#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wyl h LYS 3 N 0.00 1.03 -0.83 4.33 1.57 -2.02 -2.35 116.57 118.31 2wyl h LYS 3 Ca 0.00 -0.11 0.08 0.00 -1.87 0.00 0.00 60.65 58.75 2wyl h LYS 3 Cb 0.00 -0.21 -0.06 0.00 0.08 0.00 0.00 32.23 32.05 2wyl h LYS 3 CO 0.00 0.75 0.54 0.28 -0.57 0.00 0.00 179.45 180.45 2wyl h VAL 4 N 1.03 0.99 0.00 0.50 2.07 -2.07 -0.94 116.25 117.84 2wyl h VAL 4 Ca 0.27 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2wyl h VAL 4 Cb 0.01 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 2wyl h VAL 4 CO -0.05 0.15 -0.57 0.50 0.02 0.00 0.00 177.57 177.63 2wyl h LYS 5 N 0.83 0.00 0.00 1.57 3.64 -1.99 -3.39 116.57 117.23 2wyl h LYS 5 Ca 0.37 0.00 -0.39 0.00 -1.27 0.00 0.00 60.65 59.36 2wyl h LYS 5 Cb 0.35 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.11 2wyl h LYS 5 CO -0.14 0.00 -2.40 -1.13 -2.27 0.00 0.00 179.45 173.51 2wyl n SER 6 N -2.63 2.02 -4.67 4.20 3.41 -0.92 -4.98 113.62 110.05 2wyl n SER 6 Ca 0.02 0.02 -0.47 0.00 -0.26 0.00 0.00 58.87 58.19 2wyl n SER 6 Cb 0.51 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2wyl n SER 6 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wyl n ILE 7 N -3.53 0.07 -3.86 -1.33 5.41 -0.40 -5.01 119.36 110.71 2wyl n ILE 7 Ca -0.46 -0.01 -0.24 0.00 1.00 0.00 0.00 62.75 63.04 2wyl n ILE 7 Cb 0.92 -1.53 -0.03 0.00 -0.71 0.00 0.00 39.64 38.29 2wyl n ILE 7 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2wyl s THR 8 N 1.26 2.14 0.19 1.39 -4.23 -1.26 -4.99 115.64 110.14 2wyl s THR 8 Ca 0.81 -1.51 -0.11 0.00 -1.18 0.00 0.00 61.69 59.69 2wyl s THR 8 Cb -0.70 -2.65 0.12 0.00 1.34 0.00 0.00 72.50 70.61 2wyl s THR 8 CO 0.40 0.00 1.83 -0.09 -0.54 0.00 0.00 174.62 176.22 2wyl h ARG 9 N 1.03 0.91 -0.53 3.99 2.43 -2.00 -2.76 114.38 117.46 2wyl h ARG 9 Ca -0.40 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 58.62 2wyl h ARG 9 Cb 1.28 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 2wyl h ARG 9 CO 0.61 0.65 0.08 0.93 -1.51 0.00 0.00 179.97 180.73 2wyl h GLU 10 N 0.91 0.88 -0.22 0.20 3.07 -1.99 -1.97 114.58 115.46 2wyl h GLU 10 Ca 0.24 -0.24 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 2wyl h GLU 10 Cb -0.03 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.77 2wyl h GLU 10 CO -0.05 0.86 -0.19 0.66 -1.40 0.00 0.00 179.01 178.90 2wyl h SER 11 N 0.76 0.37 0.19 1.42 4.64 -1.95 -0.40 113.55 118.59 2wyl h SER 11 Ca 0.16 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2wyl h SER 11 Cb 0.41 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2wyl h SER 11 CO 0.01 0.58 -0.09 -0.25 -0.87 0.00 0.00 176.83 176.21 2wyl h TRP 12 N 0.35 -0.24 -0.65 4.77 7.01 -1.36 -3.03 115.95 122.81 2wyl h TRP 12 Ca 0.06 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.10 2wyl h TRP 12 Cb 0.54 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.63 2wyl h TRP 12 CO 0.01 0.12 0.38 0.82 -2.79 0.00 0.00 178.44 176.98 2wyl h ILE 13 N -0.64 1.01 0.00 2.65 2.04 -1.17 -2.33 117.51 119.07 2wyl h ILE 13 Ca -0.03 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.59 2wyl h ILE 13 Cb 0.46 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2wyl h ILE 13 CO 0.04 0.13 0.00 -0.07 0.00 0.00 0.00 178.15 178.25 2wyl h LEU 14 N 0.71 0.00 -2.70 1.44 3.38 -1.15 -2.29 115.31 114.70 2wyl h LEU 14 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2wyl h LEU 14 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2wyl h LEU 14 CO -0.15 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.84 2wyl n SER 15 N -2.43 2.69 0.00 -0.43 3.41 -0.98 -4.65 113.62 111.23 2wyl n SER 15 Ca 0.02 -1.92 0.00 0.00 -0.26 0.00 0.00 58.87 56.71 2wyl n SER 15 Cb 0.29 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2wyl n SER 15 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2wyl n THR 16 N 0.41 0.00 -4.16 6.66 -1.04 -0.91 -5.06 114.28 110.18 2wyl n THR 16 Ca 0.10 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.81 2wyl n THR 16 Cb 0.38 -0.61 -0.08 0.00 -1.82 0.00 0.00 70.33 68.20 2wyl n THR 16 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2wyl s PHE 17 N -1.92 2.92 0.56 -1.42 0.40 -0.88 -3.83 117.98 113.81 2wyl s PHE 17 Ca 0.00 -0.06 -0.19 0.00 -0.60 0.00 0.00 56.93 56.08 2wyl s PHE 17 Cb 0.00 -1.51 -0.05 0.00 0.51 0.00 0.00 43.02 41.97 2wyl s PHE 17 CO 0.00 0.47 1.14 -1.25 0.70 0.00 0.00 175.22 176.28 2wyl s PRO 18 N -2.27 3.27 0.27 0.24 0.04 -1.26 -4.82 135.00 130.47 2wyl s PRO 18 Ca 0.24 1.64 -0.00 0.00 0.04 0.00 0.00 61.00 62.92 2wyl s PRO 18 Cb -0.12 -1.99 0.58 0.00 0.04 0.00 0.00 34.50 33.02 2wyl s PRO 18 CO 0.17 -0.92 1.72 0.93 0.04 0.00 0.00 177.00 178.94 2wyl h GLU 19 N 1.10 0.43 -0.00 4.56 3.07 -1.66 0.30 114.58 122.39 2wyl h GLU 19 Ca -0.50 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.33 2wyl h GLU 19 Cb 1.27 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2wyl h GLU 19 CO 0.56 0.29 -0.28 0.91 -1.40 0.00 0.00 179.01 179.10 2wyl n TRP 20 N -5.01 0.00 0.00 4.33 7.02 -1.09 -5.01 117.44 117.69 2wyl n TRP 20 Ca 0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.66 2wyl n TRP 20 Cb 0.52 -0.25 0.00 0.00 -2.42 0.00 0.00 31.31 29.16 2wyl n TRP 20 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2wyl n GLY 21 N 1.42 3.51 0.35 6.99 0.00 0.09 -2.15 105.19 115.40 2wyl n GLY 21 Ca 0.09 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.10 2wyl n GLY 21 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wyl n SER 22 N 8.24 2.78 -0.12 1.61 3.41 -1.26 -3.76 113.62 124.53 2wyl n SER 22 Ca 0.00 -2.75 -0.05 0.00 -0.26 0.00 0.00 58.87 55.81 2wyl n SER 22 Cb 0.00 -0.36 0.03 0.00 -0.26 0.00 0.00 64.21 63.61 2wyl n SER 22 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 2wyl h TRP 23 N 0.73 -0.01 0.01 7.33 2.91 -1.75 -1.39 115.95 123.78 2wyl h TRP 23 Ca 0.00 0.03 -0.21 0.00 1.13 0.00 0.00 58.89 59.84 2wyl h TRP 23 Cb 1.01 0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.71 2wyl h TRP 23 CO 0.16 -0.07 -0.92 1.25 -1.03 0.00 0.00 178.44 177.83 2wyl h LEU 24 N 0.11 0.34 -0.69 0.65 5.85 -1.80 -2.11 115.31 117.66 2wyl h LEU 24 Ca 0.19 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.73 2wyl h LEU 24 Cb 0.26 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.12 2wyl h LEU 24 CO -0.31 1.09 0.32 0.78 -0.34 0.00 0.00 178.44 179.98 2wyl h ASN 25 N 0.14 0.38 -0.24 1.25 4.21 -1.75 -1.11 115.58 118.45 2wyl h ASN 25 Ca -0.06 0.07 -0.17 0.00 1.21 0.00 0.00 56.30 57.35 2wyl h ASN 25 Cb 1.56 0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.78 2wyl h ASN 25 CO 0.15 0.21 -0.52 -0.33 -1.29 0.00 0.00 177.43 175.65 2wyl h GLU 26 N 0.53 0.78 -0.54 0.81 5.08 -1.17 -2.71 114.58 117.36 2wyl h GLU 26 Ca 0.35 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2wyl h GLU 26 Cb 0.41 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 2wyl h GLU 26 CO -0.30 1.14 0.35 1.49 -1.00 0.00 0.00 179.01 180.69 2wyl h GLU 27 N 0.52 0.73 -0.45 2.33 4.81 -1.09 -0.47 114.58 120.96 2wyl h GLU 27 Ca 0.00 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2wyl h GLU 27 Cb 1.13 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 2wyl h GLU 27 CO 0.11 0.50 0.21 0.82 -0.73 0.00 0.00 179.01 179.92 2wyl h ILE 28 N 0.73 1.19 -0.58 2.32 2.04 -1.26 -0.86 117.51 121.09 2wyl h ILE 28 Ca 0.20 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 2wyl h ILE 28 Cb -0.06 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2wyl h ILE 28 CO -0.04 0.21 0.34 -0.08 0.00 0.00 0.00 178.15 178.57 2wyl h GLU 29 N 0.58 0.81 0.00 2.37 4.81 -1.23 -2.94 114.58 118.98 2wyl h GLU 29 Ca 0.15 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2wyl h GLU 29 Cb 0.13 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2wyl h GLU 29 CO -0.02 0.60 -0.20 1.96 -0.73 0.00 0.00 179.01 180.62 2wyl h GLN 30 N 0.79 0.00 -6.39 1.92 4.20 -0.96 -3.46 115.11 111.21 2wyl h GLN 30 Ca 0.21 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.39 2wyl h GLN 30 Cb 0.01 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.82 2wyl h GLN 30 CO -0.04 0.20 1.22 -2.00 -0.67 0.00 0.00 178.83 177.54 2wyl s GLU 31 N -3.29 4.14 -0.60 1.46 2.56 -0.34 -4.95 118.70 117.69 2wyl s GLU 31 Ca 0.04 2.62 -0.17 0.00 0.00 0.00 0.00 54.97 57.46 2wyl s GLU 31 Cb 0.07 -4.06 0.12 0.00 2.00 0.00 0.00 34.13 32.27 2wyl s GLU 31 CO 0.67 -0.94 0.64 -0.65 -0.56 0.00 0.00 175.26 174.42 2wyl s GLN 32 N 4.14 3.08 -0.27 4.30 -1.52 -1.26 -5.03 119.66 123.10 2wyl s GLN 32 Ca 0.87 -1.58 -0.29 0.00 -1.95 0.00 0.00 55.36 52.42 2wyl s GLN 32 Cb -0.44 -4.31 -0.01 0.00 -0.22 0.00 0.00 33.01 28.04 2wyl s GLN 32 CO 0.41 -1.45 1.41 0.08 -0.25 0.00 0.00 175.29 175.50 2wyl s VAL 33 N 2.06 3.98 0.46 1.09 1.01 -1.26 -4.98 120.40 122.75 2wyl s VAL 33 Ca 0.09 1.11 -0.24 0.00 0.00 0.00 0.00 61.98 62.93 2wyl s VAL 33 Cb -0.25 -4.00 -0.07 0.00 0.00 0.00 0.00 36.38 32.06 2wyl s VAL 33 CO 0.03 -0.41 1.30 0.00 0.00 0.00 0.00 175.10 176.02 2wyl s ALA 34 N 4.67 3.09 0.32 5.51 0.00 -1.26 -4.61 121.76 129.49 2wyl s ALA 34 Ca 0.62 1.22 -0.29 0.00 0.00 0.00 0.00 51.96 53.50 2wyl s ALA 34 Cb -0.19 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.31 2wyl s ALA 34 CO 0.25 -0.96 1.43 -0.35 0.00 0.00 0.00 175.76 176.13 2wyl n PRO 35 N -0.31 2.38 -0.54 0.00 -0.04 -1.26 -2.34 135.00 132.88 2wyl n PRO 35 Ca 0.06 0.84 0.00 0.00 -0.04 0.00 0.00 63.50 64.36 2wyl n PRO 35 Cb 0.45 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.39 2wyl n PRO 35 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wyl n GLY 36 N 1.24 0.76 3.24 0.55 0.00 -1.26 -5.05 105.19 104.67 2wyl n GLY 36 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2wyl n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wyl s THR 37 N -2.70 0.61 -0.01 2.61 -4.23 -0.99 -4.63 115.64 106.30 2wyl s THR 37 Ca 0.00 -1.98 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 2wyl s THR 37 Cb 0.00 -2.17 -0.01 0.00 1.34 0.00 0.00 72.50 71.66 2wyl s THR 37 CO 0.00 -0.42 -0.11 0.72 -0.54 0.00 0.00 174.62 174.27 2wyl s PHE 38 N -3.70 1.00 0.72 3.99 -0.71 -1.08 -3.88 117.98 114.31 2wyl s PHE 38 Ca 0.26 -0.20 -0.01 0.00 -1.04 0.00 0.00 56.93 55.94 2wyl s PHE 38 Cb 0.06 -0.64 0.13 0.00 -1.21 0.00 0.00 43.02 41.36 2wyl s PHE 38 CO 0.05 -0.02 1.00 0.00 -1.34 0.00 0.00 175.22 174.91 2wyl s ALA 39 N -0.29 3.67 -0.28 1.99 0.00 -0.73 -2.43 121.76 123.68 2wyl s ALA 39 Ca 0.04 -1.70 -0.19 0.00 0.00 0.00 0.00 51.96 50.11 2wyl s ALA 39 Cb -0.04 -2.03 0.12 0.00 0.00 0.00 0.00 23.12 21.17 2wyl s ALA 39 CO -0.00 -1.46 0.94 -1.58 0.00 0.00 0.00 175.76 173.66 2wyl s TRP 41 N -3.15 -0.62 -0.40 0.00 0.51 0.39 -1.75 118.94 113.92 2wyl s TRP 41 Ca 0.66 1.33 -0.27 0.00 -2.12 0.00 0.00 56.10 55.71 2wyl s TRP 41 Cb -0.05 0.39 0.02 0.00 -0.81 0.00 0.00 33.47 33.02 2wyl s TRP 41 CO 0.44 -0.31 0.97 -0.46 -0.51 0.00 0.00 176.95 177.09 2wyl s TRP 42 N 0.99 3.01 -2.29 -1.98 -0.00 -1.06 -1.20 118.94 116.42 2wyl s TRP 42 Ca -0.05 0.72 0.27 0.00 -0.00 0.00 0.00 56.10 57.04 2wyl s TRP 42 Cb -0.04 -3.84 0.79 0.00 -0.00 0.00 0.00 33.47 30.37 2wyl s TRP 42 CO -0.12 -0.95 1.59 1.28 -0.00 0.00 0.00 176.95 178.75 2wyl n LEU 43 N 7.03 1.56 0.00 5.86 4.77 0.22 0.25 117.00 136.68 2wyl n LEU 43 Ca 0.08 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 2wyl n LEU 43 Cb 0.48 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2wyl n LEU 43 CO 0.62 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 2wyl n GLY 44 N 1.26 3.02 7.00 -0.72 0.00 -1.24 -4.67 105.19 109.84 2wyl n GLY 44 Ca 0.16 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2wyl n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wyl n THR 46 N 0.00 1.19 -2.15 0.00 -2.24 -1.26 -1.29 114.28 108.52 2wyl n THR 46 Ca 0.00 -1.25 -0.42 0.00 -2.27 0.00 0.00 64.05 60.11 2wyl n THR 46 Cb 0.00 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 2wyl n THR 46 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wyl s GLY 47 N -1.36 1.65 -0.08 3.38 0.00 0.12 -4.55 107.32 106.48 2wyl s GLY 47 Ca 0.09 0.83 0.02 0.00 0.00 0.00 0.00 44.72 45.65 2wyl s GLY 47 CO 0.02 2.77 -0.12 -0.42 0.00 0.00 0.00 173.10 175.35 2wyl s ILE 48 N 3.40 1.20 -0.20 0.90 -1.09 0.29 0.71 121.20 126.41 2wyl s ILE 48 Ca 0.67 -0.49 -0.09 0.00 -2.23 0.00 0.00 60.65 58.51 2wyl s ILE 48 Cb -0.30 -1.10 -0.05 0.00 -1.58 0.00 0.00 42.46 39.42 2wyl s ILE 48 CO 0.25 0.37 0.11 0.86 -1.23 0.00 0.00 174.94 175.31 2wyl s TRP 49 N 0.84 3.33 -0.09 3.97 -0.11 -0.34 -0.70 118.94 125.84 2wyl s TRP 49 Ca -0.11 0.20 0.03 0.00 1.22 0.00 0.00 56.10 57.44 2wyl s TRP 49 Cb -0.15 -2.15 0.01 0.00 -1.50 0.00 0.00 33.47 29.68 2wyl s TRP 49 CO 0.02 0.19 -0.19 -1.17 -4.62 0.00 0.00 176.95 171.17 2wyl s LEU 50 N 0.50 1.91 -0.17 5.86 2.96 0.44 -0.46 118.68 129.71 2wyl s LEU 50 Ca 0.06 -0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 53.51 2wyl s LEU 50 Cb -0.12 -1.17 0.04 0.00 0.50 0.00 0.00 46.19 45.44 2wyl s LEU 50 CO -0.00 0.11 -0.06 -0.75 -1.32 0.00 0.00 176.35 174.33 2wyl s LYS 51 N 0.49 1.50 0.95 1.98 2.20 -0.72 -0.68 119.74 125.47 2wyl s LYS 51 Ca -0.17 -0.55 -0.15 0.00 -0.36 0.00 0.00 55.97 54.74 2wyl s LYS 51 Cb -0.17 -2.05 0.18 0.00 -1.51 0.00 0.00 37.83 34.28 2wyl s LYS 51 CO 0.07 -0.43 1.27 -1.54 -0.36 0.00 0.00 175.35 174.36 2wyl s SER 52 N 1.61 3.21 0.37 1.43 1.04 -0.64 -1.78 113.70 118.94 2wyl s SER 52 Ca 0.01 0.42 0.11 0.00 0.48 0.00 0.00 55.95 56.96 2wyl s SER 52 Cb -0.15 -0.58 0.71 0.00 0.10 0.00 0.00 66.02 66.10 2wyl s SER 52 CO -0.08 -2.68 1.84 1.05 0.98 0.00 0.00 173.24 174.35 2wyl h GLU 53 N -1.60 0.10 0.00 4.02 4.11 -1.82 -2.53 114.58 116.86 2wyl h GLU 53 Ca -0.45 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2wyl h GLU 53 Cb 1.26 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2wyl h GLU 53 CO 0.44 0.40 0.00 0.41 0.07 0.00 0.00 179.01 180.33 2wyl n GLY 54 N -0.56 -1.02 0.61 1.06 0.00 -1.26 -4.79 105.19 99.23 2wyl n GLY 54 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2wyl n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wyl n GLY 55 N 0.88 0.72 3.69 -0.02 0.00 -0.95 -5.03 105.19 104.48 2wyl n GLY 55 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2wyl n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wyl s THR 56 N -2.29 3.54 -0.16 2.61 2.01 -1.26 -4.81 115.64 115.28 2wyl s THR 56 Ca 0.00 0.98 -0.06 0.00 0.31 0.00 0.00 61.69 62.92 2wyl s THR 56 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2wyl s THR 56 CO 0.00 0.01 0.04 0.20 -0.69 0.00 0.00 174.62 174.19 2wyl s ASN 57 N 1.82 5.52 -0.03 3.53 0.01 -1.26 -1.62 114.94 122.90 2wyl s ASN 57 Ca 0.65 0.10 0.01 0.00 -0.71 0.00 0.00 52.86 52.91 2wyl s ASN 57 Cb -0.34 -1.87 0.02 0.00 0.41 0.00 0.00 41.25 39.48 2wyl s ASN 57 CO 0.28 0.23 -0.02 -0.69 -1.51 0.00 0.00 177.10 175.38 2wyl s VAL 58 N 0.05 0.34 -0.19 1.60 1.01 0.14 -1.31 120.40 122.04 2wyl s VAL 58 Ca 0.05 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2wyl s VAL 58 Cb -0.12 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 35.89 2wyl s VAL 58 CO 0.01 0.17 -0.17 0.00 0.00 0.00 0.00 175.10 175.10 2wyl s VAL 60 N 1.29 1.97 -1.42 0.00 1.01 0.12 -0.15 120.40 123.22 2wyl s VAL 60 Ca 0.04 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.03 2wyl s VAL 60 Cb -0.14 -1.70 0.00 0.00 0.00 0.00 0.00 36.38 34.54 2wyl s VAL 60 CO -0.11 0.54 0.00 0.47 0.00 0.00 0.00 175.10 176.00 2wyl n ASP 61 N 3.38 -4.54 -4.67 3.32 9.92 -0.70 -0.55 116.55 122.70 2wyl n ASP 61 Ca -0.19 0.18 -0.42 0.00 -0.53 0.00 0.00 54.79 53.83 2wyl n ASP 61 Cb 0.53 -3.90 -0.03 0.00 -0.64 0.00 0.00 41.12 37.08 2wyl n ASP 61 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2wyl s PHE 62 N -2.66 2.39 -0.08 1.24 5.36 -1.26 -3.20 117.98 119.77 2wyl s PHE 62 Ca 0.00 0.49 0.02 0.00 -0.96 0.00 0.00 56.93 56.48 2wyl s PHE 62 Cb 0.00 -3.80 0.01 0.00 -0.34 0.00 0.00 43.02 38.90 2wyl s PHE 62 CO 0.00 -3.17 -0.13 -0.46 -1.46 0.00 0.00 175.22 170.00 2wyl s TRP 63 N 3.34 1.61 -0.18 10.12 -0.00 -1.26 -4.25 118.94 128.31 2wyl s TRP 63 Ca 0.68 -0.65 0.13 0.00 -0.00 0.00 0.00 56.10 56.26 2wyl s TRP 63 Cb -0.32 -1.18 0.42 0.00 -0.00 0.00 0.00 33.47 32.39 2wyl s TRP 63 CO 0.27 -0.34 1.21 0.00 -0.00 0.00 0.00 176.95 178.09 2wyl n GLY 65 N -0.86 1.33 3.43 0.00 0.00 -1.26 -5.04 105.19 102.78 2wyl n GLY 65 Ca 0.18 -2.09 -0.24 0.00 0.00 0.00 0.00 46.02 43.86 2wyl n GLY 65 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wyl s THR 66 N -1.44 0.32 0.00 2.61 -1.32 -1.26 -5.06 115.64 109.49 2wyl s THR 66 Ca 0.38 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.86 2wyl s THR 66 Cb -0.03 -2.37 0.00 0.00 -1.51 0.00 0.00 72.50 68.60 2wyl s THR 66 CO 0.25 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.27 2wyl n GLY 67 N -0.83 1.62 3.71 6.08 0.00 -1.26 -4.93 105.19 109.58 2wyl n GLY 67 Ca -0.01 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2wyl n GLY 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wyl n LYS 68 N 0.00 2.24 0.00 1.61 4.76 0.52 -4.89 118.16 122.39 2wyl n LYS 68 Ca 0.00 0.78 0.00 0.00 -2.87 0.00 0.00 58.31 56.22 2wyl n LYS 68 Cb 0.00 -2.40 0.00 0.00 -1.84 0.00 0.00 35.03 30.79 2wyl n LYS 68 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2wyl n GLN 69 N 0.58 3.68 -3.78 1.97 6.02 -1.26 -4.82 117.38 119.77 2wyl n GLN 69 Ca 0.04 -0.15 -0.07 0.00 -0.01 0.00 0.00 57.00 56.81 2wyl n GLN 69 Cb 0.36 -0.61 -0.02 0.00 1.02 0.00 0.00 30.24 31.00 2wyl n GLN 69 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2wyl s SER 70 N -0.57 -0.29 0.00 1.08 0.15 -1.26 -5.12 113.70 107.69 2wyl s SER 70 Ca 0.00 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2wyl s SER 70 Cb 0.00 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 64.98 2wyl s SER 70 CO 0.00 -1.21 0.00 1.41 1.20 0.00 0.00 173.24 174.64 2wyl n HIS 71 N -0.45 0.00 0.00 3.44 8.25 -1.26 -5.01 115.22 120.19 2wyl n HIS 71 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 2wyl n HIS 71 Cb 0.60 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.51 2wyl n HIS 71 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wyl n GLY 72 N 1.95 2.70 0.00 -1.41 0.00 -1.26 -5.13 105.19 102.04 2wyl n GLY 72 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2wyl n GLY 72 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wyl n ASN 73 N 1.72 0.00 0.00 1.61 3.02 -1.26 -5.30 115.26 115.05 2wyl n ASN 73 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2wyl n ASN 73 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2wyl n ASN 73 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2wyl n LYS 90 N 0.00 0.00 -1.86 3.52 2.85 -1.26 -5.27 118.16 116.14 2wyl n LYS 90 Ca 0.00 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.94 2wyl n LYS 90 Cb 0.00 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.40 2wyl n LYS 90 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2wyl s LEU 91 N 0.00 3.33 0.49 -5.58 1.43 -1.26 -5.04 118.68 112.04 2wyl s LEU 91 Ca 0.00 1.67 -0.21 0.00 -1.03 0.00 0.00 54.13 54.56 2wyl s LEU 91 Cb 0.00 -4.51 -0.08 0.00 0.03 0.00 0.00 46.19 41.63 2wyl s LEU 91 CO 0.00 -1.21 1.07 0.00 0.23 0.00 0.00 176.35 176.44 2wyl s GLN 92 N -4.60 3.75 -1.34 1.70 -2.07 -1.26 -4.96 119.66 110.88 2wyl s GLN 92 Ca 0.60 1.45 -0.09 0.00 -1.82 0.00 0.00 55.36 55.50 2wyl s GLN 92 Cb -0.14 -2.15 0.12 0.00 -1.09 0.00 0.00 33.01 29.75 2wyl s GLN 92 CO 0.46 -0.49 2.15 -0.35 -1.32 0.00 0.00 175.29 175.74 2wyl n PRO 93 N -0.90 3.80 -3.03 9.60 -0.04 -1.26 -4.95 135.00 138.23 2wyl n PRO 93 Ca 0.09 -3.28 -0.43 0.00 -0.04 0.00 0.00 63.50 59.84 2wyl n PRO 93 Cb 0.52 -2.88 -0.06 0.00 -0.04 0.00 0.00 33.50 31.04 2wyl n PRO 93 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2wyl s ASN 94 N 1.11 6.34 -0.14 3.54 4.22 -1.26 -4.36 114.94 124.39 2wyl s ASN 94 Ca 0.47 -0.36 -0.04 0.00 -2.14 0.00 0.00 52.86 50.78 2wyl s ASN 94 Cb 0.13 -2.35 -0.03 0.00 1.28 0.00 0.00 41.25 40.28 2wyl s ASN 94 CO -0.04 -0.91 0.01 -0.76 -2.04 0.00 0.00 177.10 173.36 2wyl s LEU 95 N 3.12 3.55 -0.02 3.54 2.01 -1.26 -0.36 118.68 129.26 2wyl s LEU 95 Ca 0.25 0.04 -0.30 0.00 0.01 0.00 0.00 54.13 54.13 2wyl s LEU 95 Cb -0.14 -1.85 -0.05 0.00 0.01 0.00 0.00 46.19 44.16 2wyl s LEU 95 CO 0.19 0.25 1.47 -0.60 1.01 0.00 0.00 176.35 178.67 2wyl s ARG 96 N -0.13 4.25 -0.07 1.70 3.52 -1.26 -1.55 118.95 125.41 2wyl s ARG 96 Ca 0.05 2.02 0.12 0.00 -0.13 0.00 0.00 55.73 57.79 2wyl s ARG 96 Cb -0.13 -3.68 0.35 0.00 -1.56 0.00 0.00 34.95 29.94 2wyl s ARG 96 CO 0.02 -0.66 1.28 0.25 -0.81 0.00 0.00 175.30 175.38 2wyl n THR 97 N 4.90 1.47 -4.94 4.11 -2.24 -0.48 -4.93 114.28 112.18 2wyl n THR 97 Ca 0.14 -1.35 -0.33 0.00 -2.27 0.00 0.00 64.05 60.25 2wyl n THR 97 Cb 0.43 0.21 -0.15 0.00 -2.10 0.00 0.00 70.33 68.73 2wyl n THR 97 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2wyl s THR 98 N -1.70 2.79 1.25 4.28 2.01 -1.26 -4.93 115.64 118.07 2wyl s THR 98 Ca 0.28 -0.79 -0.20 0.00 0.31 0.00 0.00 61.69 61.29 2wyl s THR 98 Cb 0.19 -2.11 0.31 0.00 0.01 0.00 0.00 72.50 70.89 2wyl s THR 98 CO 0.11 0.56 1.10 -2.16 -0.69 0.00 0.00 174.62 173.54 2wyl s PRO 99 N -0.06 -1.57 -0.51 4.92 0.04 -1.26 -5.00 135.00 131.55 2wyl s PRO 99 Ca -0.04 -0.14 -0.14 0.00 0.04 0.00 0.00 61.00 60.72 2wyl s PRO 99 Cb -0.14 -1.56 0.12 0.00 0.04 0.00 0.00 34.50 32.96 2wyl s PRO 99 CO 0.04 -3.93 0.44 -0.06 0.04 0.00 0.00 177.00 173.54 2wyl s PHE 100 N -2.97 3.30 -0.28 0.56 0.40 -1.26 -4.93 117.98 112.80 2wyl s PHE 100 Ca 0.72 -1.43 0.19 0.00 -0.60 0.00 0.00 56.93 55.81 2wyl s PHE 100 Cb -0.08 -3.65 0.21 0.00 0.51 0.00 0.00 43.02 40.00 2wyl s PHE 100 CO 0.56 -0.99 1.53 -0.39 0.70 0.00 0.00 175.22 176.62 2wyl h VAL 101 N 5.95 0.46 -3.52 -0.44 -1.51 -1.95 -2.87 116.25 112.37 2wyl h VAL 101 Ca -0.27 -1.64 -0.41 0.00 -1.23 0.00 0.00 66.70 63.15 2wyl h VAL 101 Cb 1.09 2.22 -0.33 0.00 -2.13 0.00 0.00 31.29 32.14 2wyl h VAL 101 CO 0.97 0.26 -0.77 -0.22 -1.23 0.00 0.00 177.57 176.58 2wyl s LEU 102 N -6.35 1.42 -0.39 4.19 2.96 -1.26 -4.31 118.68 114.94 2wyl s LEU 102 Ca 0.05 -0.13 -0.23 0.00 -0.22 0.00 0.00 54.13 53.60 2wyl s LEU 102 Cb 0.06 -0.45 0.01 0.00 0.50 0.00 0.00 46.19 46.32 2wyl s LEU 102 CO 0.71 -0.03 0.76 -0.62 -1.32 0.00 0.00 176.35 175.84 2wyl s ASP 103 N 0.77 6.49 0.38 3.68 2.15 -1.25 -4.95 116.67 123.95 2wyl s ASP 103 Ca -0.11 0.19 0.06 0.00 0.43 0.00 0.00 52.55 53.12 2wyl s ASP 103 Cb -0.13 -2.38 0.78 0.00 -0.30 0.00 0.00 42.92 40.89 2wyl s ASP 103 CO 0.00 -0.76 2.02 1.55 -0.17 0.00 0.00 175.17 177.82 2wyl h PRO 104 N 8.62 0.66 0.00 4.34 0.13 -1.95 -2.17 132.00 141.63 2wyl h PRO 104 Ca -0.25 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2wyl h PRO 104 Cb 1.09 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2wyl h PRO 104 CO 0.91 0.43 0.00 1.19 -0.23 0.00 0.00 178.00 180.31 2wyl n PHE 105 N -4.46 0.00 0.93 1.56 3.01 -1.26 -2.34 117.46 114.89 2wyl n PHE 105 Ca 0.06 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.63 2wyl n PHE 105 Cb 0.10 -0.20 0.09 0.00 -0.01 0.00 0.00 39.48 39.46 2wyl n PHE 105 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wyl n ALA 106 N -1.20 2.47 -2.10 4.37 0.00 -0.82 -4.96 120.51 118.27 2wyl n ALA 106 Ca 0.15 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.50 2wyl n ALA 106 Cb 0.18 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 2wyl n ALA 106 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wyl s ILE 107 N -1.85 3.13 0.14 0.00 1.01 -0.99 -4.90 121.20 117.75 2wyl s ILE 107 Ca 0.26 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.70 2wyl s ILE 107 Cb 0.18 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2wyl s ILE 107 CO 0.28 0.05 0.00 0.54 0.00 0.00 0.00 174.94 175.81 2wyl n ARG 108 N 4.14 0.00 -2.68 2.79 5.12 -1.26 -4.64 116.66 120.12 2wyl n ARG 108 Ca 0.12 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.62 2wyl n ARG 108 Cb 0.41 -0.29 -0.03 0.00 -1.16 0.00 0.00 32.46 31.39 2wyl n ARG 108 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2wyl s GLN 109 N -1.86 3.83 -0.14 5.56 -0.21 -1.26 -4.67 119.66 120.90 2wyl s GLN 109 Ca 0.00 0.66 -0.19 0.00 0.02 0.00 0.00 55.36 55.86 2wyl s GLN 109 Cb 0.00 -3.84 0.05 0.00 1.00 0.00 0.00 33.01 30.22 2wyl s GLN 109 CO 0.00 -1.13 0.50 -1.50 -2.12 0.00 0.00 175.29 171.04 2wyl s ILE 110 N 3.92 0.01 -0.08 1.08 2.07 -1.26 -4.90 121.20 122.04 2wyl s ILE 110 Ca 0.44 -0.08 0.10 0.00 -1.41 0.00 0.00 60.65 59.69 2wyl s ILE 110 Cb -0.10 -0.73 -0.14 0.00 0.13 0.00 0.00 42.46 41.62 2wyl s ILE 110 CO 0.23 -0.05 0.09 0.47 -1.91 0.00 0.00 174.94 173.78 2wyl n ASP 111 N 2.28 2.39 -3.64 4.50 8.00 -0.43 -4.86 116.55 124.80 2wyl n ASP 111 Ca -0.16 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.20 2wyl n ASP 111 Cb 0.56 0.95 -0.08 0.00 -0.02 0.00 0.00 41.12 42.53 2wyl n ASP 111 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wyl s ALA 112 N -2.39 -1.54 -0.13 2.24 0.00 -1.15 -4.09 121.76 114.71 2wyl s ALA 112 Ca -0.05 1.55 -0.02 0.00 0.00 0.00 0.00 51.96 53.44 2wyl s ALA 112 Cb 0.04 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 2wyl s ALA 112 CO 0.44 -0.31 -0.06 0.08 0.00 0.00 0.00 175.76 175.92 2wyl s VAL 113 N -0.14 3.72 0.12 0.00 1.01 -0.72 -1.67 120.40 122.72 2wyl s VAL 113 Ca -0.03 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.57 2wyl s VAL 113 Cb -0.03 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 2wyl s VAL 113 CO 0.03 0.52 -0.14 -0.76 0.00 0.00 0.00 175.10 174.76 2wyl s LEU 114 N 0.07 2.39 -0.00 3.92 1.02 0.79 -0.42 118.68 126.45 2wyl s LEU 114 Ca -0.01 -0.80 0.00 0.00 0.02 0.00 0.00 54.13 53.34 2wyl s LEU 114 Cb -0.14 -0.54 0.00 0.00 0.02 0.00 0.00 46.19 45.53 2wyl s LEU 114 CO 0.03 -0.14 -0.01 0.00 0.02 0.00 0.00 176.35 176.25 2wyl s ALA 115 N -2.07 0.09 -0.12 4.21 0.00 -0.75 -1.72 121.76 121.39 2wyl s ALA 115 Ca 0.08 -0.00 -0.25 0.00 0.00 0.00 0.00 51.96 51.79 2wyl s ALA 115 Cb -0.05 -0.05 -0.27 0.00 0.00 0.00 0.00 23.12 22.75 2wyl s ALA 115 CO 0.03 0.00 0.72 1.79 0.00 0.00 0.00 175.76 178.31 2wyl h THR 116 N 5.27 1.54 -4.08 0.00 1.35 -1.83 -3.39 112.91 111.77 2wyl h THR 116 Ca -0.27 -2.39 -0.18 0.00 -0.55 0.00 0.00 66.41 63.02 2wyl h THR 116 Cb 1.20 3.14 -0.11 0.00 -1.73 0.00 0.00 68.15 70.66 2wyl h THR 116 CO 0.50 0.62 -0.29 -1.38 -0.25 0.00 0.00 175.52 174.72 2wyl s HIS 117 N -2.32 0.82 -1.38 4.73 -3.43 -1.26 -1.24 115.29 111.20 2wyl s HIS 117 Ca -0.19 -1.09 0.22 0.00 -0.80 0.00 0.00 55.06 53.20 2wyl s HIS 117 Cb -0.00 -0.12 1.08 0.00 -1.43 0.00 0.00 32.58 32.10 2wyl s HIS 117 CO 0.73 -0.93 1.70 -0.40 -2.00 0.00 0.00 174.74 173.84 2wyl n ASP 118 N -0.66 0.00 -4.60 7.38 5.68 -1.25 -4.52 116.55 118.58 2wyl n ASP 118 Ca 0.00 0.04 -0.40 0.00 -0.50 0.00 0.00 54.79 53.93 2wyl n ASP 118 Cb 0.63 -0.31 0.03 0.00 -1.14 0.00 0.00 41.12 40.33 2wyl n ASP 118 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 2wyl n HIS 119 N -1.31 0.93 -0.35 2.11 -0.00 -1.26 -4.80 115.22 110.54 2wyl n HIS 119 Ca 0.10 0.50 0.13 0.00 0.46 0.00 0.00 57.72 58.91 2wyl n HIS 119 Cb 0.18 -2.18 0.32 0.00 -0.12 0.00 0.00 29.99 28.19 2wyl n HIS 119 CO 0.00 0.00 0.00 -0.97 0.46 0.00 0.00 176.34 175.83 2wyl h ASN 120 N 1.11 0.73 0.34 0.26 -1.24 -1.90 -1.81 115.58 113.07 2wyl h ASN 120 Ca -0.46 0.11 0.00 0.00 0.71 0.00 0.00 56.30 56.66 2wyl h ASN 120 Cb 1.35 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.38 2wyl h ASN 120 CO 0.54 0.24 0.00 0.47 -1.29 0.00 0.00 177.43 177.39 2wyl n ASP 121 N -4.80 0.00 -0.00 1.15 8.00 -1.26 -3.75 116.55 115.89 2wyl n ASP 121 Ca 0.23 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.40 2wyl n ASP 121 Cb 0.59 -0.20 -0.00 0.00 -0.02 0.00 0.00 41.12 41.49 2wyl n ASP 121 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2wyl n HIS 122 N -1.20 0.00 -4.02 1.24 8.25 -0.69 -4.64 115.22 114.16 2wyl n HIS 122 Ca 0.15 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.47 2wyl n HIS 122 Cb 0.17 -0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.14 2wyl n HIS 122 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2wyl s ILE 123 N -1.15 0.23 -0.04 1.59 2.07 -1.19 -4.31 121.20 118.41 2wyl s ILE 123 Ca 0.00 -0.20 -0.01 0.00 -1.41 0.00 0.00 60.65 59.03 2wyl s ILE 123 Cb 0.01 -0.22 0.03 0.00 0.13 0.00 0.00 42.46 42.41 2wyl s ILE 123 CO 0.03 0.01 0.04 -0.62 -1.91 0.00 0.00 174.94 172.49 2wyl s ASP 124 N -0.20 0.87 0.29 4.50 2.15 -1.26 -4.83 116.67 118.19 2wyl s ASP 124 Ca -0.00 0.03 0.01 0.00 0.43 0.00 0.00 52.55 53.02 2wyl s ASP 124 Cb -0.02 -0.18 0.44 0.00 -0.30 0.00 0.00 42.92 42.87 2wyl s ASP 124 CO -0.00 -0.19 1.80 1.62 -0.17 0.00 0.00 175.17 178.22 2wyl h VAL 125 N 6.37 1.23 -0.11 1.11 3.04 -1.97 -2.21 116.25 123.70 2wyl h VAL 125 Ca -0.25 -0.95 -0.14 0.00 -1.01 0.00 0.00 66.70 64.35 2wyl h VAL 125 Cb 1.12 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 2wyl h VAL 125 CO 0.28 0.33 -0.56 0.78 -1.01 0.00 0.00 177.57 177.39 2wyl h ASN 126 N 0.62 0.38 -0.23 3.17 2.35 -1.96 0.28 115.58 120.19 2wyl h ASN 126 Ca 0.12 -0.20 -0.06 0.00 -0.55 0.00 0.00 56.30 55.61 2wyl h ASN 126 Cb 0.43 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2wyl h ASN 126 CO 0.02 0.86 -0.07 0.58 -1.65 0.00 0.00 177.43 177.16 2wyl h VAL 127 N 0.26 1.29 -0.60 2.81 2.07 -1.88 -1.28 116.25 118.92 2wyl h VAL 127 Ca 0.00 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.44 2wyl h VAL 127 Cb 1.06 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 2wyl h VAL 127 CO 0.09 0.34 0.38 0.00 0.02 0.00 0.00 177.57 178.40 2wyl h ALA 128 N 0.74 0.77 -0.39 1.67 0.00 -1.28 -1.80 119.26 118.97 2wyl h ALA 128 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wyl h ALA 128 Cb 0.54 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2wyl h ALA 128 CO 0.03 0.16 0.25 0.00 0.00 0.00 0.00 179.25 179.68 2wyl h ALA 129 N 1.24 0.49 -0.62 0.00 0.00 -0.89 -3.04 119.26 116.44 2wyl h ALA 129 Ca 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2wyl h ALA 129 Cb -0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2wyl h ALA 129 CO -0.07 -0.03 0.39 0.00 0.00 0.00 0.00 179.25 179.54 2wyl h ALA 130 N 1.12 0.78 0.00 0.00 0.00 -0.95 -2.34 119.26 117.88 2wyl h ALA 130 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wyl h ALA 130 Cb -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2wyl h ALA 130 CO -0.03 0.24 0.00 0.28 0.00 0.00 0.00 179.25 179.74 2wyl n VAL 131 N -4.63 0.28 0.00 0.00 0.31 -0.70 -1.54 118.33 112.05 2wyl n VAL 131 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2wyl n VAL 131 Cb 0.04 -0.61 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 2wyl n VAL 131 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wyl n GLN 133 N 0.80 0.00 -0.02 5.55 6.02 -0.88 -1.38 117.38 127.47 2wyl n GLN 133 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.00 57.02 2wyl n GLN 133 Cb 0.15 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.31 2wyl n GLN 133 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2wyl n ASN 134 N 0.00 2.10 -3.66 1.08 3.02 -0.59 -5.06 115.26 112.14 2wyl n ASN 134 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.43 2wyl n ASN 134 Cb 0.00 1.35 0.03 0.00 -0.61 0.00 0.00 39.78 40.54 2wyl n ASN 134 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wyl s ALA 136 N -2.41 1.78 0.13 0.00 0.00 -1.26 -4.95 121.76 115.04 2wyl s ALA 136 Ca 0.30 0.13 0.34 0.00 0.00 0.00 0.00 51.96 52.73 2wyl s ALA 136 Cb -0.02 -3.25 1.40 0.00 0.00 0.00 0.00 23.12 21.24 2wyl s ALA 136 CO 0.19 -2.19 2.00 -0.44 0.00 0.00 0.00 175.76 175.32 2wyl h ASP 137 N -1.43 0.00 -0.19 0.00 3.45 -1.99 -3.29 116.42 112.97 2wyl h ASP 137 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2wyl h ASP 137 Cb 1.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.03 2wyl h ASP 137 CO 0.52 0.01 0.00 -0.90 -1.57 0.00 0.00 179.24 177.30 2wyl n ASP 138 N -3.11 2.78 -4.64 6.45 3.85 -1.26 -4.99 116.55 115.63 2wyl n ASP 138 Ca 0.00 -2.32 -0.43 0.00 -0.71 0.00 0.00 54.79 51.33 2wyl n ASP 138 Cb 0.30 -0.25 -0.02 0.00 -1.35 0.00 0.00 41.12 39.80 2wyl n ASP 138 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 2wyl s VAL 139 N -1.57 4.01 0.43 2.12 1.01 -1.24 -5.00 120.40 120.16 2wyl s VAL 139 Ca 0.21 1.16 -0.21 0.00 0.00 0.00 0.00 61.98 63.15 2wyl s VAL 139 Cb 0.15 -3.98 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 2wyl s VAL 139 CO 0.08 -0.35 0.95 -2.16 0.00 0.00 0.00 175.10 173.62 2wyl s PRO 140 N 4.20 4.22 -0.45 2.72 0.04 -1.26 -4.91 135.00 139.55 2wyl s PRO 140 Ca 0.61 1.11 -0.09 0.00 0.04 0.00 0.00 61.00 62.68 2wyl s PRO 140 Cb -0.20 -2.18 0.11 0.00 0.04 0.00 0.00 34.50 32.27 2wyl s PRO 140 CO 0.24 -0.04 0.31 -0.06 0.04 0.00 0.00 177.00 177.49 2wyl s PHE 141 N -2.19 3.41 -0.18 0.56 0.40 0.92 -1.76 117.98 119.14 2wyl s PHE 141 Ca 0.62 -1.82 -0.14 0.00 -0.60 0.00 0.00 56.93 54.99 2wyl s PHE 141 Cb -0.09 -3.34 -0.05 0.00 0.51 0.00 0.00 43.02 40.05 2wyl s PHE 141 CO 0.14 -0.96 0.29 0.42 0.70 0.00 0.00 175.22 175.81 2wyl s ILE 142 N 1.36 5.29 -0.01 0.64 1.01 0.43 -1.06 121.20 128.87 2wyl s ILE 142 Ca 0.05 0.52 -0.30 0.00 0.00 0.00 0.00 60.65 60.92 2wyl s ILE 142 Cb -0.25 -3.63 0.12 0.00 0.01 0.00 0.00 42.46 38.71 2wyl s ILE 142 CO -0.00 0.35 1.29 -0.83 0.00 0.00 0.00 174.94 175.75 2wyl s GLY 143 N 0.67 -0.38 0.99 6.18 0.00 -0.87 -1.81 107.32 112.10 2wyl s GLY 143 Ca 0.16 0.62 -0.12 0.00 0.00 0.00 0.00 44.72 45.38 2wyl s GLY 143 CO 0.05 0.71 1.08 2.56 0.00 0.00 0.00 173.10 177.50 2wyl s PRO 144 N -2.37 0.47 0.23 2.90 0.04 -1.26 -1.38 135.00 133.63 2wyl s PRO 144 Ca 0.16 1.01 -0.17 0.00 0.04 0.00 0.00 61.00 62.03 2wyl s PRO 144 Cb 0.04 -1.70 0.24 0.00 0.04 0.00 0.00 34.50 33.12 2wyl s PRO 144 CO -0.04 -2.83 1.56 -0.22 0.04 0.00 0.00 177.00 175.51 2wyl h LYS 145 N -1.99 -0.03 -0.15 4.56 1.63 -1.78 -1.00 116.57 117.82 2wyl h LYS 145 Ca -0.52 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.26 2wyl h LYS 145 Cb 1.30 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.92 2wyl h LYS 145 CO 0.50 -0.02 -0.02 0.00 -3.45 0.00 0.00 179.45 176.46 2wyl h THR 146 N -0.03 1.11 -0.06 1.00 1.03 -1.80 0.19 112.91 114.35 2wyl h THR 146 Ca 0.34 -0.44 -0.21 0.00 -0.01 0.00 0.00 66.41 66.09 2wyl h THR 146 Cb 0.60 1.02 0.00 0.00 -1.07 0.00 0.00 68.15 68.70 2wyl h THR 146 CO -0.93 0.14 -0.82 0.00 -0.01 0.00 0.00 175.52 173.90 2wyl h VAL 148 N 0.30 1.25 -0.47 0.00 2.07 -0.49 0.52 116.25 119.44 2wyl h VAL 148 Ca -0.05 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.54 2wyl h VAL 148 Cb 1.43 1.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.31 2wyl h VAL 148 CO 0.15 0.32 0.24 0.44 0.02 0.00 0.00 177.57 178.73 2wyl h ASP 149 N 0.47 0.34 -0.44 0.57 3.32 -0.66 0.24 116.42 120.26 2wyl h ASP 149 Ca 0.11 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.15 2wyl h ASP 149 Cb 0.44 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 2wyl h ASP 149 CO 0.02 0.24 0.14 0.25 -1.72 0.00 0.00 179.24 178.17 2wyl h LEU 150 N 0.47 0.64 0.28 1.55 5.85 -1.25 -2.08 115.31 120.77 2wyl h LEU 150 Ca 0.20 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 2wyl h LEU 150 Cb 0.10 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2wyl h LEU 150 CO -0.14 0.68 -0.13 -0.50 -0.34 0.00 0.00 178.44 178.01 2wyl h TRP 151 N 0.58 -0.34 -0.74 1.25 6.55 -0.50 -2.55 115.95 120.20 2wyl h TRP 151 Ca 0.14 -0.01 0.14 0.00 0.95 0.00 0.00 58.89 60.11 2wyl h TRP 151 Cb 0.26 0.11 -0.09 0.00 -0.86 0.00 0.00 29.16 28.58 2wyl h TRP 151 CO 0.01 -0.21 0.29 0.82 -1.05 0.00 0.00 178.44 178.30 2wyl h ILE 152 N -0.37 0.67 -0.58 1.49 2.04 -0.47 -0.95 117.51 119.34 2wyl h ILE 152 Ca -0.04 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2wyl h ILE 152 Cb 0.29 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 2wyl h ILE 152 CO 0.06 0.08 0.29 1.23 0.00 0.00 0.00 178.15 179.82 2wyl h GLY 153 N 0.44 0.86 2.00 5.37 0.00 -1.25 -2.24 103.07 108.25 2wyl h GLY 153 Ca 0.40 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2wyl h GLY 153 CO -0.40 0.37 0.00 0.79 0.00 0.00 0.00 176.54 177.30 2wyl n TRP 154 N -4.37 0.37 0.00 5.60 8.01 -0.40 -4.85 117.44 121.81 2wyl n TRP 154 Ca 0.05 0.14 0.00 0.00 -1.31 0.00 0.00 57.50 56.38 2wyl n TRP 154 Cb 0.11 -0.73 0.00 0.00 -2.01 0.00 0.00 31.31 28.68 2wyl n TRP 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2wyl n GLY 155 N 0.13 0.91 3.68 6.99 0.00 -0.84 -5.05 105.19 111.01 2wyl n GLY 155 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2wyl n GLY 155 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wyl s VAL 156 N -2.00 3.33 0.62 1.61 1.01 -1.00 -4.96 120.40 119.01 2wyl s VAL 156 Ca 0.00 0.66 -0.18 0.00 0.00 0.00 0.00 61.98 62.46 2wyl s VAL 156 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2wyl s VAL 156 CO 0.00 -0.02 1.25 -2.84 0.00 0.00 0.00 175.10 173.49 2wyl s PRO 157 N 3.03 2.77 0.10 2.72 0.02 -1.26 -4.03 135.00 138.35 2wyl s PRO 157 Ca 0.72 1.95 0.27 0.00 0.02 0.00 0.00 61.00 63.95 2wyl s PRO 157 Cb -0.36 -1.89 0.83 0.00 0.02 0.00 0.00 34.50 33.09 2wyl s PRO 157 CO 0.30 -1.39 1.70 0.36 -0.33 0.00 0.00 177.00 177.64 2wyl n LYS 158 N -1.73 0.15 0.13 5.54 2.85 -1.26 -2.81 118.16 121.03 2wyl n LYS 158 Ca 0.15 0.09 0.13 0.00 -1.05 0.00 0.00 58.31 57.63 2wyl n LYS 158 Cb 0.49 -1.65 0.41 0.00 -0.65 0.00 0.00 35.03 33.63 2wyl n LYS 158 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2wyl h GLU 159 N 0.00 0.00 -0.24 -1.58 5.08 -2.03 -2.36 114.58 113.46 2wyl h GLU 159 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wyl h GLU 159 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 2wyl h GLU 159 CO 0.00 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.55 2wyl n ARG 160 N -2.40 2.22 -4.13 2.33 5.12 -1.12 -4.92 116.66 113.75 2wyl n ARG 160 Ca 0.04 -1.83 -0.34 0.00 -1.93 0.00 0.00 57.85 53.80 2wyl n ARG 160 Cb 0.40 -1.47 -0.07 0.00 -1.16 0.00 0.00 32.46 30.15 2wyl n ARG 160 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2wyl s ILE 162 N -1.13 1.62 0.10 0.00 1.01 -0.22 -4.87 121.20 117.70 2wyl s ILE 162 Ca 0.21 -0.83 -0.29 0.00 0.00 0.00 0.00 60.65 59.73 2wyl s ILE 162 Cb -0.12 -1.61 -0.06 0.00 0.01 0.00 0.00 42.46 40.68 2wyl s ILE 162 CO 0.11 0.32 0.92 -0.69 0.00 0.00 0.00 174.94 175.60 2wyl s VAL 163 N 1.43 4.54 -0.04 2.92 1.01 -1.26 -2.04 120.40 126.97 2wyl s VAL 163 Ca 0.02 1.99 0.04 0.00 0.00 0.00 0.00 61.98 64.02 2wyl s VAL 163 Cb -0.15 -4.28 -0.00 0.00 0.00 0.00 0.00 36.38 31.95 2wyl s VAL 163 CO -0.10 0.33 -0.15 0.68 0.00 0.00 0.00 175.10 175.86 2wyl s VAL 164 N -0.01 1.26 0.24 2.92 -7.23 -0.48 -4.92 120.40 112.18 2wyl s VAL 164 Ca 0.45 -0.63 0.09 0.00 -1.81 0.00 0.00 61.98 60.09 2wyl s VAL 164 Cb -0.23 -1.09 -0.04 0.00 0.56 0.00 0.00 36.38 35.58 2wyl s VAL 164 CO 0.29 0.37 0.01 -0.54 -0.31 0.00 0.00 175.10 174.91 2wyl s LYS 165 N 0.05 2.34 0.12 4.82 1.02 -1.26 -4.06 119.74 122.77 2wyl s LYS 165 Ca -0.03 -1.33 -0.34 0.00 0.02 0.00 0.00 55.97 54.29 2wyl s LYS 165 Cb -0.10 -2.22 -0.13 0.00 -0.52 0.00 0.00 37.83 34.85 2wyl s LYS 165 CO 0.02 0.39 1.65 -2.30 -0.92 0.00 0.00 175.35 174.18 2wyl n PRO 166 N -0.73 2.20 0.00 -1.68 -0.02 -1.26 -2.06 135.00 131.44 2wyl n PRO 166 Ca -0.07 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2wyl n PRO 166 Cb 0.58 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2wyl n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wyl n GLY 167 N 3.63 1.22 3.79 -1.23 0.00 0.53 -4.95 105.19 108.18 2wyl n GLY 167 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2wyl n GLY 167 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wyl s ASP 168 N -0.76 6.03 -0.06 1.61 1.01 -0.88 -4.86 116.67 118.76 2wyl s ASP 168 Ca 0.00 2.03 0.04 0.00 0.71 0.00 0.00 52.55 55.32 2wyl s ASP 168 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 2wyl s ASP 168 CO 0.00 -1.00 -0.17 -0.69 0.21 0.00 0.00 175.17 173.52 2wyl s VAL 169 N -1.92 1.46 -0.15 -1.27 1.01 -1.26 -1.23 120.40 117.03 2wyl s VAL 169 Ca 0.69 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.97 2wyl s VAL 169 Cb -0.19 -1.27 0.02 0.00 0.00 0.00 0.00 36.38 34.94 2wyl s VAL 169 CO 0.24 0.42 -0.14 -0.69 0.00 0.00 0.00 175.10 174.93 2wyl s VAL 170 N 0.27 1.59 -0.54 2.92 1.01 0.04 -4.99 120.40 120.70 2wyl s VAL 170 Ca -0.09 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.04 2wyl s VAL 170 Cb -0.14 -1.49 0.08 0.00 0.00 0.00 0.00 36.38 34.82 2wyl s VAL 170 CO 0.04 0.46 0.66 -0.75 0.00 0.00 0.00 175.10 175.50 2wyl s LYS 171 N 1.48 3.09 -0.42 2.72 2.47 -1.26 -0.74 119.74 127.08 2wyl s LYS 171 Ca 0.05 -1.06 -0.13 0.00 -1.56 0.00 0.00 55.97 53.27 2wyl s LYS 171 Cb -0.13 -4.17 0.05 0.00 -1.46 0.00 0.00 37.83 32.13 2wyl s LYS 171 CO -0.11 -1.36 0.30 0.08 0.16 0.00 0.00 175.35 174.42 2wyl s VAL 172 N 2.67 4.84 0.00 4.02 1.01 -0.30 -4.95 120.40 127.69 2wyl s VAL 172 Ca 0.14 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2wyl s VAL 172 Cb -0.21 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2wyl s VAL 172 CO 0.10 -0.42 0.00 0.29 0.00 0.00 0.00 175.10 175.06 2wyl n LYS 173 N 5.08 0.00 -0.00 2.72 5.02 -1.26 -0.21 118.16 129.51 2wyl n LYS 173 Ca -0.11 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.25 2wyl n LYS 173 Cb 0.45 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.36 2wyl n LYS 173 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2wyl n ASP 174 N 2.04 0.98 -4.40 4.39 2.03 -1.26 -4.95 116.55 115.38 2wyl n ASP 174 Ca 0.00 -0.55 -0.36 0.00 0.52 0.00 0.00 54.79 54.41 2wyl n ASP 174 Cb 0.00 1.25 -0.13 0.00 -0.72 0.00 0.00 41.12 41.52 2wyl n ASP 174 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2wyl s ILE 175 N -2.64 3.91 -0.51 5.18 1.01 0.71 -4.41 121.20 124.45 2wyl s ILE 175 Ca 0.02 -0.31 -0.23 0.00 0.00 0.00 0.00 60.65 60.13 2wyl s ILE 175 Cb 0.11 -2.80 0.04 0.00 0.01 0.00 0.00 42.46 39.81 2wyl s ILE 175 CO 0.62 0.39 0.82 -0.70 0.00 0.00 0.00 174.94 176.06 2wyl s GLU 176 N 1.44 3.30 -0.35 2.79 2.12 0.08 -1.15 118.70 126.92 2wyl s GLU 176 Ca 0.05 -0.38 -0.17 0.00 0.36 0.00 0.00 54.97 54.83 2wyl s GLU 176 Cb -0.15 -4.03 -0.00 0.00 0.26 0.00 0.00 34.13 30.21 2wyl s GLU 176 CO 0.01 -1.32 0.47 0.42 -0.54 0.00 0.00 175.26 174.30 2wyl s ILE 177 N 3.43 5.06 -0.26 -3.70 1.01 0.09 -0.50 121.20 126.34 2wyl s ILE 177 Ca 0.26 0.21 -0.12 0.00 0.00 0.00 0.00 60.65 61.00 2wyl s ILE 177 Cb -0.14 -3.93 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 2wyl s ILE 177 CO 0.18 -0.20 0.25 -1.00 0.00 0.00 0.00 174.94 174.18 2wyl s HIS 178 N 2.28 3.27 -0.21 3.97 3.76 0.10 -0.78 115.29 127.67 2wyl s HIS 178 Ca 0.16 0.28 -0.20 0.00 -0.15 0.00 0.00 55.06 55.15 2wyl s HIS 178 Cb -0.16 -2.42 -0.03 0.00 1.11 0.00 0.00 32.58 31.09 2wyl s HIS 178 CO 0.13 -0.10 0.61 0.00 -0.85 0.00 0.00 174.74 174.52 2wyl s ALA 179 N 1.61 3.56 0.49 -1.40 0.00 -0.36 -0.83 121.76 124.82 2wyl s ALA 179 Ca 0.11 -0.33 0.02 0.00 0.00 0.00 0.00 51.96 51.75 2wyl s ALA 179 Cb -0.15 -2.95 -0.01 0.00 0.00 0.00 0.00 23.12 20.01 2wyl s ALA 179 CO 0.09 -0.59 0.05 -0.51 0.00 0.00 0.00 175.76 174.80 2wyl s LEU 180 N 1.98 2.14 0.10 0.00 1.43 0.22 -0.34 118.68 124.20 2wyl s LEU 180 Ca 0.27 -1.71 -0.31 0.00 -1.03 0.00 0.00 54.13 51.36 2wyl s LEU 180 Cb -0.16 -0.49 -0.07 0.00 0.03 0.00 0.00 46.19 45.51 2wyl s LEU 180 CO 0.10 -0.94 1.27 -1.81 0.23 0.00 0.00 176.35 175.21 2wyl s ASP 181 N -3.81 6.98 0.45 2.29 1.01 -1.26 -1.09 116.67 121.23 2wyl s ASP 181 Ca 0.08 2.17 0.08 0.00 0.71 0.00 0.00 52.55 55.60 2wyl s ASP 181 Cb 0.01 -2.59 0.02 0.00 1.01 0.00 0.00 42.92 41.38 2wyl s ASP 181 CO 0.06 -0.53 0.62 0.00 0.21 0.00 0.00 175.17 175.52 2wyl s ALA 182 N 0.91 4.54 -0.00 5.23 0.00 -1.26 -4.24 121.76 126.93 2wyl s ALA 182 Ca 0.60 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2wyl s ALA 182 Cb -0.33 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.18 2wyl s ALA 182 CO 0.31 -0.40 -0.01 -0.06 0.00 0.00 0.00 175.76 175.60 2wyl s PHE 183 N -2.42 0.11 0.22 0.00 0.08 -1.26 -4.98 117.98 109.72 2wyl s PHE 183 Ca 0.56 -0.01 0.00 0.00 0.12 0.00 0.00 56.93 57.60 2wyl s PHE 183 Cb -0.09 -0.09 0.00 0.00 -0.57 0.00 0.00 43.02 42.27 2wyl s PHE 183 CO 0.34 -0.01 0.00 -0.25 -0.10 0.00 0.00 175.22 175.20 2wyl n ASP 184 N 3.16 2.59 -0.88 1.36 9.92 -1.26 -3.21 116.55 128.23 2wyl n ASP 184 Ca -0.14 -1.95 0.03 0.00 -0.53 0.00 0.00 54.79 52.20 2wyl n ASP 184 Cb 0.59 0.15 0.21 0.00 -0.64 0.00 0.00 41.12 41.43 2wyl n ASP 184 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2wyl n ARG 185 N -0.55 2.07 0.00 -1.24 1.74 -1.26 -4.84 116.66 112.58 2wyl n ARG 185 Ca -0.09 -3.01 0.00 0.00 -0.77 0.00 0.00 57.85 53.98 2wyl n ARG 185 Cb 0.28 -1.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2wyl n ARG 185 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wyl n GLY 204 N -0.98 0.58 2.17 -0.13 0.00 -1.26 -5.24 105.19 100.33 2wyl n GLY 204 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2wyl n GLY 204 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wyl n ASP 206 N 1.43 0.00 -0.27 1.61 9.92 -1.26 -3.65 116.55 124.32 2wyl n ASP 206 Ca 0.00 0.00 0.13 0.00 -0.53 0.00 0.00 54.79 54.39 2wyl n ASP 206 Cb 0.00 0.00 0.33 0.00 -0.64 0.00 0.00 41.12 40.81 2wyl n ASP 206 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2wyl n ASP 207 N 0.00 1.14 -0.09 -2.24 8.00 -1.26 -4.47 116.55 117.62 2wyl n ASP 207 Ca 0.00 -0.96 -0.16 0.00 0.71 0.00 0.00 54.79 54.38 2wyl n ASP 207 Cb 0.00 0.18 -0.08 0.00 -0.02 0.00 0.00 41.12 41.20 2wyl n ASP 207 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2wyl n ARG 208 N -0.59 0.43 -3.77 -1.24 1.74 -1.24 -2.39 116.66 109.61 2wyl n ARG 208 Ca 0.12 0.13 -0.13 0.00 -0.77 0.00 0.00 57.85 57.20 2wyl n ARG 208 Cb 0.36 -1.29 -0.10 0.00 -1.02 0.00 0.00 32.46 30.42 2wyl n ARG 208 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wyl s ALA 209 N -2.36 -0.76 0.07 7.54 0.00 -1.26 -3.78 121.76 121.22 2wyl s ALA 209 Ca -0.25 0.58 0.03 0.00 0.00 0.00 0.00 51.96 52.31 2wyl s ALA 209 Cb 0.08 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2wyl s ALA 209 CO 0.38 -0.20 -0.08 0.14 0.00 0.00 0.00 175.76 176.00 2wyl s VAL 210 N -0.59 0.70 0.03 0.00 -7.23 -0.38 -4.15 120.40 108.79 2wyl s VAL 210 Ca -0.07 -1.46 -0.01 0.00 -1.81 0.00 0.00 61.98 58.64 2wyl s VAL 210 Cb -0.04 -1.10 -0.04 0.00 0.56 0.00 0.00 36.38 35.76 2wyl s VAL 210 CO 0.02 -0.55 0.16 0.20 -0.31 0.00 0.00 175.10 174.62 2wyl s ASN 211 N -2.20 6.12 -0.08 4.85 -0.87 -0.25 -4.66 114.94 117.84 2wyl s ASN 211 Ca 0.00 0.23 0.01 0.00 -1.57 0.00 0.00 52.86 51.53 2wyl s ASN 211 Cb -0.04 -1.84 -0.02 0.00 -0.02 0.00 0.00 41.25 39.32 2wyl s ASN 211 CO -0.01 0.22 -0.11 -0.31 -2.57 0.00 0.00 177.10 174.32 2wyl s TYR 212 N -1.37 2.83 -0.26 2.20 2.02 -0.20 0.70 117.35 123.26 2wyl s TYR 212 Ca 0.29 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.79 2wyl s TYR 212 Cb -0.13 -1.73 0.05 0.00 -0.40 0.00 0.00 41.96 39.75 2wyl s TYR 212 CO 0.22 0.13 -0.09 -1.17 -1.57 0.00 0.00 175.55 173.06 2wyl s LEU 213 N -0.42 3.33 -0.35 -1.29 2.96 -0.01 -0.79 118.68 122.11 2wyl s LEU 213 Ca 0.05 -1.21 -0.19 0.00 -0.22 0.00 0.00 54.13 52.57 2wyl s LEU 213 Cb -0.12 -1.59 -0.00 0.00 0.50 0.00 0.00 46.19 44.98 2wyl s LEU 213 CO 0.02 -0.17 0.56 -0.36 -1.32 0.00 0.00 176.35 175.08 2wyl s PHE 214 N 1.19 3.17 -0.37 5.38 0.08 0.44 -0.72 117.98 127.14 2wyl s PHE 214 Ca -0.05 0.24 -0.12 0.00 0.12 0.00 0.00 56.93 57.12 2wyl s PHE 214 Cb -0.19 -3.00 0.02 0.00 -0.57 0.00 0.00 43.02 39.29 2wyl s PHE 214 CO -0.05 -0.57 0.22 0.15 -0.10 0.00 0.00 175.22 174.87 2wyl s LYS 215 N 2.50 2.93 0.32 0.44 1.02 0.35 -0.34 119.74 126.96 2wyl s LYS 215 Ca 0.21 -1.02 0.08 0.00 0.02 0.00 0.00 55.97 55.26 2wyl s LYS 215 Cb -0.15 -3.76 -0.04 0.00 -0.52 0.00 0.00 37.83 33.36 2wyl s LYS 215 CO 0.14 -0.67 0.15 0.95 -0.92 0.00 0.00 175.35 175.00 2wyl s THR 216 N 1.59 3.33 -0.54 2.17 -4.23 -0.20 -0.74 115.64 117.02 2wyl s THR 216 Ca 0.03 -1.64 0.19 0.00 -1.18 0.00 0.00 61.69 59.09 2wyl s THR 216 Cb -0.19 -3.04 0.19 0.00 1.34 0.00 0.00 72.50 70.80 2wyl s THR 216 CO 0.07 -0.23 1.57 -2.65 -0.54 0.00 0.00 174.62 172.85 2wyl n PRO 217 N -1.16 0.13 -0.02 3.99 -0.02 -1.26 -2.23 135.00 134.43 2wyl n PRO 217 Ca -0.04 0.47 0.10 0.00 -2.02 0.00 0.00 63.50 62.01 2wyl n PRO 217 Cb 0.60 -1.80 0.09 0.00 -0.02 0.00 0.00 33.50 32.38 2wyl n PRO 217 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wyl n GLY 218 N -0.57 0.69 0.00 -1.23 0.00 -1.26 -4.63 105.19 98.19 2wyl n GLY 218 Ca 0.01 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2wyl n GLY 218 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wyl n GLY 219 N 1.13 1.29 3.33 -0.02 0.00 -0.95 -3.87 105.19 106.11 2wyl n GLY 219 Ca 0.12 -1.75 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2wyl n GLY 219 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wyl s SER 220 N 0.00 3.08 -0.13 1.61 1.04 -1.26 -1.03 113.70 117.00 2wyl s SER 220 Ca 0.00 -0.59 0.01 0.00 0.48 0.00 0.00 55.95 55.85 2wyl s SER 220 Cb 0.00 -0.28 0.02 0.00 0.10 0.00 0.00 66.02 65.86 2wyl s SER 220 CO 0.00 0.24 -0.15 -0.22 0.98 0.00 0.00 173.24 174.10 2wyl s LEU 221 N -1.25 1.70 -0.42 2.42 2.96 0.54 -2.18 118.68 122.45 2wyl s LEU 221 Ca 0.11 -0.46 -0.15 0.00 -0.22 0.00 0.00 54.13 53.41 2wyl s LEU 221 Cb -0.10 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.47 2wyl s LEU 221 CO 0.02 -0.03 0.33 -0.47 -1.32 0.00 0.00 176.35 174.88 2wyl s TYR 222 N 1.28 3.23 -0.30 5.38 6.14 0.86 -0.42 117.35 133.51 2wyl s TYR 222 Ca 0.00 -0.58 -0.09 0.00 0.64 0.00 0.00 57.07 57.04 2wyl s TYR 222 Cb -0.14 -2.68 -0.01 0.00 0.42 0.00 0.00 41.96 39.56 2wyl s TYR 222 CO -0.07 -0.62 0.13 -1.58 0.64 0.00 0.00 175.55 174.05 2wyl s HIS 223 N 1.75 3.17 -2.05 4.97 5.65 0.03 -0.72 115.29 128.10 2wyl s HIS 223 Ca 0.06 -0.64 0.21 0.00 0.25 0.00 0.00 55.06 54.95 2wyl s HIS 223 Cb -0.19 -2.33 0.51 0.00 -1.18 0.00 0.00 32.58 29.39 2wyl s HIS 223 CO 0.10 -0.47 1.44 -1.13 -0.65 0.00 0.00 174.74 174.03 2wyl n SER 224 N 4.96 3.62 0.00 9.88 3.41 -1.18 -1.04 113.62 133.27 2wyl n SER 224 Ca -0.14 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.49 2wyl n SER 224 Cb 0.49 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 2wyl n SER 224 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wyl n GLY 225 N 1.46 4.25 2.21 5.00 0.00 -1.26 -2.22 105.19 114.62 2wyl n GLY 225 Ca 0.21 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 46.11 2wyl n GLY 225 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2wyl n ASP 226 N 8.33 4.52 -4.75 1.61 2.03 -1.26 -4.14 116.55 122.89 2wyl n ASP 226 Ca 0.00 -3.58 -0.41 0.00 0.52 0.00 0.00 54.79 51.32 2wyl n ASP 226 Cb 0.00 -0.38 -0.04 0.00 -0.72 0.00 0.00 41.12 39.98 2wyl n ASP 226 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2wyl s SER 227 N -3.59 7.24 0.81 1.67 0.01 -0.94 -4.98 113.70 113.91 2wyl s SER 227 Ca 0.48 2.18 -0.11 0.00 1.31 0.00 0.00 55.95 59.81 2wyl s SER 227 Cb 0.40 -2.61 0.08 0.00 0.21 0.00 0.00 66.02 64.09 2wyl s SER 227 CO -0.02 -0.21 1.09 -1.00 0.41 0.00 0.00 173.24 173.51 2wyl s HIS 228 N -0.58 2.69 0.27 2.43 3.76 -1.20 -4.69 115.29 117.98 2wyl s HIS 228 Ca 0.48 1.28 -0.30 0.00 -0.15 0.00 0.00 55.06 56.37 2wyl s HIS 228 Cb -0.31 -3.09 -0.11 0.00 1.11 0.00 0.00 32.58 30.18 2wyl s HIS 228 CO 0.38 -1.88 1.55 -0.47 -0.85 0.00 0.00 174.74 173.47 2wyl s TYR 229 N -3.04 2.84 0.04 1.40 5.04 -1.26 -4.77 117.35 117.60 2wyl s TYR 229 Ca 0.61 0.83 0.01 0.00 -2.44 0.00 0.00 57.07 56.09 2wyl s TYR 229 Cb -0.16 -4.00 -0.03 0.00 0.35 0.00 0.00 41.96 38.13 2wyl s TYR 229 CO 0.55 -3.35 -0.06 0.45 -1.34 0.00 0.00 175.55 171.80 2wyl s SER 230 N 0.49 0.72 0.60 4.32 0.15 -1.26 -5.01 113.70 113.72 2wyl s SER 230 Ca 0.63 -0.63 0.39 0.00 0.70 0.00 0.00 55.95 57.04 2wyl s SER 230 Cb -0.46 0.07 1.98 0.00 -1.71 0.00 0.00 66.02 65.90 2wyl s SER 230 CO 0.46 -0.29 2.19 0.78 1.20 0.00 0.00 173.24 177.58 2wyl h ASN 231 N 4.24 0.00 0.00 5.45 2.35 -2.02 -2.82 115.58 122.78 2wyl h ASN 231 Ca -0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2wyl h ASN 231 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2wyl h ASN 231 CO 0.46 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 175.02 2wyl n TYR 232 N -3.02 0.00 0.10 1.19 4.01 -1.26 -1.98 117.16 116.20 2wyl n TYR 232 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 2wyl n TYR 232 Cb 0.15 0.00 0.31 0.00 -0.31 0.00 0.00 39.34 39.50 2wyl n TYR 232 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 2wyl h TYR 233 N 0.00 0.28 -0.41 -0.72 0.05 -1.85 -2.73 116.97 111.60 2wyl h TYR 233 Ca 0.00 -0.05 -0.06 0.00 0.05 0.00 0.00 58.73 58.67 2wyl h TYR 233 Cb 0.00 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 37.65 2wyl h TYR 233 CO 0.00 0.49 0.01 0.00 -1.05 0.00 0.00 178.16 177.61 2wyl h ALA 234 N 1.52 1.26 -0.11 3.88 0.00 -1.47 -0.38 119.26 123.96 2wyl h ALA 234 Ca 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2wyl h ALA 234 Cb 0.56 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wyl h ALA 234 CO 0.04 0.50 0.04 -0.22 0.00 0.00 0.00 179.25 179.61 2wyl h LYS 235 N 0.62 0.16 0.00 0.00 3.64 -1.64 0.59 116.57 119.93 2wyl h LYS 235 Ca 0.13 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 2wyl h LYS 235 Cb 0.37 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2wyl h LYS 235 CO 0.01 0.28 -0.38 0.45 -2.27 0.00 0.00 179.45 177.54 2wyl h HIS 236 N 0.01 0.00 -0.21 1.91 3.86 -1.37 -1.44 115.15 117.91 2wyl h HIS 236 Ca 0.04 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 59.07 2wyl h HIS 236 Cb 0.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.65 2wyl h HIS 236 CO -0.01 0.38 -0.57 0.78 0.86 0.00 0.00 177.93 179.37 2wyl h GLY 237 N 1.32 0.72 0.84 2.45 0.00 -0.81 -2.06 103.07 105.53 2wyl h GLY 237 Ca -0.00 -0.85 -0.08 0.00 0.00 0.00 0.00 47.33 46.39 2wyl h GLY 237 CO 0.05 0.77 -0.17 3.43 0.00 0.00 0.00 176.54 180.61 2wyl h ASN 238 N 0.50 0.53 1.43 0.19 2.35 -0.64 -3.35 115.58 116.59 2wyl h ASN 238 Ca 0.01 -0.45 -0.06 0.00 -0.55 0.00 0.00 56.30 55.24 2wyl h ASN 238 Cb 1.14 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.35 2wyl h ASN 238 CO 0.11 0.87 -0.59 -0.33 -1.65 0.00 0.00 177.43 175.85 2wyl h GLU 239 N 0.20 0.00 -5.22 0.81 5.08 -1.32 -3.47 114.58 110.66 2wyl h GLU 239 Ca 0.04 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 58.01 2wyl h GLU 239 Cb 0.70 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.74 2wyl h GLU 239 CO 0.05 0.21 -0.77 -1.01 -1.00 0.00 0.00 179.01 176.49 2wyl s HIS 240 N -3.11 1.14 -0.39 4.33 3.76 -0.78 -5.08 115.29 115.16 2wyl s HIS 240 Ca 0.03 -0.48 -0.24 0.00 -0.15 0.00 0.00 55.06 54.22 2wyl s HIS 240 Cb 0.07 -0.64 0.02 0.00 1.11 0.00 0.00 32.58 33.14 2wyl s HIS 240 CO 0.74 0.04 0.84 -1.14 -0.85 0.00 0.00 174.74 174.37 2wyl s GLN 241 N -1.82 3.70 -0.16 1.40 0.74 -1.26 -4.60 119.66 117.66 2wyl s GLN 241 Ca -0.02 0.31 -0.01 0.00 0.05 0.00 0.00 55.36 55.69 2wyl s GLN 241 Cb -0.09 -3.84 -0.01 0.00 1.10 0.00 0.00 33.01 30.17 2wyl s GLN 241 CO 0.02 -0.96 -0.13 0.42 -0.55 0.00 0.00 175.29 174.09 2wyl s ILE 242 N 3.31 2.88 -0.13 -2.34 1.01 -1.26 -4.78 121.20 119.88 2wyl s ILE 242 Ca 0.34 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 60.17 2wyl s ILE 242 Cb -0.12 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 2wyl s ILE 242 CO 0.19 0.50 -0.23 0.47 0.00 0.00 0.00 174.94 175.87 2wyl n ASP 243 N 4.01 1.49 -4.46 3.58 8.00 -1.20 -3.84 116.55 124.13 2wyl n ASP 243 Ca -0.19 0.35 -0.34 0.00 0.71 0.00 0.00 54.79 55.32 2wyl n ASP 243 Cb 0.52 -0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 40.77 2wyl n ASP 243 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wyl s VAL 244 N -2.34 3.71 -0.11 2.53 1.01 -0.93 -1.10 120.40 123.17 2wyl s VAL 244 Ca -0.19 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2wyl s VAL 244 Cb 0.03 -2.62 -0.00 0.00 0.00 0.00 0.00 36.38 33.78 2wyl s VAL 244 CO 0.29 0.49 -0.21 0.00 0.00 0.00 0.00 175.10 175.67 2wyl s ALA 245 N 0.49 2.30 -0.18 5.51 0.00 -0.30 -0.10 121.76 129.47 2wyl s ALA 245 Ca -0.04 -0.95 -0.03 0.00 0.00 0.00 0.00 51.96 50.93 2wyl s ALA 245 Cb -0.15 -0.93 -0.02 0.00 0.00 0.00 0.00 23.12 22.03 2wyl s ALA 245 CO 0.03 0.27 -0.05 -0.51 0.00 0.00 0.00 175.76 175.50 2wyl s LEU 246 N 0.36 3.03 -0.01 0.00 1.43 0.10 -0.86 118.68 122.74 2wyl s LEU 246 Ca -0.16 -0.27 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 2wyl s LEU 246 Cb -0.17 -1.75 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 2wyl s LEU 246 CO 0.08 0.08 -0.17 -0.83 0.23 0.00 0.00 176.35 175.74 2wyl s GLY 247 N 0.86 0.82 -0.50 -3.19 0.00 -1.04 -3.07 107.32 101.20 2wyl s GLY 247 Ca -0.01 -0.71 -0.27 0.00 0.00 0.00 0.00 44.72 43.72 2wyl s GLY 247 CO 0.01 -0.58 1.83 -0.56 0.00 0.00 0.00 173.10 173.80 2wyl s SER 248 N -0.36 5.53 0.18 1.64 0.01 -1.26 -1.65 113.70 117.79 2wyl s SER 248 Ca 0.06 0.72 0.04 0.00 1.31 0.00 0.00 55.95 58.08 2wyl s SER 248 Cb -0.07 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 2wyl s SER 248 CO -0.00 -2.10 0.28 -0.47 0.41 0.00 0.00 173.24 171.35 2wyl s TYR 249 N 8.19 3.39 0.00 2.43 5.04 0.60 -4.77 117.35 132.23 2wyl s TYR 249 Ca 0.72 0.04 0.00 0.00 -2.44 0.00 0.00 57.07 55.39 2wyl s TYR 249 Cb -0.16 -1.59 0.00 0.00 0.35 0.00 0.00 41.96 40.55 2wyl s TYR 249 CO 0.26 0.50 0.00 0.41 -1.34 0.00 0.00 175.55 175.38 2wyl n GLY 250 N -0.81 1.93 3.42 8.97 0.00 -1.26 -2.37 105.19 115.07 2wyl n GLY 250 Ca -0.08 -0.72 -0.44 0.00 0.00 0.00 0.00 46.02 44.78 2wyl n GLY 250 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wyl s GLU 251 N -2.00 3.11 0.16 1.61 2.56 -0.82 -4.63 118.70 118.68 2wyl s GLU 251 Ca 0.00 -1.10 -0.31 0.00 0.00 0.00 0.00 54.97 53.56 2wyl s GLU 251 Cb 0.00 -4.28 -0.10 0.00 2.00 0.00 0.00 34.13 31.75 2wyl s GLU 251 CO 0.00 -1.70 1.54 -0.80 -0.56 0.00 0.00 175.26 173.74 2wyl s ASN 252 N 3.65 6.62 0.77 -1.70 0.01 -1.26 -4.40 114.94 118.63 2wyl s ASN 252 Ca 0.18 2.58 -0.12 0.00 -0.71 0.00 0.00 52.86 54.79 2wyl s ASN 252 Cb -0.19 -2.59 0.06 0.00 0.41 0.00 0.00 41.25 38.93 2wyl s ASN 252 CO 0.07 -0.80 1.12 -2.84 -1.51 0.00 0.00 177.10 173.15 2wyl s PRO 253 N 1.08 2.11 0.01 -0.60 0.02 -1.26 -4.89 135.00 131.46 2wyl s PRO 253 Ca 0.69 1.37 -0.33 0.00 0.02 0.00 0.00 61.00 62.75 2wyl s PRO 253 Cb -0.43 -1.87 -0.11 0.00 0.02 0.00 0.00 34.50 32.12 2wyl s PRO 253 CO 0.31 -1.79 1.87 -2.13 -0.33 0.00 0.00 177.00 174.94 2wyl n ARG 254 N -3.33 2.46 -0.49 5.54 0.63 -1.26 -1.32 116.66 118.90 2wyl n ARG 254 Ca 0.10 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.93 2wyl n ARG 254 Cb 0.52 -2.78 0.00 0.00 0.45 0.00 0.00 32.46 30.66 2wyl n ARG 254 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wyl n GLY 255 N 4.31 0.75 3.07 5.14 0.00 -1.26 -5.07 105.19 112.14 2wyl n GLY 255 Ca 0.21 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 2wyl n GLY 255 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wyl s ILE 256 N -2.00 1.01 -0.36 -0.61 -1.09 -0.43 -5.10 121.20 112.62 2wyl s ILE 256 Ca 0.00 -0.52 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 2wyl s ILE 256 Cb 0.00 -0.86 0.11 0.00 -1.58 0.00 0.00 42.46 40.13 2wyl s ILE 256 CO 0.00 0.29 0.15 -0.89 -1.23 0.00 0.00 174.94 173.26 2wyl s THR 257 N -0.11 1.04 0.00 2.92 2.01 -1.26 -4.44 115.64 115.80 2wyl s THR 257 Ca 0.01 -1.82 0.00 0.00 0.31 0.00 0.00 61.69 60.19 2wyl s THR 257 Cb -0.07 -1.76 0.00 0.00 0.01 0.00 0.00 72.50 70.68 2wyl s THR 257 CO 0.00 -0.77 0.00 -0.67 -0.69 0.00 0.00 174.62 172.49 2wyl n ASP 258 N 4.35 3.61 0.00 3.53 2.03 -1.26 -5.03 116.55 123.78 2wyl n ASP 258 Ca 0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.34 2wyl n ASP 258 Cb 0.39 0.40 0.00 0.00 -0.72 0.00 0.00 41.12 41.19 2wyl n ASP 258 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2wyl n LYS 259 N -1.53 0.22 -4.59 -0.67 4.76 -1.26 -4.80 118.16 110.29 2wyl n LYS 259 Ca 0.00 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.17 2wyl n LYS 259 Cb 0.32 0.00 -0.08 0.00 -1.84 0.00 0.00 35.03 33.43 2wyl n LYS 259 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2wyl s THR 261 N 4.00 0.92 0.13 -0.18 -4.23 -1.26 -4.82 115.64 110.19 2wyl s THR 261 Ca 0.00 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 2wyl s THR 261 Cb 0.00 -2.39 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 2wyl s THR 261 CO 0.00 0.00 1.58 0.77 -0.54 0.00 0.00 174.62 176.43 2wyl h SER 262 N 1.70 0.72 -0.28 3.99 4.64 -1.94 -2.97 113.55 119.40 2wyl h SER 262 Ca -0.39 -0.30 -0.07 0.00 -0.47 0.00 0.00 61.79 60.56 2wyl h SER 262 Cb 1.28 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.16 2wyl h SER 262 CO 0.65 0.84 -0.04 0.00 -0.87 0.00 0.00 176.83 177.41 2wyl h ALA 263 N 0.90 1.20 0.00 5.18 0.00 -1.95 -3.11 119.26 121.48 2wyl h ALA 263 Ca 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2wyl h ALA 263 Cb 0.46 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2wyl h ALA 263 CO 0.02 0.52 0.00 -0.25 0.00 0.00 0.00 179.25 179.54 2wyl n ASP 264 N -4.22 0.10 0.00 0.00 9.92 -1.13 -2.18 116.55 119.04 2wyl n ASP 264 Ca 0.02 -0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.20 2wyl n ASP 264 Cb 0.30 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 40.76 2wyl n ASP 264 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2wyl n LEU 266 N 0.94 0.00 -0.96 0.64 4.77 -1.18 -4.66 117.00 116.55 2wyl n LEU 266 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2wyl n LEU 266 Cb 0.02 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2wyl n LEU 266 CO 0.00 0.00 0.18 0.54 -1.33 0.00 0.00 177.39 176.78 2wyl n ARG 267 N 0.00 0.38 0.00 3.23 1.74 -0.93 -2.00 116.66 119.09 2wyl n ARG 267 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2wyl n ARG 267 Cb 0.00 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 2wyl n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wyl n GLY 269 N 0.77 0.00 0.23 -0.13 0.00 -1.26 -1.15 105.19 103.65 2wyl n GLY 269 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2wyl n GLY 269 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wyl h GLU 270 N 0.00 0.75 -0.40 1.61 4.81 -1.75 -1.22 114.58 118.38 2wyl h GLU 270 Ca 0.00 -0.31 -0.08 0.00 -0.13 0.00 0.00 59.36 58.84 2wyl h GLU 270 Cb 0.00 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2wyl h GLU 270 CO 0.00 0.91 -0.07 0.00 -0.73 0.00 0.00 179.01 179.13 2wyl h ALA 271 N 0.82 0.55 0.00 2.92 0.00 -1.41 -3.00 119.26 119.14 2wyl h ALA 271 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2wyl h ALA 271 Cb 0.66 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2wyl h ALA 271 CO 0.04 0.39 0.00 1.28 0.00 0.00 0.00 179.25 180.97 2wyl n LEU 272 N -4.37 0.18 -2.83 0.00 4.77 -1.21 -3.69 117.00 109.86 2wyl n LEU 272 Ca -0.01 0.52 -0.21 0.00 -0.03 0.00 0.00 56.01 56.28 2wyl n LEU 272 Cb 0.34 -0.47 0.02 0.00 -2.33 0.00 0.00 43.42 40.98 2wyl n LEU 272 CO 0.42 -0.10 -0.10 0.59 -1.33 0.00 0.00 177.39 176.87 2wyl n ASN 273 N -1.68 -5.71 -4.79 -1.43 3.02 -0.53 -4.34 115.26 99.80 2wyl n ASN 273 Ca 0.06 -0.18 -0.30 0.00 -0.03 0.00 0.00 54.58 54.13 2wyl n ASN 273 Cb 0.32 -4.67 0.09 0.00 -0.61 0.00 0.00 39.78 34.91 2wyl n ASN 273 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wyl s ALA 274 N -3.08 2.27 -0.17 5.41 0.00 -0.77 -4.66 121.76 120.77 2wyl s ALA 274 Ca 0.20 -0.08 0.19 0.00 0.00 0.00 0.00 51.96 52.27 2wyl s ALA 274 Cb -0.09 -3.15 -0.26 0.00 0.00 0.00 0.00 23.12 19.62 2wyl s ALA 274 CO 0.25 -1.68 0.15 1.63 0.00 0.00 0.00 175.76 176.11 2wyl n LYS 275 N -3.42 0.68 -4.47 0.00 4.76 -0.26 -3.89 118.16 111.57 2wyl n LYS 275 Ca 0.07 -0.04 -0.21 0.00 -2.87 0.00 0.00 58.31 55.27 2wyl n LYS 275 Cb 0.55 -1.53 -0.15 0.00 -1.84 0.00 0.00 35.03 32.06 2wyl n LYS 275 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wyl s VAL 276 N -2.67 0.89 -0.18 -0.18 1.01 -0.58 -1.54 120.40 117.14 2wyl s VAL 276 Ca -0.10 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.46 2wyl s VAL 276 Cb 0.07 -0.77 0.03 0.00 0.00 0.00 0.00 36.38 35.71 2wyl s VAL 276 CO 0.84 0.27 -0.13 -0.69 0.00 0.00 0.00 175.10 175.39 2wyl s VAL 277 N 0.09 1.72 -0.17 2.92 1.01 -0.52 -1.15 120.40 124.30 2wyl s VAL 277 Ca -0.02 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.06 2wyl s VAL 277 Cb -0.08 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.61 2wyl s VAL 277 CO 0.00 0.31 -0.20 -0.63 0.00 0.00 0.00 175.10 174.59 2wyl s ILE 278 N 1.39 2.13 0.36 2.22 1.01 -0.04 -1.18 121.20 127.09 2wyl s ILE 278 Ca 0.01 -0.93 -0.25 0.00 0.00 0.00 0.00 60.65 59.48 2wyl s ILE 278 Cb -0.15 -1.88 -0.10 0.00 0.01 0.00 0.00 42.46 40.34 2wyl s ILE 278 CO -0.10 0.54 0.98 -2.16 0.00 0.00 0.00 174.94 174.20 2wyl s PRO 279 N 1.12 4.42 0.26 2.79 0.04 -1.26 -2.49 135.00 139.90 2wyl s PRO 279 Ca 0.01 1.37 0.04 0.00 0.04 0.00 0.00 61.00 62.46 2wyl s PRO 279 Cb -0.14 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.72 2wyl s PRO 279 CO -0.09 0.12 0.27 1.97 0.04 0.00 0.00 177.00 179.31 2wyl n PHE 280 N 0.25 -0.79 0.00 0.56 -0.00 -0.66 -4.76 117.46 112.06 2wyl n PHE 280 Ca 0.03 -2.11 0.00 0.00 -0.00 0.00 0.00 57.45 55.37 2wyl n PHE 280 Cb 0.50 0.29 0.00 0.00 -0.00 0.00 0.00 39.48 40.27 2wyl n PHE 280 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 2wyl n HIS 281 N -0.49 0.00 0.31 2.97 -0.00 -0.42 -0.29 115.22 117.30 2wyl n HIS 281 Ca 0.05 0.00 0.15 0.00 0.46 0.00 0.00 57.72 58.38 2wyl n HIS 281 Cb 0.47 -0.02 0.55 0.00 -0.12 0.00 0.00 29.99 30.88 2wyl n HIS 281 CO 0.00 0.00 0.00 1.12 0.46 0.00 0.00 176.34 177.92 2wyl h HIS 282 N 0.00 0.00 -0.07 1.57 2.07 -1.76 -3.22 115.15 113.73 2wyl h HIS 282 Ca 0.00 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.37 2wyl h HIS 282 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 2wyl h HIS 282 CO 0.00 0.00 -0.63 0.38 -3.07 0.00 0.00 177.93 174.61 2wyl h ASP 283 N 0.00 0.32 0.25 3.10 2.03 -1.88 -3.39 116.42 116.85 2wyl h ASP 283 Ca 0.00 -0.19 -0.34 0.00 -0.73 0.00 0.00 57.03 55.77 2wyl h ASP 283 Cb 0.58 -0.09 0.03 0.00 -0.83 0.00 0.00 39.33 39.02 2wyl h ASP 283 CO 0.00 0.87 -1.56 -0.29 -1.03 0.00 0.00 179.24 177.22 2wyl h ILE 284 N 0.20 1.18 -3.39 4.15 6.09 -1.91 -3.38 117.51 120.45 2wyl h ILE 284 Ca -0.01 -2.65 -0.65 0.00 -1.37 0.00 0.00 64.86 60.18 2wyl h ILE 284 Cb 1.15 2.97 -0.25 0.00 0.47 0.00 0.00 36.82 41.15 2wyl h ILE 284 CO 0.10 0.83 -0.70 0.26 -3.07 0.00 0.00 178.15 175.56 2wyl s TRP 285 N -2.59 2.97 0.21 2.19 0.23 -1.26 -1.38 118.94 119.30 2wyl s TRP 285 Ca -0.11 -0.67 -0.10 0.00 -2.03 0.00 0.00 56.10 53.19 2wyl s TRP 285 Cb 0.04 -2.04 0.30 0.00 0.03 0.00 0.00 33.47 31.80 2wyl s TRP 285 CO 0.92 -0.34 1.67 0.66 0.96 0.00 0.00 176.95 180.82 2wyl h SER 286 N 7.54 -0.20 0.70 2.95 4.64 -1.60 -0.99 113.55 126.59 2wyl h SER 286 Ca -0.36 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2wyl h SER 286 Cb 1.18 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2wyl h SER 286 CO 0.60 -0.08 0.00 -0.46 -0.87 0.00 0.00 176.83 176.02 2wyl n ASN 287 N -5.24 0.44 -1.09 4.97 6.94 -1.26 -2.44 115.26 117.58 2wyl n ASN 287 Ca 0.09 0.60 0.08 0.00 -0.02 0.00 0.00 54.58 55.33 2wyl n ASN 287 Cb 0.35 -0.70 0.27 0.00 -2.36 0.00 0.00 39.78 37.34 2wyl n ASN 287 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2wyl n PHE 288 N -1.98 1.00 -1.52 -2.53 3.01 -0.39 -4.65 117.46 110.40 2wyl n PHE 288 Ca 0.03 -0.65 -0.60 0.00 1.01 0.00 0.00 57.45 57.24 2wyl n PHE 288 Cb 0.22 -0.19 -0.10 0.00 -0.01 0.00 0.00 39.48 39.41 2wyl n PHE 288 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 2wyl n GLN 289 N 0.48 0.44 -4.34 -1.08 7.27 -1.02 -1.95 117.38 117.18 2wyl n GLN 289 Ca 0.20 0.14 -0.22 0.00 0.07 0.00 0.00 57.00 57.19 2wyl n GLN 289 Cb 0.74 -1.80 -0.13 0.00 2.41 0.00 0.00 30.24 31.46 2wyl n GLN 289 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2wyl s ALA 290 N 4.91 1.51 -0.42 1.69 0.00 -1.26 -4.37 121.76 123.83 2wyl s ALA 290 Ca 1.10 -1.07 -0.18 0.00 0.00 0.00 0.00 51.96 51.81 2wyl s ALA 290 Cb -1.29 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 21.63 2wyl s ALA 290 CO 0.67 0.29 0.48 0.34 0.00 0.00 0.00 175.76 177.55 2wyl s ASP 291 N -1.58 6.23 0.54 0.00 2.15 -1.26 -4.96 116.67 117.80 2wyl s ASP 291 Ca 0.04 -0.55 0.25 0.00 0.43 0.00 0.00 52.55 52.72 2wyl s ASP 291 Cb -0.09 -2.25 1.52 0.00 -0.30 0.00 0.00 42.92 41.80 2wyl s ASP 291 CO 0.03 -0.61 2.15 -0.65 -0.17 0.00 0.00 175.17 175.91 2wyl h PRO 292 N 8.74 0.00 -0.07 4.34 0.11 -2.01 -2.60 132.00 140.52 2wyl h PRO 292 Ca -0.26 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.87 2wyl h PRO 292 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2wyl h PRO 292 CO 0.81 0.07 0.10 1.96 -0.21 0.00 0.00 178.00 180.72 2wyl h GLN 293 N 0.00 0.00 -0.98 1.05 1.08 -2.01 -0.16 115.11 114.09 2wyl h GLN 293 Ca -0.00 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 57.36 2wyl h GLN 293 Cb 0.15 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.49 2wyl h GLN 293 CO 0.01 0.00 0.61 1.49 -0.95 0.00 0.00 178.83 179.99 2wyl h GLU 294 N 0.00 0.76 -0.24 1.46 4.81 -1.89 -1.41 114.58 118.07 2wyl h GLU 294 Ca 0.03 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2wyl h GLU 294 Cb 0.23 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2wyl h GLU 294 CO -0.00 0.50 -0.09 0.82 -0.73 0.00 0.00 179.01 179.51 2wyl h ILE 295 N 0.78 1.30 -0.53 2.32 2.04 -1.23 -3.02 117.51 119.17 2wyl h ILE 295 Ca 0.53 -1.14 0.02 0.00 1.00 0.00 0.00 64.86 65.27 2wyl h ILE 295 Cb 0.79 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 2wyl h ILE 295 CO -0.30 0.35 0.32 -0.09 0.00 0.00 0.00 178.15 178.43 2wyl h ARG 296 N 0.21 0.62 -0.14 2.37 9.65 -1.42 -1.44 114.38 124.24 2wyl h ARG 296 Ca 0.06 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 2wyl h ARG 296 Cb 0.58 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.01 2wyl h ARG 296 CO 0.03 0.41 0.05 0.28 2.80 0.00 0.00 179.97 183.54 2wyl h VAL 297 N 0.64 1.18 -0.82 0.20 2.07 -1.33 -1.47 116.25 116.72 2wyl h VAL 297 Ca 0.21 -0.55 0.01 0.00 0.82 0.00 0.00 66.70 67.19 2wyl h VAL 297 Cb 0.00 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 2wyl h VAL 297 CO -0.09 0.16 0.54 -0.07 0.02 0.00 0.00 177.57 178.14 2wyl h LEU 298 N 0.05 0.95 -0.50 2.57 3.38 -1.46 -2.66 115.31 117.64 2wyl h LEU 298 Ca 0.05 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.03 2wyl h LEU 298 Cb 0.22 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 2wyl h LEU 298 CO -0.00 0.69 0.24 -0.25 0.09 0.00 0.00 178.44 179.21 2wyl h TRP 299 N 1.12 0.44 0.00 1.13 7.01 -1.00 -0.41 115.95 124.23 2wyl h TRP 299 Ca 0.30 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.32 2wyl h TRP 299 Cb -0.12 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 26.82 2wyl h TRP 299 CO -0.01 0.21 0.00 0.39 -2.79 0.00 0.00 178.44 176.24 2wyl n GLU 300 N -4.90 0.05 0.00 2.65 -0.58 -0.57 0.23 120.64 117.51 2wyl n GLU 300 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2wyl n GLU 300 Cb 0.14 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.68 2wyl n GLU 300 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2wyl n LYS 302 N 0.82 0.00 -0.26 3.49 5.02 -0.17 -4.77 118.16 122.29 2wyl n LYS 302 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.30 2wyl n LYS 302 Cb 0.02 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.17 2wyl n LYS 302 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2wyl h LYS 303 N 0.00 0.64 0.12 1.97 2.10 -0.45 -1.11 116.57 119.84 2wyl h LYS 303 Ca 0.00 -0.04 -0.17 0.00 -2.00 0.00 0.00 60.65 58.44 2wyl h LYS 303 Cb 0.00 -0.15 0.02 0.00 -0.90 0.00 0.00 32.23 31.20 2wyl h LYS 303 CO 0.00 0.43 -0.75 -0.44 -2.00 0.00 0.00 179.45 176.68 2wyl h ASP 304 N 0.66 0.45 -0.88 7.07 3.32 -1.86 -0.14 116.42 125.05 2wyl h ASP 304 Ca 0.36 -0.94 0.03 0.00 0.02 0.00 0.00 57.03 56.49 2wyl h ASP 304 Cb 0.34 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 2wyl h ASP 304 CO -0.25 1.36 0.57 -0.09 -1.72 0.00 0.00 179.24 179.11 2wyl h ARG 305 N -0.38 1.10 -0.05 3.56 2.43 -1.93 -2.80 114.38 116.30 2wyl h ARG 305 Ca -0.13 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2wyl h ARG 305 Cb 1.58 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 2wyl h ARG 305 CO 0.14 0.73 0.00 1.28 -1.51 0.00 0.00 179.97 180.61 2wyl n LEU 306 N -4.51 2.77 -3.81 3.80 4.32 -0.43 -4.99 117.00 114.14 2wyl n LEU 306 Ca 0.11 -0.94 -0.23 0.00 -0.02 0.00 0.00 56.01 54.92 2wyl n LEU 306 Cb 0.06 -0.02 0.01 0.00 -1.62 0.00 0.00 43.42 41.86 2wyl n LEU 306 CO 0.35 0.47 -0.14 0.29 -1.22 0.00 0.00 177.39 177.14 2wyl n LYS 307 N 1.15 -4.23 -1.71 3.23 5.02 -0.51 -4.90 118.16 116.22 2wyl n LYS 307 Ca 0.15 0.53 -0.43 0.00 -2.02 0.00 0.00 58.31 56.54 2wyl n LYS 307 Cb 0.56 -4.90 -0.03 0.00 -0.02 0.00 0.00 35.03 30.64 2wyl n LYS 307 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wyl n TYR 308 N -4.33 2.55 -0.38 2.13 4.01 -0.18 -4.90 117.16 116.06 2wyl n TYR 308 Ca -0.31 0.25 0.09 0.00 -0.16 0.00 0.00 57.90 57.78 2wyl n TYR 308 Cb 0.68 -2.57 0.33 0.00 -0.31 0.00 0.00 39.34 37.47 2wyl n TYR 308 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wyl n GLY 309 N 2.80 2.44 3.34 2.72 0.00 -1.26 -4.96 105.19 110.27 2wyl n GLY 309 Ca 0.13 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 2wyl n GLY 309 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wyl s PHE 310 N -1.72 1.61 0.07 1.61 -0.12 -1.25 -4.48 117.98 113.70 2wyl s PHE 310 Ca 0.47 -0.80 0.09 0.00 -0.05 0.00 0.00 56.93 56.64 2wyl s PHE 310 Cb 0.29 -0.89 -0.03 0.00 -0.63 0.00 0.00 43.02 41.76 2wyl s PHE 310 CO 0.24 0.10 -0.24 0.15 -0.05 0.00 0.00 175.22 175.42 2wyl s LYS 311 N -3.78 1.75 0.68 1.99 1.02 -0.59 -4.98 119.74 115.81 2wyl s LYS 311 Ca 0.26 -1.16 -0.11 0.00 0.02 0.00 0.00 55.97 54.98 2wyl s LYS 311 Cb 0.04 -2.01 -0.00 0.00 -0.52 0.00 0.00 37.83 35.33 2wyl s LYS 311 CO 0.08 0.50 1.06 -1.25 -0.92 0.00 0.00 175.35 174.81 2wyl s PRO 312 N -1.60 3.10 -0.13 -1.68 0.04 -1.26 -1.44 135.00 132.04 2wyl s PRO 312 Ca 0.14 0.76 -0.05 0.00 0.04 0.00 0.00 61.00 61.88 2wyl s PRO 312 Cb -0.10 -2.02 0.06 0.00 0.04 0.00 0.00 34.50 32.48 2wyl s PRO 312 CO 0.05 -0.93 0.28 0.12 0.04 0.00 0.00 177.00 176.56 2wyl s PHE 313 N -3.16 -0.44 -0.39 0.56 5.36 -0.32 -4.37 117.98 115.21 2wyl s PHE 313 Ca 0.57 0.99 -0.16 0.00 -0.96 0.00 0.00 56.93 57.37 2wyl s PHE 313 Cb -0.12 0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.60 2wyl s PHE 313 CO 0.54 -0.33 0.36 0.42 -1.46 0.00 0.00 175.22 174.75 2wyl s ILE 314 N 2.06 5.18 0.61 3.12 1.01 -0.16 -4.16 121.20 128.86 2wyl s ILE 314 Ca -0.03 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.29 2wyl s ILE 314 Cb -0.11 -3.92 0.07 0.00 0.01 0.00 0.00 42.46 38.50 2wyl s ILE 314 CO -0.09 -0.27 0.86 0.86 0.00 0.00 0.00 174.94 176.29 2wyl s TRP 315 N 1.93 2.36 0.02 3.97 -0.11 -1.26 -0.64 118.94 125.21 2wyl s TRP 315 Ca 0.09 -0.12 0.04 0.00 1.22 0.00 0.00 56.10 57.33 2wyl s TRP 315 Cb -0.18 -2.82 -0.02 0.00 -1.50 0.00 0.00 33.47 28.96 2wyl s TRP 315 CO 0.12 -1.19 -0.11 -0.65 -4.62 0.00 0.00 176.95 170.50 2wyl s GLN 316 N -4.90 0.81 0.23 5.86 -1.52 -1.26 -4.87 119.66 114.01 2wyl s GLN 316 Ca 0.61 -0.59 -0.31 0.00 -1.95 0.00 0.00 55.36 53.11 2wyl s GLN 316 Cb -0.08 -0.77 -0.12 0.00 -0.22 0.00 0.00 33.01 31.82 2wyl s GLN 316 CO 0.41 0.20 1.67 0.08 -0.25 0.00 0.00 175.29 177.40 2wyl s VAL 317 N -0.67 2.06 0.00 1.09 1.01 -1.26 -1.00 120.40 121.63 2wyl s VAL 317 Ca 0.01 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2wyl s VAL 317 Cb -0.06 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2wyl s VAL 317 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2wyl n GLY 318 N 3.36 2.18 3.81 4.51 0.00 0.14 -5.02 105.19 114.16 2wyl n GLY 318 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 2wyl n GLY 318 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wyl s GLY 319 N -2.17 2.38 0.08 -0.02 0.00 -0.17 -4.74 107.32 102.67 2wyl s GLY 319 Ca 0.00 0.48 -0.12 0.00 0.00 0.00 0.00 44.72 45.08 2wyl s GLY 319 CO 0.00 0.78 0.44 1.25 0.00 0.00 0.00 173.10 175.57 2wyl s LYS 320 N -3.43 3.84 -0.00 2.90 2.20 -1.26 -2.55 119.74 121.44 2wyl s LYS 320 Ca 0.64 0.30 0.07 0.00 -0.36 0.00 0.00 55.97 56.62 2wyl s LYS 320 Cb -0.14 -3.02 -0.02 0.00 -1.51 0.00 0.00 37.83 33.14 2wyl s LYS 320 CO 0.22 0.57 -0.21 0.12 -0.36 0.00 0.00 175.35 175.68 2wyl s PHE 321 N -1.35 1.90 -0.19 4.03 2.19 -1.26 -5.00 117.98 118.29 2wyl s PHE 321 Ca 0.32 -0.36 0.00 0.00 0.33 0.00 0.00 56.93 57.23 2wyl s PHE 321 Cb -0.15 -1.21 0.04 0.00 -1.31 0.00 0.00 43.02 40.40 2wyl s PHE 321 CO 0.17 -0.01 -0.08 0.99 1.83 0.00 0.00 175.22 178.12 2wyl s THR 322 N -0.56 1.48 0.14 0.12 2.01 -1.26 -4.47 115.64 113.10 2wyl s THR 322 Ca 0.08 -0.92 -0.24 0.00 0.31 0.00 0.00 61.69 60.93 2wyl s THR 322 Cb -0.08 -1.60 -0.07 0.00 0.01 0.00 0.00 72.50 70.75 2wyl s THR 322 CO -0.00 0.13 0.74 0.86 -0.69 0.00 0.00 174.62 175.66 2wyl s TRP 323 N 1.47 3.87 -2.19 4.92 -0.11 -1.02 -1.13 118.94 124.75 2wyl s TRP 323 Ca -0.01 1.55 0.20 0.00 1.22 0.00 0.00 56.10 59.06 2wyl s TRP 323 Cb -0.16 -2.72 0.53 0.00 -1.50 0.00 0.00 33.47 29.62 2wyl s TRP 323 CO -0.08 0.51 1.45 -0.35 -4.62 0.00 0.00 176.95 173.85 2wyl n PRO 324 N 1.74 2.33 -0.28 5.86 -0.04 -1.26 -2.63 135.00 140.71 2wyl n PRO 324 Ca -0.06 -2.05 0.06 0.00 -0.04 0.00 0.00 63.50 61.41 2wyl n PRO 324 Cb 0.49 -1.47 0.27 0.00 -0.04 0.00 0.00 33.50 32.76 2wyl n PRO 324 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2wyl h LEU 325 N 3.62 0.84 -2.61 1.53 4.07 -1.84 -2.56 115.31 118.36 2wyl h LEU 325 Ca 0.00 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.97 2wyl h LEU 325 Cb 0.81 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.39 2wyl h LEU 325 CO 0.00 0.52 0.00 0.47 -1.08 0.00 0.00 178.44 178.35 2wyl n ASP 326 N -4.51 3.81 0.14 -0.43 8.00 -0.28 -4.60 116.55 118.69 2wyl n ASP 326 Ca 0.14 -2.00 0.12 0.00 0.71 0.00 0.00 54.79 53.76 2wyl n ASP 326 Cb 0.25 -0.44 0.53 0.00 -0.02 0.00 0.00 41.12 41.43 2wyl n ASP 326 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2wyl n LYS 327 N 1.60 0.18 -0.05 -1.24 2.85 -0.97 -1.99 118.16 118.55 2wyl n LYS 327 Ca 0.23 0.51 0.03 0.00 -1.05 0.00 0.00 58.31 58.03 2wyl n LYS 327 Cb 0.61 -1.91 0.05 0.00 -0.65 0.00 0.00 35.03 33.14 2wyl n LYS 327 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2wyl n ASP 328 N -2.25 2.03 0.22 -5.58 8.00 -1.26 -4.69 116.55 113.02 2wyl n ASP 328 Ca 0.01 -1.67 0.09 0.00 0.71 0.00 0.00 54.79 53.93 2wyl n ASP 328 Cb 0.16 -0.07 0.49 0.00 -0.02 0.00 0.00 41.12 41.68 2wyl n ASP 328 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 2wyl h ASN 329 N 1.06 0.00 0.00 -2.24 4.21 -1.72 -3.47 115.58 113.42 2wyl h ASN 329 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2wyl h ASN 329 Cb 0.45 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.65 2wyl h ASN 329 CO 0.00 0.25 0.00 0.49 -1.29 0.00 0.00 177.43 176.88 2wyl n PHE 330 N -3.55 0.00 -4.04 1.19 3.72 -1.26 -4.77 117.46 108.75 2wyl n PHE 330 Ca -0.01 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.22 2wyl n PHE 330 Cb 0.40 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.78 2wyl n PHE 330 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2wyl s GLU 331 N 0.00 0.46 0.39 -1.08 2.02 -1.26 -0.99 118.70 118.23 2wyl s GLU 331 Ca 0.00 -0.03 -0.23 0.00 0.02 0.00 0.00 54.97 54.73 2wyl s GLU 331 Cb 0.00 -0.54 -0.10 0.00 0.10 0.00 0.00 34.13 33.59 2wyl s GLU 331 CO 0.00 -0.07 0.97 -0.47 0.02 0.00 0.00 175.26 175.72 2wyl s TYR 332 N 0.73 3.42 -0.01 1.61 5.04 0.19 -4.95 117.35 123.38 2wyl s TYR 332 Ca -0.08 1.68 0.02 0.00 -2.44 0.00 0.00 57.07 56.24 2wyl s TYR 332 Cb -0.11 -2.95 -0.00 0.00 0.35 0.00 0.00 41.96 39.25 2wyl s TYR 332 CO -0.01 -0.14 -0.05 -1.58 -1.34 0.00 0.00 175.55 172.43 2wyl s HIS 333 N -1.86 0.51 0.56 4.97 5.65 -1.26 -4.84 115.29 119.02 2wyl s HIS 333 Ca 0.57 -0.10 -0.21 0.00 0.25 0.00 0.00 55.06 55.57 2wyl s HIS 333 Cb -0.16 -0.35 -0.04 0.00 -1.18 0.00 0.00 32.58 30.85 2wyl s HIS 333 CO 0.20 -0.03 1.35 0.71 -0.65 0.00 0.00 174.74 176.32 2wyl s TYR 334 N -0.00 2.25 0.04 3.88 2.02 -1.26 -4.91 117.35 119.35 2wyl s TYR 334 Ca 0.01 1.39 -0.37 0.00 -0.37 0.00 0.00 57.07 57.72 2wyl s TYR 334 Cb -0.04 -3.79 -0.17 0.00 -0.40 0.00 0.00 41.96 37.57 2wyl s TYR 334 CO -0.00 -2.91 1.39 -2.30 -1.57 0.00 0.00 175.55 170.16 2wyl n PRO 335 N -1.17 1.14 -0.05 -1.71 -0.02 -1.26 -4.90 135.00 127.03 2wyl n PRO 335 Ca 0.11 0.41 -0.10 0.00 -2.02 0.00 0.00 63.50 61.91 2wyl n PRO 335 Cb 0.45 -2.06 -0.15 0.00 -0.02 0.00 0.00 33.50 31.73 2wyl n PRO 335 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wyl n ARG 336 N 2.91 0.66 0.00 -0.52 1.74 -1.26 -5.09 116.66 115.09 2wyl n ARG 336 Ca 0.19 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 2wyl n ARG 336 Cb 0.18 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 2wyl n ARG 336 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wyl n GLY 337 N 1.65 -0.84 0.00 -0.13 0.00 -1.26 -5.34 105.19 99.27 2wyl n GLY 337 Ca -0.23 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.61 2wyl n GLY 337 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01