abq h ASP 98 Ca 0.19 -0.19 -0.12 0.00 0.02 0.00 0.00 57.03 56.94 3abq h ASP 98 Cb 0.19 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 3abq h ASP 98 CO -0.02 0.82 -0.41 -0.74 -1.72 0.00 0.00 179.24 177.17 3abq h HIS 99 N 0.70 0.41 -0.64 4.55 2.76 -0.92 -0.20 115.15 121.82 3abq h HIS 99 Ca 0.13 -0.11 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 3abq h HIS 99 Cb 0.48 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.33 3abq h HIS 99 CO 0.02 0.71 0.14 0.66 -1.30 0.00 0.00 177.93 178.16 3abq h SER 100 N 0.29 0.97 -0.07 3.26 4.64 -1.23 -1.90 113.55 119.50 3abq h SER 100 Ca 0.03 -0.20 -0.18 0.00 -0.47 0.00 0.00 61.79 60.97 3abq h SER 100 Cb 0.86 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3abq h SER 100 CO 0.07 0.94 -0.58 -0.09 -0.87 0.00 0.00 176.83 176.30 3abq h ARG 101 N 0.97 0.67 -0.35 4.77 2.43 -1.29 -3.25 114.38 118.32 3abq h ARG 101 Ca 0.20 -0.44 -0.09 0.00 -0.81 0.00 0.00 59.98 58.84 3abq h ARG 101 Cb 0.37 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 3abq h ARG 101 CO 0.00 1.06 -0.16 1.03 -1.51 0.00 0.00 179.97 180.39 3abq h SER 102 N 0.51 0.64 -0.81 -3.80 0.87 -0.82 -2.54 113.55 107.59 3abq h SER 102 Ca 0.00 -0.20 0.04 0.00 -1.23 0.00 0.00 61.79 60.40 3abq h SER 102 Cb 1.16 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 62.90 3abq h SER 102 CO 0.12 0.82 0.53 0.11 -0.53 0.00 0.00 176.83 177.88 3abq h LYS 103 N 0.58 0.96 0.00 2.24 1.79 -1.38 -2.65 116.57 118.10 3abq h LYS 103 Ca 0.09 -0.06 -0.14 0.00 -2.18 0.00 0.00 60.65 58.37 3abq h LYS 103 Cb 0.61 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 3abq h LYS 103 CO 0.04 0.63 -0.65 -0.44 -1.08 0.00 0.00 179.45 177.96 3abq h ASP 104 N 0.99 0.00 0.66 0.86 3.32 -1.51 -3.02 116.42 117.71 3abq h ASP 104 Ca 0.33 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.32 3abq h ASP 104 Cb 0.07 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3abq h ASP 104 CO -0.10 0.65 -0.29 0.71 -1.72 0.00 0.00 179.24 178.49 3abq h THR 105 N 0.00 0.82 -0.44 0.35 1.35 -1.26 -2.67 112.91 111.07 3abq h THR 105 Ca -0.01 -1.18 -0.03 0.00 -0.55 0.00 0.00 66.41 64.64 3abq h THR 105 Cb 1.24 1.72 -0.02 0.00 -1.73 0.00 0.00 68.15 69.37 3abq h THR 105 CO 0.08 0.28 0.15 0.58 -0.25 0.00 0.00 175.52 176.37 3abq h VAL 106 N 0.00 1.21 0.00 6.82 2.07 -1.45 -3.31 116.25 121.60 3abq h VAL 106 Ca -0.00 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3abq h VAL 106 Cb 0.70 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3abq h VAL 106 CO 0.04 0.25 -0.82 -0.07 0.02 0.00 0.00 177.57 176.99 3abq h LEU 107 N 0.56 0.00 -9.82 2.57 3.38 -1.60 -3.46 115.31 106.94 3abq h LEU 107 Ca 0.14 -0.18 -0.51 0.00 0.09 0.00 0.00 57.88 57.42 3abq h LEU 107 Cb 0.23 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.01 3abq h LEU 107 CO -0.01 0.09 0.53 -1.59 0.09 0.00 0.00 178.44 177.55 3abq s LYS 108 N -3.23 4.55 0.16 1.13 -2.85 -1.03 -5.04 119.74 113.43 3abq s LYS 108 Ca 0.04 1.93 0.10 0.00 -1.00 0.00 0.00 55.97 57.04 3abq s LYS 108 Cb 0.12 -3.16 -0.04 0.00 -2.06 0.00 0.00 37.83 32.70 3abq s LYS 108 CO 0.76 0.08 -0.23 -1.21 0.10 0.00 0.00 175.35 174.84 3abq s GLU 109 N -1.48 1.40 0.07 1.78 2.02 -1.26 -4.37 118.70 116.86 3abq s GLU 109 Ca 0.46 -1.42 -0.31 0.00 0.02 0.00 0.00 54.97 53.72 3abq s GLU 109 Cb -0.34 -1.70 -0.06 0.00 0.10 0.00 0.00 34.13 32.13 3abq s GLU 109 CO 0.44 0.37 1.19 0.54 0.02 0.00 0.00 175.26 177.83 3abq s VAL 110 N -1.56 4.00 0.17 2.63 0.11 -1.26 -4.98 120.40 119.51 3abq s VAL 110 Ca 0.17 1.46 -0.34 0.00 -2.93 0.00 0.00 61.98 60.34 3abq s VAL 110 Cb -0.08 -3.93 -0.14 0.00 -1.53 0.00 0.00 36.38 30.69 3abq s VAL 110 CO 0.08 0.12 1.51 -2.65 -3.33 0.00 0.00 175.10 170.83 3abq n PRO 111 N 3.79 1.99 0.32 1.54 -0.02 -1.26 -4.85 135.00 136.51 3abq n PRO 111 Ca 0.08 0.71 0.19 0.00 -2.02 0.00 0.00 63.50 62.47 3abq n PRO 111 Cb 0.46 -2.44 1.07 0.00 -0.02 0.00 0.00 33.50 32.57 3abq n PRO 111 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 3abq h GLU 112 N 5.38 0.00 -0.43 -0.52 9.09 -2.00 -0.58 114.58 125.53 3abq h GLU 112 Ca -0.45 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 58.93 3abq h GLU 112 Cb 1.27 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.35 3abq h GLU 112 CO 0.85 0.00 0.17 0.93 0.05 0.00 0.00 179.01 181.01 3abq h GLU 113 N 0.00 0.64 -0.77 1.06 4.39 -1.99 -1.86 114.58 116.05 3abq h GLU 113 Ca -0.00 -0.12 -0.05 0.00 0.34 0.00 0.00 59.36 59.53 3abq h GLU 113 Cb 0.02 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.53 3abq h GLU 113 CO 0.00 0.59 0.27 2.35 -1.16 0.00 0.00 179.01 181.06 3abq h TRP 114 N 0.54 1.21 -0.51 4.33 7.01 -1.48 0.61 115.95 127.67 3abq h TRP 114 Ca 0.14 -0.11 -0.06 0.00 2.11 0.00 0.00 58.89 60.98 3abq h TRP 114 Cb 0.19 -0.36 -0.02 0.00 -2.10 0.00 0.00 29.16 26.88 3abq h TRP 114 CO 0.00 0.93 0.10 0.28 -2.79 0.00 0.00 178.44 176.96 3abq h VAL 115 N 1.14 1.25 0.00 2.65 2.07 -1.36 -1.15 116.25 120.84 3abq h VAL 115 Ca 0.25 -0.90 -0.08 0.00 0.82 0.00 0.00 66.70 66.79 3abq h VAL 115 Cb 0.27 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3abq h VAL 115 CO -0.01 0.32 -0.36 0.50 0.02 0.00 0.00 177.57 178.04 3abq h LYS 116 N 0.71 0.00 0.00 1.57 3.64 -1.15 -2.29 116.57 119.05 3abq h LYS 116 Ca 0.16 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 3abq h LYS 116 Cb 0.37 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 3abq h LYS 116 CO 0.01 0.36 -0.62 0.00 -2.27 0.00 0.00 179.45 176.93 3abq h ALA 117 N 1.64 0.92 0.00 5.00 0.00 -0.42 -2.57 119.26 123.82 3abq h ALA 117 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3abq h ALA 117 Cb 0.88 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3abq h ALA 117 CO 0.05 0.77 0.00 1.04 0.00 0.00 0.00 179.25 181.11 3abq n GLN 118 N -3.72 0.45 -0.94 0.00 1.13 -0.48 -4.88 117.38 108.95 3abq n GLN 118 Ca -0.01 0.03 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 3abq n GLN 118 Cb 0.63 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.48 3abq n GLN 118 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3abq n GLY 119 N 0.89 0.47 3.80 1.08 0.00 -0.97 -5.03 105.19 105.43 3abq n GLY 119 Ca 0.14 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 3abq n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3abq s LEU 120 N 0.00 4.45 -0.05 0.99 1.43 -0.88 -5.02 118.68 119.59 3abq s LEU 120 Ca 0.00 1.03 -0.30 0.00 -1.03 0.00 0.00 54.13 53.83 3abq s LEU 120 Cb 0.00 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 3abq s LEU 120 CO 0.00 0.23 1.34 -0.22 0.23 0.00 0.00 176.35 177.93 3abq s LEU 121 N -0.69 4.28 -0.23 1.79 0.20 -1.26 -4.29 118.68 118.48 3abq s LEU 121 Ca 0.26 1.96 -0.12 0.00 0.69 0.00 0.00 54.13 56.92 3abq s LEU 121 Cb -0.17 -3.55 -0.05 0.00 -0.43 0.00 0.00 46.19 41.99 3abq s LEU 121 CO 0.14 -0.70 0.24 -0.70 -0.29 0.00 0.00 176.35 175.04 3abq s GLU 122 N 2.66 4.10 0.23 1.98 2.12 -1.26 -0.27 118.70 128.27 3abq s GLU 122 Ca 0.61 -0.12 0.07 0.00 0.36 0.00 0.00 54.97 55.89 3abq s GLU 122 Cb -0.28 -3.54 -0.05 0.00 0.26 0.00 0.00 34.13 30.52 3abq s GLU 122 CO 0.23 0.02 -0.10 0.54 -0.54 0.00 0.00 175.26 175.41 3abq s VAL 123 N 1.15 1.65 0.09 3.70 0.11 0.31 -4.97 120.40 122.44 3abq s VAL 123 Ca 0.11 -2.17 0.09 0.00 -2.93 0.00 0.00 61.98 57.08 3abq s VAL 123 Cb -0.14 -2.21 -0.04 0.00 -1.53 0.00 0.00 36.38 32.47 3abq s VAL 123 CO 0.06 -0.47 -0.21 -0.60 -3.33 0.00 0.00 175.10 170.54 3abq s ARG 124 N -3.69 1.79 0.00 1.54 3.52 -1.26 0.08 118.95 120.92 3abq s ARG 124 Ca 0.25 -1.15 0.00 0.00 -0.13 0.00 0.00 55.73 54.70 3abq s ARG 124 Cb 0.01 -2.07 0.00 0.00 -1.56 0.00 0.00 34.95 31.33 3abq s ARG 124 CO 0.09 0.49 0.00 -1.13 -0.81 0.00 0.00 175.30 173.94 3abq n SER 125 N 1.16 -0.27 0.27 -2.12 3.41 -0.87 -2.59 113.62 112.62 3abq n SER 125 Ca -0.16 -0.53 0.16 0.00 -0.26 0.00 0.00 58.87 58.08 3abq n SER 125 Cb 0.52 0.00 0.58 0.00 -0.26 0.00 0.00 64.21 65.05 3abq n SER 125 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3abq h GLU 126 N 0.00 0.00 -6.93 4.33 5.08 -1.35 -3.28 114.58 112.42 3abq h GLU 126 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 3abq h GLU 126 Cb 0.00 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.33 3abq h GLU 126 CO 0.00 0.01 0.63 0.42 -1.00 0.00 0.00 179.01 179.07 3abq s ILE 127 N -3.58 2.59 -0.17 3.13 -1.09 -1.26 -4.95 121.20 115.86 3abq s ILE 127 Ca 0.02 0.55 0.11 0.00 -2.23 0.00 0.00 60.65 59.10 3abq s ILE 127 Cb 0.08 -3.33 -0.18 0.00 -1.58 0.00 0.00 42.46 37.45 3abq s ILE 127 CO 0.57 0.09 -0.01 -1.54 -1.23 0.00 0.00 174.94 172.83 3abq n SER 128 N 0.28 1.33 -4.08 3.58 3.41 -1.26 -4.99 113.62 111.89 3abq n SER 128 Ca 0.03 -0.03 -0.10 0.00 -0.26 0.00 0.00 58.87 58.50 3abq n SER 128 Cb 0.43 0.58 -0.08 0.00 -0.26 0.00 0.00 64.21 64.88 3abq n SER 128 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 3abq s ASP 129 N -5.28 0.05 0.32 4.04 1.47 -1.26 -5.07 116.67 110.94 3abq s ASP 129 Ca -0.13 -1.11 0.04 0.00 1.18 0.00 0.00 52.55 52.52 3abq s ASP 129 Cb 0.05 0.46 0.54 0.00 -0.34 0.00 0.00 42.92 43.63 3abq s ASP 129 CO 0.62 -0.95 1.82 0.11 0.68 0.00 0.00 175.17 177.45 3abq h LYS 130 N 2.49 0.49 0.00 2.11 1.79 -1.97 -2.44 116.57 119.04 3abq h LYS 130 Ca -0.32 -0.13 -0.05 0.00 -2.18 0.00 0.00 60.65 57.97 3abq h LYS 130 Cb 1.24 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.83 3abq h LYS 130 CO 0.46 0.60 -0.23 -0.91 -1.08 0.00 0.00 179.45 178.29 3abq h ASN 131 N 0.46 0.00 0.81 0.86 -0.26 -1.99 -2.85 115.58 112.61 3abq h ASN 131 Ca 0.09 0.00 -0.22 0.00 -0.56 0.00 0.00 56.30 55.60 3abq h ASN 131 Cb 0.46 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.69 3abq h ASN 131 CO 0.03 0.23 -1.28 0.25 -1.06 0.00 0.00 177.43 175.59 3abq h LEU 132 N 0.00 0.00 -1.05 1.61 5.85 -1.90 -3.34 115.31 116.48 3abq h LEU 132 Ca -0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 3abq h LEU 132 Cb 0.75 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3abq h LEU 132 CO 0.03 0.89 0.12 0.22 -0.34 0.00 0.00 178.44 179.36 3abq h TYR 133 N 0.00 0.82 0.00 1.25 5.03 -1.22 0.09 116.97 122.94 3abq h TYR 133 Ca -0.14 -0.08 -0.03 0.00 2.58 0.00 0.00 58.73 61.07 3abq h TYR 133 Cb 1.80 -0.24 -0.00 0.00 1.55 0.00 0.00 36.73 39.83 3abq h TYR 133 CO 0.00 0.70 -0.13 -0.07 -1.32 0.00 0.00 178.16 177.34 3abq h LEU 134 N 0.77 0.00 0.00 2.82 4.07 -1.64 -3.28 115.31 118.05 3abq h LEU 134 Ca 0.17 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.13 3abq h LEU 134 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 3abq h LEU 134 CO -0.00 0.13 -1.15 1.07 -1.08 0.00 0.00 178.44 177.40 3abq n THR 135 N -3.28 0.00 -3.82 0.22 5.66 -1.03 -4.83 114.28 107.20 3abq n THR 135 Ca 0.00 -0.23 -0.29 0.00 -3.05 0.00 0.00 64.05 60.48 3abq n THR 135 Cb 0.38 0.48 -0.13 0.00 -1.55 0.00 0.00 70.33 69.51 3abq n THR 135 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 3abq s ARG 136 N -2.44 1.74 0.35 1.09 1.81 -0.01 -4.93 118.95 116.56 3abq s ARG 136 Ca -0.02 -2.49 0.17 0.00 -1.72 0.00 0.00 55.73 51.68 3abq s ARG 136 Cb 0.06 -2.85 0.56 0.00 -0.45 0.00 0.00 34.95 32.28 3abq s ARG 136 CO 0.39 -1.18 1.68 -1.00 -0.68 0.00 0.00 175.30 174.51 3abq h PRO 137 N 6.34 0.00 -0.46 3.54 0.13 -1.85 -3.13 132.00 136.56 3abq h PRO 137 Ca 0.01 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.07 3abq h PRO 137 Cb 0.88 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.99 3abq h PRO 137 CO 0.60 0.44 0.01 0.38 -0.23 0.00 0.00 178.00 179.19 3abq h ASP 138 N 0.00 0.72 0.63 1.44 -0.00 -1.95 -2.64 116.42 114.62 3abq h ASP 138 Ca -0.00 -0.16 -0.21 0.00 -0.00 0.00 0.00 57.03 56.65 3abq h ASP 138 Cb 0.99 -0.19 -0.01 0.00 -0.00 0.00 0.00 39.33 40.11 3abq h ASP 138 CO 0.06 0.78 -0.94 0.24 -0.00 0.00 0.00 179.24 179.38 3abq h MET 139 N 0.71 0.19 0.00 4.15 2.86 -1.92 -3.15 114.93 117.77 3abq h MET 139 Ca 0.14 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3abq h MET 139 Cb 0.42 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.15 3abq h MET 139 CO 0.02 0.99 0.00 0.41 1.06 0.00 0.00 176.91 179.39 3abq n GLY 140 N 1.01 -1.22 0.29 8.32 0.00 -1.08 -2.55 105.19 109.96 3abq n GLY 140 Ca -0.04 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.05 3abq n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3abq n ARG 141 N -1.62 0.85 -4.39 1.61 1.74 -1.01 -1.59 116.66 112.24 3abq n ARG 141 Ca 0.05 -0.59 -0.22 0.00 -0.77 0.00 0.00 57.85 56.32 3abq n ARG 141 Cb 0.24 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.09 3abq n ARG 141 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3abq s ARG 142 N -2.56 1.46 0.22 5.56 0.52 -1.06 -3.58 118.95 119.51 3abq s ARG 142 Ca 0.21 -1.61 -0.13 0.00 -0.52 0.00 0.00 55.73 53.68 3abq s ARG 142 Cb 0.19 -1.46 -0.08 0.00 0.52 0.00 0.00 34.95 34.12 3abq s ARG 142 CO 0.57 0.27 0.60 -0.51 0.02 0.00 0.00 175.30 176.25 3abq s LEU 143 N -3.18 4.21 0.00 2.53 1.43 -1.26 -2.24 118.68 120.17 3abq s LEU 143 Ca 0.23 1.07 0.00 0.00 -1.03 0.00 0.00 54.13 54.41 3abq s LEU 143 Cb -0.04 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.55 3abq s LEU 143 CO 0.10 -0.04 0.00 0.00 0.23 0.00 0.00 176.35 176.64 3abq n GLU 146 N 0.00 0.00 0.03 0.00 1.02 -1.26 -3.86 120.64 116.57 3abq n GLU 146 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 3abq n GLU 146 Cb 0.00 -1.56 -0.07 0.00 -0.02 0.00 0.00 31.44 29.80 3abq n GLU 146 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3abq h ALA 147 N 0.00 0.29 0.00 0.62 0.00 -1.89 -2.79 119.26 115.48 3abq h ALA 147 Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 3abq h ALA 147 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3abq h ALA 147 CO 0.00 0.73 -0.22 0.28 0.00 0.00 0.00 179.25 180.03 3abq h VAL 148 N 0.38 0.86 0.02 0.00 2.07 -1.91 -2.71 116.25 114.96 3abq h VAL 148 Ca -0.09 -0.86 -0.25 0.00 0.82 0.00 0.00 66.70 66.32 3abq h VAL 148 Cb 1.55 1.51 0.01 0.00 -1.52 0.00 0.00 31.29 32.85 3abq h VAL 148 CO 0.18 0.22 -1.04 -0.33 0.02 0.00 0.00 177.57 176.62 3abq h GLU 149 N 0.00 0.55 -0.15 1.57 4.39 -1.88 -2.71 114.58 116.36 3abq h GLU 149 Ca -0.00 -0.62 -0.14 0.00 0.34 0.00 0.00 59.36 58.93 3abq h GLU 149 Cb 0.49 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 3abq h GLU 149 CO 0.03 1.24 -0.52 0.00 -1.16 0.00 0.00 179.01 178.59 3abq h ALA 150 N 0.54 0.82 0.01 3.43 0.00 -1.31 -3.24 119.26 119.52 3abq h ALA 150 Ca -0.12 -0.50 -0.23 0.00 0.00 0.00 0.00 54.91 54.06 3abq h ALA 150 Cb 1.69 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 19.41 3abq h ALA 150 CO 0.19 0.68 -0.91 -0.07 0.00 0.00 0.00 179.25 179.14 3abq h LEU 151 N 0.32 0.79 -7.98 0.00 4.07 -1.56 -3.52 115.31 107.44 3abq h LEU 151 Ca 0.01 -0.75 -0.60 0.00 0.08 0.00 0.00 57.88 56.62 3abq h LEU 151 Cb 1.03 -0.24 -0.08 0.00 1.08 0.00 0.00 40.66 42.45 3abq h LEU 151 CO 0.09 1.44 1.79 -0.54 -1.08 0.00 0.00 178.44 180.14 3abq s LYS 152 N -3.26 3.65 0.68 1.13 1.02 -1.02 -4.98 119.74 116.96 3abq s LYS 152 Ca -0.11 -1.54 -0.15 0.00 0.02 0.00 0.00 55.97 54.19 3abq s LYS 152 Cb 0.06 -5.43 0.01 0.00 -0.52 0.00 0.00 37.83 31.95 3abq s LYS 152 CO 0.89 -2.45 1.14 0.14 -0.92 0.00 0.00 175.35 174.15 3abq s VAL 156 N 5.36 2.95 0.10 3.17 -7.23 -1.26 -5.05 120.40 118.44 3abq s VAL 156 Ca 0.53 0.45 -0.24 0.00 -1.81 0.00 0.00 61.98 60.91 3abq s VAL 156 Cb 0.02 -2.97 -0.07 0.00 0.56 0.00 0.00 36.38 33.92 3abq s VAL 156 CO 0.02 -0.27 0.73 0.00 -0.31 0.00 0.00 175.10 175.27 3abq s ALA 157 N -2.23 3.45 -1.11 1.32 0.00 -1.26 -4.48 121.76 117.44 3abq s ALA 157 Ca 0.69 0.26 -0.10 0.00 0.00 0.00 0.00 51.96 52.81 3abq s ALA 157 Cb -0.23 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 19.95 3abq s ALA 157 CO 0.43 0.22 0.86 0.09 0.00 0.00 0.00 175.76 177.36 3abq n ASN 158 N 2.11 -5.43 -4.83 0.00 3.02 0.12 -5.01 115.26 105.24 3abq n ASN 158 Ca -0.05 -0.81 -0.27 0.00 -0.03 0.00 0.00 54.58 53.41 3abq n ASN 158 Cb 0.50 -4.52 0.09 0.00 -0.61 0.00 0.00 39.78 35.23 3abq n ASN 158 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3abq s PRO 159 N -5.10 1.94 -0.11 3.52 0.04 -1.26 -4.92 135.00 129.12 3abq s PRO 159 Ca 0.39 -0.19 0.02 0.00 0.04 0.00 0.00 61.00 61.26 3abq s PRO 159 Cb -0.09 -2.07 -0.24 0.00 0.04 0.00 0.00 34.50 32.14 3abq s PRO 159 CO 0.78 -1.48 0.39 -0.25 0.04 0.00 0.00 177.00 176.48 3abq n ASP 160 N -3.13 1.58 -3.87 6.66 10.43 0.20 -1.99 116.55 126.43 3abq n ASP 160 Ca 0.09 0.23 -0.24 0.00 2.57 0.00 0.00 54.79 57.44 3abq n ASP 160 Cb 0.61 -0.45 -0.17 0.00 1.84 0.00 0.00 41.12 42.95 3abq n ASP 160 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 3abq s VAL 161 N -2.56 0.76 -0.17 2.53 -7.23 -0.78 -1.40 120.40 111.55 3abq s VAL 161 Ca -0.17 -0.15 0.01 0.00 -1.81 0.00 0.00 61.98 59.85 3abq s VAL 161 Cb 0.07 -0.81 0.03 0.00 0.56 0.00 0.00 36.38 36.23 3abq s VAL 161 CO 0.78 0.31 -0.14 -1.58 -0.31 0.00 0.00 175.10 174.16 3abq s GLN 162 N 1.55 2.33 -0.23 4.82 2.00 0.05 0.11 119.66 130.29 3abq s GLN 162 Ca 0.00 -0.71 -0.13 0.00 -2.00 0.00 0.00 55.36 52.53 3abq s GLN 162 Cb -0.13 -2.29 -0.04 0.00 0.80 0.00 0.00 33.01 31.35 3abq s GLN 162 CO -0.05 -0.30 0.29 0.08 -0.50 0.00 0.00 175.29 174.81 3abq s VAL 163 N 1.42 5.26 0.01 1.34 1.01 -1.26 -0.70 120.40 127.48 3abq s VAL 163 Ca 0.03 0.44 0.07 0.00 0.00 0.00 0.00 61.98 62.52 3abq s VAL 163 Cb -0.14 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3abq s VAL 163 CO -0.10 0.27 -0.22 -0.69 0.00 0.00 0.00 175.10 174.36 3abq s VAL 164 N 1.39 2.47 -0.06 2.92 1.01 0.52 -3.49 120.40 125.16 3abq s VAL 164 Ca 0.13 -1.12 0.04 0.00 0.00 0.00 0.00 61.98 61.03 3abq s VAL 164 Cb -0.15 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.28 3abq s VAL 164 CO 0.07 0.47 -0.18 -0.63 0.00 0.00 0.00 175.10 174.83 3abq s ILE 165 N -0.76 1.52 -0.00 2.22 1.01 -0.65 -0.71 121.20 123.83 3abq s ILE 165 Ca 0.12 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 60.02 3abq s ILE 165 Cb -0.10 -1.33 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 3abq s ILE 165 CO 0.02 0.44 0.02 -0.55 0.00 0.00 0.00 174.94 174.87 3abq s SER 166 N 0.29 0.03 0.26 3.58 0.15 -0.48 -0.54 113.70 116.99 3abq s SER 166 Ca -0.11 -0.07 -0.05 0.00 0.70 0.00 0.00 55.95 56.43 3abq s SER 166 Cb -0.15 0.07 0.31 0.00 -1.71 0.00 0.00 66.02 64.54 3abq s SER 166 CO 0.04 -0.08 1.92 -2.24 1.20 0.00 0.00 173.24 174.08 3abq h ASP 167 N 5.75 1.08 0.00 5.45 2.03 -1.87 -3.18 116.42 125.68 3abq h ASP 167 Ca -0.26 -0.05 0.00 0.00 -0.73 0.00 0.00 57.03 55.99 3abq h ASP 167 Cb 1.21 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 39.44 3abq h ASP 167 CO 0.47 0.81 0.00 0.61 -1.03 0.00 0.00 179.24 180.10 3abq n GLY 168 N -1.31 3.35 0.36 7.15 0.00 -1.26 -2.22 105.19 111.25 3abq n GLY 168 Ca 0.10 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.36 3abq n GLY 168 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3abq n LEU 169 N 0.00 1.61 -3.59 0.99 4.77 -0.11 -4.79 117.00 115.87 3abq n LEU 169 Ca 0.00 -0.83 -0.14 0.00 -0.03 0.00 0.00 56.01 55.00 3abq n LEU 169 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 3abq n LEU 169 CO 0.00 0.31 -0.15 -0.55 -1.33 0.00 0.00 177.39 175.67 3abq s SER 170 N -1.47 0.61 0.13 -1.43 0.15 -0.94 -4.31 113.70 106.44 3abq s SER 170 Ca 0.12 0.35 -0.10 0.00 0.70 0.00 0.00 55.95 57.01 3abq s SER 170 Cb 0.11 0.65 -0.07 0.00 -1.71 0.00 0.00 66.02 64.99 3abq s SER 170 CO 0.28 -0.27 1.41 0.74 1.20 0.00 0.00 173.24 176.60 3abq h THR 171 N 6.29 1.28 -0.55 6.45 2.02 -1.76 -3.22 112.91 123.41 3abq h THR 171 Ca -0.15 -1.77 0.04 0.00 0.77 0.00 0.00 66.41 65.30 3abq h THR 171 Cb 1.13 1.68 -0.03 0.00 -1.74 0.00 0.00 68.15 69.19 3abq h THR 171 CO 0.18 0.57 0.37 0.44 0.37 0.00 0.00 175.52 177.45 3abq h ASP 172 N 0.63 0.51 0.08 4.18 3.45 -1.87 -0.87 116.42 122.52 3abq h ASP 172 Ca 0.01 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 3abq h ASP 172 Cb 1.18 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.83 3abq h ASP 172 CO 0.12 0.34 -0.07 0.00 -1.57 0.00 0.00 179.24 178.07 3abq h ALA 173 N 1.69 1.82 0.00 3.45 0.00 -1.54 -0.48 119.26 124.20 3abq h ALA 173 Ca 0.23 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3abq h ALA 173 Cb 0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3abq h ALA 173 CO -0.06 0.08 -0.41 0.82 0.00 0.00 0.00 179.25 179.68 3abq h ILE 174 N 0.00 1.46 -0.14 0.00 1.08 -1.32 -3.33 117.51 115.25 3abq h ILE 174 Ca -0.00 -2.25 -0.19 0.00 -0.39 0.00 0.00 64.86 62.03 3abq h ILE 174 Cb 0.12 2.91 -0.00 0.00 -3.07 0.00 0.00 36.82 36.78 3abq h ILE 174 CO 0.01 0.49 -0.69 0.74 -0.69 0.00 0.00 178.15 178.02 3abq h THR 175 N -1.00 1.33 -0.29 -0.27 2.02 -1.17 -1.34 112.91 112.19 3abq h THR 175 Ca -0.11 -1.97 -0.19 0.00 0.77 0.00 0.00 66.41 64.91 3abq h THR 175 Cb 1.07 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 69.43 3abq h THR 175 CO -0.07 0.61 -0.55 0.58 0.37 0.00 0.00 175.52 176.46 3abq h VAL 176 N 0.42 1.27 0.00 3.16 2.07 -1.31 -3.32 116.25 118.54 3abq h VAL 176 Ca -0.02 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.76 3abq h VAL 176 Cb 1.27 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 3abq h VAL 176 CO 0.13 0.57 -0.84 0.59 0.02 0.00 0.00 177.57 178.04 3abq n ASN 177 N -4.01 0.68 0.24 0.57 3.02 -1.21 -4.68 115.26 109.88 3abq n ASN 177 Ca -0.04 -0.45 -0.17 0.00 -0.03 0.00 0.00 54.58 53.88 3abq n ASN 177 Cb 0.63 0.67 -0.09 0.00 -0.61 0.00 0.00 39.78 40.38 3abq n ASN 177 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3abq h TYR 178 N 0.00 -1.39 0.00 3.10 3.20 -1.35 -2.35 116.97 118.19 3abq h TYR 178 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3abq h TYR 178 Cb 0.58 0.55 -0.00 0.00 1.54 0.00 0.00 36.73 39.41 3abq h TYR 178 CO 0.00 -0.63 -0.02 1.49 -1.64 0.00 0.00 178.16 177.36 3abq h GLU 179 N -0.91 0.00 0.00 1.82 4.57 -1.84 -0.34 114.58 117.88 3abq h GLU 179 Ca -0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 3abq h GLU 179 Cb 0.81 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.40 3abq h GLU 179 CO -0.12 0.02 -0.52 -1.91 -1.18 0.00 0.00 179.01 175.31 3abq n GLU 180 N -4.22 0.21 -0.02 1.92 2.13 -0.92 -4.37 120.64 115.37 3abq n GLU 180 Ca -0.03 0.07 -0.03 0.00 0.66 0.00 0.00 57.16 57.83 3abq n GLU 180 Cb 0.11 -1.64 -0.01 0.00 0.27 0.00 0.00 31.44 30.16 3abq n GLU 180 CO 0.00 0.00 0.00 1.51 -0.41 0.00 0.00 177.13 178.23 3abq n ILE 181 N -1.94 0.19 0.12 6.31 3.06 -0.75 -3.10 119.36 123.26 3abq n ILE 181 Ca 0.04 -0.07 -0.11 0.00 -2.50 0.00 0.00 62.75 60.11 3abq n ILE 181 Cb 0.41 -0.88 -0.07 0.00 0.54 0.00 0.00 39.64 39.64 3abq n ILE 181 CO 0.00 0.00 0.00 0.25 -2.50 0.00 0.00 176.55 174.30 3abq h LEU 182 N -0.04 -0.31 -0.20 9.51 7.12 -1.31 -2.22 115.31 127.87 3abq h LEU 182 Ca -0.08 -0.22 0.06 0.00 0.13 0.00 0.00 57.88 57.77 3abq h LEU 182 Cb 1.11 0.08 -0.06 0.00 -0.53 0.00 0.00 40.66 41.25 3abq h LEU 182 CO -0.02 0.16 -0.22 -0.65 -0.13 0.00 0.00 178.44 177.57 3abq h PRO 183 N -0.89 -0.23 0.00 5.25 0.11 -1.76 -0.86 132.00 133.60 3abq h PRO 183 Ca -0.04 0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.04 3abq h PRO 183 Cb 0.51 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 3abq h PRO 183 CO 0.06 -0.16 -0.25 -1.00 -0.21 0.00 0.00 178.00 176.45 3abq h PRO 184 N -0.24 0.00 -0.04 1.05 0.13 -1.85 -0.14 132.00 130.91 3abq h PRO 184 Ca 0.12 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3abq h PRO 184 Cb 0.43 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.56 3abq h PRO 184 CO -0.34 0.25 0.01 1.25 -0.23 0.00 0.00 178.00 178.93 3abq h LEU 185 N 0.00 0.06 -1.49 1.56 5.85 -0.92 0.74 115.31 121.11 3abq h LEU 185 Ca -0.00 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.41 3abq h LEU 185 Cb 0.59 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3abq h LEU 185 CO 0.03 0.30 -0.23 0.24 -0.34 0.00 0.00 178.44 178.44 3abq h MET 186 N -0.19 0.04 -0.07 1.25 2.86 -0.78 -1.07 114.93 116.97 3abq h MET 186 Ca 0.01 -0.01 -0.19 0.00 -2.06 0.00 0.00 59.70 57.46 3abq h MET 186 Cb 0.27 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.92 3abq h MET 186 CO 0.00 0.27 -0.74 0.00 1.06 0.00 0.00 176.91 177.50 3abq h ALA 187 N 1.73 0.59 -0.30 6.32 0.00 -0.90 -2.78 119.26 123.92 3abq h ALA 187 Ca 0.01 -0.61 -0.17 0.00 0.00 0.00 0.00 54.91 54.14 3abq h ALA 187 Cb 0.43 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3abq h ALA 187 CO 0.03 0.77 -0.46 0.78 0.00 0.00 0.00 179.25 180.37 3abq h GLY 188 N 1.29 0.92 1.55 0.00 0.00 -0.22 -2.25 103.07 104.36 3abq h GLY 188 Ca -0.03 -1.03 -0.09 0.00 0.00 0.00 0.00 47.33 46.17 3abq h GLY 188 CO 0.13 0.93 -0.22 1.41 0.00 0.00 0.00 176.54 178.78 3abq h LEU 189 N 0.62 0.53 -0.04 3.11 3.38 -1.27 -3.06 115.31 118.57 3abq h LEU 189 Ca 0.03 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.68 3abq h LEU 189 Cb 1.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 3abq h LEU 189 CO 0.11 0.75 -0.68 0.50 0.09 0.00 0.00 178.44 179.21 3abq h LYS 190 N 0.47 0.00 -6.32 1.13 3.11 -1.48 -3.24 116.57 110.24 3abq h LYS 190 Ca 0.07 0.00 -0.55 0.00 -2.81 0.00 0.00 60.65 57.37 3abq h LYS 190 Cb 0.64 0.00 -0.08 0.00 -1.00 0.00 0.00 32.23 31.79 3abq h LYS 190 CO 0.05 0.68 1.12 -0.65 -2.81 0.00 0.00 179.45 177.84 3abq s GLN 191 N -2.90 3.23 -1.06 1.90 -0.21 -0.85 -4.33 119.66 115.45 3abq s GLN 191 Ca 0.03 -0.34 -0.20 0.00 0.02 0.00 0.00 55.36 54.86 3abq s GLN 191 Cb 0.09 -4.34 0.02 0.00 1.00 0.00 0.00 33.01 29.78 3abq s GLN 191 CO 0.77 -2.17 0.67 0.00 -2.12 0.00 0.00 175.29 172.45 3abq n ALA 192 N 9.37 -2.67 0.00 6.09 0.00 -1.26 -4.92 120.51 127.12 3abq n ALA 192 Ca 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.10 3abq n ALA 192 Cb 0.49 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3abq n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3abq n GLY 193 N -1.88 1.65 0.00 0.00 0.00 -1.23 -5.07 105.19 98.67 3abq n GLY 193 Ca -0.17 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3abq n GLY 193 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3abq n LEU 194 N 0.00 0.00 -4.59 0.99 7.94 -1.22 -5.01 117.00 115.11 3abq n LEU 194 Ca 0.00 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.48 3abq n LEU 194 Cb 0.00 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 43.92 3abq n LEU 194 CO 0.00 0.00 1.48 -0.75 -1.11 0.00 0.00 177.39 177.01 3abq s LYS 195 N 1.39 3.23 -0.19 1.96 2.20 -1.26 -4.77 119.74 122.30 3abq s LYS 195 Ca 0.00 1.12 -0.07 0.00 -0.36 0.00 0.00 55.97 56.66 3abq s LYS 195 Cb 0.00 -4.20 -0.04 0.00 -1.51 0.00 0.00 37.83 32.08 3abq s LYS 195 CO 0.00 -1.99 0.06 0.54 -0.36 0.00 0.00 175.35 173.60 3abq s VAL 196 N 7.03 4.65 1.06 4.02 0.11 -1.26 -0.63 120.40 135.38 3abq s VAL 196 Ca 0.72 -0.08 -0.17 0.00 -2.93 0.00 0.00 61.98 59.53 3abq s VAL 196 Cb -0.18 -3.11 0.23 0.00 -1.53 0.00 0.00 36.38 31.79 3abq s VAL 196 CO 0.30 0.43 1.18 -0.83 -3.33 0.00 0.00 175.10 172.86 3abq s GLY 197 N 0.63 1.64 -0.18 6.54 0.00 0.12 -4.96 107.32 111.11 3abq s GLY 197 Ca 0.03 -0.91 -0.26 0.00 0.00 0.00 0.00 44.72 43.57 3abq s GLY 197 CO 0.02 -0.14 0.89 -1.08 0.00 0.00 0.00 173.10 172.78 3abq s THR 198 N -3.33 4.83 0.16 0.90 -1.32 -1.26 -4.72 115.64 110.90 3abq s THR 198 Ca 0.70 1.75 -0.30 0.00 -1.21 0.00 0.00 61.69 62.63 3abq s THR 198 Cb -0.09 -4.19 -0.07 0.00 -1.51 0.00 0.00 72.50 66.63 3abq s THR 198 CO 0.55 -0.02 1.09 -2.16 -2.21 0.00 0.00 174.62 171.87 3abq s PRO 199 N 2.36 4.59 0.11 7.08 0.04 -1.26 -4.73 135.00 143.18 3abq s PRO 199 Ca 0.40 1.70 -0.06 0.00 0.04 0.00 0.00 61.00 63.08 3abq s PRO 199 Cb -0.16 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 3abq s PRO 199 CO 0.12 0.07 0.16 -0.59 0.04 0.00 0.00 177.00 176.79 3abq s PHE 200 N -0.13 0.37 -0.32 0.56 -0.12 -1.23 -4.37 117.98 112.74 3abq s PHE 200 Ca 0.50 -0.79 -0.07 0.00 -0.05 0.00 0.00 56.93 56.52 3abq s PHE 200 Cb -0.29 -0.17 0.02 0.00 -0.63 0.00 0.00 43.02 41.96 3abq s PHE 200 CO 0.34 -0.56 0.09 0.12 -0.05 0.00 0.00 175.22 175.16 3abq s PHE 201 N -3.92 3.20 -0.30 3.49 2.19 0.63 -1.64 117.98 121.63 3abq s PHE 201 Ca 0.11 -1.20 -0.18 0.00 0.33 0.00 0.00 56.93 56.00 3abq s PHE 201 Cb 0.05 -2.26 -0.02 0.00 -1.31 0.00 0.00 43.02 39.48 3abq s PHE 201 CO -0.06 -0.65 0.50 0.08 1.83 0.00 0.00 175.22 176.91 3abq s VAL 202 N 1.45 5.06 0.18 3.12 1.01 0.30 -0.53 120.40 131.00 3abq s VAL 202 Ca 0.01 0.61 -0.24 0.00 0.00 0.00 0.00 61.98 62.36 3abq s VAL 202 Cb -0.18 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.25 3abq s VAL 202 CO 0.03 -0.04 0.76 -0.60 0.00 0.00 0.00 175.10 175.25 3abq s ARG 203 N 2.32 4.47 -1.19 2.72 3.52 0.11 -4.01 118.95 126.89 3abq s ARG 203 Ca 0.19 1.07 -0.03 0.00 -0.13 0.00 0.00 55.73 56.83 3abq s ARG 203 Cb -0.16 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.09 3abq s ARG 203 CO 0.11 0.52 1.01 0.66 -0.81 0.00 0.00 175.30 176.79 3abq n TYR 204 N 1.34 -2.31 -3.78 5.12 4.01 -1.26 -2.04 117.16 118.23 3abq n TYR 204 Ca -0.05 0.92 -0.35 0.00 -0.16 0.00 0.00 57.90 58.26 3abq n TYR 204 Cb 0.49 -4.91 -0.05 0.00 -0.31 0.00 0.00 39.34 34.56 3abq n TYR 204 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3abq s GLY 205 N -3.96 2.24 0.12 2.72 0.00 -1.26 -4.60 107.32 102.57 3abq s GLY 205 Ca 0.19 -0.59 0.09 0.00 0.00 0.00 0.00 44.72 44.42 3abq s GLY 205 CO 0.70 -0.39 -0.24 0.50 0.00 0.00 0.00 173.10 173.67 3abq s ARG 206 N -1.64 1.25 0.39 2.90 0.52 -0.62 -4.18 118.95 117.57 3abq s ARG 206 Ca 0.26 -1.25 0.14 0.00 -0.52 0.00 0.00 55.73 54.36 3abq s ARG 206 Cb -0.13 -1.61 0.98 0.00 0.52 0.00 0.00 34.95 34.71 3abq s ARG 206 CO 0.14 0.38 1.86 -0.39 0.02 0.00 0.00 175.30 177.31 3abq h VAL 207 N 3.98 0.73 0.00 3.52 -1.51 -1.97 0.16 116.25 121.16 3abq h VAL 207 Ca -0.48 -0.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 3abq h VAL 207 Cb 1.18 0.18 0.00 0.00 -2.13 0.00 0.00 31.29 30.51 3abq h VAL 207 CO 0.39 0.09 0.00 0.29 -1.23 0.00 0.00 177.57 177.12 3abq n LYS 208 N -4.54 0.05 0.20 5.19 5.02 -1.26 -1.83 118.16 120.99 3abq n LYS 208 Ca 0.19 0.30 0.14 0.00 -2.02 0.00 0.00 58.31 56.92 3abq n LYS 208 Cb 0.61 -1.50 0.54 0.00 -0.02 0.00 0.00 35.03 34.66 3abq n LYS 208 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 3abq h ILE 209 N 0.00 0.00 0.00 -0.18 2.10 -0.73 -2.83 117.51 115.87 3abq h ILE 209 Ca 0.00 -0.45 0.00 0.00 1.08 0.00 0.00 64.86 65.49 3abq h ILE 209 Cb 0.11 1.36 0.00 0.00 -1.09 0.00 0.00 36.82 37.19 3abq h ILE 209 CO 0.00 0.00 0.00 -1.84 -1.08 0.00 0.00 178.15 175.23 3abq n GLU 210 N -2.70 0.16 0.04 2.19 0.28 -0.76 -2.26 120.64 117.59 3abq n GLU 210 Ca 0.02 0.33 -0.20 0.00 -0.16 0.00 0.00 57.16 57.15 3abq n GLU 210 Cb 0.31 -1.77 -0.11 0.00 1.43 0.00 0.00 31.44 31.30 3abq n GLU 210 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 3abq h ASP 211 N 0.00 0.78 -0.23 -1.84 3.32 -1.72 -1.61 116.42 115.12 3abq h ASP 211 Ca 0.00 -0.76 -0.12 0.00 0.02 0.00 0.00 57.03 56.16 3abq h ASP 211 Cb 0.42 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3abq h ASP 211 CO 0.00 1.45 -0.29 -0.61 -1.72 0.00 0.00 179.24 178.07 3abq h GLN 212 N 0.20 0.73 -0.47 3.56 4.15 -1.68 -2.55 115.11 119.05 3abq h GLN 212 Ca -0.12 -0.32 -0.09 0.00 0.77 0.00 0.00 58.65 58.89 3abq h GLN 212 Cb 1.61 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 29.26 3abq h GLN 212 CO 0.18 0.93 -0.05 0.82 -1.93 0.00 0.00 178.83 178.78 3abq h ILE 213 N 0.62 1.25 -0.46 2.39 2.04 -1.47 -0.98 117.51 120.91 3abq h ILE 213 Ca 0.08 -1.10 -0.09 0.00 1.00 0.00 0.00 64.86 64.74 3abq h ILE 213 Cb 0.80 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 3abq h ILE 213 CO 0.07 0.38 -0.08 1.23 0.00 0.00 0.00 178.15 179.75 3abq h GLY 214 N 0.98 0.87 0.84 5.37 0.00 -1.21 -2.66 103.07 107.26 3abq h GLY 214 Ca 0.14 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.71 3abq h GLY 214 CO 0.03 0.59 -0.35 0.83 0.00 0.00 0.00 176.54 177.63 3abq h GLU 215 N 0.73 0.50 0.00 4.80 5.08 -1.18 -1.99 114.58 122.53 3abq h GLU 215 Ca 0.13 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 3abq h GLU 215 Cb 0.56 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3abq h GLU 215 CO 0.03 0.95 -0.00 0.82 -1.00 0.00 0.00 179.01 179.81 3abq h ILE 216 N 0.12 1.24 0.00 3.13 2.04 -1.18 -3.22 117.51 119.64 3abq h ILE 216 Ca -0.00 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 3abq h ILE 216 Cb 0.96 1.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.78 3abq h ILE 216 CO 0.08 0.19 -0.46 -0.07 0.00 0.00 0.00 178.15 177.89 3abq h LEU 217 N -0.32 0.00 -0.63 1.44 3.38 -1.61 -3.48 115.31 114.09 3abq h LEU 217 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3abq h LEU 217 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3abq h LEU 217 CO 0.00 0.04 -0.03 0.61 0.09 0.00 0.00 178.44 179.15 3abq n GLY 218 N 1.15 0.70 3.74 0.83 0.00 -0.79 0.13 105.19 110.95 3abq n GLY 218 Ca 0.02 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 3abq n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3abq s ALA 219 N -2.71 3.30 0.09 4.61 0.00 -0.93 -3.99 121.76 122.13 3abq s ALA 219 Ca 0.02 0.61 -0.12 0.00 0.00 0.00 0.00 51.96 52.47 3abq s ALA 219 Cb -0.01 -3.24 -0.18 0.00 0.00 0.00 0.00 23.12 19.68 3abq s ALA 219 CO 0.03 0.10 1.24 0.87 0.00 0.00 0.00 175.76 178.00 3abq h LYS 220 N 4.74 0.67 -3.95 0.00 1.79 -1.52 -3.39 116.57 114.92 3abq h LYS 220 Ca -0.44 -0.67 -0.43 0.00 -2.18 0.00 0.00 60.65 56.92 3abq h LYS 220 Cb 1.20 0.18 -0.36 0.00 -1.58 0.00 0.00 32.23 31.68 3abq h LYS 220 CO 0.70 1.27 -0.77 0.08 -1.08 0.00 0.00 179.45 179.64 3abq s VAL 221 N -3.41 0.55 -0.21 0.50 1.01 -0.49 0.21 120.40 118.56 3abq s VAL 221 Ca -0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 3abq s VAL 221 Cb 0.08 -0.61 -0.01 0.00 0.00 0.00 0.00 36.38 35.84 3abq s VAL 221 CO 0.91 0.25 -0.06 -0.69 0.00 0.00 0.00 175.10 175.51 3abq s VAL 222 N 1.36 3.23 -0.20 2.92 1.01 -0.39 -0.77 120.40 127.56 3abq s VAL 222 Ca -0.04 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 3abq s VAL 222 Cb -0.13 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 3abq s VAL 222 CO -0.03 0.44 0.02 -0.51 0.00 0.00 0.00 175.10 175.03 3abq s ILE 223 N 1.36 4.15 -0.25 2.22 2.07 0.13 -1.58 121.20 129.29 3abq s ILE 223 Ca 0.04 -0.25 -0.04 0.00 -1.41 0.00 0.00 60.65 59.00 3abq s ILE 223 Cb -0.14 -2.88 0.01 0.00 0.13 0.00 0.00 42.46 39.58 3abq s ILE 223 CO -0.03 0.42 -0.02 -0.22 -1.91 0.00 0.00 174.94 173.18 3abq s LEU 224 N 0.94 3.27 -0.28 8.50 2.96 0.42 -0.36 118.68 134.14 3abq s LEU 224 Ca 0.02 -0.69 -0.16 0.00 -0.22 0.00 0.00 54.13 53.07 3abq s LEU 224 Cb -0.14 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3abq s LEU 224 CO 0.02 -0.11 0.45 -0.76 -1.32 0.00 0.00 176.35 174.62 3abq s LEU 225 N 1.41 4.09 -0.03 -0.68 1.43 0.11 -1.02 118.68 124.00 3abq s LEU 225 Ca 0.02 0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 53.36 3abq s LEU 225 Cb -0.16 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.53 3abq s LEU 225 CO -0.02 -0.27 0.21 0.54 0.23 0.00 0.00 176.35 177.04 3abq s VAL 226 N 2.21 0.05 -0.13 -1.59 0.11 -0.57 -1.39 120.40 119.09 3abq s VAL 226 Ca 0.18 -0.40 -0.29 0.00 -2.93 0.00 0.00 61.98 58.53 3abq s VAL 226 Cb -0.16 -0.43 -0.01 0.00 -1.53 0.00 0.00 36.38 34.25 3abq s VAL 226 CO 0.10 -0.22 1.09 -0.83 -3.33 0.00 0.00 175.10 171.91 3abq s GLY 227 N -0.85 2.07 0.73 6.54 0.00 -1.18 -1.47 107.32 113.16 3abq s GLY 227 Ca -0.09 0.41 -0.11 0.00 0.00 0.00 0.00 44.72 44.92 3abq s GLY 227 CO 0.02 2.12 1.10 -1.83 0.00 0.00 0.00 173.10 174.51 3abq s GLU 228 N 2.49 2.64 0.32 2.90 -1.05 -1.19 -0.94 118.70 123.87 3abq s GLU 228 Ca 0.50 0.48 -0.29 0.00 -0.15 0.00 0.00 54.97 55.51 3abq s GLU 228 Cb -0.20 -1.99 -0.12 0.00 -0.44 0.00 0.00 34.13 31.38 3abq s GLU 228 CO 0.16 -1.20 1.43 2.89 0.95 0.00 0.00 175.26 179.49 3abq n ARG 229 N -3.12 2.36 -2.13 -4.83 0.00 -1.26 -3.84 116.66 103.84 3abq n ARG 229 Ca 0.07 0.83 -0.40 0.00 -0.00 0.00 0.00 57.85 58.36 3abq n ARG 229 Cb 0.57 -2.51 -0.02 0.00 -0.00 0.00 0.00 32.46 30.51 3abq n ARG 229 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 3abq s PRO 230 N -1.33 4.17 0.81 2.89 0.02 -1.26 -5.00 135.00 135.29 3abq s PRO 230 Ca 0.59 2.12 -0.07 0.00 0.02 0.00 0.00 61.00 63.66 3abq s PRO 230 Cb -0.55 -2.89 0.14 0.00 0.02 0.00 0.00 34.50 31.22 3abq s PRO 230 CO 0.57 -0.31 1.12 0.20 -0.33 0.00 0.00 177.00 178.25 3abq s GLY 231 N -0.70 1.76 0.09 0.52 0.00 0.24 -5.01 107.32 104.21 3abq s GLY 231 Ca 0.53 -1.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.55 3abq s GLY 231 CO 0.49 -0.79 1.63 -2.00 0.00 0.00 0.00 173.10 172.43 3abq h LEU 232 N -0.95 -0.79 -2.97 0.66 6.46 -1.96 -3.27 115.31 112.49 3abq h LEU 232 Ca -0.41 0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.42 3abq h LEU 232 Cb 1.26 0.26 0.00 0.00 -0.73 0.00 0.00 40.66 41.46 3abq h LEU 232 CO 0.43 -0.43 0.00 0.61 -0.62 0.00 0.00 178.44 178.43 3abq n GLY 233 N -1.42 3.02 3.03 3.75 0.00 -1.26 -4.47 105.19 107.84 3abq n GLY 233 Ca -0.09 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 3abq n GLY 233 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3abq s GLN 234 N -1.44 0.18 0.00 1.61 -0.44 -1.23 -5.03 119.66 113.31 3abq s GLN 234 Ca 0.30 0.38 0.00 0.00 -2.50 0.00 0.00 55.36 53.54 3abq s GLN 234 Cb 0.19 -0.04 0.00 0.00 -1.64 0.00 0.00 33.01 31.52 3abq s GLN 234 CO 0.16 -0.10 0.27 -1.13 0.50 0.00 0.00 175.29 174.99 3abq n SER 235 N 3.68 0.55 -0.96 6.67 3.41 -1.26 -0.59 113.62 125.12 3abq n SER 235 Ca -0.20 -0.78 0.07 0.00 -0.26 0.00 0.00 58.87 57.70 3abq n SER 235 Cb 0.55 0.37 0.26 0.00 -0.26 0.00 0.00 64.21 65.13 3abq n SER 235 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3abq n GLU 236 N -0.37 2.91 -2.55 4.33 0.28 -1.26 -2.95 120.64 121.03 3abq n GLU 236 Ca 0.00 -2.88 -0.43 0.00 -0.16 0.00 0.00 57.16 53.69 3abq n GLU 236 Cb 0.01 -1.86 -0.02 0.00 1.43 0.00 0.00 31.44 31.00 3abq n GLU 236 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3abq s SER 237 N -1.93 6.93 -0.01 -1.84 0.15 -1.26 -4.54 113.70 111.20 3abq s SER 237 Ca 0.43 1.31 0.02 0.00 0.70 0.00 0.00 55.95 58.41 3abq s SER 237 Cb 0.35 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 62.09 3abq s SER 237 CO 0.09 -0.84 -0.02 -0.22 1.20 0.00 0.00 173.24 173.44 3abq s LEU 238 N 3.64 3.40 0.17 3.45 0.20 -0.14 -3.19 118.68 126.22 3abq s LEU 238 Ca 0.49 -0.04 0.10 0.00 0.69 0.00 0.00 54.13 55.37 3abq s LEU 238 Cb -0.16 -1.93 -0.04 0.00 -0.43 0.00 0.00 46.19 43.63 3abq s LEU 238 CO 0.14 0.29 -0.18 -0.44 -0.29 0.00 0.00 176.35 175.87 3abq s SER 239 N -1.45 3.79 -0.19 3.68 0.01 -0.54 -0.42 113.70 118.57 3abq s SER 239 Ca 0.18 -0.71 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 3abq s SER 239 Cb -0.11 -0.46 -0.00 0.00 0.21 0.00 0.00 66.02 65.65 3abq s SER 239 CO 0.09 0.13 -0.11 0.00 0.41 0.00 0.00 173.24 173.75 3abq s TYR 241 N 1.16 3.01 -0.01 0.00 1.51 -0.18 -1.42 117.35 121.41 3abq s TYR 241 Ca 0.01 -0.63 0.04 0.00 -1.01 0.00 0.00 57.07 55.48 3abq s TYR 241 Cb -0.14 -2.11 -0.01 0.00 -0.11 0.00 0.00 41.96 39.59 3abq s TYR 241 CO -0.04 -0.37 -0.12 0.00 -1.11 0.00 0.00 175.55 173.91 3abq s ALA 242 N 1.25 1.04 0.11 3.71 0.00 -0.55 -0.44 121.76 126.88 3abq s ALA 242 Ca 0.03 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.52 3abq s ALA 242 Cb -0.15 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 3abq s ALA 242 CO 0.00 0.25 -0.13 0.14 0.00 0.00 0.00 175.76 176.02 3abq s VAL 243 N -0.25 1.23 -0.15 0.00 -7.23 -0.61 -0.20 120.40 113.18 3abq s VAL 243 Ca 0.04 -1.65 -0.13 0.00 -1.81 0.00 0.00 61.98 58.43 3abq s VAL 243 Cb -0.05 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.40 3abq s VAL 243 CO -0.00 -0.42 0.27 -0.47 -0.31 0.00 0.00 175.10 174.16 3abq s TYR 244 N -2.09 3.48 -0.62 2.82 6.14 -1.26 -1.26 117.35 124.56 3abq s TYR 244 Ca 0.07 0.58 -0.02 0.00 0.64 0.00 0.00 57.07 58.34 3abq s TYR 244 Cb -0.05 -2.28 0.00 0.00 0.42 0.00 0.00 41.96 40.05 3abq s TYR 244 CO 0.02 0.31 0.47 0.43 0.64 0.00 0.00 175.55 177.42 3abq n SER 245 N 3.32 -3.72 -4.80 4.32 7.64 0.57 -4.87 113.62 116.09 3abq n SER 245 Ca -0.13 -0.73 -0.34 0.00 1.01 0.00 0.00 58.87 58.68 3abq n SER 245 Cb 0.52 -1.23 -0.03 0.00 -1.01 0.00 0.00 64.21 62.47 3abq n SER 245 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3abq s PRO 246 N -4.17 3.73 -0.02 1.43 0.04 -1.26 -5.05 135.00 129.70 3abq s PRO 246 Ca 0.02 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.40 3abq s PRO 246 Cb -0.00 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.48 3abq s PRO 246 CO 0.69 -0.49 0.00 0.50 0.04 0.00 0.00 177.00 177.75 3abq s ARG 247 N -3.35 0.21 0.30 4.56 6.06 -1.26 -4.36 118.95 121.10 3abq s ARG 247 Ca 0.67 0.09 -0.02 0.00 -2.50 0.00 0.00 55.73 53.97 3abq s ARG 247 Cb -0.16 -0.40 0.45 0.00 0.06 0.00 0.00 34.95 34.90 3abq s ARG 247 CO 0.22 -0.12 1.96 0.52 -2.50 0.00 0.00 175.30 175.38 3abq h MET 248 N 7.14 1.08 0.00 5.12 2.86 -1.93 -1.40 114.93 127.81 3abq h MET 248 Ca -0.42 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.03 3abq h MET 248 Cb 1.14 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 3abq h MET 248 CO 0.48 0.72 -0.86 0.00 1.06 0.00 0.00 176.91 178.31 3abq h ALA 249 N 1.48 0.66 0.00 6.32 0.00 -1.97 -3.40 119.26 122.35 3abq h ALA 249 Ca 0.32 -0.56 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 3abq h ALA 249 Cb -0.08 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3abq h ALA 249 CO -0.08 0.68 -1.46 0.25 0.00 0.00 0.00 179.25 178.65 3abq n THR 250 N -3.07 0.46 -2.19 0.00 -2.24 -1.12 -5.04 114.28 101.08 3abq n THR 250 Ca -0.02 -0.19 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 3abq n THR 250 Cb 0.76 -0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 68.17 3abq n THR 250 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3abq s THR 251 N -2.16 2.93 0.42 4.28 -1.32 -0.54 -5.03 115.64 114.22 3abq s THR 251 Ca -0.10 0.89 0.07 0.00 -1.21 0.00 0.00 61.69 61.35 3abq s THR 251 Cb 0.03 -3.57 -0.03 0.00 -1.51 0.00 0.00 72.50 67.42 3abq s THR 251 CO 0.20 0.19 0.31 0.68 -2.21 0.00 0.00 174.62 173.79 3abq s VAL 252 N -0.84 2.47 0.35 5.08 -7.23 -1.26 -4.96 120.40 114.01 3abq s VAL 252 Ca 0.50 -1.48 0.09 0.00 -1.81 0.00 0.00 61.98 59.27 3abq s VAL 252 Cb -0.38 -2.95 0.11 0.00 0.56 0.00 0.00 36.38 33.72 3abq s VAL 252 CO 0.48 0.00 1.83 -0.08 -0.31 0.00 0.00 175.10 177.02 3abq h GLU 253 N 1.16 0.23 0.00 4.82 4.57 -1.98 -2.00 114.58 121.38 3abq h GLU 253 Ca -0.42 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3abq h GLU 253 Cb 1.26 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 3abq h GLU 253 CO 0.62 0.46 0.00 0.00 -1.18 0.00 0.00 179.01 178.91 3abq h ALA 254 N 1.55 1.00 0.00 2.92 0.00 -1.98 -2.27 119.26 120.47 3abq h ALA 254 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3abq h ALA 254 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3abq h ALA 254 CO 0.04 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.04 3abq n ASP 255 N -2.63 0.20 -4.86 0.00 8.00 -0.75 -1.66 116.55 114.85 3abq n ASP 255 Ca -0.01 0.52 -0.33 0.00 0.71 0.00 0.00 54.79 55.68 3abq n ASP 255 Cb 0.10 -0.58 -0.05 0.00 -0.02 0.00 0.00 41.12 40.57 3abq n ASP 255 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3abq s ARG 256 N -3.03 3.85 -0.25 -1.24 0.52 -0.86 -3.02 118.95 114.93 3abq s ARG 256 Ca 0.12 0.33 -0.12 0.00 -0.52 0.00 0.00 55.73 55.54 3abq s ARG 256 Cb 0.16 -2.79 -0.05 0.00 0.52 0.00 0.00 34.95 32.79 3abq s ARG 256 CO 0.52 0.41 0.23 0.99 0.02 0.00 0.00 175.30 177.46 3abq s THR 257 N -1.64 5.30 -0.16 0.02 2.01 0.73 -4.05 115.64 117.84 3abq s THR 257 Ca 0.42 0.30 -0.07 0.00 0.31 0.00 0.00 61.69 62.66 3abq s THR 257 Cb -0.13 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 3abq s THR 257 CO 0.20 0.28 0.06 0.00 -0.69 0.00 0.00 174.62 174.47 3abq s ILE 259 N 0.10 1.81 0.55 0.00 2.07 -0.51 -4.99 121.20 120.23 3abq s ILE 259 Ca 0.05 -1.35 0.07 0.00 -1.41 0.00 0.00 60.65 58.01 3abq s ILE 259 Cb -0.12 -1.98 0.06 0.00 0.13 0.00 0.00 42.46 40.54 3abq s ILE 259 CO 0.01 -0.02 0.54 -0.94 -1.91 0.00 0.00 174.94 172.62 3abq s SER 260 N 1.28 4.80 -1.45 4.50 1.04 -1.26 -0.88 113.70 121.73 3abq s SER 260 Ca -0.06 -1.10 -0.11 0.00 0.48 0.00 0.00 55.95 55.15 3abq s SER 260 Cb -0.19 0.36 0.05 0.00 0.10 0.00 0.00 66.02 66.34 3abq s SER 260 CO -0.06 -1.18 1.09 0.59 0.98 0.00 0.00 173.24 174.66 3abq n ASN 261 N -1.93 -5.65 -4.59 7.02 4.13 -1.15 -4.82 115.26 108.27 3abq n ASN 261 Ca 0.05 -0.66 -0.43 0.00 1.68 0.00 0.00 54.58 55.22 3abq n ASN 261 Cb 0.63 -4.47 -0.03 0.00 -1.54 0.00 0.00 39.78 34.37 3abq n ASN 261 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3abq s ILE 262 N -3.31 4.40 0.00 2.41 1.01 0.43 -2.54 121.20 123.60 3abq s ILE 262 Ca 0.63 1.09 -0.06 0.00 0.00 0.00 0.00 60.65 62.31 3abq s ILE 262 Cb -0.30 -4.48 0.02 0.00 0.01 0.00 0.00 42.46 37.72 3abq s ILE 262 CO 0.78 -0.81 0.28 0.00 0.00 0.00 0.00 174.94 175.19 3abq n HIS 263 N 7.32 -0.30 0.28 3.97 1.44 -0.92 -0.97 115.22 126.04 3abq n HIS 263 Ca 0.09 -0.19 0.16 0.00 -2.01 0.00 0.00 57.72 55.78 3abq n HIS 263 Cb 0.48 0.09 0.74 0.00 0.12 0.00 0.00 29.99 31.42 3abq n HIS 263 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 3abq h GLN 264 N 0.00 0.00 -0.22 -1.40 5.75 -1.89 -2.44 115.11 114.91 3abq h GLN 264 Ca -0.05 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3abq h GLN 264 Cb 0.27 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.82 3abq h GLN 264 CO 0.07 0.06 0.00 0.41 -2.65 0.00 0.00 178.83 176.72 3abq n GLY 265 N -0.25 1.20 0.00 2.39 0.00 -1.26 -4.80 105.19 102.48 3abq n GLY 265 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3abq n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3abq n GLY 266 N 1.06 1.58 3.59 -0.02 0.00 -0.93 -5.06 105.19 105.41 3abq n GLY 266 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3abq n GLY 266 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3abq s THR 267 N 2.52 5.10 0.34 2.61 -1.32 -1.05 -4.86 115.64 118.98 3abq s THR 267 Ca 0.00 0.52 -0.28 0.00 -1.21 0.00 0.00 61.69 60.72 3abq s THR 267 Cb 0.00 -3.82 -0.12 0.00 -1.51 0.00 0.00 72.50 67.05 3abq s THR 267 CO 0.00 0.01 1.28 -2.65 -2.21 0.00 0.00 174.62 171.05 3abq n PRO 268 N 5.50 2.09 -0.29 7.08 -0.02 -1.17 -2.16 135.00 146.03 3abq n PRO 268 Ca -0.06 0.73 0.11 0.00 -2.02 0.00 0.00 63.50 62.26 3abq n PRO 268 Cb 0.50 -2.31 0.28 0.00 -0.02 0.00 0.00 33.50 31.94 3abq n PRO 268 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3abq h PRO 269 N 2.51 0.35 -0.02 0.52 0.11 -1.87 0.36 132.00 133.95 3abq h PRO 269 Ca -0.46 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3abq h PRO 269 Cb 1.29 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3abq h PRO 269 CO 0.62 0.23 0.01 0.28 -0.21 0.00 0.00 178.00 178.93 3abq h VAL 270 N 0.36 1.16 -0.68 3.15 2.07 -1.88 -0.84 116.25 119.58 3abq h VAL 270 Ca 0.53 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.59 3abq h VAL 270 Cb 0.98 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 3abq h VAL 270 CO -0.54 0.12 0.44 -0.08 0.02 0.00 0.00 177.57 177.54 3abq h GLU 271 N -0.15 0.87 0.00 1.57 4.81 -1.57 -2.64 114.58 117.47 3abq h GLU 271 Ca 0.01 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 3abq h GLU 271 Cb 0.19 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3abq h GLU 271 CO -0.00 0.57 -0.29 0.00 -0.73 0.00 0.00 179.01 178.57 3abq h ALA 272 N 1.26 1.07 -0.67 2.92 0.00 -0.23 -2.70 119.26 120.90 3abq h ALA 272 Ca 0.26 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3abq h ALA 272 Cb -0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3abq h ALA 272 CO -0.07 0.36 0.16 0.00 0.00 0.00 0.00 179.25 179.70 3abq h ALA 273 N 1.71 1.01 0.00 0.00 0.00 -0.77 -1.49 119.26 119.73 3abq h ALA 273 Ca -0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 3abq h ALA 273 Cb 0.75 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3abq h ALA 273 CO 0.04 0.64 -0.61 0.00 0.00 0.00 0.00 179.25 179.33 3abq h ALA 274 N 1.15 0.88 -0.38 0.00 0.00 -1.44 -2.38 119.26 117.10 3abq h ALA 274 Ca 0.21 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 3abq h ALA 274 Cb 0.36 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3abq h ALA 274 CO 0.00 0.76 -0.30 0.28 0.00 0.00 0.00 179.25 179.99 3abq h VAL 275 N 0.00 1.28 -0.17 0.00 2.07 -1.22 -2.54 116.25 115.66 3abq h VAL 275 Ca -0.01 -1.45 -0.07 0.00 0.82 0.00 0.00 66.70 65.99 3abq h VAL 275 Cb 1.15 1.30 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 3abq h VAL 275 CO 0.08 0.48 -0.15 0.40 0.02 0.00 0.00 177.57 178.40 3abq h ILE 276 N 0.71 1.33 -0.34 4.57 2.04 -1.16 -1.97 117.51 122.69 3abq h ILE 276 Ca 0.08 -1.30 0.05 0.00 1.00 0.00 0.00 64.86 64.69 3abq h ILE 276 Cb 0.85 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.68 3abq h ILE 276 CO 0.07 0.39 0.09 0.58 0.00 0.00 0.00 178.15 179.28 3abq h VAL 277 N 0.07 0.86 -0.87 1.67 2.07 -1.46 0.52 116.25 119.10 3abq h VAL 277 Ca 0.03 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.52 3abq h VAL 277 Cb 0.68 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3abq h VAL 277 CO 0.04 0.04 0.57 -0.78 0.02 0.00 0.00 177.57 177.46 3abq h ASP 278 N 0.22 0.90 0.34 0.57 -0.00 -1.45 -1.99 116.42 115.01 3abq h ASP 278 Ca 0.16 -0.00 -0.18 0.00 -0.00 0.00 0.00 57.03 57.01 3abq h ASP 278 Cb 0.16 -0.20 -0.01 0.00 -0.00 0.00 0.00 39.33 39.28 3abq h ASP 278 CO -0.19 0.60 -0.74 0.25 -0.00 0.00 0.00 179.24 179.16 3abq h LEU 279 N 1.04 0.40 -0.72 2.28 7.12 -0.46 -2.78 115.31 122.20 3abq h LEU 279 Ca 0.36 -0.27 -0.03 0.00 0.13 0.00 0.00 57.88 58.07 3abq h LEU 279 Cb 0.11 -0.12 -0.03 0.00 -0.53 0.00 0.00 40.66 40.09 3abq h LEU 279 CO -0.12 1.01 0.32 0.00 -0.13 0.00 0.00 178.44 179.51 3abq h ALA 280 N 0.98 0.93 0.00 1.25 0.00 0.71 -1.46 119.26 121.68 3abq h ALA 280 Ca -0.03 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3abq h ALA 280 Cb 1.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3abq h ALA 280 CO 0.12 0.52 -0.31 1.57 0.00 0.00 0.00 179.25 181.15 3abq h LYS 281 N 1.02 0.00 -0.21 0.00 2.10 -1.46 -2.91 116.57 115.11 3abq h LYS 281 Ca 0.24 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.72 3abq h LYS 281 Cb 0.17 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.49 3abq h LYS 281 CO -0.03 0.31 -0.58 0.00 -2.00 0.00 0.00 179.45 177.16 3abq h ARG 282 N 0.00 0.68 -0.67 0.07 3.08 -1.16 -2.17 114.38 114.20 3abq h ARG 282 Ca -0.00 -0.45 -0.05 0.00 0.07 0.00 0.00 59.98 59.55 3abq h ARG 282 Cb 1.13 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 3abq h ARG 282 CO 0.04 1.07 0.22 0.52 -1.07 0.00 0.00 179.97 180.75 3abq h MET 283 N 0.51 1.04 -0.24 0.04 2.86 -1.24 -1.46 114.93 116.44 3abq h MET 283 Ca 0.00 -0.22 -0.12 0.00 -2.06 0.00 0.00 59.70 57.31 3abq h MET 283 Cb 1.16 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 3abq h MET 283 CO 0.12 0.90 -0.34 -0.07 1.06 0.00 0.00 176.91 178.58 3abq h LEU 284 N 0.97 0.53 -0.03 1.22 3.38 -1.46 0.26 115.31 120.19 3abq h LEU 284 Ca 0.22 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 3abq h LEU 284 Cb 0.29 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3abq h LEU 284 CO -0.01 0.83 -0.40 -0.33 0.09 0.00 0.00 178.44 178.62 3abq h GLU 285 N 0.43 0.32 0.00 1.13 5.08 -1.31 -3.31 114.58 116.93 3abq h GLU 285 Ca 0.05 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 3abq h GLU 285 Cb 0.80 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3abq h GLU 285 CO 0.06 0.99 -0.14 1.96 -1.00 0.00 0.00 179.01 180.88 3abq h GLN 286 N -0.22 0.00 -4.60 2.33 4.20 -1.27 -3.47 115.11 112.08 3abq h GLN 286 Ca -0.04 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.29 3abq h GLN 286 Cb 1.10 0.00 0.08 0.00 0.30 0.00 0.00 27.48 28.97 3abq h GLN 286 CO 0.08 0.00 -0.58 1.63 -0.67 0.00 0.00 178.83 179.29 3abq n LYS 287 N -2.94 -5.51 -3.62 1.46 5.02 0.07 -5.00 118.16 107.64 3abq n LYS 287 Ca 0.04 0.82 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 3abq n LYS 287 Cb 0.52 -5.58 -0.05 0.00 -0.02 0.00 0.00 35.03 29.90 3abq n LYS 287 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3abq s ALA 288 N -3.19 -1.09 0.04 7.82 0.00 -1.14 -5.04 121.76 119.16 3abq s ALA 288 Ca 0.37 0.28 -0.09 0.00 0.00 0.00 0.00 51.96 52.52 3abq s ALA 288 Cb -0.16 0.49 0.00 0.00 0.00 0.00 0.00 23.12 23.45 3abq s ALA 288 CO 0.46 -0.54 0.18 -1.54 0.00 0.00 0.00 175.76 174.31 3abq s SER 289 N -2.29 0.06 1.61 0.00 1.04 -1.26 -4.38 113.70 108.49 3abq s SER 289 Ca -0.02 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.00 3abq s SER 289 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 3abq s SER 289 CO -0.06 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.22 3abq n GLY 290 N 0.68 2.44 0.00 7.32 0.00 -1.17 -2.70 105.19 111.76 3abq n GLY 290 Ca -0.19 -0.31 0.06 0.00 0.00 0.00 0.00 46.02 45.58 3abq n GLY 290 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3abq n ILE 291 N 0.00 0.81 1.20 -0.61 0.00 -0.67 -2.04 119.36 118.05 3abq n ILE 291 Ca 0.00 0.20 0.13 0.00 0.00 0.00 0.00 62.75 63.08 3abq n ILE 291 Cb 0.00 -1.01 0.27 0.00 0.00 0.00 0.00 39.64 38.90 3abq n ILE 291 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3abq n ASN 292 N -1.33 1.53 -4.87 9.51 3.02 -1.10 -4.92 115.26 117.10 3abq n ASN 292 Ca 0.05 -1.24 -0.33 0.00 -0.03 0.00 0.00 54.58 53.03 3abq n ASN 292 Cb 0.10 0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 39.41 3abq n ASN 292 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3abq s MET 293 N -2.38 3.85 0.62 3.52 -1.94 -0.86 -4.69 119.30 117.42 3abq s MET 293 Ca 0.25 0.35 -0.16 0.00 -1.71 0.00 0.00 55.69 54.42 3abq s MET 293 Cb 0.19 -2.67 -0.02 0.00 2.01 0.00 0.00 34.83 34.34 3abq s MET 293 CO 0.49 0.33 1.09 0.95 -0.01 0.00 0.00 175.02 177.87 3abq s THR 294 N -1.77 3.46 0.00 2.05 -4.23 -1.26 -5.01 115.64 108.88 3abq s THR 294 Ca 0.46 0.70 0.00 0.00 -1.18 0.00 0.00 61.69 61.68 3abq s THR 294 Cb -0.12 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.50 3abq s THR 294 CO 0.20 -0.40 0.00 -2.11 -0.54 0.00 0.00 174.62 171.78