#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4k s VAL 3 N 0.00 4.59 0.78 12.58 -7.23 -1.26 -5.12 120.40 124.75 2w4k s VAL 3 Ca 0.00 -0.10 -0.03 0.00 -1.81 0.00 0.00 61.98 60.03 2w4k s VAL 3 Cb 0.00 -3.07 0.15 0.00 0.56 0.00 0.00 36.38 34.02 2w4k s VAL 3 CO 0.00 0.45 1.07 -0.36 -0.31 0.00 0.00 175.10 175.95 2w4k s PHE 4 N 0.51 1.41 0.25 2.82 0.08 -1.26 -5.03 117.98 116.75 2w4k s PHE 4 Ca 0.02 -0.23 -0.31 0.00 0.12 0.00 0.00 56.93 56.53 2w4k s PHE 4 Cb -0.13 -3.21 -0.12 0.00 -0.57 0.00 0.00 43.02 38.99 2w4k s PHE 4 CO 0.01 -1.97 1.61 0.54 -0.10 0.00 0.00 175.22 175.31 2w4k n ARG 5 N -3.04 2.58 0.00 0.44 1.74 -0.47 -4.67 116.66 113.24 2w4k n ARG 5 Ca 0.16 0.92 0.11 0.00 -0.77 0.00 0.00 57.85 58.27 2w4k n ARG 5 Cb 0.60 -2.71 0.06 0.00 -1.02 0.00 0.00 32.46 29.39 2w4k n ARG 5 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2w4k n GLN 6 N 2.85 0.51 -1.44 5.56 1.13 -1.26 -0.70 117.38 124.03 2w4k n GLN 6 Ca 0.12 -0.39 -0.31 0.00 -1.94 0.00 0.00 57.00 54.48 2w4k n GLN 6 Cb 0.35 -1.49 0.08 0.00 0.11 0.00 0.00 30.24 29.28 2w4k n GLN 6 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2w4k s GLU 7 N -2.76 2.41 -0.11 -1.09 8.01 -1.26 -4.90 118.70 119.01 2w4k s GLU 7 Ca 0.14 0.94 -0.29 0.00 0.01 0.00 0.00 54.97 55.77 2w4k s GLU 7 Cb 0.17 -1.93 -0.05 0.00 -4.31 0.00 0.00 34.13 28.01 2w4k s GLU 7 CO 0.69 -1.47 1.77 1.21 0.01 0.00 0.00 175.26 177.48 2w4k s ASN 8 N -3.67 6.39 0.49 -0.19 3.84 -1.26 -4.71 114.94 115.83 2w4k s ASN 8 Ca 0.60 2.10 0.24 0.00 0.21 0.00 0.00 52.86 56.01 2w4k s ASN 8 Cb -0.15 -2.53 1.30 0.00 -0.55 0.00 0.00 41.25 39.32 2w4k s ASN 8 CO 0.55 -1.18 1.92 1.62 -2.79 0.00 0.00 177.10 177.22 2w4k h VAL 9 N 5.95 0.67 0.00 -5.21 3.04 -1.95 0.45 116.25 119.20 2w4k h VAL 9 Ca -0.40 -0.05 -0.01 0.00 -1.01 0.00 0.00 66.70 65.23 2w4k h VAL 9 Cb 1.19 0.50 -0.00 0.00 -2.01 0.00 0.00 31.29 30.97 2w4k h VAL 9 CO 0.97 0.03 -0.04 0.44 -1.01 0.00 0.00 177.57 177.95 2w4k h ASP 10 N 0.16 0.00 0.45 3.17 3.32 -1.90 0.35 116.42 121.98 2w4k h ASP 10 Ca 0.38 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.38 2w4k h ASP 10 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2w4k h ASP 10 CO -0.06 0.04 -0.22 0.44 -1.72 0.00 0.00 179.24 177.72 2w4k h ASP 11 N 0.00 0.00 0.00 6.45 3.32 -1.29 -3.34 116.42 121.57 2w4k h ASP 11 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2w4k h ASP 11 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2w4k h ASP 11 CO 0.01 0.22 -1.28 -1.22 -1.72 0.00 0.00 179.24 175.25 2w4k n TYR 12 N -3.78 0.00 -4.20 4.55 4.01 -0.04 -4.96 117.16 112.74 2w4k n TYR 12 Ca -0.02 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.56 2w4k n TYR 12 Cb 0.33 -0.19 -0.13 0.00 -0.31 0.00 0.00 39.34 39.04 2w4k n TYR 12 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2w4k s TYR 13 N -2.57 0.88 -0.14 -0.72 2.02 -0.33 -0.25 117.35 116.24 2w4k s TYR 13 Ca -0.02 -0.36 -0.14 0.00 -0.37 0.00 0.00 57.07 56.18 2w4k s TYR 13 Cb 0.07 -0.53 -0.05 0.00 -0.40 0.00 0.00 41.96 41.06 2w4k s TYR 13 CO 0.43 -0.01 0.30 -0.51 -1.57 0.00 0.00 175.55 174.19 2w4k s ASP 14 N -1.13 6.48 -0.05 2.29 1.01 -0.19 -4.40 116.67 120.67 2w4k s ASP 14 Ca -0.03 0.56 -0.12 0.00 0.71 0.00 0.00 52.55 53.67 2w4k s ASP 14 Cb -0.08 -2.19 -0.05 0.00 1.01 0.00 0.00 42.92 41.62 2w4k s ASP 14 CO 0.01 0.13 0.31 -0.89 0.21 0.00 0.00 175.17 174.94 2w4k s THR 15 N 0.24 5.21 0.00 -1.27 2.01 -1.26 -0.36 115.64 120.22 2w4k s THR 15 Ca 0.17 0.61 0.00 0.00 0.31 0.00 0.00 61.69 62.78 2w4k s THR 15 Cb -0.13 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.78 2w4k s THR 15 CO 0.05 0.58 0.00 0.61 -0.69 0.00 0.00 174.62 175.17 2w4k n GLY 16 N 1.98 4.98 3.79 4.40 0.00 0.21 -4.96 105.19 115.58 2w4k n GLY 16 Ca -0.16 -1.74 -0.33 0.00 0.00 0.00 0.00 46.02 43.79 2w4k n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2w4k s GLU 17 N 3.06 2.94 0.13 1.61 1.03 -1.26 -4.43 118.70 121.78 2w4k s GLU 17 Ca 0.00 1.27 -0.31 0.00 0.03 0.00 0.00 54.97 55.96 2w4k s GLU 17 Cb 0.00 -1.98 -0.10 0.00 -0.80 0.00 0.00 34.13 31.26 2w4k s GLU 17 CO 0.00 -1.12 1.61 -2.00 -1.33 0.00 0.00 175.26 172.42 2w4k s GLU 18 N -4.23 4.20 -0.05 -4.83 2.12 -1.26 -0.69 118.70 113.97 2w4k s GLU 18 Ca 0.65 2.37 0.16 0.00 0.36 0.00 0.00 54.97 58.50 2w4k s GLU 18 Cb -0.18 -3.32 -0.21 0.00 0.26 0.00 0.00 34.13 30.68 2w4k s GLU 18 CO 0.42 -0.66 0.56 1.28 -0.54 0.00 0.00 175.26 176.32 2w4k n LEU 19 N 4.59 0.59 0.00 2.70 4.77 0.21 -4.88 117.00 124.97 2w4k n LEU 19 Ca 0.15 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2w4k n LEU 19 Cb 0.39 0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2w4k n LEU 19 CO 0.62 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2w4k n GLY 20 N 1.53 -1.50 3.44 -0.72 0.00 -1.06 -5.00 105.19 101.86 2w4k n GLY 20 Ca -0.17 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 2w4k n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w4k s SER 21 N -1.02 -0.33 0.18 1.61 1.04 -1.26 -0.75 113.70 113.16 2w4k s SER 21 Ca 0.00 -0.30 0.03 0.00 0.48 0.00 0.00 55.95 56.15 2w4k s SER 21 Cb 0.00 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 2w4k s SER 21 CO 0.00 -0.97 0.10 0.61 0.98 0.00 0.00 173.24 173.95 2w4k n GLY 22 N -0.32 3.61 0.22 7.32 0.00 0.69 -4.98 105.19 111.73 2w4k n GLY 22 Ca -0.14 -1.91 -0.00 0.00 0.00 0.00 0.00 46.02 43.97 2w4k n GLY 22 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2w4k h GLN 23 N 0.00 0.30 0.00 1.61 4.15 -2.02 -3.11 115.11 116.04 2w4k h GLN 23 Ca -0.14 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 2w4k h GLN 23 Cb 0.58 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.15 2w4k h GLN 23 CO 0.21 0.20 -0.43 1.19 -1.93 0.00 0.00 178.83 178.07 2w4k n PHE 24 N -5.07 0.00 -3.80 3.99 3.72 -1.26 -5.05 117.46 109.99 2w4k n PHE 24 Ca 0.08 -1.09 -0.12 0.00 -0.05 0.00 0.00 57.45 56.26 2w4k n PHE 24 Cb 0.28 -0.19 -0.11 0.00 -0.94 0.00 0.00 39.48 38.53 2w4k n PHE 24 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2w4k s ALA 25 N -2.42 -0.58 -0.03 4.37 0.00 -1.18 -0.86 121.76 121.07 2w4k s ALA 25 Ca 0.33 0.43 0.06 0.00 0.00 0.00 0.00 51.96 52.77 2w4k s ALA 25 Cb 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 2w4k s ALA 25 CO -0.05 -0.17 -0.21 0.08 0.00 0.00 0.00 175.76 175.41 2w4k s VAL 26 N -0.54 1.71 -0.15 0.00 1.01 -0.74 -0.23 120.40 121.46 2w4k s VAL 26 Ca -0.06 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.01 2w4k s VAL 26 Cb -0.04 -1.43 -0.00 0.00 0.00 0.00 0.00 36.38 34.91 2w4k s VAL 26 CO 0.01 0.48 -0.15 -0.69 0.00 0.00 0.00 175.10 174.76 2w4k s VAL 27 N -0.37 2.70 0.06 2.92 1.01 0.07 -0.39 120.40 126.41 2w4k s VAL 27 Ca 0.05 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.34 2w4k s VAL 27 Cb -0.10 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 2w4k s VAL 27 CO 0.00 0.51 -0.19 -0.54 0.00 0.00 0.00 175.10 174.88 2w4k s LYS 28 N 0.80 1.20 0.44 2.72 1.02 -0.11 0.66 119.74 126.47 2w4k s LYS 28 Ca -0.05 -0.98 -0.24 0.00 0.02 0.00 0.00 55.97 54.72 2w4k s LYS 28 Cb -0.15 -1.34 -0.08 0.00 -0.52 0.00 0.00 37.83 35.74 2w4k s LYS 28 CO 0.00 0.33 1.23 0.21 -0.92 0.00 0.00 175.35 176.20 2w4k s LYS 29 N -1.42 3.81 0.09 1.68 2.20 0.13 0.21 119.74 126.44 2w4k s LYS 29 Ca 0.06 1.95 -0.13 0.00 -0.36 0.00 0.00 55.97 57.49 2w4k s LYS 29 Cb -0.09 -2.55 0.02 0.00 -1.51 0.00 0.00 37.83 33.69 2w4k s LYS 29 CO 0.02 -0.56 0.30 0.00 -0.36 0.00 0.00 175.35 174.76 2w4k s ARG 31 N -3.45 2.19 -0.05 0.00 3.52 0.52 -0.68 118.95 121.00 2w4k s ARG 31 Ca 0.01 -0.52 -0.30 0.00 -0.13 0.00 0.00 55.73 54.79 2w4k s ARG 31 Cb 0.02 -2.00 -0.05 0.00 -1.56 0.00 0.00 34.95 31.36 2w4k s ARG 31 CO -0.09 -0.20 1.43 -2.00 -0.81 0.00 0.00 175.30 173.62 2w4k s GLU 32 N 1.41 4.25 0.23 5.12 2.12 0.33 -1.02 118.70 131.14 2w4k s GLU 32 Ca 0.03 1.95 -0.04 0.00 0.36 0.00 0.00 54.97 57.26 2w4k s GLU 32 Cb -0.13 -3.71 0.23 0.00 0.26 0.00 0.00 34.13 30.78 2w4k s GLU 32 CO -0.09 -0.67 1.71 0.87 -0.54 0.00 0.00 175.26 176.55 2w4k h LYS 33 N 8.31 0.89 0.00 4.30 1.57 -0.95 0.28 116.57 130.98 2w4k h LYS 33 Ca -0.36 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.09 2w4k h LYS 33 Cb 1.16 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 2w4k h LYS 33 CO 0.93 0.89 -0.36 0.66 -0.57 0.00 0.00 179.45 181.00 2w4k h SER 34 N 0.83 0.00 0.00 0.86 4.64 -1.92 -3.33 113.55 114.63 2w4k h SER 34 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2w4k h SER 34 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2w4k h SER 34 CO 0.02 0.36 -0.96 0.35 -0.87 0.00 0.00 176.83 175.74 2w4k n THR 35 N -3.78 0.00 -0.97 2.95 -2.24 -1.14 -5.00 114.28 104.10 2w4k n THR 35 Ca -0.01 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2w4k n THR 35 Cb 0.44 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 2w4k n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2w4k n GLY 36 N 2.16 0.30 3.85 3.38 0.00 0.97 -5.01 105.19 110.85 2w4k n GLY 36 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2w4k n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w4k s LEU 37 N 0.00 4.10 -0.01 0.99 1.43 -1.24 -4.75 118.68 119.20 2w4k s LEU 37 Ca 0.00 1.27 -0.10 0.00 -1.03 0.00 0.00 54.13 54.27 2w4k s LEU 37 Cb 0.00 -3.99 -0.05 0.00 0.03 0.00 0.00 46.19 42.18 2w4k s LEU 37 CO 0.00 -0.17 0.31 -1.10 0.23 0.00 0.00 176.35 175.62 2w4k s GLN 38 N -2.85 3.69 0.33 1.70 -0.21 -1.26 -0.51 119.66 120.55 2w4k s GLN 38 Ca 0.52 0.12 0.05 0.00 0.02 0.00 0.00 55.36 56.08 2w4k s GLN 38 Cb -0.11 -3.14 -0.03 0.00 1.00 0.00 0.00 33.01 30.73 2w4k s GLN 38 CO 0.18 0.68 0.22 0.71 -2.12 0.00 0.00 175.29 174.96 2w4k s TYR 39 N -1.17 1.68 -0.17 0.91 2.02 0.14 -4.39 117.35 116.36 2w4k s TYR 39 Ca 0.24 -1.53 -0.01 0.00 -0.37 0.00 0.00 57.07 55.40 2w4k s TYR 39 Cb -0.14 -0.80 0.00 0.00 -0.40 0.00 0.00 41.96 40.62 2w4k s TYR 39 CO 0.12 -0.70 -0.14 0.00 -1.57 0.00 0.00 175.55 173.27 2w4k s ALA 40 N -3.50 2.54 -0.30 3.71 0.00 0.58 -1.74 121.76 123.05 2w4k s ALA 40 Ca 0.37 -1.10 -0.15 0.00 0.00 0.00 0.00 51.96 51.08 2w4k s ALA 40 Cb 0.03 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 2w4k s ALA 40 CO 0.22 -0.17 0.35 0.00 0.00 0.00 0.00 175.76 176.16 2w4k s ALA 41 N 1.04 3.53 -0.36 0.00 0.00 0.13 0.04 121.76 126.14 2w4k s ALA 41 Ca -0.01 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.83 2w4k s ALA 41 Cb -0.15 -2.74 0.02 0.00 0.00 0.00 0.00 23.12 20.25 2w4k s ALA 41 CO -0.03 -0.83 0.19 0.21 0.00 0.00 0.00 175.76 175.30 2w4k s LYS 42 N 2.02 2.96 -0.39 0.00 2.20 0.10 -0.93 119.74 125.70 2w4k s LYS 42 Ca 0.13 -0.98 -0.18 0.00 -0.36 0.00 0.00 55.97 54.57 2w4k s LYS 42 Cb -0.16 -3.69 0.01 0.00 -1.51 0.00 0.00 37.83 32.48 2w4k s LYS 42 CO 0.11 -0.62 0.52 -0.06 -0.36 0.00 0.00 175.35 174.93 2w4k s PHE 43 N 1.57 3.15 -0.21 4.03 0.40 0.48 -0.59 117.98 126.80 2w4k s PHE 43 Ca 0.03 -0.04 -0.06 0.00 -0.60 0.00 0.00 56.93 56.26 2w4k s PHE 43 Cb -0.19 -3.02 -0.03 0.00 0.51 0.00 0.00 43.02 40.30 2w4k s PHE 43 CO 0.07 -0.66 0.04 0.42 0.70 0.00 0.00 175.22 175.78 2w4k s ILE 44 N 2.42 4.23 -0.05 0.64 1.01 0.29 -1.79 121.20 127.95 2w4k s ILE 44 Ca 0.18 -0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.31 2w4k s ILE 44 Cb -0.16 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 2w4k s ILE 44 CO 0.15 0.40 1.35 -0.75 0.00 0.00 0.00 174.94 176.09 2w4k s LYS 45 N 1.11 4.28 0.26 2.79 2.47 -0.04 -0.97 119.74 129.64 2w4k s LYS 45 Ca 0.03 1.86 -0.29 0.00 -1.56 0.00 0.00 55.97 56.01 2w4k s LYS 45 Cb -0.14 -3.64 -0.09 0.00 -1.46 0.00 0.00 37.83 32.49 2w4k s LYS 45 CO 0.02 -0.59 1.19 0.15 0.16 0.00 0.00 175.35 176.28 2w4k s LYS 46 N 2.71 4.52 0.24 4.03 1.02 -0.12 -0.12 119.74 132.02 2w4k s LYS 46 Ca 0.61 1.94 -0.02 0.00 0.02 0.00 0.00 55.97 58.52 2w4k s LYS 46 Cb -0.28 -3.18 0.28 0.00 -0.52 0.00 0.00 37.83 34.14 2w4k s LYS 46 CO 0.23 0.00 1.68 0.07 -0.92 0.00 0.00 175.35 176.41 2w4k h ARG 47 N 4.24 0.66 0.00 1.68 0.11 -1.46 -3.41 114.38 116.20 2w4k h ARG 47 Ca -0.46 -0.25 0.00 0.00 0.10 0.00 0.00 59.98 59.36 2w4k h ARG 47 Cb 1.22 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.26 2w4k h ARG 47 CO 0.69 0.83 0.00 0.54 0.10 0.00 0.00 179.97 182.13 2w4k n ARG 48 N -4.12 0.00 -5.23 0.08 1.74 -1.26 -4.78 116.66 103.08 2w4k n ARG 48 Ca 0.00 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 2w4k n ARG 48 Cb 0.41 0.00 -0.16 0.00 -1.02 0.00 0.00 32.46 31.69 2w4k n ARG 48 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2w4k s THR 49 N -0.02 2.17 0.54 0.55 -4.23 -1.26 -5.03 115.64 108.36 2w4k s THR 49 Ca 0.00 -1.04 0.23 0.00 -1.18 0.00 0.00 61.69 59.70 2w4k s THR 49 Cb 0.00 -1.78 0.34 0.00 1.34 0.00 0.00 72.50 72.40 2w4k s THR 49 CO 0.00 0.57 2.08 0.11 -0.54 0.00 0.00 174.62 176.85 2w4k h LYS 50 N 5.89 0.00 -0.00 3.99 1.57 -2.03 -0.92 116.57 125.06 2w4k h LYS 50 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2w4k h LYS 50 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2w4k h LYS 50 CO 0.48 0.00 -0.15 -1.13 -0.57 0.00 0.00 179.45 178.08 2w4k n SER 51 N -4.29 0.36 -4.77 0.86 3.41 -1.26 -4.85 113.62 103.08 2w4k n SER 51 Ca 0.03 -0.28 -0.39 0.00 -0.26 0.00 0.00 58.87 57.96 2w4k n SER 51 Cb 0.34 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 2w4k n SER 51 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2w4k s SER 52 N -2.68 7.35 0.00 4.04 0.15 -0.35 -4.95 113.70 117.26 2w4k s SER 52 Ca 0.23 1.60 0.22 0.00 0.70 0.00 0.00 55.95 58.69 2w4k s SER 52 Cb 0.19 -2.49 0.57 0.00 -1.71 0.00 0.00 66.02 62.58 2w4k s SER 52 CO 0.52 0.17 1.48 0.54 1.20 0.00 0.00 173.24 177.16 2w4k n ARG 53 N 1.87 2.57 -0.85 5.44 3.00 -1.26 -4.66 116.66 122.76 2w4k n ARG 53 Ca -0.05 -2.42 -0.14 0.00 -0.01 0.00 0.00 57.85 55.24 2w4k n ARG 53 Cb 0.49 -1.53 0.16 0.00 0.00 0.00 0.00 32.46 31.57 2w4k n ARG 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2w4k n ARG 54 N 1.51 2.22 -2.33 5.56 1.74 -1.26 -4.94 116.66 119.16 2w4k n ARG 54 Ca 0.22 -2.20 0.01 0.00 -0.77 0.00 0.00 57.85 55.11 2w4k n ARG 54 Cb 0.59 -1.89 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 2w4k n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2w4k n GLY 55 N -0.51 0.60 3.73 -0.13 0.00 -1.26 -4.78 105.19 102.84 2w4k n GLY 55 Ca 0.40 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 2w4k n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2w4k s VAL 56 N -2.16 4.55 0.65 1.61 1.01 0.83 -4.43 120.40 122.46 2w4k s VAL 56 Ca 0.07 -0.22 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 2w4k s VAL 56 Cb -0.00 -2.95 -0.00 0.00 0.00 0.00 0.00 36.38 33.42 2w4k s VAL 56 CO 0.00 0.56 1.20 -0.94 0.00 0.00 0.00 175.10 175.92 2w4k s SER 57 N -1.07 4.80 0.29 3.32 1.04 -1.26 -1.44 113.70 119.38 2w4k s SER 57 Ca 0.15 2.33 -0.01 0.00 0.48 0.00 0.00 55.95 58.90 2w4k s SER 57 Cb -0.12 -2.59 0.42 0.00 0.10 0.00 0.00 66.02 63.84 2w4k s SER 57 CO 0.05 -1.86 1.86 -0.09 0.98 0.00 0.00 173.24 174.18 2w4k h ARG 58 N 0.32 0.86 -0.51 4.02 2.43 -1.98 -2.22 114.38 117.31 2w4k h ARG 58 Ca -0.49 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 58.60 2w4k h ARG 58 Cb 1.29 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 30.64 2w4k h ARG 58 CO 0.53 0.73 0.20 1.49 -1.51 0.00 0.00 179.97 181.40 2w4k h GLU 59 N 0.84 0.38 -0.22 0.20 4.81 -1.99 0.24 114.58 118.83 2w4k h GLU 59 Ca 0.19 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 2w4k h GLU 59 Cb 0.22 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2w4k h GLU 59 CO -0.01 0.25 -0.38 -0.44 -0.73 0.00 0.00 179.01 177.69 2w4k h ASP 60 N 0.39 0.52 0.03 1.04 3.32 -1.85 -1.51 116.42 118.36 2w4k h ASP 60 Ca 0.24 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 2w4k h ASP 60 Cb 0.25 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2w4k h ASP 60 CO -0.23 0.86 -0.02 0.40 -1.72 0.00 0.00 179.24 178.53 2w4k h ILE 61 N 0.42 1.24 -0.87 0.35 2.04 -0.95 -2.66 117.51 117.08 2w4k h ILE 61 Ca 0.04 -0.89 0.11 0.00 1.00 0.00 0.00 64.86 65.12 2w4k h ILE 61 Cb 0.86 1.83 -0.08 0.00 -0.74 0.00 0.00 36.82 38.69 2w4k h ILE 61 CO 0.07 0.23 0.50 -0.33 0.00 0.00 0.00 178.15 178.62 2w4k h GLU 62 N -0.44 0.79 0.16 2.37 4.39 -0.50 -0.93 114.58 120.43 2w4k h GLU 62 Ca -0.00 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2w4k h GLU 62 Cb 0.40 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2w4k h GLU 62 CO 0.01 0.52 -0.09 -0.09 -1.16 0.00 0.00 179.01 178.20 2w4k h ARG 63 N 0.81 -0.23 -0.33 2.33 2.43 -1.27 0.13 114.38 118.26 2w4k h ARG 63 Ca 0.43 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.67 2w4k h ARG 63 Cb 0.44 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2w4k h ARG 63 CO -0.27 -0.15 0.05 1.49 -1.51 0.00 0.00 179.97 179.58 2w4k h GLU 64 N -0.24 0.16 -0.56 0.20 4.81 -1.09 -1.27 114.58 116.60 2w4k h GLU 64 Ca -0.02 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2w4k h GLU 64 Cb 0.19 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 2w4k h GLU 64 CO 0.02 0.10 0.36 0.28 -0.73 0.00 0.00 179.01 179.04 2w4k h VAL 65 N 0.16 1.11 -0.53 0.32 2.07 -1.05 -0.78 116.25 117.54 2w4k h VAL 65 Ca 0.15 -0.25 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 2w4k h VAL 65 Cb 0.18 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2w4k h VAL 65 CO -0.22 0.13 0.01 -1.28 0.02 0.00 0.00 177.57 176.23 2w4k h SER 66 N 0.72 0.87 -0.13 0.57 0.87 -0.27 -0.20 113.55 115.97 2w4k h SER 66 Ca 0.21 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 2w4k h SER 66 Cb -0.04 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.69 2w4k h SER 66 CO -0.07 0.92 -0.05 0.40 -0.53 0.00 0.00 176.83 177.51 2w4k h ILE 67 N 0.83 1.31 -0.38 2.23 2.04 -1.11 -3.06 117.51 119.36 2w4k h ILE 67 Ca 0.16 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 2w4k h ILE 67 Cb 0.48 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 2w4k h ILE 67 CO 0.02 0.30 0.11 -0.07 0.00 0.00 0.00 178.15 178.52 2w4k h LEU 68 N -0.06 0.50 -1.02 1.44 3.38 -0.87 -2.30 115.31 116.38 2w4k h LEU 68 Ca 0.03 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2w4k h LEU 68 Cb 0.49 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 2w4k h LEU 68 CO 0.02 0.48 0.47 0.11 0.09 0.00 0.00 178.44 179.61 2w4k h LYS 69 N 0.54 1.15 -0.01 1.13 1.57 -1.02 -2.87 116.57 117.05 2w4k h LYS 69 Ca 0.13 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 2w4k h LYS 69 Cb 0.17 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 2w4k h LYS 69 CO -0.01 0.83 -0.58 0.93 -0.57 0.00 0.00 179.45 180.05 2w4k h GLU 70 N 1.16 0.05 -6.19 3.15 5.08 -1.31 -3.46 114.58 113.05 2w4k h GLU 70 Ca 0.30 -0.03 -0.55 0.00 -1.00 0.00 0.00 59.36 58.07 2w4k h GLU 70 Cb 0.01 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2w4k h GLU 70 CO -0.05 0.62 0.11 0.96 -1.00 0.00 0.00 179.01 179.65 2w4k s ILE 71 N -3.72 4.85 -0.32 3.13 -4.36 -1.08 -5.00 121.20 114.69 2w4k s ILE 71 Ca -0.02 1.52 -0.00 0.00 -0.26 0.00 0.00 60.65 61.88 2w4k s ILE 71 Cb 0.13 -4.07 0.13 0.00 1.25 0.00 0.00 42.46 39.91 2w4k s ILE 71 CO 0.76 0.34 0.26 -1.10 0.24 0.00 0.00 174.94 175.44 2w4k s GLN 72 N 0.17 0.40 -0.17 0.37 -1.52 -1.26 -4.68 119.66 112.97 2w4k s GLN 72 Ca 0.37 -0.60 -0.27 0.00 -1.95 0.00 0.00 55.36 52.92 2w4k s GLN 72 Cb -0.19 -0.90 0.07 0.00 -0.22 0.00 0.00 33.01 31.77 2w4k s GLN 72 CO 0.21 -1.10 0.69 -1.58 -0.25 0.00 0.00 175.29 173.26 2w4k s HIS 73 N 1.87 -0.71 0.55 0.91 2.46 -1.26 -5.05 115.29 114.06 2w4k s HIS 73 Ca 0.12 1.54 0.25 0.00 0.47 0.00 0.00 55.06 57.45 2w4k s HIS 73 Cb -0.16 0.32 1.47 0.00 -0.13 0.00 0.00 32.58 34.08 2w4k s HIS 73 CO -0.22 -0.47 2.05 -1.35 -2.47 0.00 0.00 174.74 172.29 2w4k h PRO 74 N 4.16 0.00 -0.73 2.88 0.11 -1.99 -2.65 132.00 133.79 2w4k h PRO 74 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2w4k h PRO 74 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2w4k h PRO 74 CO 0.20 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.08 2w4k n ASN 75 N -4.17 4.13 -4.14 -2.05 5.03 -1.26 -4.76 115.26 108.04 2w4k n ASN 75 Ca 0.05 -2.08 -0.21 0.00 0.87 0.00 0.00 54.58 53.21 2w4k n ASN 75 Cb 0.43 -0.51 -0.14 0.00 -1.02 0.00 0.00 39.78 38.54 2w4k n ASN 75 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2w4k s VAL 76 N -1.16 1.14 0.64 2.41 1.01 -1.00 -0.73 120.40 122.71 2w4k s VAL 76 Ca 0.50 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 61.38 2w4k s VAL 76 Cb 0.27 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.63 2w4k s VAL 76 CO 0.32 0.08 1.17 0.27 0.00 0.00 0.00 175.10 176.94 2w4k s ILE 77 N -0.74 2.77 0.22 2.22 -4.36 -0.98 -4.52 121.20 115.81 2w4k s ILE 77 Ca 0.03 0.42 0.10 0.00 -0.26 0.00 0.00 60.65 60.93 2w4k s ILE 77 Cb -0.07 -3.05 -0.04 0.00 1.25 0.00 0.00 42.46 40.54 2w4k s ILE 77 CO 0.01 -0.16 -0.09 0.42 0.24 0.00 0.00 174.94 175.36 2w4k s THR 78 N -1.90 3.14 -0.11 8.37 -4.23 -1.26 -4.87 115.64 114.78 2w4k s THR 78 Ca 0.73 -1.86 -0.17 0.00 -1.18 0.00 0.00 61.69 59.21 2w4k s THR 78 Cb -0.27 -2.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 2w4k s THR 78 CO 0.37 -0.24 0.45 -0.22 -0.54 0.00 0.00 174.62 174.44 2w4k s LEU 79 N -3.19 4.29 -0.23 4.79 2.96 -1.25 -1.27 118.68 124.79 2w4k s LEU 79 Ca 0.27 0.79 -0.16 0.00 -0.22 0.00 0.00 54.13 54.81 2w4k s LEU 79 Cb -0.07 -2.64 -0.12 0.00 0.50 0.00 0.00 46.19 43.85 2w4k s LEU 79 CO 0.16 0.05 -0.18 1.57 -1.32 0.00 0.00 176.35 176.63 2w4k n HIS 80 N 3.48 0.38 -3.80 5.38 -0.00 0.15 -4.93 115.22 115.88 2w4k n HIS 80 Ca -0.08 0.17 -0.10 0.00 -0.00 0.00 0.00 57.72 57.71 2w4k n HIS 80 Cb 0.52 -0.92 -0.05 0.00 -0.00 0.00 0.00 29.99 29.53 2w4k n HIS 80 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2w4k s GLU 81 N -2.51 1.18 -0.04 1.57 2.02 -1.09 -5.01 118.70 114.82 2w4k s GLU 81 Ca -0.32 -0.94 0.03 0.00 0.02 0.00 0.00 54.97 53.76 2w4k s GLU 81 Cb 0.09 0.44 0.01 0.00 0.10 0.00 0.00 34.13 34.77 2w4k s GLU 81 CO 0.48 -0.46 -0.11 0.08 0.02 0.00 0.00 175.26 175.27 2w4k s VAL 82 N -3.89 0.98 0.26 2.63 1.01 -1.26 -0.25 120.40 119.89 2w4k s VAL 82 Ca 0.10 -0.43 0.11 0.00 0.00 0.00 0.00 61.98 61.75 2w4k s VAL 82 Cb 0.02 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.46 2w4k s VAL 82 CO -0.05 0.31 -0.18 -0.31 0.00 0.00 0.00 175.10 174.87 2w4k s TYR 83 N 0.42 2.12 -0.04 5.22 1.51 0.07 -1.36 117.35 125.28 2w4k s TYR 83 Ca -0.08 -0.41 -0.09 0.00 -1.01 0.00 0.00 57.07 55.47 2w4k s TYR 83 Cb -0.12 -0.95 0.01 0.00 -0.11 0.00 0.00 41.96 40.79 2w4k s TYR 83 CO 0.02 0.60 0.21 -1.83 -1.11 0.00 0.00 175.55 173.44 2w4k s GLU 84 N -3.56 0.44 0.00 -0.62 -1.05 0.12 0.08 118.70 114.12 2w4k s GLU 84 Ca 0.28 -0.08 0.00 0.00 -0.15 0.00 0.00 54.97 55.02 2w4k s GLU 84 Cb -0.03 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 2w4k s GLU 84 CO 0.13 -0.10 0.00 0.27 0.95 0.00 0.00 175.26 176.51 2w4k n ASN 85 N 2.00 1.02 -0.22 0.83 0.23 -0.36 -4.59 115.26 114.16 2w4k n ASN 85 Ca -0.19 -0.53 0.04 0.00 -0.53 0.00 0.00 54.58 53.37 2w4k n ASN 85 Cb 0.57 0.00 0.29 0.00 -2.08 0.00 0.00 39.78 38.55 2w4k n ASN 85 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 2w4k h LYS 86 N 0.00 0.89 0.00 -3.83 1.79 -2.01 -3.27 116.57 110.14 2w4k h LYS 86 Ca 0.00 -0.05 -0.17 0.00 -2.18 0.00 0.00 60.65 58.24 2w4k h LYS 86 Cb 0.00 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 30.42 2w4k h LYS 86 CO 0.00 0.59 -1.91 0.25 -1.08 0.00 0.00 179.45 177.29 2w4k n THR 87 N -4.46 0.65 -4.35 -0.16 -2.24 -1.26 -4.95 114.28 97.50 2w4k n THR 87 Ca 0.11 -0.53 -0.20 0.00 -2.27 0.00 0.00 64.05 61.15 2w4k n THR 87 Cb 0.15 -0.34 -0.13 0.00 -2.10 0.00 0.00 70.33 67.92 2w4k n THR 87 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2w4k s ASP 88 N -4.47 1.75 -0.17 3.42 1.01 -1.23 -0.95 116.67 116.03 2w4k s ASP 88 Ca -0.07 -0.49 -0.07 0.00 0.71 0.00 0.00 52.55 52.63 2w4k s ASP 88 Cb 0.07 -0.11 -0.04 0.00 1.01 0.00 0.00 42.92 43.85 2w4k s ASP 88 CO 0.63 0.03 0.06 -0.69 0.21 0.00 0.00 175.17 175.41 2w4k s VAL 89 N -0.91 4.79 -0.24 -1.27 1.01 -0.14 -1.22 120.40 122.40 2w4k s VAL 89 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.96 2w4k s VAL 89 Cb -0.08 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.20 2w4k s VAL 89 CO 0.01 0.48 -0.10 -0.63 0.00 0.00 0.00 175.10 174.87 2w4k s ILE 90 N 0.17 2.51 -0.30 2.22 1.01 0.11 -0.55 121.20 126.38 2w4k s ILE 90 Ca 0.04 -1.24 -0.14 0.00 0.00 0.00 0.00 60.65 59.31 2w4k s ILE 90 Cb -0.12 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 2w4k s ILE 90 CO 0.01 0.16 0.34 -0.76 0.00 0.00 0.00 174.94 174.68 2w4k s LEU 91 N 1.24 4.17 -0.43 2.97 1.43 0.24 -0.75 118.68 127.54 2w4k s LEU 91 Ca -0.02 0.07 -0.22 0.00 -1.03 0.00 0.00 54.13 52.92 2w4k s LEU 91 Cb -0.17 -2.35 0.02 0.00 0.03 0.00 0.00 46.19 43.72 2w4k s LEU 91 CO -0.06 -0.21 0.74 -0.63 0.23 0.00 0.00 176.35 176.42 2w4k s ILE 92 N 2.01 4.72 0.16 -0.59 -1.09 0.66 0.01 121.20 127.07 2w4k s ILE 92 Ca 0.13 0.41 0.07 0.00 -2.23 0.00 0.00 60.65 59.02 2w4k s ILE 92 Cb -0.16 -4.26 -0.04 0.00 -1.58 0.00 0.00 42.46 36.42 2w4k s ILE 92 CO 0.11 -0.63 0.02 -0.76 -1.23 0.00 0.00 174.94 172.45 2w4k s LEU 93 N 3.11 3.40 0.02 2.97 1.43 0.11 0.33 118.68 130.05 2w4k s LEU 93 Ca 0.28 -0.32 -0.37 0.00 -1.03 0.00 0.00 54.13 52.69 2w4k s LEU 93 Cb -0.13 -2.07 -0.16 0.00 0.03 0.00 0.00 46.19 43.87 2w4k s LEU 93 CO 0.21 0.10 1.47 1.21 0.23 0.00 0.00 176.35 179.57 2w4k n GLU 94 N -0.01 1.34 -2.49 1.70 2.13 -0.40 -0.31 120.64 122.60 2w4k n GLU 94 Ca -0.10 0.48 -0.42 0.00 0.66 0.00 0.00 57.16 57.79 2w4k n GLU 94 Cb 0.54 -2.16 -0.03 0.00 0.27 0.00 0.00 31.44 30.06 2w4k n GLU 94 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2w4k s LEU 95 N 1.27 4.33 -0.28 4.31 2.96 -1.26 -4.49 118.68 125.52 2w4k s LEU 95 Ca 0.87 1.87 -0.03 0.00 -0.22 0.00 0.00 54.13 56.62 2w4k s LEU 95 Cb -0.92 -3.57 0.04 0.00 0.50 0.00 0.00 46.19 42.23 2w4k s LEU 95 CO 0.49 -0.48 -0.01 0.68 -1.32 0.00 0.00 176.35 175.72 2w4k s VAL 96 N 1.51 3.11 -1.22 1.68 -7.23 -1.26 -4.96 120.40 112.04 2w4k s VAL 96 Ca 0.56 -1.16 0.16 0.00 -1.81 0.00 0.00 61.98 59.73 2w4k s VAL 96 Cb -0.26 -2.69 -0.07 0.00 0.56 0.00 0.00 36.38 33.91 2w4k s VAL 96 CO 0.26 0.02 0.80 0.00 -0.31 0.00 0.00 175.10 175.87 2w4k n ALA 97 N 4.68 3.58 0.23 1.32 0.00 -0.76 -4.58 120.51 124.98 2w4k n ALA 97 Ca -0.14 -0.51 0.07 0.00 0.00 0.00 0.00 53.44 52.85 2w4k n ALA 97 Cb 0.45 -0.59 0.23 0.00 0.00 0.00 0.00 19.45 19.55 2w4k n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w4k n GLY 98 N 1.26 1.65 7.00 0.00 0.00 0.67 -4.82 105.19 110.94 2w4k n GLY 98 Ca 0.05 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2w4k n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4k n GLY 99 N 1.04 -1.20 3.77 -0.02 0.00 -1.25 -4.49 105.19 103.04 2w4k n GLY 99 Ca 0.17 -1.20 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 2w4k n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w4k s GLU 100 N 0.00 4.65 0.19 1.61 2.02 -1.26 -0.89 118.70 125.01 2w4k s GLU 100 Ca 0.00 1.35 -0.17 0.00 0.02 0.00 0.00 54.97 56.17 2w4k s GLU 100 Cb 0.00 -2.96 0.15 0.00 0.10 0.00 0.00 34.13 31.42 2w4k s GLU 100 CO 0.00 0.37 1.63 1.25 0.02 0.00 0.00 175.26 178.52 2w4k h LEU 101 N 3.52 -0.69 -1.10 1.80 5.85 -1.30 -2.59 115.31 120.79 2w4k h LEU 101 Ca -0.46 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2w4k h LEU 101 Cb 1.19 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 42.58 2w4k h LEU 101 CO 0.66 -0.23 0.60 -0.26 -0.34 0.00 0.00 178.44 178.87 2w4k h PHE 102 N -0.08 1.14 -0.41 1.25 -1.00 -1.86 -0.09 116.94 115.88 2w4k h PHE 102 Ca 0.24 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 61.00 2w4k h PHE 102 Cb 0.45 -0.39 -0.02 0.00 3.61 0.00 0.00 35.95 39.60 2w4k h PHE 102 CO -0.49 0.72 0.08 -0.44 -1.61 0.00 0.00 178.31 176.58 2w4k h ASP 103 N 1.23 0.57 -0.15 2.17 3.32 -1.83 0.13 116.42 121.87 2w4k h ASP 103 Ca 0.33 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.17 2w4k h ASP 103 Cb -0.14 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.27 2w4k h ASP 103 CO -0.07 0.59 -0.37 0.15 -1.72 0.00 0.00 179.24 177.81 2w4k h PHE 104 N 0.60 0.66 -0.44 4.55 3.57 -1.16 -3.16 116.94 121.56 2w4k h PHE 104 Ca 0.14 -0.25 -0.07 0.00 3.53 0.00 0.00 57.97 61.31 2w4k h PHE 104 Cb 0.26 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 2w4k h PHE 104 CO 0.01 1.00 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.99 2w4k h LEU 105 N 0.14 0.70 -0.62 0.59 3.38 -0.70 -2.69 115.31 116.10 2w4k h LEU 105 Ca -0.01 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2w4k h LEU 105 Cb 0.99 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2w4k h LEU 105 CO 0.08 0.79 0.00 0.00 0.09 0.00 0.00 178.44 179.40 2w4k n ALA 106 N -2.48 1.55 1.34 1.53 0.00 0.43 -1.73 120.51 121.15 2w4k n ALA 106 Ca 0.02 0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.67 2w4k n ALA 106 Cb 0.31 -1.33 0.54 0.00 0.00 0.00 0.00 19.45 18.97 2w4k n ALA 106 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2w4k n GLU 107 N -2.06 0.68 -2.34 0.00 1.02 -1.01 -4.83 120.64 112.10 2w4k n GLU 107 Ca 0.02 -0.28 -0.28 0.00 -0.02 0.00 0.00 57.16 56.59 2w4k n GLU 107 Cb 0.18 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.12 2w4k n GLU 107 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2w4k s LYS 108 N -2.51 3.40 0.07 3.49 1.02 -0.71 -4.99 119.74 119.50 2w4k s LYS 108 Ca 0.27 0.33 -0.07 0.00 0.02 0.00 0.00 55.97 56.51 2w4k s LYS 108 Cb 0.20 -2.25 -0.30 0.00 -0.52 0.00 0.00 37.83 34.95 2w4k s LYS 108 CO 0.49 -0.45 1.11 0.93 -0.92 0.00 0.00 175.35 176.51 2w4k h GLU 109 N -0.05 0.33 -3.60 1.68 3.07 -1.91 -3.48 114.58 110.62 2w4k h GLU 109 Ca -0.46 -0.57 -0.05 0.00 -0.50 0.00 0.00 59.36 57.78 2w4k h GLU 109 Cb 1.21 0.21 -0.09 0.00 -0.84 0.00 0.00 28.75 29.25 2w4k h GLU 109 CO 0.62 1.27 -0.10 -1.54 -1.40 0.00 0.00 179.01 177.86 2w4k s SER 110 N -7.25 -0.11 -0.28 1.42 1.04 -1.26 -4.96 113.70 102.30 2w4k s SER 110 Ca -0.05 -0.88 -0.06 0.00 0.48 0.00 0.00 55.95 55.44 2w4k s SER 110 Cb 0.06 0.59 0.14 0.00 0.10 0.00 0.00 66.02 66.91 2w4k s SER 110 CO 0.90 -1.14 0.58 -0.22 0.98 0.00 0.00 173.24 174.35 2w4k s LEU 111 N -3.00 -1.11 0.79 2.42 2.96 -1.26 -5.08 118.68 114.40 2w4k s LEU 111 Ca 0.21 1.19 -0.12 0.00 -0.22 0.00 0.00 54.13 55.19 2w4k s LEU 111 Cb -0.01 2.04 0.07 0.00 0.50 0.00 0.00 46.19 48.79 2w4k s LEU 111 CO 0.08 -0.24 1.10 0.42 -1.32 0.00 0.00 176.35 176.39 2w4k s THR 112 N 2.82 3.01 0.31 3.68 -4.23 -1.26 -0.30 115.64 119.68 2w4k s THR 112 Ca 0.04 0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.88 2w4k s THR 112 Cb -0.13 -3.12 0.21 0.00 1.34 0.00 0.00 72.50 70.80 2w4k s THR 112 CO -0.18 -0.43 1.92 -0.33 -0.54 0.00 0.00 174.62 175.05 2w4k h GLU 113 N -1.05 0.84 -0.19 3.99 5.08 -1.22 0.63 114.58 122.66 2w4k h GLU 113 Ca -0.47 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 57.81 2w4k h GLU 113 Cb 1.27 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2w4k h GLU 113 CO 0.60 0.65 0.02 1.49 -1.00 0.00 0.00 179.01 180.78 2w4k h GLU 114 N 0.84 0.09 -0.70 2.33 4.81 -1.78 0.21 114.58 120.37 2w4k h GLU 114 Ca 0.21 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.38 2w4k h GLU 114 Cb 0.09 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2w4k h GLU 114 CO -0.03 0.06 0.22 0.93 -0.73 0.00 0.00 179.01 179.46 2w4k h GLU 115 N 0.09 1.09 -0.85 1.92 5.08 -1.83 -2.53 114.58 117.55 2w4k h GLU 115 Ca 0.09 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2w4k h GLU 115 Cb 0.09 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 2w4k h GLU 115 CO -0.13 0.94 0.54 0.00 -1.00 0.00 0.00 179.01 179.36 2w4k h ALA 116 N 1.10 1.08 0.00 3.43 0.00 -0.48 -2.92 119.26 121.48 2w4k h ALA 116 Ca 0.23 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2w4k h ALA 116 Cb 0.30 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2w4k h ALA 116 CO -0.01 0.52 -0.36 1.79 0.00 0.00 0.00 179.25 181.19 2w4k h THR 117 N 1.16 1.08 -0.86 0.00 1.35 -0.19 -1.35 112.91 114.11 2w4k h THR 117 Ca 0.31 -1.33 0.02 0.00 -0.55 0.00 0.00 66.41 64.86 2w4k h THR 117 Cb -0.09 1.75 -0.05 0.00 -1.73 0.00 0.00 68.15 68.04 2w4k h THR 117 CO -0.06 0.36 0.56 -0.33 -0.25 0.00 0.00 175.52 175.79 2w4k h GLU 118 N 0.00 1.08 -0.10 4.72 5.08 -1.28 0.32 114.58 124.41 2w4k h GLU 118 Ca -0.00 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2w4k h GLU 118 Cb 0.72 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2w4k h GLU 118 CO 0.05 0.72 -0.12 0.74 -1.00 0.00 0.00 179.01 179.39 2w4k h PHE 119 N 1.11 0.32 -0.86 4.33 0.04 -1.44 -3.26 116.94 117.18 2w4k h PHE 119 Ca 0.33 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 61.03 2w4k h PHE 119 Cb -0.06 -0.06 -0.05 0.00 2.20 0.00 0.00 35.95 37.97 2w4k h PHE 119 CO -0.02 0.71 0.56 1.25 -0.60 0.00 0.00 178.31 180.21 2w4k h LEU 120 N -0.16 0.92 -1.35 1.54 6.46 -1.03 -1.67 115.31 120.02 2w4k h LEU 120 Ca 0.01 -0.01 0.15 0.00 -0.12 0.00 0.00 57.88 57.91 2w4k h LEU 120 Cb 0.66 -0.21 -0.07 0.00 -0.73 0.00 0.00 40.66 40.32 2w4k h LEU 120 CO 0.03 0.64 0.56 0.11 -0.62 0.00 0.00 178.44 179.16 2w4k h LYS 121 N 1.08 0.61 -0.48 1.25 1.57 -0.43 0.49 116.57 120.66 2w4k h LYS 121 Ca 0.34 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.95 2w4k h LYS 121 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2w4k h LYS 121 CO -0.11 0.40 -0.23 1.96 -0.57 0.00 0.00 179.45 180.90 2w4k h GLN 122 N 0.63 1.00 0.01 3.15 4.20 -1.34 0.16 115.11 122.91 2w4k h GLN 122 Ca 0.43 -0.43 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2w4k h GLN 122 Cb 0.76 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 2w4k h GLN 122 CO -0.19 1.11 -0.07 0.82 -0.67 0.00 0.00 178.83 179.83 2w4k h ILE 123 N 0.86 0.81 -0.86 2.54 2.04 -1.17 -0.78 117.51 120.96 2w4k h ILE 123 Ca 0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 2w4k h ILE 123 Cb 0.81 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 37.64 2w4k h ILE 123 CO 0.07 0.00 0.53 -0.07 0.00 0.00 0.00 178.15 178.68 2w4k h LEU 124 N -0.13 0.83 -0.51 1.44 3.38 -0.67 -0.28 115.31 119.37 2w4k h LEU 124 Ca 0.03 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2w4k h LEU 124 Cb 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2w4k h LEU 124 CO -0.07 0.53 0.21 0.78 0.09 0.00 0.00 178.44 179.98 2w4k h ASN 125 N 0.97 0.70 -0.75 -0.43 2.35 -0.41 0.12 115.58 118.14 2w4k h ASN 125 Ca 0.37 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2w4k h ASN 125 Cb 0.17 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 2w4k h ASN 125 CO -0.17 0.68 0.48 1.23 -1.65 0.00 0.00 177.43 177.99 2w4k h GLY 126 N 0.69 1.07 1.52 2.83 0.00 -0.66 -1.73 103.07 106.79 2w4k h GLY 126 Ca 0.17 -0.42 -0.16 0.00 0.00 0.00 0.00 47.33 46.92 2w4k h GLY 126 CO -0.01 0.41 -0.58 -2.08 0.00 0.00 0.00 176.54 174.27 2w4k h VAL 127 N 1.02 1.33 -0.47 4.60 2.07 -0.86 -1.64 116.25 122.31 2w4k h VAL 127 Ca 0.27 -1.86 0.04 0.00 0.82 0.00 0.00 66.70 65.97 2w4k h VAL 127 Cb -0.08 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2w4k h VAL 127 CO -0.06 0.57 0.23 0.22 0.02 0.00 0.00 177.57 178.56 2w4k h TYR 128 N 0.38 0.43 0.29 1.57 3.20 -0.61 0.36 116.97 122.58 2w4k h TYR 128 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2w4k h TYR 128 Cb 1.12 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 2w4k h TYR 128 CO 0.04 0.21 -0.25 -0.92 -1.64 0.00 0.00 178.16 175.60 2w4k h TYR 129 N 0.46 -0.67 -0.16 -3.82 3.20 -1.11 -0.94 116.97 113.94 2w4k h TYR 129 Ca 0.21 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.10 2w4k h TYR 129 Cb 0.12 0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 2w4k h TYR 129 CO -0.10 -0.37 -0.00 -0.07 -1.64 0.00 0.00 178.16 175.97 2w4k h LEU 130 N -0.56 -0.07 -1.60 2.82 3.38 -0.75 -2.30 115.31 116.22 2w4k h LEU 130 Ca -0.02 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2w4k h LEU 130 Cb 0.50 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2w4k h LEU 130 CO -0.03 -0.01 -0.21 0.45 0.09 0.00 0.00 178.44 178.73 2w4k h HIS 131 N 0.05 0.00 0.00 1.13 3.86 -0.28 -0.30 115.15 119.61 2w4k h HIS 131 Ca 0.07 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 2w4k h HIS 131 Cb 0.09 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 2w4k h HIS 131 CO -0.16 0.21 -0.17 0.77 0.86 0.00 0.00 177.93 179.45 2w4k h SER 132 N 0.00 0.00 -0.63 2.45 0.02 -0.60 -1.28 113.55 113.51 2w4k h SER 132 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2w4k h SER 132 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2w4k h SER 132 CO 0.03 0.17 0.00 0.18 -1.14 0.00 0.00 176.83 176.06 2w4k n LEU 133 N -3.84 4.01 -2.27 5.07 4.77 -0.25 -4.95 117.00 119.55 2w4k n LEU 133 Ca -0.02 -2.02 -0.18 0.00 -0.03 0.00 0.00 56.01 53.76 2w4k n LEU 133 Cb 0.26 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 40.86 2w4k n LEU 133 CO 0.33 0.81 -0.12 0.00 -1.33 0.00 0.00 177.39 177.08 2w4k n GLN 134 N 1.22 -2.70 -3.73 3.23 1.13 -0.48 -4.89 117.38 111.17 2w4k n GLN 134 Ca 0.23 0.81 -0.37 0.00 -1.94 0.00 0.00 57.00 55.74 2w4k n GLN 134 Cb 0.70 -5.33 -0.12 0.00 0.11 0.00 0.00 30.24 25.60 2w4k n GLN 134 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2w4k s ILE 135 N -2.97 4.48 -0.18 5.09 1.01 -0.43 0.14 121.20 128.33 2w4k s ILE 135 Ca 0.12 -0.12 -0.17 0.00 0.00 0.00 0.00 60.65 60.49 2w4k s ILE 135 Cb -0.05 -3.10 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 2w4k s ILE 135 CO 0.15 0.32 0.44 0.00 0.00 0.00 0.00 174.94 175.85 2w4k s ALA 136 N 1.64 3.53 0.01 9.38 0.00 0.01 -3.58 121.76 132.75 2w4k s ALA 136 Ca 0.06 -0.40 -0.21 0.00 0.00 0.00 0.00 51.96 51.41 2w4k s ALA 136 Cb -0.15 -2.66 -0.18 0.00 0.00 0.00 0.00 23.12 20.12 2w4k s ALA 136 CO 0.05 -0.23 1.22 1.25 0.00 0.00 0.00 175.76 178.06 2w4k h HIS 137 N 7.17 0.43 0.00 0.00 2.76 -1.90 -0.44 115.15 123.17 2w4k h HIS 137 Ca -0.37 -0.17 0.00 0.00 -2.20 0.00 0.00 60.37 57.63 2w4k h HIS 137 Cb 1.16 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.05 2w4k h HIS 137 CO 0.66 0.87 0.00 1.19 -1.30 0.00 0.00 177.93 179.35 2w4k n PHE 138 N -4.48 0.00 -2.76 5.26 3.72 -1.26 -2.63 117.46 115.32 2w4k n PHE 138 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 2w4k n PHE 138 Cb 0.45 -0.99 0.06 0.00 -0.94 0.00 0.00 39.48 38.06 2w4k n PHE 138 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2w4k n ASP 139 N -0.28 1.00 -4.66 4.37 2.03 -1.26 -4.85 116.55 112.91 2w4k n ASP 139 Ca 0.00 -2.05 -0.43 0.00 0.52 0.00 0.00 54.79 52.84 2w4k n ASP 139 Cb 0.14 -0.27 -0.02 0.00 -0.72 0.00 0.00 41.12 40.24 2w4k n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2w4k s LEU 140 N -3.33 4.20 0.14 -2.67 1.43 -1.26 -4.78 118.68 112.41 2w4k s LEU 140 Ca 0.25 1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 54.96 2w4k s LEU 140 Cb 0.34 -3.54 0.07 0.00 0.03 0.00 0.00 46.19 43.09 2w4k s LEU 140 CO -0.07 -0.87 0.75 -1.59 0.23 0.00 0.00 176.35 174.81 2w4k s LYS 141 N 3.80 1.24 0.34 1.70 -2.85 -1.26 -4.84 119.74 117.88 2w4k s LYS 141 Ca 0.63 -0.55 0.06 0.00 -1.00 0.00 0.00 55.97 55.10 2w4k s LYS 141 Cb -0.26 0.51 0.73 0.00 -2.06 0.00 0.00 37.83 36.75 2w4k s LYS 141 CO 0.21 -0.55 1.90 -1.35 0.10 0.00 0.00 175.35 175.66 2w4k h PRO 142 N 2.00 0.77 0.00 1.78 0.11 -1.94 -0.00 132.00 134.72 2w4k h PRO 142 Ca -0.26 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2w4k h PRO 142 Cb 1.27 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2w4k h PRO 142 CO 0.31 0.51 0.00 1.05 -0.21 0.00 0.00 178.00 179.66 2w4k h GLU 143 N 0.79 0.00 -0.43 1.05 4.11 -1.97 -1.52 114.58 116.61 2w4k h GLU 143 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2w4k h GLU 143 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2w4k h GLU 143 CO -0.16 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.01 2w4k n ASN 144 N -2.72 3.10 -4.27 3.06 3.02 -0.02 -4.73 115.26 112.70 2w4k n ASN 144 Ca 0.00 -1.95 -0.40 0.00 -0.03 0.00 0.00 54.58 52.20 2w4k n ASN 144 Cb 0.22 -0.28 -0.10 0.00 -0.61 0.00 0.00 39.78 39.00 2w4k n ASN 144 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2w4k s ILE 145 N -1.43 4.21 0.50 2.41 -1.09 -0.57 -1.52 121.20 123.70 2w4k s ILE 145 Ca 0.39 -1.37 0.02 0.00 -2.23 0.00 0.00 60.65 57.46 2w4k s ILE 145 Cb 0.21 -3.56 -0.02 0.00 -1.58 0.00 0.00 42.46 37.51 2w4k s ILE 145 CO 0.30 -0.48 0.04 -0.04 -1.23 0.00 0.00 174.94 173.52 2w4k s MET 146 N 1.42 2.16 -0.05 2.79 -1.94 -0.36 -0.96 119.30 122.37 2w4k s MET 146 Ca 0.03 -2.32 0.06 0.00 -1.71 0.00 0.00 55.69 51.75 2w4k s MET 146 Cb -0.23 -1.60 -0.01 0.00 2.01 0.00 0.00 34.83 35.00 2w4k s MET 146 CO 0.02 -0.33 -0.25 -0.51 -0.01 0.00 0.00 175.02 173.95 2w4k s LEU 147 N -3.88 2.06 0.13 -0.03 1.43 -0.07 -0.51 118.68 117.80 2w4k s LEU 147 Ca 0.13 -0.50 -0.19 0.00 -1.03 0.00 0.00 54.13 52.55 2w4k s LEU 147 Cb 0.03 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 2w4k s LEU 147 CO 0.07 0.25 1.77 0.25 0.23 0.00 0.00 176.35 178.92 2w4k h LEU 148 N 6.01 0.30 -6.71 1.79 5.85 -1.13 0.19 115.31 121.61 2w4k h LEU 148 Ca -0.33 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.31 2w4k h LEU 148 Cb 1.17 -0.08 -0.26 0.00 0.37 0.00 0.00 40.66 41.87 2w4k h LEU 148 CO 0.47 0.24 -0.35 -0.62 -0.34 0.00 0.00 178.44 177.84 2w4k s ASP 149 N -5.45 -0.44 0.01 1.25 -1.08 -1.26 -1.82 116.67 107.87 2w4k s ASP 149 Ca -0.13 0.84 0.27 0.00 -0.52 0.00 0.00 52.55 53.00 2w4k s ASP 149 Cb 0.09 1.57 1.14 0.00 -1.46 0.00 0.00 42.92 44.26 2w4k s ASP 149 CO 0.70 -0.26 1.86 -2.11 0.52 0.00 0.00 175.17 175.89 2w4k n ARG 150 N 5.40 0.01 -2.09 4.34 1.85 -1.26 -4.04 116.66 120.87 2w4k n ARG 150 Ca -0.06 0.05 -0.36 0.00 -1.00 0.00 0.00 57.85 56.48 2w4k n ARG 150 Cb 0.50 -1.52 0.03 0.00 -1.05 0.00 0.00 32.46 30.42 2w4k n ARG 150 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2w4k n ASN 151 N -1.54 6.61 -4.32 2.89 3.02 -1.26 -4.91 115.26 115.76 2w4k n ASN 151 Ca 0.06 -3.80 -0.17 0.00 -0.03 0.00 0.00 54.58 50.65 2w4k n ASN 151 Cb 0.32 -0.87 -0.10 0.00 -0.61 0.00 0.00 39.78 38.52 2w4k n ASN 151 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2w4k s VAL 152 N -5.22 1.32 0.26 2.41 -7.23 -1.26 -5.07 120.40 105.62 2w4k s VAL 152 Ca 0.51 -2.10 -0.04 0.00 -1.81 0.00 0.00 61.98 58.54 2w4k s VAL 152 Cb 0.43 -2.10 0.20 0.00 0.56 0.00 0.00 36.38 35.47 2w4k s VAL 152 CO -0.34 -0.54 1.86 -0.65 -0.31 0.00 0.00 175.10 175.13 2w4k h PRO 153 N 2.58 1.11 -3.10 4.82 0.11 -1.94 -3.35 132.00 132.22 2w4k h PRO 153 Ca -0.38 -0.15 -0.62 0.00 0.11 0.00 0.00 66.00 64.97 2w4k h PRO 153 Cb 1.21 -0.21 -0.41 0.00 0.11 0.00 0.00 31.00 31.71 2w4k h PRO 153 CO 0.64 0.84 -0.68 0.15 -0.21 0.00 0.00 178.00 178.74 2w4k s LYS 154 N -5.66 1.80 0.39 1.05 -0.14 -1.26 -5.11 119.74 110.81 2w4k s LYS 154 Ca -0.12 -2.57 -0.28 0.00 -1.36 0.00 0.00 55.97 51.64 2w4k s LYS 154 Cb 0.17 -2.89 -0.10 0.00 -1.68 0.00 0.00 37.83 33.32 2w4k s LYS 154 CO 0.82 -1.19 1.47 -2.14 -0.76 0.00 0.00 175.35 173.54 2w4k s PRO 155 N -0.36 4.04 -0.18 -1.68 0.02 -1.26 -4.97 135.00 130.62 2w4k s PRO 155 Ca 0.20 2.52 -0.14 0.00 0.02 0.00 0.00 61.00 63.61 2w4k s PRO 155 Cb -0.18 -2.91 -0.04 0.00 0.02 0.00 0.00 34.50 31.38 2w4k s PRO 155 CO -0.06 -0.57 0.30 0.50 -0.33 0.00 0.00 177.00 176.85 2w4k s ARG 156 N -2.15 4.22 0.21 5.54 3.52 -1.26 -5.00 118.95 124.03 2w4k s ARG 156 Ca 0.54 0.08 -0.30 0.00 -0.13 0.00 0.00 55.73 55.92 2w4k s ARG 156 Cb -0.46 -3.46 -0.08 0.00 -1.56 0.00 0.00 34.95 29.39 2w4k s ARG 156 CO 0.61 0.15 1.18 0.42 -0.81 0.00 0.00 175.30 176.86 2w4k s ILE 157 N 0.73 3.53 -0.13 4.11 -1.09 -1.26 -0.52 121.20 126.56 2w4k s ILE 157 Ca 0.16 1.34 0.00 0.00 -2.23 0.00 0.00 60.65 59.93 2w4k s ILE 157 Cb -0.13 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 36.91 2w4k s ILE 157 CO 0.05 0.24 -0.13 -0.54 -1.23 0.00 0.00 174.94 173.32 2w4k s LYS 158 N -0.55 2.16 0.02 2.79 -0.14 0.34 -4.26 119.74 120.10 2w4k s LYS 158 Ca 0.51 -0.51 -0.30 0.00 -1.36 0.00 0.00 55.97 54.31 2w4k s LYS 158 Cb -0.33 -1.98 -0.04 0.00 -1.68 0.00 0.00 37.83 33.81 2w4k s LYS 158 CO 0.38 -0.20 1.02 0.42 -0.76 0.00 0.00 175.35 176.20 2w4k s ILE 159 N 1.42 4.68 0.32 2.17 1.01 0.09 -1.22 121.20 129.67 2w4k s ILE 159 Ca 0.03 1.96 0.00 0.00 0.00 0.00 0.00 60.65 62.63 2w4k s ILE 159 Cb -0.13 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.09 2w4k s ILE 159 CO -0.08 0.17 0.01 2.30 0.00 0.00 0.00 174.94 177.33 2w4k n ILE 160 N 3.77 0.00 -2.42 2.92 -5.35 -0.57 -2.33 119.36 115.38 2w4k n ILE 160 Ca 0.06 -1.52 -0.05 0.00 -0.27 0.00 0.00 62.75 60.96 2w4k n ILE 160 Cb 0.50 0.29 0.01 0.00 -1.74 0.00 0.00 39.64 38.70 2w4k n ILE 160 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2w4k n ASP 161 N -1.21 -6.07 -1.81 7.28 -0.08 -1.26 -4.89 116.55 108.50 2w4k n ASP 161 Ca -0.13 0.36 -0.00 0.00 -1.51 0.00 0.00 54.79 53.51 2w4k n ASP 161 Cb 0.41 -4.01 0.31 0.00 2.34 0.00 0.00 41.12 40.17 2w4k n ASP 161 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2w4k n PHE 162 N -0.38 2.04 0.30 -0.67 3.01 -1.26 -4.55 117.46 115.95 2w4k n PHE 162 Ca 0.08 -0.88 0.18 0.00 1.01 0.00 0.00 57.45 57.83 2w4k n PHE 162 Cb 0.32 -0.56 0.93 0.00 -0.01 0.00 0.00 39.48 40.16 2w4k n PHE 162 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2w4k h GLY 163 N 3.49 0.00 -0.64 1.37 0.00 -1.92 -2.61 103.07 102.76 2w4k h GLY 163 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2w4k h GLY 163 CO 0.56 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.14 2w4k n LEU 164 N -3.34 1.89 -4.77 3.11 4.77 -1.26 -4.93 117.00 112.46 2w4k n LEU 164 Ca -0.02 -1.30 -0.37 0.00 -0.03 0.00 0.00 56.01 54.29 2w4k n LEU 164 Cb 0.17 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2w4k n LEU 164 CO 0.25 0.42 0.80 0.00 -1.33 0.00 0.00 177.39 177.53 2w4k s ALA 165 N -0.71 3.08 0.00 -1.18 0.00 -0.98 -4.61 121.76 117.36 2w4k s ALA 165 Ca 0.10 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2w4k s ALA 165 Cb 0.06 -3.34 -0.00 0.00 0.00 0.00 0.00 23.12 19.84 2w4k s ALA 165 CO 0.09 -0.45 -0.02 -1.01 0.00 0.00 0.00 175.76 174.37 2w4k s HIS 166 N -1.53 0.15 -0.01 0.00 3.76 -0.17 -4.77 115.29 112.71 2w4k s HIS 166 Ca 0.59 -0.12 -0.30 0.00 -0.15 0.00 0.00 55.06 55.08 2w4k s HIS 166 Cb -0.27 -0.10 -0.04 0.00 1.11 0.00 0.00 32.58 33.28 2w4k s HIS 166 CO 0.34 -0.03 1.17 0.21 -0.85 0.00 0.00 174.74 175.57 2w4k s LYS 167 N -0.32 4.41 -0.45 1.40 2.47 -1.26 -0.81 119.74 125.18 2w4k s LYS 167 Ca -0.03 1.67 -0.29 0.00 -1.56 0.00 0.00 55.97 55.76 2w4k s LYS 167 Cb -0.02 -3.47 0.03 0.00 -1.46 0.00 0.00 37.83 32.90 2w4k s LYS 167 CO -0.00 -0.33 1.17 0.42 0.16 0.00 0.00 175.35 176.77 2w4k s ILE 168 N 1.66 4.19 -0.25 5.43 -1.09 0.12 -4.96 121.20 126.32 2w4k s ILE 168 Ca 0.56 1.24 -0.10 0.00 -2.23 0.00 0.00 60.65 60.12 2w4k s ILE 168 Cb -0.26 -4.52 -0.05 0.00 -1.58 0.00 0.00 42.46 36.05 2w4k s ILE 168 CO 0.25 -0.91 0.16 -1.81 -1.23 0.00 0.00 174.94 171.40 2w4k s ASP 169 N 2.58 6.01 0.35 3.58 1.01 -1.26 -4.96 116.67 123.99 2w4k s ASP 169 Ca 0.50 0.07 -0.29 0.00 0.71 0.00 0.00 52.55 53.54 2w4k s ASP 169 Cb -0.09 -2.09 -0.11 0.00 1.01 0.00 0.00 42.92 41.64 2w4k s ASP 169 CO 0.30 0.04 1.52 0.12 0.21 0.00 0.00 175.17 177.36 2w4k s PHE 170 N 1.19 2.63 0.00 4.23 5.36 -1.26 -2.66 117.98 127.47 2w4k s PHE 170 Ca 0.07 1.05 0.00 0.00 -0.96 0.00 0.00 56.93 57.10 2w4k s PHE 170 Cb -0.14 -4.04 0.00 0.00 -0.34 0.00 0.00 43.02 38.50 2w4k s PHE 170 CO 0.06 -3.18 0.00 0.41 -1.46 0.00 0.00 175.22 171.05 2w4k n GLY 171 N 0.94 1.28 2.63 13.12 0.00 -1.26 -5.00 105.19 116.90 2w4k n GLY 171 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 2w4k n GLY 171 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w4k s ASN 172 N -1.78 2.14 0.32 1.61 -0.87 -1.09 -5.13 114.94 110.14 2w4k s ASN 172 Ca 0.00 -0.50 -0.29 0.00 -1.57 0.00 0.00 52.86 50.50 2w4k s ASN 172 Cb 0.00 -0.19 -0.12 0.00 -0.02 0.00 0.00 41.25 40.93 2w4k s ASN 172 CO 0.00 -0.34 1.49 1.21 -2.57 0.00 0.00 177.10 176.89 2w4k n GLU 173 N 5.29 2.51 -4.49 -0.60 2.13 -1.26 -4.54 120.64 119.67 2w4k n GLU 173 Ca -0.06 0.89 -0.33 0.00 0.66 0.00 0.00 57.16 58.31 2w4k n GLU 173 Cb 0.49 -2.60 -0.16 0.00 0.27 0.00 0.00 31.44 29.44 2w4k n GLU 173 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2w4k s PHE 174 N -0.53 2.76 -0.02 4.31 5.36 -1.26 -5.04 117.98 123.56 2w4k s PHE 174 Ca 0.60 -1.17 0.02 0.00 -0.96 0.00 0.00 56.93 55.41 2w4k s PHE 174 Cb -0.52 -1.88 0.01 0.00 -0.34 0.00 0.00 43.02 40.28 2w4k s PHE 174 CO 0.56 -0.55 -0.05 0.15 -1.46 0.00 0.00 175.22 173.87 2w4k s LYS 175 N 0.90 0.65 -0.07 10.12 1.02 -1.26 -0.52 119.74 130.57 2w4k s LYS 175 Ca -0.04 -0.16 -0.29 0.00 0.02 0.00 0.00 55.97 55.50 2w4k s LYS 175 Cb -0.15 -0.66 0.11 0.00 -0.52 0.00 0.00 37.83 36.61 2w4k s LYS 175 CO -0.02 0.02 0.90 1.21 -0.92 0.00 0.00 175.35 176.55 2w4k s ASN 176 N 0.40 -0.41 -0.21 2.83 2.47 -1.26 -5.06 114.94 113.70 2w4k s ASN 176 Ca -0.05 0.26 -0.06 0.00 0.42 0.00 0.00 52.86 53.43 2w4k s ASN 176 Cb -0.09 0.37 -0.03 0.00 -1.45 0.00 0.00 41.25 40.06 2w4k s ASN 176 CO -0.00 -0.51 0.02 -0.63 -3.72 0.00 0.00 177.10 172.26 2w4k s ILE 177 N -2.05 4.10 0.22 -5.21 1.01 -1.26 -4.73 121.20 113.28 2w4k s ILE 177 Ca 0.00 -0.26 -0.22 0.00 0.00 0.00 0.00 60.65 60.18 2w4k s ILE 177 Cb -0.01 -2.87 0.06 0.00 0.01 0.00 0.00 42.46 39.65 2w4k s ILE 177 CO -0.02 0.40 0.94 0.72 0.00 0.00 0.00 174.94 176.98 2w4k s PHE 178 N 1.16 -0.01 0.00 3.97 -0.71 -1.26 -5.14 117.98 116.00 2w4k s PHE 178 Ca 0.03 -0.42 0.00 0.00 -1.04 0.00 0.00 56.93 55.50 2w4k s PHE 178 Cb -0.14 0.71 0.00 0.00 -1.21 0.00 0.00 43.02 42.37 2w4k s PHE 178 CO 0.02 -1.04 0.00 0.41 -1.34 0.00 0.00 175.22 173.27 2w4k n GLY 179 N -0.57 -2.84 3.62 1.99 0.00 -1.26 -4.87 105.19 101.26 2w4k n GLY 179 Ca -0.05 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.86 2w4k n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w4k s THR 180 N -0.88 5.07 0.27 2.61 2.01 -1.26 -4.98 115.64 118.47 2w4k s THR 180 Ca 0.00 0.88 -0.05 0.00 0.31 0.00 0.00 61.69 62.84 2w4k s THR 180 Cb 0.00 -3.83 0.34 0.00 0.01 0.00 0.00 72.50 69.02 2w4k s THR 180 CO 0.00 0.10 1.61 -0.65 -0.69 0.00 0.00 174.62 174.98 2w4k h PRO 181 N 7.96 0.06 0.00 4.92 0.11 -1.95 0.18 132.00 143.29 2w4k h PRO 181 Ca -0.29 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2w4k h PRO 181 Cb 1.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2w4k h PRO 181 CO 0.72 0.04 0.00 1.05 -0.21 0.00 0.00 178.00 179.60 2w4k h GLU 182 N 0.06 0.00 -0.01 1.05 4.11 -1.93 -3.10 114.58 114.77 2w4k h GLU 182 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.90 2w4k h GLU 182 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2w4k h GLU 182 CO -0.78 0.00 -0.27 1.19 0.07 0.00 0.00 179.01 179.22 2w4k n PHE 183 N -2.53 0.00 -3.36 2.06 3.01 0.00 -4.72 117.46 111.92 2w4k n PHE 183 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 2w4k n PHE 183 Cb 0.17 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.58 2w4k n PHE 183 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2w4k s VAL 184 N -1.51 4.88 0.73 -4.37 -7.23 -0.89 -4.35 120.40 107.65 2w4k s VAL 184 Ca 0.08 0.58 -0.11 0.00 -1.81 0.00 0.00 61.98 60.72 2w4k s VAL 184 Cb 0.08 -3.62 0.03 0.00 0.56 0.00 0.00 36.38 33.43 2w4k s VAL 184 CO 0.29 -0.08 1.07 0.00 -0.31 0.00 0.00 175.10 176.08 2w4k s ALA 185 N -1.83 2.50 0.41 1.32 0.00 -1.26 -4.88 121.76 118.01 2w4k s ALA 185 Ca 0.48 0.14 0.09 0.00 0.00 0.00 0.00 51.96 52.68 2w4k s ALA 185 Cb -0.11 -3.21 0.90 0.00 0.00 0.00 0.00 23.12 20.70 2w4k s ALA 185 CO 0.20 -1.45 2.01 -1.35 0.00 0.00 0.00 175.76 175.17 2w4k h PRO 186 N -0.89 0.53 0.00 0.00 0.11 -1.88 -1.80 132.00 128.06 2w4k h PRO 186 Ca -0.44 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2w4k h PRO 186 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2w4k h PRO 186 CO 0.55 0.35 -0.32 1.05 -0.21 0.00 0.00 178.00 179.41 2w4k h GLU 187 N 0.54 0.00 -0.16 1.05 9.09 -1.92 0.23 114.58 123.41 2w4k h GLU 187 Ca 0.23 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.58 2w4k h GLU 187 Cb 0.23 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.33 2w4k h GLU 187 CO -0.06 0.32 -0.13 0.82 0.05 0.00 0.00 179.01 180.01 2w4k h ILE 188 N 0.00 1.33 -0.49 -1.06 2.04 -1.62 0.58 117.51 118.29 2w4k h ILE 188 Ca -0.00 -1.25 0.04 0.00 1.00 0.00 0.00 64.86 64.64 2w4k h ILE 188 Cb 0.57 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 2w4k h ILE 188 CO 0.04 0.37 0.26 0.58 0.00 0.00 0.00 178.15 179.40 2w4k h VAL 189 N 0.01 0.98 -0.50 1.67 2.07 -1.00 -2.85 116.25 116.63 2w4k h VAL 189 Ca 0.03 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2w4k h VAL 189 Cb 0.64 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2w4k h VAL 189 CO 0.03 0.09 0.00 0.59 0.02 0.00 0.00 177.57 178.31 2w4k n ASN 190 N -4.87 2.76 -3.67 0.57 5.03 0.02 -4.93 115.26 110.17 2w4k n ASN 190 Ca 0.04 -2.03 -0.23 0.00 0.87 0.00 0.00 54.58 53.23 2w4k n ASN 190 Cb 0.12 -0.35 0.05 0.00 -1.02 0.00 0.00 39.78 38.58 2w4k n ASN 190 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2w4k n TYR 191 N 0.94 -2.23 -3.51 3.10 9.36 -0.95 -5.00 117.16 118.88 2w4k n TYR 191 Ca 0.17 0.91 -0.20 0.00 3.32 0.00 0.00 57.90 62.09 2w4k n TYR 191 Cb 0.45 -4.58 -0.03 0.00 -0.63 0.00 0.00 39.34 34.55 2w4k n TYR 191 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2w4k s GLU 192 N -6.02 2.60 0.16 2.98 2.02 0.16 -4.87 118.70 115.72 2w4k s GLU 192 Ca 0.24 -1.46 -0.34 0.00 0.02 0.00 0.00 54.97 53.43 2w4k s GLU 192 Cb -0.11 -2.45 -0.14 0.00 0.10 0.00 0.00 34.13 31.52 2w4k s GLU 192 CO 0.78 -0.17 1.52 -2.30 0.02 0.00 0.00 175.26 175.11 2w4k n PRO 193 N -1.58 1.97 -4.15 0.39 -0.02 -1.26 -4.63 135.00 125.73 2w4k n PRO 193 Ca 0.04 0.71 -0.24 0.00 -2.02 0.00 0.00 63.50 61.98 2w4k n PRO 193 Cb 0.61 -2.44 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 2w4k n PRO 193 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2w4k s LEU 194 N 0.76 3.62 0.00 2.45 1.43 0.32 -4.95 118.68 122.32 2w4k s LEU 194 Ca 0.79 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 2w4k s LEU 194 Cb -0.72 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 43.29 2w4k s LEU 194 CO 0.40 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.62 2w4k n GLY 195 N -0.64 3.05 0.16 -3.19 0.00 -1.26 -4.53 105.19 98.78 2w4k n GLY 195 Ca -0.08 -0.53 0.13 0.00 0.00 0.00 0.00 46.02 45.54 2w4k n GLY 195 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2w4k h LEU 196 N 0.00 0.00 -0.95 0.99 3.38 -1.96 -3.30 115.31 113.47 2w4k h LEU 196 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2w4k h LEU 196 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2w4k h LEU 196 CO 0.00 0.00 -0.21 -0.33 0.09 0.00 0.00 178.44 177.99 2w4k h GLU 197 N 0.00 0.52 -0.82 1.13 3.07 -1.95 -3.07 114.58 113.46 2w4k h GLU 197 Ca 0.00 -0.19 0.09 0.00 -0.50 0.00 0.00 59.36 58.77 2w4k h GLU 197 Cb 0.43 -0.04 -0.07 0.00 -0.84 0.00 0.00 28.75 28.23 2w4k h GLU 197 CO 0.00 0.70 0.47 0.00 -1.40 0.00 0.00 179.01 178.78 2w4k h ALA 198 N 1.31 1.16 -0.80 3.43 0.00 -1.97 -0.99 119.26 121.40 2w4k h ALA 198 Ca 0.07 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2w4k h ALA 198 Cb 0.63 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2w4k h ALA 198 CO 0.04 0.11 0.53 -0.44 0.00 0.00 0.00 179.25 179.49 2w4k h ASP 199 N 0.80 0.88 -0.50 0.00 3.32 -1.79 -1.59 116.42 117.54 2w4k h ASP 199 Ca 0.39 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.37 2w4k h ASP 199 Cb 0.34 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2w4k h ASP 199 CO -0.24 0.62 0.10 0.24 -1.72 0.00 0.00 179.24 178.24 2w4k h MET 200 N 1.03 0.81 -0.07 3.56 2.86 -1.26 -0.92 114.93 120.93 2w4k h MET 200 Ca 0.31 -0.21 0.04 0.00 -2.06 0.00 0.00 59.70 57.78 2w4k h MET 200 Cb -0.03 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 31.47 2w4k h MET 200 CO -0.08 0.80 -0.29 2.35 1.06 0.00 0.00 176.91 180.75 2w4k h TRP 201 N 0.70 -0.78 -0.92 -0.22 2.91 -1.00 -1.88 115.95 114.75 2w4k h TRP 201 Ca 0.15 0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.33 2w4k h TRP 201 Cb 0.36 0.36 -0.07 0.00 -0.51 0.00 0.00 29.16 29.30 2w4k h TRP 201 CO 0.02 -0.37 0.59 0.77 -1.03 0.00 0.00 178.44 178.42 2w4k h SER 202 N -0.39 0.75 -0.69 2.65 0.02 -0.99 0.68 113.55 115.59 2w4k h SER 202 Ca 0.08 0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 2w4k h SER 202 Cb 0.51 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 2w4k h SER 202 CO -0.30 0.40 0.26 0.40 -1.14 0.00 0.00 176.83 176.45 2w4k h ILE 203 N 0.81 1.25 -0.75 3.27 2.04 -0.82 -0.08 117.51 123.22 2w4k h ILE 203 Ca 0.46 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 65.52 2w4k h ILE 203 Cb 0.61 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 2w4k h ILE 203 CO -0.22 0.32 0.50 1.23 0.00 0.00 0.00 178.15 179.98 2w4k h GLY 204 N 1.09 1.05 0.88 5.37 0.00 -0.08 -0.29 103.07 111.09 2w4k h GLY 204 Ca 0.23 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2w4k h GLY 204 CO -0.02 0.39 0.06 -2.08 0.00 0.00 0.00 176.54 174.89 2w4k h VAL 205 N 1.02 1.16 -0.58 4.60 2.07 -0.95 -0.67 116.25 122.90 2w4k h VAL 205 Ca 0.27 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.37 2w4k h VAL 205 Cb -0.12 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 2w4k h VAL 205 CO -0.06 0.15 0.29 0.40 0.02 0.00 0.00 177.57 178.37 2w4k h ILE 206 N 0.11 0.93 -0.19 4.57 2.04 -0.71 -1.75 117.51 122.51 2w4k h ILE 206 Ca 0.05 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 2w4k h ILE 206 Cb 0.18 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2w4k h ILE 206 CO -0.00 0.10 0.02 0.74 0.00 0.00 0.00 178.15 179.01 2w4k h THR 207 N 0.55 1.23 -0.48 -0.27 2.02 -0.88 0.95 112.91 116.04 2w4k h THR 207 Ca 0.26 -0.78 0.10 0.00 0.77 0.00 0.00 66.41 66.76 2w4k h THR 207 Cb 0.19 1.37 -0.09 0.00 -1.74 0.00 0.00 68.15 67.88 2w4k h THR 207 CO -0.19 0.24 -0.14 0.22 0.37 0.00 0.00 175.52 176.02 2w4k h TYR 208 N 0.11 -0.32 -0.47 3.16 5.03 -0.89 -1.52 116.97 122.07 2w4k h TYR 208 Ca 0.06 0.05 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 2w4k h TYR 208 Cb 0.34 0.21 -0.02 0.00 1.55 0.00 0.00 36.73 38.81 2w4k h TYR 208 CO 0.02 -0.23 0.13 0.82 -1.32 0.00 0.00 178.16 177.59 2w4k h ILE 209 N -0.03 1.23 -0.91 1.81 2.04 -0.97 -2.55 117.51 118.12 2w4k h ILE 209 Ca 0.23 -0.78 0.15 0.00 1.00 0.00 0.00 64.86 65.46 2w4k h ILE 209 Cb 0.38 0.85 -0.09 0.00 -0.74 0.00 0.00 36.82 37.22 2w4k h ILE 209 CO -0.51 0.28 0.52 0.25 0.00 0.00 0.00 178.15 178.69 2w4k h LEU 210 N 0.62 0.68 0.00 1.44 6.46 -0.16 0.17 115.31 124.52 2w4k h LEU 210 Ca 0.15 0.08 -0.10 0.00 -0.12 0.00 0.00 57.88 57.89 2w4k h LEU 210 Cb 0.29 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 2w4k h LEU 210 CO -0.00 0.30 -0.92 -0.07 -0.62 0.00 0.00 178.44 177.13 2w4k h LEU 211 N 0.74 0.00 0.00 2.25 3.38 -1.19 -3.41 115.31 117.07 2w4k h LEU 211 Ca 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.45 2w4k h LEU 211 Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2w4k h LEU 211 CO -0.34 0.38 -1.06 -1.54 0.09 0.00 0.00 178.44 175.97 2w4k n SER 212 N -2.97 4.76 -0.41 -0.43 3.41 -0.97 -1.24 113.62 115.77 2w4k n SER 212 Ca -0.03 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.53 2w4k n SER 212 Cb 0.72 0.68 -0.02 0.00 -0.26 0.00 0.00 64.21 65.32 2w4k n SER 212 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w4k n GLY 213 N 2.79 0.75 3.40 5.00 0.00 0.58 -4.11 105.19 113.61 2w4k n GLY 213 Ca -0.01 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 2w4k n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w4k s ALA 214 N -2.00 2.42 -0.21 4.61 0.00 -1.26 -4.38 121.76 120.93 2w4k s ALA 214 Ca 0.00 -1.37 -0.16 0.00 0.00 0.00 0.00 51.96 50.42 2w4k s ALA 214 Cb 0.00 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2w4k s ALA 214 CO 0.00 0.55 0.42 0.45 0.00 0.00 0.00 175.76 177.18 2w4k s SER 215 N -1.81 6.44 0.33 0.00 0.15 -1.26 -3.75 113.70 113.80 2w4k s SER 215 Ca 0.14 0.52 0.03 0.00 0.70 0.00 0.00 55.95 57.34 2w4k s SER 215 Cb -0.10 -2.24 0.58 0.00 -1.71 0.00 0.00 66.02 62.55 2w4k s SER 215 CO 0.06 -0.11 1.89 1.55 1.20 0.00 0.00 173.24 177.82 2w4k h PRO 216 N 7.49 0.62 -0.01 5.44 0.13 -1.90 -3.27 132.00 140.49 2w4k h PRO 216 Ca -0.35 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2w4k h PRO 216 Cb 1.16 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2w4k h PRO 216 CO 0.71 0.58 -0.07 1.19 -0.23 0.00 0.00 178.00 180.18 2w4k n PHE 217 N -4.31 0.00 -1.77 1.56 3.72 -1.26 -4.54 117.46 110.86 2w4k n PHE 217 Ca 0.02 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.00 2w4k n PHE 217 Cb 0.21 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.72 2w4k n PHE 217 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2w4k s LEU 218 N -0.98 4.03 0.00 4.37 2.96 -1.24 -4.41 118.68 123.41 2w4k s LEU 218 Ca 0.06 2.20 0.00 0.00 -0.22 0.00 0.00 54.13 56.17 2w4k s LEU 218 Cb 0.05 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.22 2w4k s LEU 218 CO 0.12 -1.35 0.00 0.61 -1.32 0.00 0.00 176.35 174.41 2w4k n GLY 219 N 4.89 2.16 0.12 7.98 0.00 -1.26 -4.94 105.19 114.13 2w4k n GLY 219 Ca 0.22 -2.10 0.13 0.00 0.00 0.00 0.00 46.02 44.28 2w4k n GLY 219 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2w4k n ASP 220 N -1.69 0.66 -4.05 1.61 8.00 -1.26 -4.76 116.55 115.06 2w4k n ASP 220 Ca 0.00 -0.50 -0.09 0.00 0.71 0.00 0.00 54.79 54.90 2w4k n ASP 220 Cb 0.00 0.09 -0.09 0.00 -0.02 0.00 0.00 41.12 41.11 2w4k n ASP 220 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2w4k s THR 221 N -2.71 0.10 0.14 -3.53 -4.23 -1.26 -5.02 115.64 99.14 2w4k s THR 221 Ca 0.20 -1.66 -0.23 0.00 -1.18 0.00 0.00 61.69 58.82 2w4k s THR 221 Cb 0.19 -1.86 0.01 0.00 1.34 0.00 0.00 72.50 72.17 2w4k s THR 221 CO 0.58 -0.47 1.63 0.50 -0.54 0.00 0.00 174.62 176.31 2w4k h LYS 222 N 2.77 -0.28 -0.94 3.99 3.64 -2.00 0.18 116.57 123.93 2w4k h LYS 222 Ca -0.34 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.20 2w4k h LYS 222 Cb 1.20 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 33.01 2w4k h LYS 222 CO 0.56 -0.19 0.60 1.96 -2.27 0.00 0.00 179.45 180.11 2w4k h GLN 223 N -0.29 0.80 -0.18 1.90 7.50 -1.99 -0.37 115.11 122.48 2w4k h GLN 223 Ca 0.12 -0.05 -0.18 0.00 0.50 0.00 0.00 58.65 59.04 2w4k h GLN 223 Cb 0.47 -0.18 0.01 0.00 0.05 0.00 0.00 27.48 27.82 2w4k h GLN 223 CO -0.35 0.53 -0.60 1.49 -1.50 0.00 0.00 178.83 178.40 2w4k h GLU 224 N 0.82 0.72 -0.42 1.46 4.81 -1.79 -2.10 114.58 118.08 2w4k h GLU 224 Ca 0.47 -0.54 0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2w4k h GLU 224 Cb 0.63 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 2w4k h GLU 224 CO -0.24 1.16 0.13 1.15 -0.73 0.00 0.00 179.01 180.48 2w4k h THR 225 N 0.43 0.85 -0.55 0.32 2.02 0.11 -0.50 112.91 115.59 2w4k h THR 225 Ca -0.03 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 2w4k h THR 225 Cb 1.23 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 68.15 2w4k h THR 225 CO 0.13 0.05 0.18 -0.07 0.37 0.00 0.00 175.52 176.18 2w4k h LEU 226 N 0.29 0.75 -0.58 2.58 3.38 -1.07 -0.97 115.31 119.69 2w4k h LEU 226 Ca 0.20 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 2w4k h LEU 226 Cb 0.20 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2w4k h LEU 226 CO -0.21 0.71 -0.14 0.00 0.09 0.00 0.00 178.44 178.89 2w4k h ALA 227 N 1.40 0.78 -0.38 1.53 0.00 -0.95 -1.05 119.26 120.60 2w4k h ALA 227 Ca 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2w4k h ALA 227 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2w4k h ALA 227 CO -0.01 0.66 0.24 -0.91 0.00 0.00 0.00 179.25 179.23 2w4k h ASN 228 N 0.87 0.45 0.32 0.00 -0.26 -0.38 -0.95 115.58 115.63 2w4k h ASN 228 Ca 0.13 -0.04 -0.01 0.00 -0.56 0.00 0.00 56.30 55.82 2w4k h ASN 228 Cb 0.70 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.84 2w4k h ASN 228 CO 0.05 0.36 -0.23 0.58 -1.06 0.00 0.00 177.43 177.13 2w4k h VAL 229 N 0.50 0.51 -0.97 2.81 2.07 -1.08 0.22 116.25 120.31 2w4k h VAL 229 Ca 0.14 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.73 2w4k h VAL 229 Cb -0.02 0.51 -0.07 0.00 -1.52 0.00 0.00 31.29 30.19 2w4k h VAL 229 CO -0.03 0.00 0.63 -1.28 0.02 0.00 0.00 177.57 176.91 2w4k h SER 230 N -0.55 0.98 0.35 0.57 0.87 -1.08 -0.07 113.55 114.62 2w4k h SER 230 Ca -0.02 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2w4k h SER 230 Cb 0.47 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 2w4k h SER 230 CO 0.00 0.62 -0.08 0.00 -0.53 0.00 0.00 176.83 176.84 2w4k n ALA 231 N -2.38 2.71 -3.94 6.23 0.00 -0.37 -4.91 120.51 117.85 2w4k n ALA 231 Ca 0.15 -0.25 -0.27 0.00 0.00 0.00 0.00 53.44 53.07 2w4k n ALA 231 Cb 0.20 -1.37 -0.00 0.00 0.00 0.00 0.00 19.45 18.28 2w4k n ALA 231 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2w4k n VAL 232 N -0.97 -2.84 -2.91 0.00 0.31 -0.04 -4.90 118.33 106.97 2w4k n VAL 232 Ca 0.15 -0.33 -0.44 0.00 -0.01 0.00 0.00 64.34 63.72 2w4k n VAL 232 Cb 0.26 -2.76 -0.03 0.00 -0.91 0.00 0.00 33.84 30.40 2w4k n VAL 232 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2w4k s ASN 233 N -4.01 6.50 0.10 4.52 3.04 0.62 -4.97 114.94 120.74 2w4k s ASN 233 Ca 0.24 -1.77 -0.06 0.00 0.04 0.00 0.00 52.86 51.32 2w4k s ASN 233 Cb -0.13 -2.40 -0.02 0.00 -1.54 0.00 0.00 41.25 37.16 2w4k s ASN 233 CO 0.87 -1.16 0.14 -0.72 -3.04 0.00 0.00 177.10 173.18 2w4k s TYR 234 N 3.05 0.40 0.05 0.43 1.13 -1.26 -4.68 117.35 116.46 2w4k s TYR 234 Ca 0.30 -0.83 0.00 0.00 -1.41 0.00 0.00 57.07 55.13 2w4k s TYR 234 Cb -0.08 -0.20 -0.03 0.00 -1.10 0.00 0.00 41.96 40.54 2w4k s TYR 234 CO -0.04 -0.54 -0.05 -1.21 -2.51 0.00 0.00 175.55 171.20 2w4k s GLU 235 N -3.92 0.56 -1.19 -3.49 0.41 -1.26 -5.06 118.70 104.74 2w4k s GLU 235 Ca 0.11 -1.00 -0.11 0.00 -0.41 0.00 0.00 54.97 53.55 2w4k s GLU 235 Cb 0.06 0.02 0.20 0.00 -1.78 0.00 0.00 34.13 32.63 2w4k s GLU 235 CO -0.07 -0.05 1.43 1.19 -0.49 0.00 0.00 175.26 177.27 2w4k n PHE 236 N 0.71 4.62 -1.68 1.61 3.72 -1.26 -5.01 117.46 120.18 2w4k n PHE 236 Ca -0.18 -3.37 -0.46 0.00 -0.05 0.00 0.00 57.45 53.39 2w4k n PHE 236 Cb 0.58 -1.99 -0.04 0.00 -0.94 0.00 0.00 39.48 37.09 2w4k n PHE 236 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2w4k n GLU 237 N 4.46 2.27 0.04 -1.08 -0.58 -1.26 -4.75 120.64 119.74 2w4k n GLU 237 Ca 0.34 0.82 0.17 0.00 -0.42 0.00 0.00 57.16 58.07 2w4k n GLU 237 Cb 0.40 -2.64 0.66 0.00 -0.57 0.00 0.00 31.44 29.30 2w4k n GLU 237 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2w4k h ASP 238 N 7.60 0.03 -0.31 1.62 3.32 -1.95 0.12 116.42 126.84 2w4k h ASP 238 Ca -0.46 0.00 0.09 0.00 0.02 0.00 0.00 57.03 56.68 2w4k h ASP 238 Cb 1.26 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 2w4k h ASP 238 CO 0.92 0.02 0.32 -0.08 -1.72 0.00 0.00 179.24 178.69 2w4k h GLU 239 N 0.03 0.00 0.00 3.56 4.81 -2.02 -2.80 114.58 118.16 2w4k h GLU 239 Ca 0.21 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 2w4k h GLU 239 Cb 0.79 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.15 2w4k h GLU 239 CO -0.01 0.00 -1.35 0.66 -0.73 0.00 0.00 179.01 177.58 2w4k n TYR 240 N -3.86 0.00 -0.38 0.92 4.02 0.08 -4.79 117.16 113.15 2w4k n TYR 240 Ca 0.05 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 58.00 2w4k n TYR 240 Cb 0.47 -0.25 0.17 0.00 -0.02 0.00 0.00 39.34 39.71 2w4k n TYR 240 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2w4k n PHE 241 N -2.24 0.54 0.03 -0.72 3.01 0.19 -4.68 117.46 113.59 2w4k n PHE 241 Ca -0.09 -0.60 0.13 0.00 1.01 0.00 0.00 57.45 57.91 2w4k n PHE 241 Cb 0.66 -0.10 0.59 0.00 -0.01 0.00 0.00 39.48 40.62 2w4k n PHE 241 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2w4k h SER 242 N 1.79 0.16 -0.47 4.37 4.64 -1.71 -2.34 113.55 119.98 2w4k h SER 242 Ca 0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.15 2w4k h SER 242 Cb 0.90 -0.03 -0.10 0.00 -0.31 0.00 0.00 62.40 62.85 2w4k h SER 242 CO 0.06 0.10 0.10 0.59 -0.87 0.00 0.00 176.83 176.81 2w4k n ASN 243 N -4.46 3.48 -4.71 4.97 5.03 -1.26 -4.97 115.26 113.35 2w4k n ASN 243 Ca 0.07 -3.43 -0.35 0.00 0.87 0.00 0.00 54.58 51.73 2w4k n ASN 243 Cb 0.37 -0.65 -0.09 0.00 -1.02 0.00 0.00 39.78 38.39 2w4k n ASN 243 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2w4k s THR 244 N -3.09 5.10 0.82 3.41 2.01 -0.88 -2.93 115.64 120.09 2w4k s THR 244 Ca 0.47 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.44 2w4k s THR 244 Cb 0.40 -3.29 0.09 0.00 0.01 0.00 0.00 72.50 69.71 2w4k s THR 244 CO 0.06 0.48 1.11 -0.94 -0.69 0.00 0.00 174.62 174.65 2w4k s SER 245 N 0.11 3.95 0.23 3.53 1.04 -1.26 -4.90 113.70 116.39 2w4k s SER 245 Ca 0.07 1.96 -0.03 0.00 0.48 0.00 0.00 55.95 58.43 2w4k s SER 245 Cb -0.12 -2.54 0.23 0.00 0.10 0.00 0.00 66.02 63.69 2w4k s SER 245 CO -0.00 -2.41 1.65 0.00 0.98 0.00 0.00 173.24 173.46 2w4k h ALA 246 N -1.36 0.93 -0.82 5.32 0.00 -1.98 -2.53 119.26 118.83 2w4k h ALA 246 Ca -0.43 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 2w4k h ALA 246 Cb 1.25 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2w4k h ALA 246 CO 0.48 0.62 0.45 -0.07 0.00 0.00 0.00 179.25 180.72 2w4k h LEU 247 N 0.65 1.02 -0.50 0.00 3.38 -1.99 -0.61 115.31 117.26 2w4k h LEU 247 Ca 0.09 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2w4k h LEU 247 Cb 0.70 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2w4k h LEU 247 CO 0.05 0.82 0.19 0.00 0.09 0.00 0.00 178.44 179.59 2w4k h ALA 248 N 1.24 0.65 -0.56 1.53 0.00 -1.90 -0.66 119.26 119.56 2w4k h ALA 248 Ca 0.29 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2w4k h ALA 248 Cb 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2w4k h ALA 248 CO -0.05 0.27 0.06 0.87 0.00 0.00 0.00 179.25 180.40 2w4k h LYS 249 N 0.67 0.92 -0.48 0.00 1.57 -1.15 -1.95 116.57 116.16 2w4k h LYS 249 Ca 0.17 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 2w4k h LYS 249 Cb 0.21 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2w4k h LYS 249 CO -0.01 0.87 0.00 0.22 -0.57 0.00 0.00 179.45 179.96 2w4k h ASP 250 N 0.86 0.82 -0.27 0.86 1.82 -0.99 0.82 116.42 120.35 2w4k h ASP 250 Ca 0.17 -0.31 0.06 0.00 -0.39 0.00 0.00 57.03 56.57 2w4k h ASP 250 Cb 0.43 -0.22 -0.06 0.00 0.68 0.00 0.00 39.33 40.15 2w4k h ASP 250 CO 0.01 0.93 -0.15 0.15 -1.61 0.00 0.00 179.24 178.57 2w4k h PHE 251 N 0.70 -0.38 -0.32 0.28 3.04 -0.79 -1.71 116.94 117.76 2w4k h PHE 251 Ca 0.14 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 62.11 2w4k h PHE 251 Cb 0.50 0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.21 2w4k h PHE 251 CO 0.04 -0.23 0.18 0.82 -2.02 0.00 0.00 178.31 177.11 2w4k h ILE 252 N -0.13 1.12 -0.72 1.41 2.04 -1.22 -2.96 117.51 117.05 2w4k h ILE 252 Ca 0.14 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2w4k h ILE 252 Cb 0.34 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 2w4k h ILE 252 CO -0.35 0.12 0.47 -0.09 0.00 0.00 0.00 178.15 178.31 2w4k h ARG 253 N 0.40 0.81 0.00 2.37 2.43 -0.56 0.98 114.38 120.82 2w4k h ARG 253 Ca 0.11 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2w4k h ARG 253 Cb 0.03 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2w4k h ARG 253 CO -0.02 0.54 0.00 0.00 -1.51 0.00 0.00 179.97 178.98 2w4k h ARG 254 N 0.84 0.00 0.07 0.20 3.08 -1.20 -3.23 114.38 114.13 2w4k h ARG 254 Ca 0.29 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.98 2w4k h ARG 254 Cb 0.12 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 2w4k h ARG 254 CO -0.09 0.00 -2.13 1.28 -1.07 0.00 0.00 179.97 177.97 2w4k n LEU 255 N -2.42 2.37 -3.70 3.04 4.77 -0.33 -1.20 117.00 119.54 2w4k n LEU 255 Ca 0.04 0.12 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 2w4k n LEU 255 Cb 0.36 -0.82 -0.00 0.00 -2.33 0.00 0.00 43.42 40.63 2w4k n LEU 255 CO 0.27 0.80 2.41 0.18 -1.33 0.00 0.00 177.39 179.72 2w4k n LEU 256 N -3.33 7.19 -4.20 2.23 4.77 0.19 -4.18 117.00 119.68 2w4k n LEU 256 Ca -0.34 -4.51 -0.32 0.00 -0.03 0.00 0.00 56.01 50.81 2w4k n LEU 256 Cb 1.04 -1.52 -0.17 0.00 -2.33 0.00 0.00 43.42 40.44 2w4k n LEU 256 CO 0.38 1.49 -0.55 -0.69 -1.33 0.00 0.00 177.39 176.69 2w4k s VAL 257 N 1.17 2.05 0.08 4.08 1.01 -1.26 -4.92 120.40 122.61 2w4k s VAL 257 Ca 0.47 -1.00 -0.24 0.00 0.00 0.00 0.00 61.98 61.22 2w4k s VAL 257 Cb 0.13 -1.79 -0.16 0.00 0.00 0.00 0.00 36.38 34.57 2w4k s VAL 257 CO -0.05 0.55 1.70 0.50 0.00 0.00 0.00 175.10 177.81 2w4k h LYS 258 N 6.98 -0.06 -6.28 2.72 3.64 -1.95 -3.41 116.57 118.21 2w4k h LYS 258 Ca -0.25 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.57 2w4k h LYS 258 Cb 1.22 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 33.02 2w4k h LYS 258 CO 0.51 -0.01 1.03 0.34 -2.27 0.00 0.00 179.45 179.05 2w4k s ASP 259 N -5.17 6.60 0.44 4.20 -1.08 -1.26 -4.78 116.67 115.61 2w4k s ASP 259 Ca -0.13 1.53 0.13 0.00 -0.52 0.00 0.00 52.55 53.56 2w4k s ASP 259 Cb 0.06 -2.54 1.02 0.00 -1.46 0.00 0.00 42.92 40.00 2w4k s ASP 259 CO 0.66 -1.09 2.00 -0.65 0.52 0.00 0.00 175.17 176.61 2w4k h PRO 260 N 9.70 0.40 0.00 4.34 0.11 -1.97 -1.72 132.00 142.85 2w4k h PRO 260 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2w4k h PRO 260 Cb 1.13 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2w4k h PRO 260 CO 1.00 0.26 0.00 0.87 -0.21 0.00 0.00 178.00 179.93 2w4k h LYS 261 N 0.41 0.00 -0.00 1.05 1.57 -1.95 -2.62 116.57 115.03 2w4k h LYS 261 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2w4k h LYS 261 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2w4k h LYS 261 CO -0.07 0.00 -0.84 1.63 -0.57 0.00 0.00 179.45 179.60 2w4k n LYS 262 N -2.86 0.86 -2.31 3.15 4.76 -0.68 -4.98 118.16 116.10 2w4k n LYS 262 Ca 0.01 -0.08 -0.36 0.00 -2.87 0.00 0.00 58.31 55.01 2w4k n LYS 262 Cb 0.30 -1.39 -0.01 0.00 -1.84 0.00 0.00 35.03 32.10 2w4k n LYS 262 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2w4k s ARG 263 N -2.72 3.63 0.33 1.97 3.52 -0.99 -4.98 118.95 119.71 2w4k s ARG 263 Ca 0.08 1.65 -0.29 0.00 -0.13 0.00 0.00 55.73 57.04 2w4k s ARG 263 Cb 0.14 -2.22 -0.11 0.00 -1.56 0.00 0.00 34.95 31.20 2w4k s ARG 263 CO 0.75 -0.63 1.53 -1.64 -0.81 0.00 0.00 175.30 174.49 2w4k s MET 264 N -2.97 4.12 0.66 5.12 -1.94 -0.34 -5.01 119.30 118.93 2w4k s MET 264 Ca 0.67 2.56 -0.08 0.00 -1.71 0.00 0.00 55.69 57.13 2w4k s MET 264 Cb -0.25 -3.00 0.03 0.00 2.01 0.00 0.00 34.83 33.62 2w4k s MET 264 CO 0.30 -0.57 0.99 0.95 -0.01 0.00 0.00 175.02 176.68 2w4k s THR 265 N -0.58 3.23 0.20 2.05 -4.23 -1.26 -4.87 115.64 110.17 2w4k s THR 265 Ca 0.58 0.08 -0.11 0.00 -1.18 0.00 0.00 61.69 61.05 2w4k s THR 265 Cb -0.47 -3.34 0.11 0.00 1.34 0.00 0.00 72.50 70.14 2w4k s THR 265 CO 0.55 -0.39 1.81 -0.29 -0.54 0.00 0.00 174.62 175.77 2w4k h ILE 266 N -0.45 1.00 -0.79 2.99 6.09 -1.95 -0.56 117.51 123.85 2w4k h ILE 266 Ca -0.45 -0.23 -0.04 0.00 -1.37 0.00 0.00 64.86 62.78 2w4k h ILE 266 Cb 1.27 0.29 -0.04 0.00 0.47 0.00 0.00 36.82 38.81 2w4k h ILE 266 CO 0.62 0.12 0.35 0.06 -3.07 0.00 0.00 178.15 176.23 2w4k h GLN 267 N 0.66 1.14 -0.08 2.19 -0.00 -1.97 -2.13 115.11 114.93 2w4k h GLN 267 Ca 0.26 -0.18 -0.12 0.00 -0.00 0.00 0.00 58.65 58.61 2w4k h GLN 267 Cb 0.11 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.48 27.38 2w4k h GLN 267 CO -0.15 0.90 -0.50 -0.44 -0.00 0.00 0.00 178.83 178.64 2w4k h ASP 268 N 1.13 0.23 -0.29 0.06 3.32 -1.85 -2.96 116.42 116.05 2w4k h ASP 268 Ca 0.27 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2w4k h ASP 268 Cb 0.16 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2w4k h ASP 268 CO -0.03 0.69 0.09 0.77 -1.72 0.00 0.00 179.24 179.05 2w4k h SER 269 N 0.17 0.48 0.94 6.45 4.64 -0.47 -0.94 113.55 124.82 2w4k h SER 269 Ca 0.01 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 2w4k h SER 269 Cb 0.95 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.91 2w4k h SER 269 CO 0.08 0.49 -0.17 -0.07 -0.87 0.00 0.00 176.83 176.28 2w4k h LEU 270 N 0.52 0.00 -0.45 5.97 3.38 -1.27 -2.85 115.31 120.61 2w4k h LEU 270 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2w4k h LEU 270 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2w4k h LEU 270 CO -0.00 0.17 -0.65 0.00 0.09 0.00 0.00 178.44 178.05 2w4k n GLN 271 N -3.34 0.58 -1.74 1.13 1.13 -0.69 -4.37 117.38 110.08 2w4k n GLN 271 Ca 0.00 -0.45 -0.42 0.00 -1.94 0.00 0.00 57.00 54.19 2w4k n GLN 271 Cb 0.40 -1.49 -0.01 0.00 0.11 0.00 0.00 30.24 29.25 2w4k n GLN 271 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 2w4k n HIS 272 N -0.81 2.69 0.33 1.08 -0.00 -0.44 -4.62 115.22 113.45 2w4k n HIS 272 Ca 0.07 0.40 0.22 0.00 0.46 0.00 0.00 57.72 58.87 2w4k n HIS 272 Cb 0.39 -2.52 1.18 0.00 -0.12 0.00 0.00 29.99 28.92 2w4k n HIS 272 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2w4k h PRO 273 N 3.69 0.00 -0.08 1.57 0.13 -1.91 0.23 132.00 135.63 2w4k h PRO 273 Ca -0.48 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 2w4k h PRO 273 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2w4k h PRO 273 CO 0.71 0.00 -0.56 2.35 -0.23 0.00 0.00 178.00 180.26 2w4k h TRP 274 N 0.00 0.32 0.15 1.56 7.01 -1.89 -2.56 115.95 120.55 2w4k h TRP 274 Ca 0.00 -0.12 -0.32 0.00 2.11 0.00 0.00 58.89 60.57 2w4k h TRP 274 Cb 0.03 -0.06 0.00 0.00 -2.10 0.00 0.00 29.16 27.04 2w4k h TRP 274 CO 0.00 0.76 -1.59 0.82 -2.79 0.00 0.00 178.44 175.64 2w4k h ILE 275 N 0.20 0.98 -2.74 2.65 1.08 -1.16 -3.43 117.51 115.09 2w4k h ILE 275 Ca -0.00 -2.46 -0.60 0.00 -0.39 0.00 0.00 64.86 61.41 2w4k h ILE 275 Cb 1.05 2.75 -0.40 0.00 -3.07 0.00 0.00 36.82 37.15 2w4k h ILE 275 CO 0.09 0.79 -0.78 -0.75 -0.69 0.00 0.00 178.15 176.81 2w4k s LYS 276 N -2.53 1.59 0.31 2.37 2.20 0.57 -5.02 119.74 119.23 2w4k s LYS 276 Ca -0.18 -2.60 -0.29 0.00 -0.36 0.00 0.00 55.97 52.55 2w4k s LYS 276 Cb 0.05 -2.36 -0.13 0.00 -1.51 0.00 0.00 37.83 33.88 2w4k s LYS 276 CO 0.81 -1.32 1.24 -2.30 -0.36 0.00 0.00 175.35 173.43 2w4k n PRO 277 N 2.59 1.92 0.05 4.03 -0.02 -0.96 -4.18 135.00 138.42 2w4k n PRO 277 Ca 0.23 0.67 0.12 0.00 -2.02 0.00 0.00 63.50 62.50 2w4k n PRO 277 Cb 0.41 -2.21 0.12 0.00 -0.02 0.00 0.00 33.50 31.79 2w4k n PRO 277 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2w4k n LYS 278 N 0.84 0.30 -3.20 -0.52 5.02 -1.26 -4.95 118.16 114.39 2w4k n LYS 278 Ca 0.07 0.06 -0.09 0.00 -2.02 0.00 0.00 58.31 56.32 2w4k n LYS 278 Cb 0.34 -1.66 -0.01 0.00 -0.02 0.00 0.00 35.03 33.69 2w4k n LYS 278 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2w4k n ASP 279 N -2.07 -1.21 -0.17 4.39 5.68 -1.26 -5.07 116.55 116.84 2w4k n ASP 279 Ca 0.03 -2.29 -0.10 0.00 -0.50 0.00 0.00 54.79 51.92 2w4k n ASP 279 Cb 0.44 2.15 0.00 0.00 -1.14 0.00 0.00 41.12 42.57 2w4k n ASP 279 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2w4k h THR 280 N 1.72 1.27 -0.57 2.12 2.02 -1.99 -2.73 112.91 114.75 2w4k h THR 280 Ca -0.21 -1.18 -0.02 0.00 0.77 0.00 0.00 66.41 65.78 2w4k h THR 280 Cb 0.87 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 2w4k h THR 280 CO 0.28 0.41 0.30 1.56 0.37 0.00 0.00 175.52 178.43 2w4k h GLN 281 N 0.75 0.81 -0.36 6.66 7.50 -1.99 0.36 115.11 128.85 2w4k h GLN 281 Ca 0.13 -0.11 -0.01 0.00 0.50 0.00 0.00 58.65 59.16 2w4k h GLN 281 Cb 0.60 -0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.96 2w4k h GLN 281 CO 0.04 0.64 0.18 1.96 -1.50 0.00 0.00 178.83 180.15 2w4k h GLN 282 N 0.78 0.51 -0.36 1.46 4.20 -1.96 -1.61 115.11 118.12 2w4k h GLN 282 Ca 0.20 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.82 2w4k h GLN 282 Cb 0.08 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2w4k h GLN 282 CO -0.03 0.44 0.14 0.00 -0.67 0.00 0.00 178.83 178.72 2w4k h ALA 283 N 1.04 1.58 -0.10 3.87 0.00 -1.15 -2.67 119.26 121.82 2w4k h ALA 283 Ca 0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2w4k h ALA 283 Cb 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2w4k h ALA 283 CO -0.02 0.33 -0.10 -0.07 0.00 0.00 0.00 179.25 179.39 2w4k h LEU 284 N 0.51 0.27 -0.31 0.00 3.38 -0.55 -2.20 115.31 116.40 2w4k h LEU 284 Ca 0.13 -0.48 0.07 0.00 0.09 0.00 0.00 57.88 57.68 2w4k h LEU 284 Cb 0.11 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.70 2w4k h LEU 284 CO -0.01 0.70 -0.23 0.28 0.09 0.00 0.00 178.44 179.26 2w4k h SER 285 N -0.15 -0.76 -0.35 -0.43 0.02 -1.22 0.25 113.55 110.90 2w4k h SER 285 Ca 0.02 0.15 0.04 0.00 -0.84 0.00 0.00 61.79 61.16 2w4k h SER 285 Cb 0.62 0.37 -0.04 0.00 0.14 0.00 0.00 62.40 63.50 2w4k h SER 285 CO 0.03 -0.26 0.11 -0.09 -1.14 0.00 0.00 176.83 175.47 2w4k h ARG 286 N -0.20 0.24 -0.55 3.45 2.43 -1.48 0.15 114.38 118.42 2w4k h ARG 286 Ca 0.16 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 2w4k h ARG 286 Cb 0.45 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2w4k h ARG 286 CO -0.43 0.16 0.19 -0.22 -1.51 0.00 0.00 179.97 178.16 2w4k h LYS 287 N 0.25 0.85 -0.10 0.20 3.64 -1.07 -2.92 116.57 117.42 2w4k h LYS 287 Ca 0.16 -0.17 -0.08 0.00 -1.27 0.00 0.00 60.65 59.29 2w4k h LYS 287 Cb 0.15 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2w4k h LYS 287 CO -0.18 0.76 -0.29 0.00 -2.27 0.00 0.00 179.45 177.48 2w4k h ALA 288 N 1.05 1.34 -2.20 5.00 0.00 0.09 -3.43 119.26 121.11 2w4k h ALA 288 Ca 0.18 -0.31 -0.47 0.00 0.00 0.00 0.00 54.91 54.31 2w4k h ALA 288 Cb 0.26 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w4k h ALA 288 CO -0.01 0.46 0.34 -1.12 0.00 0.00 0.00 179.25 178.92 2w4k s SER 289 N -6.89 6.63 0.08 0.00 0.01 0.48 -4.99 113.70 109.02 2w4k s SER 289 Ca -0.04 1.52 0.04 0.00 1.31 0.00 0.00 55.95 58.77 2w4k s SER 289 Cb 0.14 -2.49 -0.03 0.00 0.21 0.00 0.00 66.02 63.85 2w4k s SER 289 CO 0.74 -0.55 -0.10 0.00 0.41 0.00 0.00 173.24 173.74 2w4k s ALA 290 N -2.57 1.00 0.56 1.44 0.00 -1.15 -1.39 121.76 119.66 2w4k s ALA 290 Ca 0.58 -1.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.26 2w4k s ALA 290 Cb -0.10 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 2w4k s ALA 290 CO 0.30 -0.01 1.25 0.08 0.00 0.00 0.00 175.76 177.38 2w4k s VAL 291 N -2.09 2.50 -1.14 0.00 1.01 0.59 -4.55 120.40 116.72 2w4k s VAL 291 Ca 0.01 0.34 -0.21 0.00 0.00 0.00 0.00 61.98 62.13 2w4k s VAL 291 Cb -0.05 -3.16 0.05 0.00 0.00 0.00 0.00 36.38 33.22 2w4k s VAL 291 CO 0.00 -0.04 1.59 0.21 0.00 0.00 0.00 175.10 176.87 2w4k s ASN 292 N -1.33 6.58 0.18 3.32 3.84 -0.37 -4.78 114.94 122.38 2w4k s ASN 292 Ca 0.73 -1.86 -0.08 0.00 0.21 0.00 0.00 52.86 51.86 2w4k s ASN 292 Cb -0.34 -2.57 0.06 0.00 -0.55 0.00 0.00 41.25 37.85 2w4k s ASN 292 CO 0.38 -1.42 1.57 -0.03 -2.79 0.00 0.00 177.10 174.81 2w4k h MET 293 N 8.88 0.92 -0.09 0.43 1.85 -1.92 0.40 114.93 125.40 2w4k h MET 293 Ca 0.30 -0.40 0.02 0.00 -0.61 0.00 0.00 59.70 59.02 2w4k h MET 293 Cb 0.95 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.93 2w4k h MET 293 CO 1.43 1.05 -0.05 1.49 -0.40 0.00 0.00 176.91 180.43 2w4k h GLU 294 N 0.79 -0.05 -0.37 0.39 4.22 -1.93 0.17 114.58 117.80 2w4k h GLU 294 Ca 0.10 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.43 2w4k h GLU 294 Cb 0.80 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2w4k h GLU 294 CO 0.07 -0.03 -0.23 0.87 -2.18 0.00 0.00 179.01 177.51 2w4k h LYS 295 N -0.05 0.80 -0.09 1.92 1.79 -1.78 -2.97 116.57 116.18 2w4k h LYS 295 Ca 0.06 -0.37 0.01 0.00 -2.18 0.00 0.00 60.65 58.17 2w4k h LYS 295 Cb 0.13 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2w4k h LYS 295 CO -0.12 1.00 -0.00 0.35 -1.08 0.00 0.00 179.45 179.59 2w4k h PHE 296 N 0.59 -0.01 -0.94 -1.35 3.57 0.02 -1.24 116.94 117.59 2w4k h PHE 296 Ca 0.08 0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.79 2w4k h PHE 296 Cb 0.79 0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.46 2w4k h PHE 296 CO 0.06 -0.01 0.61 0.87 -2.23 0.00 0.00 178.31 177.61 2w4k h LYS 297 N 0.03 0.47 -0.45 1.11 1.57 -0.69 -0.30 116.57 118.31 2w4k h LYS 297 Ca 0.04 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2w4k h LYS 297 Cb 0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2w4k h LYS 297 CO -0.07 0.31 -0.04 0.87 -0.57 0.00 0.00 179.45 179.95 2w4k h LYS 298 N 0.49 0.82 -0.55 3.15 1.57 -1.09 -2.82 116.57 118.14 2w4k h LYS 298 Ca 0.50 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 59.02 2w4k h LYS 298 Cb 1.14 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 2w4k h LYS 298 CO -0.23 0.90 0.34 0.35 -0.57 0.00 0.00 179.45 180.25 2w4k h PHE 299 N 0.66 0.64 0.00 -1.35 3.57 -0.24 -2.58 116.94 117.65 2w4k h PHE 299 Ca 0.12 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2w4k h PHE 299 Cb 0.56 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2w4k h PHE 299 CO 0.04 0.37 -0.19 0.00 -2.23 0.00 0.00 178.31 176.30 2w4k h ALA 300 N 1.23 1.19 0.00 2.41 0.00 -1.31 -1.50 119.26 121.28 2w4k h ALA 300 Ca 0.22 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2w4k h ALA 300 Cb -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2w4k h ALA 300 CO -0.08 0.24 -0.47 0.00 0.00 0.00 0.00 179.25 178.94 2w4k h ALA 301 N 1.81 0.90 0.00 0.00 0.00 -1.20 -3.48 119.26 117.28 2w4k h ALA 301 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2w4k h ALA 301 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2w4k h ALA 301 CO 0.03 0.58 0.00 2.89 0.00 0.00 0.00 179.25 182.75