#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cw4 s SER 3 N 0.00 6.12 0.00 1.62 0.15 -1.26 -4.93 113.70 115.41 1cw4 s SER 3 Ca 0.00 2.65 0.14 0.00 0.70 0.00 0.00 55.95 59.44 1cw4 s SER 3 Cb 0.00 -2.63 0.36 0.00 -1.71 0.00 0.00 66.02 62.04 1cw4 s SER 3 CO 0.00 -0.98 1.28 0.29 1.20 0.00 0.00 173.24 175.04 1cw4 n LYS 4 N -0.12 2.57 -2.83 5.44 5.02 -1.26 -4.95 118.16 122.02 1cw4 n LYS 4 Ca 0.05 -2.11 -0.41 0.00 -2.02 0.00 0.00 58.31 53.82 1cw4 n LYS 4 Cb 0.44 -1.35 -0.04 0.00 -0.02 0.00 0.00 35.03 34.07 1cw4 n LYS 4 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1cw4 s VAL 5 N -1.04 4.91 -0.33 -0.18 1.01 -1.26 -5.03 120.40 118.49 1cw4 s VAL 5 Ca 0.29 1.84 -0.09 0.00 0.00 0.00 0.00 61.98 64.02 1cw4 s VAL 5 Cb 0.15 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 32.33 1cw4 s VAL 5 CO 0.21 0.20 0.15 -0.69 0.00 0.00 0.00 175.10 174.97 1cw4 s VAL 6 N 0.88 4.35 -0.03 2.92 1.01 -1.26 -5.07 120.40 123.20 1cw4 s VAL 6 Ca 0.47 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 1cw4 s VAL 6 Cb -0.20 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 1cw4 s VAL 6 CO 0.25 -0.08 1.34 -0.69 0.00 0.00 0.00 175.10 175.92 1cw4 s VAL 7 N 1.54 3.90 0.21 2.92 1.01 -1.26 -4.78 120.40 123.94 1cw4 s VAL 7 Ca 0.02 1.25 -0.32 0.00 0.00 0.00 0.00 61.98 62.93 1cw4 s VAL 7 Cb -0.18 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.26 1cw4 s VAL 7 CO 0.05 -0.01 1.58 -2.65 0.00 0.00 0.00 175.10 174.06 1cw4 n PRO 8 N 5.46 2.34 -0.05 2.72 -0.02 -1.26 -4.91 135.00 139.28 1cw4 n PRO 8 Ca 0.13 0.84 -0.10 0.00 -2.02 0.00 0.00 63.50 62.34 1cw4 n PRO 8 Cb 0.44 -2.60 -0.04 0.00 -0.02 0.00 0.00 33.50 31.29 1cw4 n PRO 8 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1cw4 h ALA 9 N 5.59 0.26 -2.89 3.55 0.00 -2.00 -3.38 119.26 120.39 1cw4 h ALA 9 Ca -0.45 -0.04 -0.61 0.00 0.00 0.00 0.00 54.91 53.81 1cw4 h ALA 9 Cb 1.24 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.82 1cw4 h ALA 9 CO 0.86 -0.23 -0.29 1.14 0.00 0.00 0.00 179.25 180.73 1cw4 s GLN 10 N -6.02 4.11 0.00 0.00 0.00 -1.26 -4.97 119.66 111.52 1cw4 s GLN 10 Ca -0.13 0.04 0.00 0.00 -0.00 0.00 0.00 55.36 55.26 1cw4 s GLN 10 Cb 0.08 -3.56 0.00 0.00 0.00 0.00 0.00 33.01 29.53 1cw4 s GLN 10 CO 0.70 -0.07 0.00 0.41 0.00 0.00 0.00 175.29 176.33 1cw4 n GLY 11 N 4.20 4.27 2.99 2.60 0.00 -1.26 -4.81 105.19 113.19 1cw4 n GLY 11 Ca -0.10 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 1cw4 n GLY 11 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cw4 s LYS 12 N -3.20 0.46 0.29 1.61 2.20 0.12 -4.89 119.74 116.33 1cw4 s LYS 12 Ca 0.00 -0.39 -0.29 0.00 -0.36 0.00 0.00 55.97 54.93 1cw4 s LYS 12 Cb 0.00 -0.37 -0.10 0.00 -1.51 0.00 0.00 37.83 35.85 1cw4 s LYS 12 CO 0.00 0.09 1.26 0.21 -0.36 0.00 0.00 175.35 176.55 1cw4 s LYS 13 N -0.63 4.43 0.36 4.03 2.20 -1.26 -1.91 119.74 126.96 1cw4 s LYS 13 Ca -0.02 2.08 -0.25 0.00 -0.36 0.00 0.00 55.97 57.42 1cw4 s LYS 13 Cb -0.05 -3.12 -0.10 0.00 -1.51 0.00 0.00 37.83 33.05 1cw4 s LYS 13 CO 0.00 -0.10 0.99 0.42 -0.36 0.00 0.00 175.35 176.30 1cw4 s ILE 14 N -0.91 4.03 0.37 5.43 1.01 -1.26 -4.77 121.20 125.09 1cw4 s ILE 14 Ca 0.49 1.61 0.07 0.00 0.00 0.00 0.00 60.65 62.82 1cw4 s ILE 14 Cb -0.37 -3.86 -0.07 0.00 0.01 0.00 0.00 42.46 38.17 1cw4 s ILE 14 CO 0.47 0.06 -0.01 0.42 0.00 0.00 0.00 174.94 175.88 1cw4 s THR 15 N -1.67 1.87 -0.09 2.92 -4.23 -0.73 -4.70 115.64 109.02 1cw4 s THR 15 Ca 0.54 -2.06 0.02 0.00 -1.18 0.00 0.00 61.69 59.01 1cw4 s THR 15 Cb -0.19 -2.83 0.01 0.00 1.34 0.00 0.00 72.50 70.83 1cw4 s THR 15 CO 0.25 -0.08 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.87 1cw4 s LEU 16 N -3.62 1.76 -0.08 4.79 0.20 -1.26 -0.06 118.68 120.41 1cw4 s LEU 16 Ca 0.34 -0.40 -0.03 0.00 0.69 0.00 0.00 54.13 54.73 1cw4 s LEU 16 Cb 0.07 -1.03 0.04 0.00 -0.43 0.00 0.00 46.19 44.84 1cw4 s LEU 16 CO 0.17 0.05 0.15 -1.10 -0.29 0.00 0.00 176.35 175.33 1cw4 s GLN 17 N 0.72 0.04 -1.47 1.98 -1.52 0.22 -4.88 119.66 114.76 1cw4 s GLN 17 Ca -0.13 0.50 -0.12 0.00 -1.95 0.00 0.00 55.36 53.67 1cw4 s GLN 17 Cb -0.16 -0.25 0.06 0.00 -0.22 0.00 0.00 33.01 32.43 1cw4 s GLN 17 CO 0.03 -0.27 1.05 0.27 -0.25 0.00 0.00 175.29 176.12 1cw4 n ASN 18 N 5.02 -5.48 -0.35 5.90 6.94 -1.26 -0.85 115.26 125.18 1cw4 n ASN 18 Ca -0.11 -0.67 -0.05 0.00 -0.02 0.00 0.00 54.58 53.74 1cw4 n ASN 18 Cb 0.50 -4.35 -0.02 0.00 -2.36 0.00 0.00 39.78 33.56 1cw4 n ASN 18 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cw4 n GLY 19 N -1.81 0.67 3.17 4.83 0.00 -1.26 -5.00 105.19 105.79 1cw4 n GLY 19 Ca 0.03 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 1cw4 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cw4 s LYS 20 N -1.81 2.07 0.07 1.61 0.00 -0.03 -5.12 119.74 116.54 1cw4 s LYS 20 Ca 0.00 -0.69 -0.30 0.00 0.00 0.00 0.00 55.97 54.98 1cw4 s LYS 20 Cb 0.00 -1.76 -0.05 0.00 0.00 0.00 0.00 37.83 36.03 1cw4 s LYS 20 CO 0.00 0.26 0.99 -0.51 0.00 0.00 0.00 175.35 176.09 1cw4 s LEU 21 N 0.05 4.44 -0.58 2.77 1.43 -1.26 -0.61 118.68 124.92 1cw4 s LEU 21 Ca -0.06 1.77 -0.10 0.00 -1.03 0.00 0.00 54.13 54.72 1cw4 s LEU 21 Cb -0.13 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.66 1cw4 s LEU 21 CO 0.03 -0.17 0.46 0.21 0.23 0.00 0.00 176.35 177.12 1cw4 s ASN 22 N 0.43 5.87 -0.28 2.29 3.84 0.92 -4.96 114.94 123.05 1cw4 s ASN 22 Ca 0.50 -2.24 -0.12 0.00 0.21 0.00 0.00 52.86 51.20 1cw4 s ASN 22 Cb -0.23 -2.04 -0.05 0.00 -0.55 0.00 0.00 41.25 38.38 1cw4 s ASN 22 CO 0.29 -0.62 0.24 -0.69 -2.79 0.00 0.00 177.10 173.53 1cw4 s VAL 23 N 0.86 5.27 0.87 -5.21 1.01 -1.26 -1.77 120.40 120.17 1cw4 s VAL 23 Ca 0.10 0.28 -0.12 0.00 0.00 0.00 0.00 61.98 62.24 1cw4 s VAL 23 Cb -0.22 -3.57 0.11 0.00 0.00 0.00 0.00 36.38 32.70 1cw4 s VAL 23 CO -0.03 0.23 1.15 -2.16 0.00 0.00 0.00 175.10 174.29 1cw4 s PRO 24 N 1.83 1.49 0.54 2.72 0.04 -1.26 -4.94 135.00 135.42 1cw4 s PRO 24 Ca 0.09 0.26 0.33 0.00 0.04 0.00 0.00 61.00 61.72 1cw4 s PRO 24 Cb -0.16 -1.88 1.32 0.00 0.04 0.00 0.00 34.50 33.82 1cw4 s PRO 24 CO 0.11 -1.95 1.97 0.93 0.04 0.00 0.00 177.00 178.09 1cw4 h GLU 25 N -1.32 0.00 -2.16 4.56 5.08 -1.93 -3.23 114.58 115.57 1cw4 h GLU 25 Ca -0.49 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.30 1cw4 h GLU 25 Cb 1.33 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 30.16 1cw4 h GLU 25 CO 0.63 0.02 -0.73 0.27 -1.00 0.00 0.00 179.01 178.20 1cw4 n ASN 26 N -3.12 4.00 -4.77 1.42 2.04 -1.26 -0.59 115.26 112.99 1cw4 n ASN 26 Ca 0.01 -3.59 -0.39 0.00 -0.44 0.00 0.00 54.58 50.17 1cw4 n ASN 26 Cb 0.32 -0.56 -0.03 0.00 -2.53 0.00 0.00 39.78 36.98 1cw4 n ASN 26 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 1cw4 s PRO 27 N -3.35 4.32 -0.18 -0.53 0.04 -1.22 0.14 135.00 134.22 1cw4 s PRO 27 Ca 0.47 1.83 -0.22 0.00 0.04 0.00 0.00 61.00 63.13 1cw4 s PRO 27 Cb 0.30 -2.90 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 1cw4 s PRO 27 CO -0.13 -0.08 0.66 0.42 0.04 0.00 0.00 177.00 177.90 1cw4 s ILE 28 N -1.32 5.00 -0.22 0.56 1.01 -0.80 -0.54 121.20 124.88 1cw4 s ILE 28 Ca 0.51 1.27 0.02 0.00 0.00 0.00 0.00 60.65 62.45 1cw4 s ILE 28 Cb -0.31 -3.98 0.04 0.00 0.01 0.00 0.00 42.46 38.22 1cw4 s ILE 28 CO 0.40 0.11 -0.15 -0.63 0.00 0.00 0.00 174.94 174.66 1cw4 s ILE 29 N 1.86 2.14 0.35 2.92 -1.09 -0.32 -4.75 121.20 122.31 1cw4 s ILE 29 Ca 0.31 -1.26 -0.27 0.00 -2.23 0.00 0.00 60.65 57.20 1cw4 s ILE 29 Cb -0.16 -2.07 -0.09 0.00 -1.58 0.00 0.00 42.46 38.56 1cw4 s ILE 29 CO 0.11 0.27 1.17 -2.84 -1.23 0.00 0.00 174.94 172.42 1cw4 s PRO 30 N 1.21 4.29 -0.02 2.79 0.02 -1.25 -0.94 135.00 141.10 1cw4 s PRO 30 Ca -0.01 1.89 -0.03 0.00 0.02 0.00 0.00 61.00 62.86 1cw4 s PRO 30 Cb -0.16 -2.90 0.00 0.00 0.02 0.00 0.00 34.50 31.47 1cw4 s PRO 30 CO -0.09 -0.13 0.07 1.52 -0.33 0.00 0.00 177.00 178.05 1cw4 s TYR 31 N -1.30 -0.05 -0.26 6.54 -0.85 0.10 -2.31 117.35 119.22 1cw4 s TYR 31 Ca 0.52 0.13 -0.06 0.00 -0.52 0.00 0.00 57.07 57.13 1cw4 s TYR 31 Cb -0.32 0.01 -0.01 0.00 0.38 0.00 0.00 41.96 42.01 1cw4 s TYR 31 CO 0.42 -0.07 0.05 0.42 -1.52 0.00 0.00 175.55 174.85 1cw4 s ILE 32 N -0.18 4.00 0.22 -3.49 1.01 -0.41 -1.03 121.20 121.33 1cw4 s ILE 32 Ca -0.02 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.13 1cw4 s ILE 32 Cb -0.02 -2.92 0.20 0.00 0.01 0.00 0.00 42.46 39.73 1cw4 s ILE 32 CO 0.00 0.27 1.68 -0.08 0.00 0.00 0.00 174.94 176.82 1cw4 h GLU 33 N 8.21 0.20 0.00 2.79 4.81 -1.89 -0.06 114.58 128.64 1cw4 h GLU 33 Ca -0.37 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1cw4 h GLU 33 Cb 1.16 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1cw4 h GLU 33 CO 0.59 0.13 0.00 0.41 -0.73 0.00 0.00 179.01 179.42 1cw4 n GLY 34 N -1.35 1.42 3.82 1.92 0.00 -1.26 -3.50 105.19 106.24 1cw4 n GLY 34 Ca 0.10 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 1cw4 n GLY 34 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cw4 s ASP 35 N -0.51 3.80 0.86 1.61 -0.00 0.15 -4.17 116.67 118.42 1cw4 s ASP 35 Ca 0.00 0.91 0.00 0.00 -0.00 0.00 0.00 52.55 53.46 1cw4 s ASP 35 Cb 0.00 -1.46 0.00 0.00 -0.00 0.00 0.00 42.92 41.46 1cw4 s ASP 35 CO 0.00 -2.36 0.00 0.61 -0.00 0.00 0.00 175.17 173.42 1cw4 n GLY 36 N -2.53 2.99 0.00 0.21 0.00 -1.26 -0.94 105.19 103.65 1cw4 n GLY 36 Ca 0.07 0.28 0.04 0.00 0.00 0.00 0.00 46.02 46.40 1cw4 n GLY 36 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1cw4 n ILE 37 N 0.00 0.69 0.26 -0.61 -5.35 -0.14 -2.39 119.36 111.82 1cw4 n ILE 37 Ca 0.00 0.17 0.12 0.00 -0.27 0.00 0.00 62.75 62.77 1cw4 n ILE 37 Cb 0.00 -1.05 0.77 0.00 -1.74 0.00 0.00 39.64 37.61 1cw4 n ILE 37 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1cw4 h GLY 38 N 1.17 0.00 2.00 3.28 0.00 -1.20 0.27 103.07 108.59 1cw4 h GLY 38 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1cw4 h GLY 38 CO 0.00 0.00 -0.07 -0.24 0.00 0.00 0.00 176.54 176.23 1cw4 h VAL 39 N 0.00 0.26 0.00 4.60 3.04 -1.64 -1.95 116.25 120.56 1cw4 h VAL 39 Ca 0.02 -0.53 -0.34 0.00 -1.01 0.00 0.00 66.70 64.84 1cw4 h VAL 39 Cb 0.09 1.42 -0.05 0.00 -2.01 0.00 0.00 31.29 30.74 1cw4 h VAL 39 CO -0.00 0.07 -1.93 0.47 -1.01 0.00 0.00 177.57 175.17 1cw4 n ASP 40 N -3.30 1.92 0.01 3.17 8.00 0.80 -4.53 116.55 122.62 1cw4 n ASP 40 Ca -0.01 0.38 -0.08 0.00 0.71 0.00 0.00 54.79 55.79 1cw4 n ASP 40 Cb 0.27 -0.87 0.07 0.00 -0.02 0.00 0.00 41.12 40.57 1cw4 n ASP 40 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 1cw4 h VAL 41 N -1.00 1.32 -0.25 2.53 -1.51 -1.14 -3.29 116.25 112.91 1cw4 h VAL 41 Ca -0.52 -1.78 -0.00 0.00 -1.23 0.00 0.00 66.70 63.17 1cw4 h VAL 41 Cb 1.43 1.76 -0.01 0.00 -2.13 0.00 0.00 31.29 32.34 1cw4 h VAL 41 CO -0.31 0.55 0.14 0.74 -1.23 0.00 0.00 177.57 177.46 1cw4 h THR 42 N 0.40 1.11 -0.90 7.19 2.02 -1.59 -1.09 112.91 120.06 1cw4 h THR 42 Ca 0.01 -0.29 0.04 0.00 0.77 0.00 0.00 66.41 66.94 1cw4 h THR 42 Cb 1.06 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 68.26 1cw4 h THR 42 CO 0.10 0.11 0.58 -0.65 0.37 0.00 0.00 175.52 176.03 1cw4 h PRO 43 N 0.30 1.09 -0.68 6.66 0.11 -1.79 0.14 132.00 137.83 1cw4 h PRO 43 Ca 0.09 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1cw4 h PRO 43 Cb 0.05 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 30.89 1cw4 h PRO 43 CO -0.01 0.72 0.38 0.00 -0.21 0.00 0.00 178.00 178.88 1cw4 h ALA 44 N 1.38 0.87 -0.22 -0.75 0.00 -1.57 -1.79 119.26 117.19 1cw4 h ALA 44 Ca 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1cw4 h ALA 44 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1cw4 h ALA 44 CO -0.13 0.38 0.07 1.98 0.00 0.00 0.00 179.25 181.55 1cw4 h MET 45 N 0.93 0.34 -0.63 0.00 -1.53 -0.17 -0.61 114.93 113.26 1cw4 h MET 45 Ca 0.24 -0.07 0.05 0.00 -3.44 0.00 0.00 59.70 56.48 1cw4 h MET 45 Cb 0.03 -0.05 -0.05 0.00 -0.55 0.00 0.00 31.60 30.98 1cw4 h MET 45 CO -0.04 0.42 0.35 -0.07 0.14 0.00 0.00 176.91 177.71 1cw4 h LEU 46 N 0.19 0.52 -0.39 3.39 3.38 -0.79 0.12 115.31 121.73 1cw4 h LEU 46 Ca 0.07 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1cw4 h LEU 46 Cb 0.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1cw4 h LEU 46 CO -0.00 0.34 -0.06 0.50 0.09 0.00 0.00 178.44 179.31 1cw4 h LYS 47 N 0.66 0.73 -0.38 1.13 3.64 -1.19 -1.48 116.57 119.67 1cw4 h LYS 47 Ca 0.28 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 1cw4 h LYS 47 Cb 0.16 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1cw4 h LYS 47 CO -0.17 0.86 0.03 0.28 -2.27 0.00 0.00 179.45 178.17 1cw4 h VAL 48 N 0.54 1.25 -0.30 2.00 2.07 -0.63 -1.83 116.25 119.35 1cw4 h VAL 48 Ca 0.10 -0.94 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1cw4 h VAL 48 Cb 0.57 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1cw4 h VAL 48 CO 0.03 0.32 0.11 0.58 0.02 0.00 0.00 177.57 178.63 1cw4 h VAL 49 N 0.49 1.19 -0.93 2.57 2.07 -0.75 -1.36 116.25 119.52 1cw4 h VAL 49 Ca 0.11 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1cw4 h VAL 49 Cb 0.43 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1cw4 h VAL 49 CO 0.01 0.20 0.62 0.44 0.02 0.00 0.00 177.57 178.86 1cw4 h ASP 50 N 0.34 1.05 -0.46 0.57 3.45 -1.20 0.29 116.42 120.46 1cw4 h ASP 50 Ca 0.10 -0.02 -0.10 0.00 0.43 0.00 0.00 57.03 57.43 1cw4 h ASP 50 Cb 0.20 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 1cw4 h ASP 50 CO -0.01 0.75 -0.11 0.00 -1.57 0.00 0.00 179.24 178.30 1cw4 h ALA 51 N 1.43 0.63 -0.42 3.45 0.00 -1.04 0.08 119.26 123.38 1cw4 h ALA 51 Ca 0.35 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1cw4 h ALA 51 Cb -0.10 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1cw4 h ALA 51 CO -0.09 0.53 0.15 0.00 0.00 0.00 0.00 179.25 179.84 1cw4 h ALA 52 N 0.87 0.55 -0.23 0.00 0.00 -0.59 0.04 119.26 119.89 1cw4 h ALA 52 Ca 0.11 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1cw4 h ALA 52 Cb 0.66 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1cw4 h ALA 52 CO 0.05 0.18 0.05 0.28 0.00 0.00 0.00 179.25 179.81 1cw4 h VAL 53 N 0.54 1.21 -0.41 0.00 2.07 -0.86 0.83 116.25 119.63 1cw4 h VAL 53 Ca 0.14 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1cw4 h VAL 53 Cb 0.23 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1cw4 h VAL 53 CO -0.01 0.22 0.26 -0.08 0.02 0.00 0.00 177.57 177.98 1cw4 h GLU 54 N 0.20 0.56 -0.29 1.57 4.57 -0.88 -1.82 114.58 118.49 1cw4 h GLU 54 Ca 0.07 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 1cw4 h GLU 54 Cb 0.29 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 1cw4 h GLU 54 CO 0.00 0.40 -0.12 -0.22 -1.18 0.00 0.00 179.01 177.89 1cw4 h LYS 55 N 0.55 0.59 -0.29 1.92 3.64 -0.88 -1.70 116.57 120.41 1cw4 h LYS 55 Ca 0.15 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1cw4 h LYS 55 Cb -0.02 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1cw4 h LYS 55 CO -0.03 0.81 0.09 0.00 -2.27 0.00 0.00 179.45 178.05 1cw4 h ALA 56 N 0.76 0.38 -0.40 5.00 0.00 -0.72 -3.28 119.26 121.00 1cw4 h ALA 56 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1cw4 h ALA 56 Cb 0.62 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1cw4 h ALA 56 CO 0.04 0.01 0.00 0.66 0.00 0.00 0.00 179.25 179.96 1cw4 n TYR 57 N -4.70 1.31 -4.09 0.00 4.01 -0.69 -4.96 117.16 108.02 1cw4 n TYR 57 Ca -0.02 -0.78 -0.29 0.00 -0.16 0.00 0.00 57.90 56.65 1cw4 n TYR 57 Cb 0.17 -0.35 -0.04 0.00 -0.31 0.00 0.00 39.34 38.81 1cw4 n TYR 57 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1cw4 n LYS 58 N 0.07 -2.68 -0.59 -0.72 4.76 -0.66 -0.70 118.16 117.64 1cw4 n LYS 58 Ca 0.23 0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.99 1cw4 n LYS 58 Cb 0.95 -4.41 0.00 0.00 -1.84 0.00 0.00 35.03 29.74 1cw4 n LYS 58 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cw4 n GLY 59 N -2.01 1.37 0.19 0.72 0.00 -1.04 -4.87 105.19 99.56 1cw4 n GLY 59 Ca -0.25 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 1cw4 n GLY 59 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1cw4 h GLU 60 N 2.14 0.39 -6.64 1.61 4.39 -1.24 -3.44 114.58 111.79 1cw4 h GLU 60 Ca 0.00 -0.24 -0.67 0.00 0.34 0.00 0.00 59.36 58.79 1cw4 h GLU 60 Cb 0.00 0.03 -0.17 0.00 -0.10 0.00 0.00 28.75 28.51 1cw4 h GLU 60 CO 0.00 0.84 -0.77 1.03 -1.16 0.00 0.00 179.01 178.95 1cw4 s ARG 61 N -3.94 1.95 -0.28 2.33 0.52 -1.26 -4.85 118.95 113.42 1cw4 s ARG 61 Ca -0.06 -1.11 -0.14 0.00 -0.52 0.00 0.00 55.73 53.91 1cw4 s ARG 61 Cb 0.12 -2.21 0.09 0.00 0.52 0.00 0.00 34.95 33.47 1cw4 s ARG 61 CO 0.81 0.49 0.66 0.21 0.02 0.00 0.00 175.30 177.50 1cw4 s LYS 62 N -2.19 0.66 0.15 3.54 2.20 0.25 -4.58 119.74 119.76 1cw4 s LYS 62 Ca 0.20 1.27 -0.30 0.00 -0.36 0.00 0.00 55.97 56.78 1cw4 s LYS 62 Cb -0.11 0.33 -0.07 0.00 -1.51 0.00 0.00 37.83 36.47 1cw4 s LYS 62 CO 0.12 -0.17 0.99 0.42 -0.36 0.00 0.00 175.35 176.35 1cw4 s ILE 63 N 1.98 4.27 -0.56 5.43 1.01 -1.26 -3.87 121.20 128.19 1cw4 s ILE 63 Ca -0.09 1.98 -0.13 0.00 0.00 0.00 0.00 60.65 62.41 1cw4 s ILE 63 Cb -0.07 -4.26 0.14 0.00 0.01 0.00 0.00 42.46 38.28 1cw4 s ILE 63 CO -0.19 0.35 0.48 -0.44 0.00 0.00 0.00 174.94 175.13 1cw4 s SER 64 N -0.29 6.05 0.25 3.58 0.01 0.29 -4.98 113.70 118.62 1cw4 s SER 64 Ca 0.46 -2.00 -0.30 0.00 1.31 0.00 0.00 55.95 55.42 1cw4 s SER 64 Cb -0.25 -2.12 -0.09 0.00 0.21 0.00 0.00 66.02 63.76 1cw4 s SER 64 CO 0.31 -0.74 1.28 0.26 0.41 0.00 0.00 173.24 174.76 1cw4 s TRP 65 N 1.25 3.24 -0.17 2.43 0.52 -1.26 -1.17 118.94 123.78 1cw4 s TRP 65 Ca 0.07 1.34 -0.01 0.00 0.02 0.00 0.00 56.10 57.51 1cw4 s TRP 65 Cb -0.26 -3.58 0.05 0.00 -1.15 0.00 0.00 33.47 28.53 1cw4 s TRP 65 CO -0.00 -1.70 -0.02 1.41 0.02 0.00 0.00 176.95 176.66 1cw4 s MET 66 N -0.76 1.07 0.04 4.98 1.75 -0.11 -4.83 119.30 121.44 1cw4 s MET 66 Ca 0.53 -0.43 -0.30 0.00 -1.25 0.00 0.00 55.69 54.23 1cw4 s MET 66 Cb -0.37 -1.94 -0.05 0.00 2.84 0.00 0.00 34.83 35.31 1cw4 s MET 66 CO 0.43 -0.50 1.21 -2.00 -0.65 0.00 0.00 175.02 173.51 1cw4 s GLU 67 N 1.74 4.41 0.40 4.11 2.12 -1.26 -0.72 118.70 129.50 1cw4 s GLU 67 Ca 0.00 1.76 0.05 0.00 0.36 0.00 0.00 54.97 57.15 1cw4 s GLU 67 Cb -0.16 -3.39 -0.07 0.00 0.26 0.00 0.00 34.13 30.78 1cw4 s GLU 67 CO -0.07 -0.30 0.03 0.96 -0.54 0.00 0.00 175.26 175.34 1cw4 s ILE 68 N 1.28 1.61 0.05 -3.70 -4.36 -0.20 -4.62 121.20 111.26 1cw4 s ILE 68 Ca 0.59 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 59.04 1cw4 s ILE 68 Cb -0.29 -2.82 -0.03 0.00 1.25 0.00 0.00 42.46 40.58 1cw4 s ILE 68 CO 0.28 0.00 -0.19 -0.31 0.24 0.00 0.00 174.94 174.96 1cw4 s TYR 69 N -2.92 1.68 -0.28 1.37 2.02 -1.26 -4.28 117.35 113.68 1cw4 s TYR 69 Ca 0.32 -0.37 -0.25 0.00 -0.37 0.00 0.00 57.07 56.39 1cw4 s TYR 69 Cb 0.08 -0.99 0.11 0.00 -0.40 0.00 0.00 41.96 40.76 1cw4 s TYR 69 CO 0.15 0.09 0.96 0.99 -1.57 0.00 0.00 175.55 176.17 1cw4 s THR 70 N -0.84 0.00 0.00 -0.71 2.01 -1.26 -4.38 115.64 110.46 1cw4 s THR 70 Ca 0.06 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.06 1cw4 s THR 70 Cb -0.09 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.42 1cw4 s THR 70 CO 0.02 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.56 1cw4 n GLY 71 N 2.35 -1.31 0.36 4.40 0.00 0.94 -4.34 105.19 107.60 1cw4 n GLY 71 Ca -0.13 -1.82 0.04 0.00 0.00 0.00 0.00 46.02 44.12 1cw4 n GLY 71 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1cw4 h GLU 72 N 0.00 1.05 0.00 1.61 4.57 -1.87 -0.93 114.58 119.01 1cw4 h GLU 72 Ca 0.00 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.08 1cw4 h GLU 72 Cb 0.00 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.35 1cw4 h GLU 72 CO 0.00 0.70 -0.19 -0.22 -1.18 0.00 0.00 179.01 178.12 1cw4 h LYS 73 N 1.08 0.00 -0.32 1.92 3.64 -1.93 -2.49 116.57 118.47 1cw4 h LYS 73 Ca 0.46 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.73 1cw4 h LYS 73 Cb 0.31 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1cw4 h LYS 73 CO -0.21 0.19 -0.22 1.03 -2.27 0.00 0.00 179.45 177.96 1cw4 h SER 74 N 0.00 0.76 -0.39 4.20 0.87 -1.36 -1.42 113.55 116.20 1cw4 h SER 74 Ca -0.00 -0.43 -0.02 0.00 -1.23 0.00 0.00 61.79 60.10 1cw4 h SER 74 Cb 0.51 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 1cw4 h SER 74 CO 0.02 1.03 0.18 0.71 -0.53 0.00 0.00 176.83 178.24 1cw4 h THR 75 N 0.49 1.17 0.00 2.23 1.35 -0.99 0.31 112.91 117.46 1cw4 h THR 75 Ca 0.06 -0.52 -0.12 0.00 -0.55 0.00 0.00 66.41 65.28 1cw4 h THR 75 Cb 0.77 0.64 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 1cw4 h THR 75 CO 0.06 0.20 -0.57 1.56 -0.25 0.00 0.00 175.52 176.53 1cw4 h GLN 76 N 0.62 0.00 0.08 4.72 1.08 -1.33 0.32 115.11 120.60 1cw4 h GLN 76 Ca 0.15 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.08 1cw4 h GLN 76 Cb 0.13 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 1cw4 h GLN 76 CO -0.02 0.57 -1.46 0.28 -0.95 0.00 0.00 178.83 177.25 1cw4 h VAL 77 N 0.00 0.92 0.00 -0.54 2.07 -0.36 -3.41 116.25 114.93 1cw4 h VAL 77 Ca -0.01 -2.31 0.00 0.00 0.82 0.00 0.00 66.70 65.20 1cw4 h VAL 77 Cb 1.23 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 33.53 1cw4 h VAL 77 CO 0.07 0.63 -0.72 -1.22 0.02 0.00 0.00 177.57 176.35 1cw4 n TYR 78 N -4.00 0.00 0.00 1.57 0.53 1.00 -5.04 117.16 111.22 1cw4 n TYR 78 Ca -0.28 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.60 1cw4 n TYR 78 Cb 0.85 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 39.15 1cw4 n TYR 78 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1cw4 n GLY 79 N 1.35 2.40 0.03 2.72 0.00 0.11 -4.85 105.19 106.96 1cw4 n GLY 79 Ca 0.03 -2.14 -0.01 0.00 0.00 0.00 0.00 46.02 43.90 1cw4 n GLY 79 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1cw4 n GLN 80 N -0.71 -0.03 -0.34 1.61 7.27 -1.24 -1.83 117.38 122.11 1cw4 n GLN 80 Ca 0.00 0.40 0.09 0.00 0.07 0.00 0.00 57.00 57.55 1cw4 n GLN 80 Cb 0.00 -0.59 0.26 0.00 2.41 0.00 0.00 30.24 32.32 1cw4 n GLN 80 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1cw4 n ASP 81 N -2.77 3.23 -4.47 1.69 10.43 -1.26 -4.78 116.55 118.62 1cw4 n ASP 81 Ca 0.00 -2.10 -0.44 0.00 2.57 0.00 0.00 54.79 54.83 1cw4 n ASP 81 Cb 0.02 -0.41 -0.01 0.00 1.84 0.00 0.00 41.12 42.55 1cw4 n ASP 81 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1cw4 s VAL 82 N -1.40 4.83 -0.04 2.53 1.01 -0.76 -4.72 120.40 121.85 1cw4 s VAL 82 Ca 0.38 -2.14 -0.00 0.00 0.00 0.00 0.00 61.98 60.22 1cw4 s VAL 82 Cb 0.21 -4.88 -0.26 0.00 0.00 0.00 0.00 36.38 31.45 1cw4 s VAL 82 CO 0.24 -1.61 0.67 -0.50 0.00 0.00 0.00 175.10 173.90 1cw4 h TRP 83 N 7.89 0.35 -2.51 5.22 4.06 -1.86 -2.47 115.95 126.63 1cw4 h TRP 83 Ca 0.26 -0.26 -0.51 0.00 2.06 0.00 0.00 58.89 60.45 1cw4 h TRP 83 Cb 0.93 -0.01 -0.38 0.00 -1.00 0.00 0.00 29.16 28.70 1cw4 h TRP 83 CO 1.15 1.41 -0.78 -1.17 -3.56 0.00 0.00 178.44 175.49 1cw4 s LEU 84 N -6.79 0.54 0.48 -4.49 2.96 -1.26 -0.04 118.68 110.08 1cw4 s LEU 84 Ca -0.12 -1.64 -0.23 0.00 -0.22 0.00 0.00 54.13 51.92 1cw4 s LEU 84 Cb 0.07 -0.14 -0.07 0.00 0.50 0.00 0.00 46.19 46.55 1cw4 s LEU 84 CO 0.82 -0.36 1.30 -2.84 -1.32 0.00 0.00 176.35 173.96 1cw4 s PRO 85 N 1.61 3.56 0.35 0.98 0.02 -1.26 -4.92 135.00 135.34 1cw4 s PRO 85 Ca 0.14 2.12 0.04 0.00 0.02 0.00 0.00 61.00 63.32 1cw4 s PRO 85 Cb -0.19 -2.46 0.67 0.00 0.02 0.00 0.00 34.50 32.54 1cw4 s PRO 85 CO -0.16 -0.82 1.99 0.00 -0.33 0.00 0.00 177.00 177.68 1cw4 h ALA 86 N 2.01 1.61 0.00 -1.55 0.00 -2.00 -1.87 119.26 117.45 1cw4 h ALA 86 Ca -0.50 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 1cw4 h ALA 86 Cb 1.27 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1cw4 h ALA 86 CO 0.60 0.32 -0.10 1.05 0.00 0.00 0.00 179.25 181.13 1cw4 h GLU 87 N 0.83 0.00 -0.51 0.00 4.11 -1.98 -1.95 114.58 115.09 1cw4 h GLU 87 Ca 0.27 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.64 1cw4 h GLU 87 Cb 0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1cw4 h GLU 87 CO -0.07 0.10 0.07 1.15 0.07 0.00 0.00 179.01 180.32 1cw4 h THR 88 N 0.00 1.25 -0.48 -1.06 2.02 -1.64 0.61 112.91 113.62 1cw4 h THR 88 Ca -0.00 -0.96 -0.10 0.00 0.77 0.00 0.00 66.41 66.12 1cw4 h THR 88 Cb 0.17 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1cw4 h THR 88 CO 0.01 0.34 -0.09 -0.07 0.37 0.00 0.00 175.52 176.08 1cw4 h LEU 89 N 0.73 0.86 -0.25 2.58 3.38 -1.46 -1.69 115.31 119.46 1cw4 h LEU 89 Ca 0.15 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 1cw4 h LEU 89 Cb 0.42 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1cw4 h LEU 89 CO 0.01 0.98 -0.06 0.44 0.09 0.00 0.00 178.44 179.90 1cw4 h ASP 90 N 0.79 0.48 -0.59 -0.43 3.32 -0.93 -2.70 116.42 116.36 1cw4 h ASP 90 Ca 0.13 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 1cw4 h ASP 90 Cb 0.60 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1cw4 h ASP 90 CO 0.04 0.74 0.18 -0.07 -1.72 0.00 0.00 179.24 178.41 1cw4 h LEU 91 N 0.22 0.86 -0.40 1.55 3.38 0.37 0.15 115.31 121.45 1cw4 h LEU 91 Ca 0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1cw4 h LEU 91 Cb 0.53 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1cw4 h LEU 91 CO 0.03 0.85 0.16 0.40 0.09 0.00 0.00 178.44 179.96 1cw4 h ILE 92 N 0.84 1.19 -0.30 1.22 2.04 -1.34 0.15 117.51 121.30 1cw4 h ILE 92 Ca 0.19 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 1cw4 h ILE 92 Cb 0.29 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1cw4 h ILE 92 CO -0.00 0.21 0.12 -0.09 0.00 0.00 0.00 178.15 178.38 1cw4 h ARG 93 N 0.50 0.45 -0.33 2.37 9.65 -1.26 -1.03 114.38 124.72 1cw4 h ARG 93 Ca 0.13 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1cw4 h ARG 93 Cb 0.18 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 1cw4 h ARG 93 CO -0.01 0.47 0.21 1.49 2.80 0.00 0.00 179.97 184.93 1cw4 h GLU 94 N 0.33 0.45 -0.01 0.20 4.81 -0.43 -3.02 114.58 116.91 1cw4 h GLU 94 Ca 0.10 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1cw4 h GLU 94 Cb 0.19 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1cw4 h GLU 94 CO -0.01 0.32 -0.02 0.66 -0.73 0.00 0.00 179.01 179.23 1cw4 n TYR 95 N -4.83 0.00 0.00 0.92 4.01 0.49 -4.81 117.16 112.94 1cw4 n TYR 95 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1cw4 n TYR 95 Cb 0.04 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1cw4 n TYR 95 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1cw4 n ARG 96 N -0.15 0.00 -4.20 -0.72 5.12 -0.40 -4.41 116.66 111.90 1cw4 n ARG 96 Ca 0.19 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.92 1cw4 n ARG 96 Cb 0.31 -0.75 -0.16 0.00 -1.16 0.00 0.00 32.46 30.70 1cw4 n ARG 96 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1cw4 s VAL 97 N 0.00 0.53 0.15 1.55 1.01 -1.26 -1.13 120.40 121.26 1cw4 s VAL 97 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 1cw4 s VAL 97 Cb 0.00 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.88 1cw4 s VAL 97 CO 0.00 0.20 0.38 0.00 0.00 0.00 0.00 175.10 175.68 1cw4 s ALA 98 N 0.54 -0.65 0.07 5.51 0.00 -0.80 -3.82 121.76 122.60 1cw4 s ALA 98 Ca -0.07 -0.34 0.01 0.00 0.00 0.00 0.00 51.96 51.56 1cw4 s ALA 98 Cb -0.11 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.72 1cw4 s ALA 98 CO 0.00 -0.67 -0.06 -1.50 0.00 0.00 0.00 175.76 173.53 1cw4 s ILE 99 N -3.86 0.54 0.02 0.00 2.07 -0.98 -0.59 121.20 118.39 1cw4 s ILE 99 Ca 0.08 -1.57 -0.15 0.00 -1.41 0.00 0.00 60.65 57.60 1cw4 s ILE 99 Cb 0.02 -1.21 0.03 0.00 0.13 0.00 0.00 42.46 41.42 1cw4 s ILE 99 CO -0.07 -0.70 0.33 -1.59 -1.91 0.00 0.00 174.94 171.00 1cw4 s LYS 100 N -2.94 0.78 0.38 3.50 -2.85 0.03 -1.29 119.74 117.35 1cw4 s LYS 100 Ca 0.02 -0.33 -0.06 0.00 -1.00 0.00 0.00 55.97 54.61 1cw4 s LYS 100 Cb -0.00 0.34 0.09 0.00 -2.06 0.00 0.00 37.83 36.19 1cw4 s LYS 100 CO -0.03 -0.24 0.52 0.41 0.10 0.00 0.00 175.35 176.11 1cw4 n GLY 101 N 0.86 -0.91 3.76 0.59 0.00 -0.04 -1.87 105.19 107.58 1cw4 n GLY 101 Ca -0.20 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 1cw4 n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1cw4 s PRO 102 N -4.07 3.27 0.05 1.61 0.04 -1.26 -4.55 135.00 130.09 1cw4 s PRO 102 Ca 0.30 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.44 1cw4 s PRO 102 Cb -0.01 -2.23 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1cw4 s PRO 102 CO 0.21 -1.02 -0.20 -0.51 0.04 0.00 0.00 177.00 175.52 1cw4 s LEU 103 N -3.51 2.19 0.07 -3.56 1.02 -1.26 0.34 118.68 113.97 1cw4 s LEU 103 Ca 0.71 -0.54 0.07 0.00 0.02 0.00 0.00 54.13 54.39 1cw4 s LEU 103 Cb -0.35 -0.90 -0.03 0.00 0.02 0.00 0.00 46.19 44.93 1cw4 s LEU 103 CO 0.41 0.12 -0.19 0.28 0.02 0.00 0.00 176.35 176.99 1cw4 s THR 104 N -0.87 1.56 -0.14 5.49 -1.32 -1.26 -4.82 115.64 114.28 1cw4 s THR 104 Ca 0.06 -1.30 -0.04 0.00 -1.21 0.00 0.00 61.69 59.21 1cw4 s THR 104 Cb -0.09 -1.39 -0.03 0.00 -1.51 0.00 0.00 72.50 69.48 1cw4 s THR 104 CO 0.02 0.05 -0.00 -0.89 -2.21 0.00 0.00 174.62 171.59 1cw4 s THR 105 N -0.97 4.22 0.56 5.08 2.01 -1.26 -4.72 115.64 120.56 1cw4 s THR 105 Ca 0.05 -0.25 -0.17 0.00 0.31 0.00 0.00 61.69 61.63 1cw4 s THR 105 Cb -0.09 -2.83 -0.05 0.00 0.01 0.00 0.00 72.50 69.53 1cw4 s THR 105 CO 0.03 0.52 1.06 -2.16 -0.69 0.00 0.00 174.62 173.38 1cw4 s PRO 106 N -0.06 3.45 0.06 4.92 0.04 -1.26 -5.06 135.00 137.09 1cw4 s PRO 106 Ca 0.03 1.30 0.07 0.00 0.04 0.00 0.00 61.00 62.44 1cw4 s PRO 106 Cb -0.13 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1cw4 s PRO 106 CO 0.02 -0.72 -0.14 0.54 0.04 0.00 0.00 177.00 176.74 1cw4 s VAL 107 N -2.24 3.09 0.00 -0.36 0.11 -1.26 -4.59 120.40 115.15 1cw4 s VAL 107 Ca 0.66 -1.20 0.00 0.00 -2.93 0.00 0.00 61.98 58.51 1cw4 s VAL 107 Cb -0.17 -2.37 0.00 0.00 -1.53 0.00 0.00 36.38 32.31 1cw4 s VAL 107 CO 0.31 0.25 0.00 0.61 -3.33 0.00 0.00 175.10 172.94 1cw4 n GLY 108 N 1.20 2.92 1.06 6.54 0.00 -1.26 -4.91 105.19 110.75 1cw4 n GLY 108 Ca -0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1cw4 n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cw4 n GLY 109 N -1.12 1.93 2.38 -0.02 0.00 -1.26 -4.97 105.19 102.13 1cw4 n GLY 109 Ca 0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 1cw4 n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cw4 n GLY 110 N 1.29 0.99 3.78 -0.02 0.00 -1.26 -5.00 105.19 104.97 1cw4 n GLY 110 Ca 0.18 -0.38 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 1cw4 n GLY 110 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cw4 s ILE 111 N -2.18 4.93 0.41 -0.61 1.01 -1.26 -5.08 121.20 118.43 1cw4 s ILE 111 Ca 0.00 1.14 -0.02 0.00 0.00 0.00 0.00 60.65 61.77 1cw4 s ILE 111 Cb 0.00 -3.88 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 1cw4 s ILE 111 CO 0.00 0.46 0.65 -0.13 0.00 0.00 0.00 174.94 175.92 1cw4 s ARG 112 N -0.38 3.46 -0.28 2.79 0.52 -1.26 -4.84 118.95 118.96 1cw4 s ARG 112 Ca 0.29 -0.15 -0.27 0.00 -0.52 0.00 0.00 55.73 55.08 1cw4 s ARG 112 Cb -0.18 -2.54 -0.11 0.00 0.52 0.00 0.00 34.95 32.64 1cw4 s ARG 112 CO 0.16 -0.03 0.92 0.45 0.02 0.00 0.00 175.30 176.82 1cw4 n SER 113 N -2.00 0.69 0.09 0.23 2.88 -1.26 -4.81 113.62 109.44 1cw4 n SER 113 Ca -0.02 0.67 -0.02 0.00 -1.33 0.00 0.00 58.87 58.18 1cw4 n SER 113 Cb 0.56 -0.50 0.24 0.00 -0.75 0.00 0.00 64.21 63.76 1cw4 n SER 113 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1cw4 h LEU 114 N 2.88 0.25 -0.45 2.46 3.38 -1.93 -0.81 115.31 121.09 1cw4 h LEU 114 Ca -0.25 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 1cw4 h LEU 114 Cb 0.78 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1cw4 h LEU 114 CO 0.56 0.61 0.09 0.78 0.09 0.00 0.00 178.44 180.57 1cw4 h ASN 115 N 0.21 0.70 -0.08 -0.43 2.35 -1.91 -1.14 115.58 115.27 1cw4 h ASN 115 Ca 0.02 -0.24 -0.13 0.00 -0.55 0.00 0.00 56.30 55.40 1cw4 h ASN 115 Cb 0.76 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1cw4 h ASN 115 CO 0.06 0.76 -0.37 0.58 -1.65 0.00 0.00 177.43 176.81 1cw4 h VAL 116 N 0.60 1.29 -0.31 2.81 2.07 -1.88 -2.56 116.25 118.28 1cw4 h VAL 116 Ca 0.14 -1.52 0.02 0.00 0.82 0.00 0.00 66.70 66.16 1cw4 h VAL 116 Cb 0.35 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1cw4 h VAL 116 CO 0.00 0.48 0.16 0.00 0.02 0.00 0.00 177.57 178.24 1cw4 h ALA 117 N 1.10 0.38 -0.58 1.67 0.00 -0.76 0.58 119.26 121.65 1cw4 h ALA 117 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1cw4 h ALA 117 Cb 0.87 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1cw4 h ALA 117 CO 0.07 -0.22 0.37 -0.07 0.00 0.00 0.00 179.25 179.41 1cw4 h LEU 118 N 0.33 0.63 0.06 0.00 3.38 -1.08 -0.38 115.31 118.26 1cw4 h LEU 118 Ca 0.13 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1cw4 h LEU 118 Cb 0.03 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1cw4 h LEU 118 CO -0.08 0.45 -0.03 0.03 0.09 0.00 0.00 178.44 178.90 1cw4 h ARG 119 N 0.75 -0.08 -0.33 1.13 3.08 -1.03 -2.62 114.38 115.28 1cw4 h ARG 119 Ca 0.22 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.21 1cw4 h ARG 119 Cb -0.05 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1cw4 h ARG 119 CO -0.07 0.16 -0.05 1.96 -1.07 0.00 0.00 179.97 180.90 1cw4 h GLN 120 N -0.32 0.62 0.00 0.04 4.20 -0.81 0.10 115.11 118.94 1cw4 h GLN 120 Ca -0.01 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.40 1cw4 h GLN 120 Cb 0.28 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1cw4 h GLN 120 CO 0.01 0.78 -0.35 0.93 -0.67 0.00 0.00 178.83 179.53 1cw4 h GLU 121 N 0.41 0.00 -0.12 1.46 5.08 -1.14 -2.62 114.58 117.65 1cw4 h GLU 121 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1cw4 h GLU 121 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1cw4 h GLU 121 CO 0.03 0.35 0.00 1.28 -1.00 0.00 0.00 179.01 179.67 1cw4 n LEU 122 N -3.69 2.95 -3.81 1.33 4.77 -0.99 -4.97 117.00 112.59 1cw4 n LEU 122 Ca -0.01 -1.07 -0.27 0.00 -0.03 0.00 0.00 56.01 54.63 1cw4 n LEU 122 Cb 0.45 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.52 1cw4 n LEU 122 CO 0.37 0.53 0.09 -0.67 -1.33 0.00 0.00 177.39 176.38 1cw4 n ASP 123 N 1.26 -4.13 -4.38 -1.43 2.03 -0.62 -4.86 116.55 104.43 1cw4 n ASP 123 Ca 0.16 -0.75 -0.43 0.00 0.52 0.00 0.00 54.79 54.28 1cw4 n ASP 123 Cb 0.57 -4.11 0.00 0.00 -0.72 0.00 0.00 41.12 36.86 1cw4 n ASP 123 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1cw4 n LEU 124 N -4.63 5.42 0.03 -2.67 4.77 0.25 -4.50 117.00 115.68 1cw4 n LEU 124 Ca -0.05 -4.20 0.07 0.00 -0.03 0.00 0.00 56.01 51.80 1cw4 n LEU 124 Cb 0.57 -1.67 0.29 0.00 -2.33 0.00 0.00 43.42 40.28 1cw4 n LEU 124 CO 0.72 0.57 0.71 0.00 -1.33 0.00 0.00 177.39 178.06 1cw4 n TYR 125 N 6.77 0.16 -4.08 -1.77 0.18 -1.12 -4.50 117.16 112.80 1cw4 n TYR 125 Ca 0.44 0.07 -0.35 0.00 1.88 0.00 0.00 57.90 59.95 1cw4 n TYR 125 Cb 0.43 -0.61 -0.14 0.00 -0.38 0.00 0.00 39.34 38.64 1cw4 n TYR 125 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1cw4 s ILE 126 N -3.08 3.40 -0.41 -3.48 1.01 -0.60 -0.76 121.20 117.28 1cw4 s ILE 126 Ca 0.05 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.11 1cw4 s ILE 126 Cb 0.07 -2.52 0.07 0.00 0.01 0.00 0.00 42.46 40.09 1cw4 s ILE 126 CO 0.23 0.44 0.25 0.00 0.00 0.00 0.00 174.94 175.86 1cw4 s LEU 128 N 1.44 4.25 -0.38 0.00 2.96 0.62 -1.00 118.68 126.57 1cw4 s LEU 128 Ca 0.03 -0.09 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1cw4 s LEU 128 Cb -0.22 -2.26 0.12 0.00 0.50 0.00 0.00 46.19 44.32 1cw4 s LEU 128 CO 0.03 -0.21 0.17 -0.13 -1.32 0.00 0.00 176.35 174.89 1cw4 s ARG 129 N 1.90 1.11 0.07 1.98 1.81 -0.11 -1.44 118.95 124.27 1cw4 s ARG 129 Ca 0.10 -1.67 -0.26 0.00 -1.72 0.00 0.00 55.73 52.18 1cw4 s ARG 129 Cb -0.16 -2.31 -0.06 0.00 -0.45 0.00 0.00 34.95 31.97 1cw4 s ARG 129 CO 0.11 -1.08 0.82 -1.25 -0.68 0.00 0.00 175.30 173.23 1cw4 s PRO 130 N 0.85 4.56 -0.18 3.54 0.04 -1.26 -0.56 135.00 141.98 1cw4 s PRO 130 Ca 0.14 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.37 1cw4 s PRO 130 Cb -0.21 -3.36 0.04 0.00 0.04 0.00 0.00 34.50 31.01 1cw4 s PRO 130 CO -0.09 0.28 -0.06 0.08 0.04 0.00 0.00 177.00 177.24 1cw4 s VAL 131 N -0.11 1.28 0.29 -0.36 1.01 0.12 -4.53 120.40 118.09 1cw4 s VAL 131 Ca 0.41 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1cw4 s VAL 131 Cb -0.21 -1.44 -0.06 0.00 0.00 0.00 0.00 36.38 34.67 1cw4 s VAL 131 CO 0.25 0.11 0.08 0.00 0.00 0.00 0.00 175.10 175.55 1cw4 s ARG 132 N 1.55 1.51 -0.08 2.72 1.70 -1.26 -0.85 118.95 124.25 1cw4 s ARG 132 Ca -0.00 -1.83 -0.04 0.00 -0.47 0.00 0.00 55.73 53.39 1cw4 s ARG 132 Cb -0.16 -0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 33.67 1cw4 s ARG 132 CO -0.08 -0.25 0.08 -0.47 -1.08 0.00 0.00 175.30 173.50 1cw4 s TYR 133 N -3.57 3.38 -0.31 5.89 5.04 -1.22 -4.95 117.35 121.61 1cw4 s TYR 133 Ca 0.37 0.34 -0.07 0.00 -2.44 0.00 0.00 57.07 55.28 1cw4 s TYR 133 Cb 0.08 -1.84 0.02 0.00 0.35 0.00 0.00 41.96 40.57 1cw4 s TYR 133 CO 0.14 0.60 0.09 0.71 -1.34 0.00 0.00 175.55 175.75 1cw4 s TYR 134 N -1.03 3.19 0.04 4.97 2.02 -1.26 -5.00 117.35 120.28 1cw4 s TYR 134 Ca 0.17 -1.17 -0.38 0.00 -0.37 0.00 0.00 57.07 55.32 1cw4 s TYR 134 Cb -0.12 -2.26 -0.17 0.00 -0.40 0.00 0.00 41.96 39.01 1cw4 s TYR 134 CO 0.06 -0.64 1.33 0.94 -1.57 0.00 0.00 175.55 175.67 1cw4 n GLN 135 N 4.84 0.97 0.00 -0.62 -0.06 -1.26 -1.49 117.38 119.76 1cw4 n GLN 135 Ca -0.14 0.35 0.00 0.00 -2.00 0.00 0.00 57.00 55.21 1cw4 n GLN 135 Cb 0.47 -1.98 0.00 0.00 -4.06 0.00 0.00 30.24 24.67 1cw4 n GLN 135 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1cw4 n GLY 136 N 2.51 0.85 3.69 1.69 0.00 -1.26 -3.62 105.19 109.05 1cw4 n GLY 136 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1cw4 n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cw4 s THR 137 N -2.14 4.35 -0.06 2.61 2.01 -0.56 -4.89 115.64 116.96 1cw4 s THR 137 Ca 0.00 1.67 -0.30 0.00 0.31 0.00 0.00 61.69 63.37 1cw4 s THR 137 Cb 0.00 -4.07 -0.06 0.00 0.01 0.00 0.00 72.50 68.38 1cw4 s THR 137 CO 0.00 0.03 1.66 -2.16 -0.69 0.00 0.00 174.62 173.45 1cw4 s PRO 138 N 1.94 4.18 0.11 4.92 0.04 -1.26 -4.90 135.00 140.03 1cw4 s PRO 138 Ca 0.55 2.19 0.10 0.00 0.04 0.00 0.00 61.00 63.87 1cw4 s PRO 138 Cb -0.24 -3.99 -0.04 0.00 0.04 0.00 0.00 34.50 30.27 1cw4 s PRO 138 CO 0.23 -0.85 -0.24 0.45 0.04 0.00 0.00 177.00 176.62 1cw4 s SER 139 N 3.37 2.92 0.00 6.66 0.15 -1.26 -4.37 113.70 121.17 1cw4 s SER 139 Ca 0.73 -0.72 0.29 0.00 0.70 0.00 0.00 55.95 56.96 1cw4 s SER 139 Cb -0.33 -0.18 1.21 0.00 -1.71 0.00 0.00 66.02 65.01 1cw4 s SER 139 CO 0.30 0.12 1.90 -0.81 1.20 0.00 0.00 173.24 175.94 1cw4 n PRO 140 N 1.01 0.08 -4.03 5.44 -0.04 -1.26 -4.86 135.00 131.34 1cw4 n PRO 140 Ca -0.19 -0.01 -0.22 0.00 -0.04 0.00 0.00 63.50 63.05 1cw4 n PRO 140 Cb 0.53 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1cw4 n PRO 140 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1cw4 s VAL 141 N -2.93 4.34 0.18 0.52 -7.23 -1.26 -5.04 120.40 108.97 1cw4 s VAL 141 Ca 0.16 -1.35 -0.04 0.00 -1.81 0.00 0.00 61.98 58.94 1cw4 s VAL 141 Cb 0.19 -3.40 -0.07 0.00 0.56 0.00 0.00 36.38 33.66 1cw4 s VAL 141 CO 0.54 -0.31 1.48 0.11 -0.31 0.00 0.00 175.10 176.60 1cw4 h LYS 142 N 1.40 0.58 -2.08 4.82 1.57 -1.94 -3.39 116.57 117.53 1cw4 h LYS 142 Ca -0.48 -0.38 -0.56 0.00 -1.87 0.00 0.00 60.65 57.36 1cw4 h LYS 142 Cb 1.24 0.05 -0.40 0.00 0.08 0.00 0.00 32.23 33.20 1cw4 h LYS 142 CO 0.60 1.00 -0.94 0.72 -0.57 0.00 0.00 179.45 180.26 1cw4 n HIS 143 N -3.95 1.31 0.29 -1.35 8.25 -1.26 -4.92 115.22 113.59 1cw4 n HIS 143 Ca -0.04 -3.82 0.17 0.00 -0.26 0.00 0.00 57.72 53.78 1cw4 n HIS 143 Cb 0.63 -0.43 0.87 0.00 1.12 0.00 0.00 29.99 32.17 1cw4 n HIS 143 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1cw4 h PRO 144 N 3.73 0.00 0.00 -0.41 0.13 -1.86 -2.55 132.00 131.04 1cw4 h PRO 144 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1cw4 h PRO 144 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1cw4 h PRO 144 CO 0.61 0.05 0.00 1.05 -0.23 0.00 0.00 178.00 179.48 1cw4 h GLU 145 N 0.00 0.00 0.00 0.86 9.09 -1.94 -1.50 114.58 121.08 1cw4 h GLU 145 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1cw4 h GLU 145 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 1cw4 h GLU 145 CO 0.01 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.35 1cw4 n LEU 146 N -2.71 0.00 -4.62 3.06 4.77 -0.96 -4.71 117.00 111.83 1cw4 n LEU 146 Ca -0.01 0.35 -0.39 0.00 -0.03 0.00 0.00 56.01 55.94 1cw4 n LEU 146 Cb 0.14 -0.35 -0.08 0.00 -2.33 0.00 0.00 43.42 40.80 1cw4 n LEU 146 CO 0.19 -0.04 0.09 -0.89 -1.33 0.00 0.00 177.39 175.41 1cw4 s THR 147 N -2.71 5.17 -0.48 -5.08 2.01 -0.57 -3.27 115.64 110.71 1cw4 s THR 147 Ca 0.21 0.64 0.06 0.00 0.31 0.00 0.00 61.69 62.91 1cw4 s THR 147 Cb 0.18 -3.72 0.18 0.00 0.01 0.00 0.00 72.50 69.15 1cw4 s THR 147 CO 0.43 0.17 0.62 -0.62 -0.69 0.00 0.00 174.62 174.53 1cw4 s ASP 148 N 1.47 -0.71 0.25 3.53 3.68 -1.24 -3.43 116.67 120.22 1cw4 s ASP 148 Ca 0.17 -1.96 0.09 0.00 2.13 0.00 0.00 52.55 52.98 1cw4 s ASP 148 Cb -0.15 1.33 -0.05 0.00 -1.45 0.00 0.00 42.92 42.59 1cw4 s ASP 148 CO 0.09 -0.09 -0.14 -0.04 0.13 0.00 0.00 175.17 175.12 1cw4 s MET 149 N 0.79 1.51 -0.16 4.34 -1.94 -0.03 -4.54 119.30 119.26 1cw4 s MET 149 Ca 0.29 -1.70 -0.01 0.00 -1.71 0.00 0.00 55.69 52.55 1cw4 s MET 149 Cb -0.00 -1.35 0.05 0.00 2.01 0.00 0.00 34.83 35.53 1cw4 s MET 149 CO -0.08 0.19 -0.01 0.08 -0.01 0.00 0.00 175.02 175.19 1cw4 s VAL 150 N -2.82 0.79 -0.21 -6.03 1.01 -0.22 0.11 120.40 113.02 1cw4 s VAL 150 Ca 0.27 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.57 1cw4 s VAL 150 Cb -0.01 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 1cw4 s VAL 150 CO 0.11 0.02 0.51 -0.63 0.00 0.00 0.00 175.10 175.11 1cw4 s ILE 151 N 1.76 5.10 -0.56 2.22 -1.09 0.27 -0.75 121.20 128.16 1cw4 s ILE 151 Ca 0.01 0.94 -0.07 0.00 -2.23 0.00 0.00 60.65 59.29 1cw4 s ILE 151 Cb -0.16 -3.84 0.14 0.00 -1.58 0.00 0.00 42.46 37.03 1cw4 s ILE 151 CO -0.07 0.17 0.41 -0.36 -1.23 0.00 0.00 174.94 173.86 1cw4 s PHE 152 N 1.70 3.49 -0.24 3.97 0.08 0.15 -0.93 117.98 126.20 1cw4 s PHE 152 Ca 0.24 -2.21 -0.13 0.00 0.12 0.00 0.00 56.93 54.95 1cw4 s PHE 152 Cb -0.15 -3.42 -0.05 0.00 -0.57 0.00 0.00 43.02 38.83 1cw4 s PHE 152 CO 0.09 -0.95 0.25 0.50 -0.10 0.00 0.00 175.22 175.02 1cw4 s ARG 153 N 0.76 4.08 0.18 0.44 3.52 -0.17 -1.50 118.95 126.26 1cw4 s ARG 153 Ca 0.11 -0.11 -0.32 0.00 -0.13 0.00 0.00 55.73 55.28 1cw4 s ARG 153 Cb -0.22 -3.56 -0.11 0.00 -1.56 0.00 0.00 34.95 29.50 1cw4 s ARG 153 CO -0.03 -0.03 1.71 -2.00 -0.81 0.00 0.00 175.30 174.14 1cw4 s GLU 154 N 1.31 4.15 0.00 5.12 -6.30 -0.22 -0.75 118.70 122.00 1cw4 s GLU 154 Ca 0.12 2.55 0.13 0.00 -2.50 0.00 0.00 54.97 55.26 1cw4 s GLU 154 Cb -0.14 -3.19 0.15 0.00 0.00 0.00 0.00 34.13 30.95 1cw4 s GLU 154 CO 0.07 -0.74 0.98 -1.71 0.02 0.00 0.00 175.26 173.88 1cw4 n ASN 155 N 4.31 2.27 0.00 -1.70 5.15 0.06 -2.61 115.26 122.74 1cw4 n ASN 155 Ca 0.16 -1.63 0.00 0.00 -0.60 0.00 0.00 54.58 52.51 1cw4 n ASN 155 Cb 0.36 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.56 1cw4 n ASN 155 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1cw4 n SER 156 N 0.70 0.61 0.00 1.20 3.41 -1.26 -4.62 113.62 113.67 1cw4 n SER 156 Ca 0.09 -0.81 0.00 0.00 -0.26 0.00 0.00 58.87 57.89 1cw4 n SER 156 Cb 0.35 0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 1cw4 n SER 156 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1cw4 n GLU 157 N -0.36 2.33 -0.58 4.33 1.02 -1.26 -4.86 120.64 121.26 1cw4 n GLU 157 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 1cw4 n GLU 157 Cb 0.01 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 1cw4 n GLU 157 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1cw4 n ASP 158 N 0.00 -3.48 0.32 1.62 4.64 -0.62 -3.67 116.55 115.35 1cw4 n ASP 158 Ca 0.00 0.30 0.20 0.00 -1.38 0.00 0.00 54.79 53.91 1cw4 n ASP 158 Cb 0.00 -1.81 1.07 0.00 -1.04 0.00 0.00 41.12 39.34 1cw4 n ASP 158 CO 0.00 0.00 0.00 0.16 -0.82 0.00 0.00 177.20 176.54 1cw4 h ILE 159 N -0.55 0.14 0.00 5.18 -0.00 -1.86 0.13 117.51 120.55 1cw4 h ILE 159 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.85 1cw4 h ILE 159 Cb 0.54 0.93 0.00 0.00 -0.00 0.00 0.00 36.82 38.29 1cw4 h ILE 159 CO 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 178.15 178.16 1cw4 n TYR 160 N -3.25 0.24 0.56 0.16 9.36 -1.26 -2.09 117.16 120.89 1cw4 n TYR 160 Ca -0.02 0.12 0.08 0.00 3.32 0.00 0.00 57.90 61.39 1cw4 n TYR 160 Cb 0.15 -0.69 0.34 0.00 -0.63 0.00 0.00 39.34 38.51 1cw4 n TYR 160 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1cw4 n ALA 161 N -1.59 1.74 -2.37 2.98 0.00 0.03 -4.92 120.51 116.39 1cw4 n ALA 161 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 1cw4 n ALA 161 Cb 0.06 -1.26 0.01 0.00 0.00 0.00 0.00 19.45 18.25 1cw4 n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cw4 n GLY 162 N 0.14 0.26 3.33 0.00 0.00 -0.89 -5.01 105.19 103.02 1cw4 n GLY 162 Ca 0.04 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1cw4 n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cw4 s ILE 163 N -2.59 4.78 0.17 -0.61 1.01 -1.26 -5.03 121.20 117.67 1cw4 s ILE 163 Ca 0.06 -1.23 -0.24 0.00 0.00 0.00 0.00 60.65 59.24 1cw4 s ILE 163 Cb -0.03 -3.89 0.06 0.00 0.01 0.00 0.00 42.46 38.61 1cw4 s ILE 163 CO 0.08 -0.56 0.76 -1.83 0.00 0.00 0.00 174.94 173.38 1cw4 s GLU 164 N 1.54 1.34 -0.01 2.79 -1.05 -1.26 -0.85 118.70 121.21 1cw4 s GLU 164 Ca 0.04 -0.64 0.01 0.00 -0.15 0.00 0.00 54.97 54.22 1cw4 s GLU 164 Cb -0.24 0.53 0.01 0.00 -0.44 0.00 0.00 34.13 33.98 1cw4 s GLU 164 CO 0.04 -0.60 -0.03 -1.58 0.95 0.00 0.00 175.26 174.04 1cw4 s TRP 165 N -3.61 0.31 0.35 4.83 0.51 -0.24 -5.01 118.94 116.08 1cw4 s TRP 165 Ca 0.07 -0.05 -0.28 0.00 -2.12 0.00 0.00 56.10 53.72 1cw4 s TRP 165 Cb -0.03 -0.25 -0.10 0.00 -0.81 0.00 0.00 33.47 32.28 1cw4 s TRP 165 CO -0.03 -0.04 1.31 0.21 -0.51 0.00 0.00 176.95 177.89 1cw4 s LYS 166 N 0.21 4.28 0.26 4.98 2.20 -1.26 -2.19 119.74 128.22 1cw4 s LYS 166 Ca -0.02 2.20 -0.31 0.00 -0.36 0.00 0.00 55.97 57.49 1cw4 s LYS 166 Cb -0.05 -3.01 -0.13 0.00 -1.51 0.00 0.00 37.83 33.14 1cw4 s LYS 166 CO -0.00 -0.25 1.42 0.00 -0.36 0.00 0.00 175.35 176.16 1cw4 n ALA 167 N 0.66 1.33 -0.89 3.13 0.00 -1.26 -1.43 120.51 122.05 1cw4 n ALA 167 Ca 0.01 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1cw4 n ALA 167 Cb 0.42 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1cw4 n ALA 167 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1cw4 n ASP 168 N 1.99 -0.22 -4.84 0.00 10.43 -1.26 -4.88 116.55 117.77 1cw4 n ASP 168 Ca 0.10 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 57.14 1cw4 n ASP 168 Cb 0.33 -0.60 -0.01 0.00 1.84 0.00 0.00 41.12 42.68 1cw4 n ASP 168 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1cw4 s SER 169 N -2.73 6.21 0.32 -2.24 1.04 -0.52 -4.92 113.70 110.87 1cw4 s SER 169 Ca 0.00 1.60 0.00 0.00 0.48 0.00 0.00 55.95 58.03 1cw4 s SER 169 Cb 0.00 -2.50 0.51 0.00 0.10 0.00 0.00 66.02 64.13 1cw4 s SER 169 CO 0.00 -0.87 1.94 0.00 0.98 0.00 0.00 173.24 175.29 1cw4 h ALA 170 N 0.36 1.41 -0.20 5.32 0.00 -1.95 -1.93 119.26 122.27 1cw4 h ALA 170 Ca -0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 1cw4 h ALA 170 Cb 1.20 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1cw4 h ALA 170 CO 0.60 0.49 0.06 -0.44 0.00 0.00 0.00 179.25 179.97 1cw4 h ASP 171 N 0.91 0.29 -0.51 0.00 3.45 -1.92 -0.97 116.42 117.67 1cw4 h ASP 171 Ca 0.23 -0.20 0.02 0.00 0.43 0.00 0.00 57.03 57.51 1cw4 h ASP 171 Cb 0.01 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 38.68 1cw4 h ASP 171 CO -0.04 0.41 0.32 0.00 -1.57 0.00 0.00 179.24 178.36 1cw4 h ALA 172 N 0.89 0.65 -0.50 3.45 0.00 -1.68 -0.03 119.26 122.05 1cw4 h ALA 172 Ca 0.06 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1cw4 h ALA 172 Cb 0.22 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1cw4 h ALA 172 CO -0.00 0.04 0.31 0.93 0.00 0.00 0.00 179.25 180.53 1cw4 h GLU 173 N 0.64 0.61 -0.15 0.00 4.39 -1.23 -0.17 114.58 118.66 1cw4 h GLU 173 Ca 0.20 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.87 1cw4 h GLU 173 Cb -0.02 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 1cw4 h GLU 173 CO -0.07 0.40 0.05 -0.22 -1.16 0.00 0.00 179.01 178.01 1cw4 h LYS 174 N 0.62 0.12 -0.15 2.33 3.64 -0.42 0.14 116.57 122.85 1cw4 h LYS 174 Ca 0.19 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1cw4 h LYS 174 Cb -0.02 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1cw4 h LYS 174 CO -0.07 0.08 0.06 0.28 -2.27 0.00 0.00 179.45 177.53 1cw4 h VAL 175 N 0.13 1.15 -0.94 2.00 2.07 -0.73 -1.22 116.25 118.72 1cw4 h VAL 175 Ca 0.06 -0.46 0.01 0.00 0.82 0.00 0.00 66.70 67.14 1cw4 h VAL 175 Cb 0.04 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1cw4 h VAL 175 CO -0.07 0.14 0.62 0.40 0.02 0.00 0.00 177.57 178.69 1cw4 h ILE 176 N 0.08 1.24 0.15 4.57 2.04 -0.85 0.18 117.51 124.93 1cw4 h ILE 176 Ca 0.05 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1cw4 h ILE 176 Cb 0.17 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.11 1cw4 h ILE 176 CO -0.00 0.23 -0.07 0.50 0.00 0.00 0.00 178.15 178.80 1cw4 h LYS 177 N 1.27 -0.20 -0.32 2.37 3.64 -0.54 -1.26 116.57 121.54 1cw4 h LYS 177 Ca 0.35 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.80 1cw4 h LYS 177 Cb -0.14 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 1cw4 h LYS 177 CO -0.08 -0.10 -0.04 0.35 -2.27 0.00 0.00 179.45 177.30 1cw4 h PHE 178 N -0.24 -0.10 -0.35 1.91 3.57 -0.64 0.14 116.94 121.23 1cw4 h PHE 178 Ca -0.02 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1cw4 h PHE 178 Cb 0.18 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1cw4 h PHE 178 CO -0.06 -0.10 0.15 -0.07 -2.23 0.00 0.00 178.31 176.00 1cw4 h LEU 179 N 0.04 0.20 -0.06 0.59 3.38 -0.78 0.62 115.31 119.30 1cw4 h LEU 179 Ca 0.15 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 1cw4 h LEU 179 Cb 0.22 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.97 1cw4 h LEU 179 CO -0.30 0.15 -0.36 0.03 0.09 0.00 0.00 178.44 178.06 1cw4 h ARG 180 N 0.32 0.35 0.19 1.13 3.08 -0.83 0.06 114.38 118.69 1cw4 h ARG 180 Ca 0.15 -0.30 -0.33 0.00 0.07 0.00 0.00 59.98 59.57 1cw4 h ARG 180 Cb 0.10 0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.22 1cw4 h ARG 180 CO -0.13 0.94 -1.60 0.93 -1.07 0.00 0.00 179.97 179.04 1cw4 h GLU 181 N -0.14 0.40 0.01 0.04 5.08 -0.76 -2.98 114.58 116.23 1cw4 h GLU 181 Ca -0.03 -0.69 -0.36 0.00 -1.00 0.00 0.00 59.36 57.29 1cw4 h GLU 181 Cb 1.02 0.26 -0.06 0.00 0.50 0.00 0.00 28.75 30.46 1cw4 h GLU 181 CO 0.07 1.31 -2.25 0.39 -1.00 0.00 0.00 179.01 177.54 1cw4 n GLU 182 N -3.60 0.68 0.00 2.33 1.02 0.15 -4.37 120.64 116.85 1cw4 n GLU 182 Ca -0.20 0.11 0.11 0.00 -0.02 0.00 0.00 57.16 57.16 1cw4 n GLU 182 Cb 1.08 -1.59 0.06 0.00 -0.02 0.00 0.00 31.44 30.97 1cw4 n GLU 182 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1cw4 n MET 183 N -2.98 0.74 -2.27 3.49 2.81 -0.83 -4.97 117.12 113.10 1cw4 n MET 183 Ca -0.33 -0.57 -0.16 0.00 -1.81 0.00 0.00 57.70 54.83 1cw4 n MET 183 Cb 1.09 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 32.10 1cw4 n MET 183 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cw4 n GLY 184 N 1.43 -0.22 3.70 3.03 0.00 -0.55 -4.94 105.19 107.65 1cw4 n GLY 184 Ca 0.08 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1cw4 n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cw4 s VAL 185 N -2.79 3.80 -0.04 1.61 1.01 -0.10 -4.90 120.40 118.99 1cw4 s VAL 185 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 61.98 63.23 1cw4 s VAL 185 Cb 0.00 -3.80 -0.00 0.00 0.00 0.00 0.00 36.38 32.58 1cw4 s VAL 185 CO 0.00 0.06 0.24 0.29 0.00 0.00 0.00 175.10 175.69 1cw4 n LYS 186 N 4.50 3.41 -0.12 2.72 5.02 -1.26 -4.37 118.16 128.05 1cw4 n LYS 186 Ca 0.11 -0.23 0.04 0.00 -2.02 0.00 0.00 58.31 56.20 1cw4 n LYS 186 Cb 0.45 -0.74 0.11 0.00 -0.02 0.00 0.00 35.03 34.82 1cw4 n LYS 186 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1cw4 n LYS 187 N -0.55 1.57 -2.80 1.97 5.02 -1.26 -4.71 118.16 117.39 1cw4 n LYS 187 Ca 0.00 -0.86 -0.43 0.00 -2.02 0.00 0.00 58.31 55.00 1cw4 n LYS 187 Cb 0.01 -1.20 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1cw4 n LYS 187 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1cw4 s ILE 188 N -1.68 4.28 0.23 -0.18 1.01 -1.26 -4.91 121.20 118.69 1cw4 s ILE 188 Ca 0.16 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.21 1cw4 s ILE 188 Cb 0.08 -4.76 0.23 0.00 0.01 0.00 0.00 42.46 38.02 1cw4 s ILE 188 CO 0.11 -1.56 1.65 -0.09 0.00 0.00 0.00 174.94 175.05 1cw4 h ARG 189 N 9.52 0.11 -3.38 2.79 9.65 -2.01 -3.34 114.38 127.72 1cw4 h ARG 189 Ca -0.17 -0.01 -0.60 0.00 -1.10 0.00 0.00 59.98 58.11 1cw4 h ARG 189 Cb 1.05 -0.02 -0.40 0.00 -1.39 0.00 0.00 29.97 29.21 1cw4 h ARG 189 CO 1.20 0.07 -0.75 -0.06 2.80 0.00 0.00 179.97 183.23 1cw4 s PHE 190 N -6.14 1.86 0.38 2.20 0.08 -1.26 -5.00 117.98 110.10 1cw4 s PHE 190 Ca -0.13 -2.03 0.26 0.00 0.12 0.00 0.00 56.93 55.14 1cw4 s PHE 190 Cb 0.20 -1.80 1.32 0.00 -0.57 0.00 0.00 43.02 42.18 1cw4 s PHE 190 CO 0.74 -0.85 2.02 -1.00 -0.10 0.00 0.00 175.22 176.04 1cw4 h PRO 191 N 7.55 0.00 -6.53 0.24 0.13 -2.00 -3.41 132.00 127.98 1cw4 h PRO 191 Ca -0.08 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.53 1cw4 h PRO 191 Cb 0.98 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.08 1cw4 h PRO 191 CO 0.47 0.15 0.02 -1.21 -0.23 0.00 0.00 178.00 177.20 1cw4 s GLU 192 N -4.14 4.04 -1.39 0.86 2.02 -1.26 -4.11 118.70 114.72 1cw4 s GLU 192 Ca -0.02 0.63 -0.00 0.00 0.02 0.00 0.00 54.97 55.59 1cw4 s GLU 192 Cb 0.13 -2.73 -0.00 0.00 0.10 0.00 0.00 34.13 31.63 1cw4 s GLU 192 CO 0.60 0.33 0.46 0.72 0.02 0.00 0.00 175.26 177.40 1cw4 n HIS 193 N 0.29 -1.69 -4.30 1.61 8.25 -1.26 -4.94 115.22 113.18 1cw4 n HIS 193 Ca -0.01 0.76 -0.32 0.00 -0.26 0.00 0.00 57.72 57.89 1cw4 n HIS 193 Cb 0.52 -3.84 -0.16 0.00 1.12 0.00 0.00 29.99 27.63 1cw4 n HIS 193 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1cw4 s GLY 195 N 1.15 2.31 -0.02 0.00 0.00 -1.26 -4.16 107.32 105.34 1cw4 s GLY 195 Ca 0.00 0.28 0.02 0.00 0.00 0.00 0.00 44.72 45.02 1cw4 s GLY 195 CO -0.08 0.54 -0.07 -0.42 0.00 0.00 0.00 173.10 173.07 1cw4 s ILE 196 N -2.23 0.60 0.09 0.90 -1.09 -0.93 -4.94 121.20 113.60 1cw4 s ILE 196 Ca 0.60 -0.26 0.06 0.00 -2.23 0.00 0.00 60.65 58.82 1cw4 s ILE 196 Cb -0.09 -0.55 -0.03 0.00 -1.58 0.00 0.00 42.46 40.20 1cw4 s ILE 196 CO 0.18 0.20 -0.17 -0.83 -1.23 0.00 0.00 174.94 173.09 1cw4 s GLY 197 N 0.24 1.03 -0.11 6.18 0.00 -1.26 -1.08 107.32 112.32 1cw4 s GLY 197 Ca -0.03 -1.12 -0.01 0.00 0.00 0.00 0.00 44.72 43.56 1cw4 s GLY 197 CO 0.00 -1.14 -0.08 -0.42 0.00 0.00 0.00 173.10 171.46 1cw4 s ILE 198 N -1.31 3.55 -0.36 0.90 -1.09 -0.03 -4.99 121.20 117.88 1cw4 s ILE 198 Ca 0.02 -0.51 0.01 0.00 -2.23 0.00 0.00 60.65 57.95 1cw4 s ILE 198 Cb -0.10 -2.49 0.10 0.00 -1.58 0.00 0.00 42.46 38.39 1cw4 s ILE 198 CO 0.03 0.55 0.09 -0.75 -1.23 0.00 0.00 174.94 173.63 1cw4 s LYS 199 N -0.14 1.81 0.05 2.79 2.20 -1.26 -4.24 119.74 120.94 1cw4 s LYS 199 Ca 0.01 -1.77 -0.04 0.00 -0.36 0.00 0.00 55.97 53.82 1cw4 s LYS 199 Cb -0.13 -3.33 -0.05 0.00 -1.51 0.00 0.00 37.83 32.82 1cw4 s LYS 199 CO 0.03 -0.94 0.26 -1.25 -0.36 0.00 0.00 175.35 173.09 1cw4 s PRO 200 N 1.03 3.52 -0.24 4.03 0.04 -1.26 -4.91 135.00 137.22 1cw4 s PRO 200 Ca 0.07 -0.23 -0.04 0.00 0.04 0.00 0.00 61.00 60.85 1cw4 s PRO 200 Cb -0.21 -3.02 0.13 0.00 0.04 0.00 0.00 34.50 31.44 1cw4 s PRO 200 CO -0.06 0.60 0.41 0.00 0.04 0.00 0.00 177.00 178.00 1cw4 s SER 202 N 2.60 5.28 0.11 0.00 1.04 -1.26 -4.90 113.70 116.57 1cw4 s SER 202 Ca 0.09 -0.44 -0.17 0.00 0.48 0.00 0.00 55.95 55.91 1cw4 s SER 202 Cb -0.14 -1.09 -0.05 0.00 0.10 0.00 0.00 66.02 64.84 1cw4 s SER 202 CO -0.15 -0.22 1.57 -0.08 0.98 0.00 0.00 173.24 175.34 1cw4 h GLU 203 N 1.39 0.56 -0.56 4.02 4.81 -1.99 -0.71 114.58 122.10 1cw4 h GLU 203 Ca -0.46 -0.16 -0.09 0.00 -0.13 0.00 0.00 59.36 58.52 1cw4 h GLU 203 Cb 1.25 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1cw4 h GLU 203 CO 0.60 0.66 0.01 1.49 -0.73 0.00 0.00 179.01 181.03 1cw4 h GLU 204 N 0.38 0.97 -0.27 1.92 4.81 -1.99 -0.18 114.58 120.22 1cw4 h GLU 204 Ca 0.10 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.01 1cw4 h GLU 204 Cb 0.38 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1cw4 h GLU 204 CO 0.01 0.95 0.06 0.78 -0.73 0.00 0.00 179.01 180.08 1cw4 h GLY 205 N 1.00 0.48 0.83 1.92 0.00 -1.94 -1.67 103.07 103.69 1cw4 h GLY 205 Ca 0.16 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 1cw4 h GLY 205 CO 0.03 0.28 -0.04 -0.84 0.00 0.00 0.00 176.54 175.97 1cw4 h THR 206 N 0.27 1.01 -0.88 4.70 2.02 -0.98 -3.02 112.91 116.03 1cw4 h THR 206 Ca 0.08 -0.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1cw4 h THR 206 Cb 0.30 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 1cw4 h THR 206 CO 0.00 0.09 0.46 0.11 0.37 0.00 0.00 175.52 176.55 1cw4 h LYS 207 N -0.29 1.25 -0.17 6.66 1.57 -0.99 -0.52 116.57 124.07 1cw4 h LYS 207 Ca -0.01 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.52 1cw4 h LYS 207 Cb 0.24 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1cw4 h LYS 207 CO 0.02 0.93 -0.25 0.07 -0.57 0.00 0.00 179.45 179.65 1cw4 h ARG 208 N 1.24 0.31 0.09 3.15 0.11 -1.33 0.21 114.38 118.16 1cw4 h ARG 208 Ca 0.31 -0.11 -0.00 0.00 0.10 0.00 0.00 59.98 60.27 1cw4 h ARG 208 Cb 0.07 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.13 1cw4 h ARG 208 CO -0.04 0.55 -0.04 1.25 0.10 0.00 0.00 179.97 181.78 1cw4 h LEU 209 N 0.28 -0.10 -1.52 0.08 7.12 -1.33 -2.66 115.31 117.17 1cw4 h LEU 209 Ca 0.04 -0.44 -0.04 0.00 0.13 0.00 0.00 57.88 57.58 1cw4 h LEU 209 Cb 0.60 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.75 1cw4 h LEU 209 CO 0.04 0.42 -0.11 0.58 -0.13 0.00 0.00 178.44 179.24 1cw4 h VAL 210 N -0.65 1.15 -0.33 1.05 2.07 -0.96 -1.83 116.25 116.75 1cw4 h VAL 210 Ca -0.01 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 1cw4 h VAL 210 Cb 0.53 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1cw4 h VAL 210 CO 0.02 0.20 0.10 -0.09 0.02 0.00 0.00 177.57 177.81 1cw4 h ARG 211 N 0.17 0.52 -0.83 1.57 2.43 -0.59 -1.16 114.38 116.49 1cw4 h ARG 211 Ca 0.04 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1cw4 h ARG 211 Cb 0.30 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1cw4 h ARG 211 CO 0.02 0.56 0.41 0.00 -1.51 0.00 0.00 179.97 179.45 1cw4 h ALA 212 N 0.93 1.16 -0.20 2.80 0.00 -1.06 -0.75 119.26 122.14 1cw4 h ALA 212 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1cw4 h ALA 212 Cb 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1cw4 h ALA 212 CO -0.00 0.65 0.09 0.00 0.00 0.00 0.00 179.25 179.99 1cw4 h ALA 213 N 1.27 0.26 -0.45 0.00 0.00 -0.98 -0.49 119.26 118.87 1cw4 h ALA 213 Ca 0.29 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1cw4 h ALA 213 Cb 0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1cw4 h ALA 213 CO -0.04 -0.17 -0.16 0.82 0.00 0.00 0.00 179.25 179.70 1cw4 h ILE 214 N 0.19 1.27 -0.53 0.00 2.04 -1.02 -1.66 117.51 117.81 1cw4 h ILE 214 Ca 0.07 -1.31 -0.02 0.00 1.00 0.00 0.00 64.86 64.61 1cw4 h ILE 214 Cb 0.14 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 1cw4 h ILE 214 CO -0.01 0.45 0.26 -0.33 0.00 0.00 0.00 178.15 178.51 1cw4 h GLU 215 N 0.75 0.73 -0.41 2.37 4.39 -1.00 -0.72 114.58 120.69 1cw4 h GLU 215 Ca 0.11 -0.09 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1cw4 h GLU 215 Cb 0.72 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1cw4 h GLU 215 CO 0.06 0.57 -0.08 -0.92 -1.16 0.00 0.00 179.01 177.47 1cw4 h TYR 216 N 0.74 0.87 -0.88 4.33 3.20 -0.79 0.48 116.97 124.92 1cw4 h TYR 216 Ca 0.18 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1cw4 h TYR 216 Cb 0.07 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 1cw4 h TYR 216 CO 0.01 0.89 0.52 0.00 -1.64 0.00 0.00 178.16 177.93 1cw4 h ALA 217 N 0.85 1.26 0.40 1.82 0.00 -0.45 -0.31 119.26 122.83 1cw4 h ALA 217 Ca 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1cw4 h ALA 217 Cb 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1cw4 h ALA 217 CO 0.04 0.63 -0.19 0.82 0.00 0.00 0.00 179.25 180.54 1cw4 h ILE 218 N 1.21 0.47 -0.67 0.00 2.04 -0.88 0.20 117.51 119.88 1cw4 h ILE 218 Ca 0.31 -0.57 0.14 0.00 1.00 0.00 0.00 64.86 65.74 1cw4 h ILE 218 Cb -0.03 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 1cw4 h ILE 218 CO -0.06 0.08 0.45 0.00 0.00 0.00 0.00 178.15 178.63 1cw4 h ALA 219 N -0.56 2.16 -0.44 1.87 0.00 -0.78 -1.69 119.26 119.82 1cw4 h ALA 219 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1cw4 h ALA 219 Cb 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1cw4 h ALA 219 CO 0.09 -0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.10 1cw4 n ASN 220 N -4.46 3.53 -3.94 0.00 3.02 -0.14 -4.99 115.26 108.29 1cw4 n ASN 220 Ca 0.12 -2.22 -0.26 0.00 -0.03 0.00 0.00 54.58 52.19 1cw4 n ASN 220 Cb 0.50 -0.38 -0.01 0.00 -0.61 0.00 0.00 39.78 39.28 1cw4 n ASN 220 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1cw4 n ASP 221 N 0.64 -0.69 -4.88 6.41 4.64 -0.11 -4.96 116.55 117.59 1cw4 n ASP 221 Ca 0.17 -0.98 -0.30 0.00 -1.38 0.00 0.00 54.79 52.31 1cw4 n ASP 221 Cb 0.60 -3.18 -0.00 0.00 -1.04 0.00 0.00 41.12 37.50 1cw4 n ASP 221 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1cw4 s ARG 222 N -6.51 3.62 0.16 -0.67 1.81 0.51 -5.02 118.95 112.85 1cw4 s ARG 222 Ca 0.06 0.52 0.09 0.00 -1.72 0.00 0.00 55.73 54.68 1cw4 s ARG 222 Cb -0.03 -2.23 -0.10 0.00 -0.45 0.00 0.00 34.95 32.14 1cw4 s ARG 222 CO 0.88 -0.35 1.34 -0.44 -0.68 0.00 0.00 175.30 176.06 1cw4 h ASP 223 N 0.16 0.00 -5.00 0.23 3.45 -1.93 -3.45 116.42 109.88 1cw4 h ASP 223 Ca -0.46 0.00 0.11 0.00 0.43 0.00 0.00 57.03 57.12 1cw4 h ASP 223 Cb 1.20 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.86 1cw4 h ASP 223 CO 0.62 0.89 0.42 -0.94 -1.57 0.00 0.00 179.24 178.66 1cw4 s SER 224 N -6.69 -0.31 -0.12 6.45 1.04 -1.26 -1.85 113.70 110.96 1cw4 s SER 224 Ca 0.01 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1cw4 s SER 224 Cb 0.10 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.73 1cw4 s SER 224 CO 0.80 -0.86 -0.10 -0.69 0.98 0.00 0.00 173.24 173.38 1cw4 s VAL 225 N -3.36 1.16 -0.21 5.02 1.01 0.25 -1.50 120.40 122.76 1cw4 s VAL 225 Ca 0.08 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.63 1cw4 s VAL 225 Cb -0.02 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1cw4 s VAL 225 CO -0.03 0.39 -0.00 -0.89 0.00 0.00 0.00 175.10 174.56 1cw4 s THR 226 N 1.55 3.82 -0.39 3.92 2.01 0.59 -1.29 115.64 125.85 1cw4 s THR 226 Ca 0.03 -0.35 -0.25 0.00 0.31 0.00 0.00 61.69 61.43 1cw4 s THR 226 Cb -0.13 -2.74 0.02 0.00 0.01 0.00 0.00 72.50 69.66 1cw4 s THR 226 CO -0.08 0.41 0.87 -0.76 -0.69 0.00 0.00 174.62 174.38 1cw4 s LEU 227 N 1.22 4.06 -0.18 4.42 1.43 0.34 -0.81 118.68 129.15 1cw4 s LEU 227 Ca 0.03 0.36 -0.08 0.00 -1.03 0.00 0.00 54.13 53.41 1cw4 s LEU 227 Cb -0.15 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.88 1cw4 s LEU 227 CO 0.01 -0.87 0.08 -0.69 0.23 0.00 0.00 176.35 175.11 1cw4 s VAL 228 N 3.41 4.98 0.31 -1.59 1.01 -0.74 -1.63 120.40 126.15 1cw4 s VAL 228 Ca 0.35 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 62.17 1cw4 s VAL 228 Cb -0.12 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 33.06 1cw4 s VAL 228 CO 0.20 0.46 0.79 -1.38 0.00 0.00 0.00 175.10 175.17 1cw4 s HIS 229 N 0.29 -0.04 -0.42 5.22 -0.00 -1.02 -4.38 115.29 114.94 1cw4 s HIS 229 Ca 0.05 -0.49 0.07 0.00 -0.00 0.00 0.00 55.06 54.69 1cw4 s HIS 229 Cb -0.12 0.76 0.42 0.00 -0.00 0.00 0.00 32.58 33.64 1cw4 s HIS 229 CO -0.00 -1.33 1.07 -0.12 -0.00 0.00 0.00 174.74 174.36 1cw4 n MET 230 N -0.50 3.00 0.21 -0.38 1.56 -1.26 0.08 117.12 119.82 1cw4 n MET 230 Ca -0.06 -4.29 0.15 0.00 -0.27 0.00 0.00 57.70 53.23 1cw4 n MET 230 Cb 0.60 -2.07 0.63 0.00 2.15 0.00 0.00 33.22 34.53 1cw4 n MET 230 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1cw4 h GLY 231 N 2.68 0.00 2.00 -5.12 0.00 -1.79 -0.70 103.07 100.13 1cw4 h GLY 231 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.51 1cw4 h GLY 231 CO 0.78 0.00 -0.20 3.45 0.00 0.00 0.00 176.54 180.58 1cw4 h ASN 232 N 0.00 0.00 0.00 0.19 -1.07 -1.96 -3.19 115.58 109.55 1cw4 h ASN 232 Ca 0.00 0.00 -0.27 0.00 0.07 0.00 0.00 56.30 56.10 1cw4 h ASN 232 Cb 0.40 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.61 1cw4 h ASN 232 CO 0.00 0.20 -1.93 -0.38 0.07 0.00 0.00 177.43 175.39 1cw4 n ILE 233 N -3.38 0.91 -3.55 6.14 2.08 -1.05 -4.81 119.36 115.71 1cw4 n ILE 233 Ca 0.00 -0.25 -0.39 0.00 0.56 0.00 0.00 62.75 62.67 1cw4 n ILE 233 Cb 0.40 -1.61 -0.05 0.00 -0.75 0.00 0.00 39.64 37.64 1cw4 n ILE 233 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 1cw4 s MET 234 N -2.31 3.48 0.22 0.38 -1.94 -0.30 -4.92 119.30 113.92 1cw4 s MET 234 Ca -0.23 -3.15 -0.07 0.00 -1.71 0.00 0.00 55.69 50.52 1cw4 s MET 234 Cb 0.08 -4.12 0.17 0.00 2.01 0.00 0.00 34.83 32.97 1cw4 s MET 234 CO 0.31 -1.25 1.79 0.87 -0.01 0.00 0.00 175.02 176.72 1cw4 h LYS 235 N 6.37 1.21 -0.00 2.03 1.57 -1.80 0.48 116.57 126.43 1cw4 h LYS 235 Ca 0.15 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1cw4 h LYS 235 Cb 0.85 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1cw4 h LYS 235 CO 0.88 0.96 -0.19 1.19 -0.57 0.00 0.00 179.45 181.72 1cw4 n PHE 236 N -4.28 0.00 0.01 -1.35 0.99 -1.26 -1.48 117.46 110.09 1cw4 n PHE 236 Ca 0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.53 1cw4 n PHE 236 Cb 0.18 -0.33 -0.00 0.00 -1.00 0.00 0.00 39.48 38.33 1cw4 n PHE 236 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1cw4 n THR 237 N -1.34 0.23 -0.13 4.37 -2.24 -1.22 -4.45 114.28 109.49 1cw4 n THR 237 Ca 0.09 0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.85 1cw4 n THR 237 Cb 0.32 -1.13 -0.02 0.00 -2.10 0.00 0.00 70.33 67.40 1cw4 n THR 237 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1cw4 h GLU 238 N -0.01 0.69 -0.50 -0.78 4.39 -1.70 -0.90 114.58 115.77 1cw4 h GLU 238 Ca 0.00 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.43 1cw4 h GLU 238 Cb 0.01 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 1cw4 h GLU 238 CO 0.00 0.81 0.18 0.78 -1.16 0.00 0.00 179.01 179.62 1cw4 h GLY 239 N 0.51 0.82 1.22 -3.84 0.00 -0.83 -2.42 103.07 98.52 1cw4 h GLY 239 Ca 0.10 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1cw4 h GLY 239 CO 0.03 0.44 0.30 0.00 0.00 0.00 0.00 176.54 177.31 1cw4 h ALA 240 N 1.03 1.23 -0.19 3.60 0.00 -1.07 -1.18 119.26 122.67 1cw4 h ALA 240 Ca 0.16 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1cw4 h ALA 240 Cb 0.24 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1cw4 h ALA 240 CO -0.01 0.58 -0.06 0.35 0.00 0.00 0.00 179.25 180.11 1cw4 h PHE 241 N 0.99 -0.12 -0.25 0.00 3.04 -0.81 0.23 116.94 120.02 1cw4 h PHE 241 Ca 0.24 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.20 1cw4 h PHE 241 Cb 0.15 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.73 1cw4 h PHE 241 CO 0.01 -0.09 0.15 -0.22 -2.02 0.00 0.00 178.31 176.14 1cw4 h LYS 242 N -0.01 0.34 -0.03 1.11 3.64 -1.07 -0.39 116.57 120.16 1cw4 h LYS 242 Ca 0.10 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1cw4 h LYS 242 Cb 0.16 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1cw4 h LYS 242 CO -0.21 0.28 -0.12 -0.44 -2.27 0.00 0.00 179.45 176.69 1cw4 h ASP 243 N 0.31 -0.34 -0.17 4.20 3.45 -0.63 -1.37 116.42 121.88 1cw4 h ASP 243 Ca 0.09 0.06 -0.04 0.00 0.43 0.00 0.00 57.03 57.57 1cw4 h ASP 243 Cb 0.02 0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.93 1cw4 h ASP 243 CO -0.02 -0.16 -0.00 -0.50 -1.57 0.00 0.00 179.24 176.99 1cw4 h TRP 244 N -0.18 0.43 -0.22 4.55 6.55 -0.47 -0.08 115.95 126.54 1cw4 h TRP 244 Ca 0.05 -0.04 -0.02 0.00 0.95 0.00 0.00 58.89 59.84 1cw4 h TRP 244 Cb 0.25 -0.13 -0.01 0.00 -0.86 0.00 0.00 29.16 28.41 1cw4 h TRP 244 CO -0.19 0.44 0.07 0.78 -1.05 0.00 0.00 178.44 178.49 1cw4 h GLY 245 N 0.74 0.36 0.92 1.49 0.00 -0.52 0.55 103.07 106.61 1cw4 h GLY 245 Ca 0.09 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 1cw4 h GLY 245 CO 0.01 0.19 0.03 -0.97 0.00 0.00 0.00 176.54 175.80 1cw4 h TYR 246 N 0.19 0.66 -0.66 5.60 0.05 -0.92 -2.29 116.97 119.61 1cw4 h TYR 246 Ca 0.07 -0.10 0.06 0.00 0.05 0.00 0.00 58.73 58.81 1cw4 h TYR 246 Cb 0.22 -0.18 -0.05 0.00 1.01 0.00 0.00 36.73 37.72 1cw4 h TYR 246 CO -0.00 0.69 0.36 0.37 -1.05 0.00 0.00 178.16 178.53 1cw4 h GLN 247 N 0.44 0.65 -0.68 4.88 4.15 -0.82 -1.20 115.11 122.53 1cw4 h GLN 247 Ca 0.11 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 1cw4 h GLN 247 Cb 0.40 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 1cw4 h GLN 247 CO 0.01 0.43 0.42 1.25 -1.93 0.00 0.00 178.83 179.01 1cw4 h LEU 248 N 0.67 0.81 -1.09 -2.39 5.85 -0.75 0.11 115.31 118.53 1cw4 h LEU 248 Ca 0.29 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.99 1cw4 h LEU 248 Cb 0.18 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.95 1cw4 h LEU 248 CO -0.18 0.63 0.62 0.00 -0.34 0.00 0.00 178.44 179.16 1cw4 h ALA 249 N 1.22 1.38 -0.01 1.25 0.00 -0.73 -0.13 119.26 122.25 1cw4 h ALA 249 Ca 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1cw4 h ALA 249 Cb -0.04 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.40 1cw4 h ALA 249 CO -0.05 0.54 -0.05 0.00 0.00 0.00 0.00 179.25 179.69 1cw4 h ARG 250 N 1.20 0.05 -0.07 0.00 3.08 -0.44 -1.05 114.38 117.15 1cw4 h ARG 250 Ca 0.36 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 60.25 1cw4 h ARG 250 Cb -0.04 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1cw4 h ARG 250 CO -0.10 0.74 -0.50 0.93 -1.07 0.00 0.00 179.97 179.97 1cw4 h GLU 251 N -0.62 0.17 0.00 0.04 5.08 -0.69 -3.12 114.58 115.43 1cw4 h GLU 251 Ca -0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1cw4 h GLU 251 Cb 0.75 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1cw4 h GLU 251 CO 0.01 0.63 -0.76 0.39 -1.00 0.00 0.00 179.01 178.28 1cw4 n GLU 252 N -3.95 2.70 -0.17 2.33 1.02 -0.07 -4.71 120.64 117.78 1cw4 n GLU 252 Ca -0.02 -0.03 0.06 0.00 -0.02 0.00 0.00 57.16 57.15 1cw4 n GLU 252 Cb 0.53 -0.96 0.08 0.00 -0.02 0.00 0.00 31.44 31.08 1cw4 n GLU 252 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1cw4 n PHE 253 N -1.42 0.00 -3.24 -0.32 3.72 -0.89 -5.01 117.46 110.30 1cw4 n PHE 253 Ca 0.00 -0.62 -0.23 0.00 -0.05 0.00 0.00 57.45 56.54 1cw4 n PHE 253 Cb 0.12 -0.10 0.03 0.00 -0.94 0.00 0.00 39.48 38.59 1cw4 n PHE 253 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1cw4 n GLY 254 N -0.87 -0.52 3.72 1.37 0.00 -1.15 -4.48 105.19 103.27 1cw4 n GLY 254 Ca 0.09 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1cw4 n GLY 254 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cw4 n GLY 255 N -1.54 1.35 3.57 -0.02 0.00 -0.45 -4.75 105.19 103.35 1cw4 n GLY 255 Ca -0.06 0.54 -0.28 0.00 0.00 0.00 0.00 46.02 46.21 1cw4 n GLY 255 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cw4 s GLU 256 N 0.23 2.07 0.09 1.61 2.02 -0.15 -4.68 118.70 119.89 1cw4 s GLU 256 Ca 0.70 -1.16 -0.30 0.00 0.02 0.00 0.00 54.97 54.23 1cw4 s GLU 256 Cb -0.53 -2.22 -0.06 0.00 0.10 0.00 0.00 34.13 31.42 1cw4 s GLU 256 CO 0.42 0.47 1.18 -1.17 0.02 0.00 0.00 175.26 176.17 1cw4 s LEU 257 N -2.52 4.39 -0.24 1.80 2.96 -1.26 -0.38 118.68 123.43 1cw4 s LEU 257 Ca 0.23 2.04 -0.14 0.00 -0.22 0.00 0.00 54.13 56.03 1cw4 s LEU 257 Cb -0.10 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1cw4 s LEU 257 CO 0.14 -0.42 0.33 -0.63 -1.32 0.00 0.00 176.35 174.46 1cw4 s ILE 258 N 0.76 5.22 0.00 6.68 1.01 -0.04 -4.87 121.20 129.96 1cw4 s ILE 258 Ca 0.57 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.74 1cw4 s ILE 258 Cb -0.30 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.51 1cw4 s ILE 258 CO 0.31 0.23 0.00 -0.67 0.00 0.00 0.00 174.94 174.81 1cw4 n ASP 259 N 4.82 0.00 -1.40 3.58 -0.08 -1.26 -1.29 116.55 120.92 1cw4 n ASP 259 Ca -0.10 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.27 1cw4 n ASP 259 Cb 0.51 0.00 0.33 0.00 2.34 0.00 0.00 41.12 44.30 1cw4 n ASP 259 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cw4 n GLY 260 N 0.00 3.05 0.00 0.27 0.00 -1.26 -5.06 105.19 102.18 1cw4 n GLY 260 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1cw4 n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cw4 n GLY 261 N 0.66 -0.23 0.31 -0.02 0.00 -0.41 -4.97 105.19 100.53 1cw4 n GLY 261 Ca 0.24 -1.79 0.13 0.00 0.00 0.00 0.00 46.02 44.61 1cw4 n GLY 261 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cw4 n PRO 262 N -0.17 1.08 -1.92 1.61 -0.04 -1.26 -5.00 135.00 129.30 1cw4 n PRO 262 Ca 0.00 -0.62 -0.37 0.00 -0.04 0.00 0.00 63.50 62.47 1cw4 n PRO 262 Cb 0.00 -1.49 0.04 0.00 -0.04 0.00 0.00 33.50 32.01 1cw4 n PRO 262 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1cw4 s TRP 263 N -2.35 2.32 0.22 0.54 0.52 -1.26 -4.89 118.94 114.04 1cw4 s TRP 263 Ca 0.29 1.49 0.08 0.00 0.02 0.00 0.00 56.10 57.97 1cw4 s TRP 263 Cb 0.20 -3.58 -0.05 0.00 -1.15 0.00 0.00 33.47 28.89 1cw4 s TRP 263 CO 0.46 -2.47 -0.13 -0.51 0.02 0.00 0.00 176.95 174.33 1cw4 s LEU 264 N -4.00 2.54 -0.06 2.99 1.02 -0.18 -0.86 118.68 120.11 1cw4 s LEU 264 Ca 0.77 -1.06 0.03 0.00 0.02 0.00 0.00 54.13 53.90 1cw4 s LEU 264 Cb -0.34 -0.67 0.01 0.00 0.02 0.00 0.00 46.19 45.21 1cw4 s LEU 264 CO 0.37 -0.20 -0.15 -1.59 0.02 0.00 0.00 176.35 174.80 1cw4 s LYS 265 N -3.66 1.87 -0.18 1.70 -2.85 0.49 0.10 119.74 117.22 1cw4 s LYS 265 Ca 0.24 -0.52 -0.01 0.00 -1.00 0.00 0.00 55.97 54.69 1cw4 s LYS 265 Cb 0.00 -1.54 0.00 0.00 -2.06 0.00 0.00 37.83 34.23 1cw4 s LYS 265 CO 0.08 0.10 -0.13 0.08 0.10 0.00 0.00 175.35 175.58 1cw4 s VAL 266 N 0.46 2.75 -0.03 1.79 1.01 0.99 -0.98 120.40 126.38 1cw4 s VAL 266 Ca -0.12 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 1cw4 s VAL 266 Cb -0.15 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1cw4 s VAL 266 CO 0.04 0.50 1.18 -1.59 0.00 0.00 0.00 175.10 175.23 1cw4 s LYS 267 N 1.05 4.38 -0.28 2.72 0.00 -1.26 0.19 119.74 126.53 1cw4 s LYS 267 Ca -0.01 1.66 -0.29 0.00 0.00 0.00 0.00 55.97 57.34 1cw4 s LYS 267 Cb -0.15 -3.51 -0.01 0.00 0.00 0.00 0.00 37.83 34.16 1cw4 s LYS 267 CO -0.03 -0.39 1.44 1.21 0.00 0.00 0.00 175.35 177.59 1cw4 s ASN 268 N 1.36 6.50 0.00 0.03 3.84 0.96 -4.86 114.94 122.77 1cw4 s ASN 268 Ca 0.56 1.32 0.02 0.00 0.21 0.00 0.00 52.86 54.97 1cw4 s ASN 268 Cb -0.25 -2.54 0.07 0.00 -0.55 0.00 0.00 41.25 37.98 1cw4 s ASN 268 CO 0.23 -1.20 1.00 -0.81 -2.79 0.00 0.00 177.10 173.53 1cw4 n PRO 269 N 7.56 0.01 -0.08 0.43 -0.04 -1.26 -0.15 135.00 141.46 1cw4 n PRO 269 Ca 0.17 0.42 -0.11 0.00 -0.04 0.00 0.00 63.50 63.95 1cw4 n PRO 269 Cb 0.46 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.35 1cw4 n PRO 269 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1cw4 n ASN 270 N -1.45 2.81 -0.00 3.54 3.02 -1.26 -4.76 115.26 117.15 1cw4 n ASN 270 Ca 0.00 -0.08 0.07 0.00 -0.03 0.00 0.00 54.58 54.54 1cw4 n ASN 270 Cb 0.02 -0.23 -0.09 0.00 -0.61 0.00 0.00 39.78 38.86 1cw4 n ASN 270 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1cw4 n THR 271 N -2.94 0.00 -0.59 3.41 -2.24 -1.15 -4.99 114.28 105.79 1cw4 n THR 271 Ca -0.27 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1cw4 n THR 271 Cb 0.79 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1cw4 n THR 271 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1cw4 n GLY 272 N 1.51 1.64 3.77 3.38 0.00 0.79 -5.00 105.19 111.29 1cw4 n GLY 272 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1cw4 n GLY 272 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cw4 s LYS 273 N -0.07 4.26 -0.57 1.61 2.20 -1.26 -4.56 119.74 121.35 1cw4 s LYS 273 Ca 0.00 2.35 -0.21 0.00 -0.36 0.00 0.00 55.97 57.75 1cw4 s LYS 273 Cb 0.00 -3.03 0.06 0.00 -1.51 0.00 0.00 37.83 33.35 1cw4 s LYS 273 CO 0.00 -0.33 0.82 -1.21 -0.36 0.00 0.00 175.35 174.27 1cw4 s GLU 274 N -1.83 3.17 -0.20 4.03 0.41 -1.26 -0.03 118.70 122.99 1cw4 s GLU 274 Ca 0.51 -0.75 -0.29 0.00 -0.41 0.00 0.00 54.97 54.03 1cw4 s GLU 274 Cb -0.42 -4.14 0.00 0.00 -1.78 0.00 0.00 34.13 27.79 1cw4 s GLU 274 CO 0.56 -1.50 1.09 0.42 -0.49 0.00 0.00 175.26 175.34 1cw4 s ILE 275 N 3.41 4.60 0.01 -1.63 1.01 0.13 -4.82 121.20 123.90 1cw4 s ILE 275 Ca 0.21 1.92 -0.29 0.00 0.00 0.00 0.00 60.65 62.49 1cw4 s ILE 275 Cb -0.17 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 1cw4 s ILE 275 CO 0.13 -0.15 0.94 -0.69 0.00 0.00 0.00 174.94 175.17 1cw4 s VAL 276 N 3.13 4.82 -0.26 2.92 1.01 -0.77 -0.01 120.40 131.25 1cw4 s VAL 276 Ca 0.47 1.99 -0.05 0.00 0.00 0.00 0.00 61.98 64.39 1cw4 s VAL 276 Cb -0.17 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.93 1cw4 s VAL 276 CO 0.09 0.20 0.02 -0.63 0.00 0.00 0.00 175.10 174.78 1cw4 s ILE 277 N 0.80 3.65 0.19 2.22 -1.09 0.12 -0.59 121.20 126.49 1cw4 s ILE 277 Ca 0.49 -0.62 0.04 0.00 -2.23 0.00 0.00 60.65 58.33 1cw4 s ILE 277 Cb -0.21 -2.79 -0.01 0.00 -1.58 0.00 0.00 42.46 37.87 1cw4 s ILE 277 CO 0.27 0.24 0.13 2.29 -1.23 0.00 0.00 174.94 176.64 1cw4 n LYS 278 N 4.82 0.38 -3.76 2.79 2.85 -0.41 -1.01 118.16 123.81 1cw4 n LYS 278 Ca -0.16 -1.81 -0.13 0.00 -1.05 0.00 0.00 58.31 55.16 1cw4 n LYS 278 Cb 0.49 1.33 -0.09 0.00 -0.65 0.00 0.00 35.03 36.11 1cw4 n LYS 278 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1cw4 s ASP 279 N -2.28 -0.21 -0.04 -5.58 -4.77 -1.26 -0.51 116.67 102.02 1cw4 s ASP 279 Ca 0.18 0.17 -0.03 0.00 -3.30 0.00 0.00 52.55 49.58 1cw4 s ASP 279 Cb 0.01 0.37 0.01 0.00 -1.09 0.00 0.00 42.92 42.22 1cw4 s ASP 279 CO 0.13 -0.40 0.09 -0.69 0.70 0.00 0.00 175.17 175.01 1cw4 s VAL 280 N -1.10 -0.01 0.25 2.11 1.01 -0.64 -4.92 120.40 117.10 1cw4 s VAL 280 Ca -0.12 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 1cw4 s VAL 280 Cb -0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 36.38 36.08 1cw4 s VAL 280 CO 0.04 0.02 1.50 -0.63 0.00 0.00 0.00 175.10 176.02 1cw4 s ILE 281 N 0.28 2.49 0.22 2.22 -1.09 -1.26 -2.42 121.20 121.64 1cw4 s ILE 281 Ca -0.02 0.41 -0.11 0.00 -2.23 0.00 0.00 60.65 58.70 1cw4 s ILE 281 Cb -0.03 -3.26 0.23 0.00 -1.58 0.00 0.00 42.46 37.82 1cw4 s ILE 281 CO -0.01 0.06 1.65 0.00 -1.23 0.00 0.00 174.94 175.41 1cw4 h ALA 282 N 5.25 0.60 -0.73 9.38 0.00 -0.69 0.89 119.26 133.95 1cw4 h ALA 282 Ca -0.46 0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1cw4 h ALA 282 Cb 1.22 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 19.37 1cw4 h ALA 282 CO 0.80 -0.41 0.20 0.38 0.00 0.00 0.00 179.25 180.22 1cw4 h ASP 283 N 0.08 1.09 -0.00 0.00 3.04 -1.91 -1.85 116.42 116.87 1cw4 h ASP 283 Ca 0.34 -0.22 -0.12 0.00 -3.24 0.00 0.00 57.03 53.79 1cw4 h ASP 283 Cb 0.56 -0.29 -0.01 0.00 -1.04 0.00 0.00 39.33 38.55 1cw4 h ASP 283 CO -0.60 1.03 -0.37 0.00 -2.04 0.00 0.00 179.24 177.27 1cw4 h ALA 284 N 1.10 0.95 -0.56 4.15 0.00 -1.75 -2.76 119.26 120.39 1cw4 h ALA 284 Ca 0.23 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1cw4 h ALA 284 Cb 0.35 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1cw4 h ALA 284 CO -0.00 0.62 0.21 0.35 0.00 0.00 0.00 179.25 180.43 1cw4 h PHE 285 N 0.42 0.82 0.00 0.00 3.57 -0.24 0.83 116.94 122.34 1cw4 h PHE 285 Ca 0.04 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1cw4 h PHE 285 Cb 0.83 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.32 1cw4 h PHE 285 CO 0.03 0.64 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.63 1cw4 h LEU 286 N 0.80 0.00 0.08 0.59 3.38 -1.05 -1.02 115.31 118.10 1cw4 h LEU 286 Ca 0.19 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.90 1cw4 h LEU 286 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1cw4 h LEU 286 CO -0.02 0.05 -1.39 1.56 0.09 0.00 0.00 178.44 178.73 1cw4 h GLN 287 N 0.00 0.18 -0.20 1.13 4.20 -1.08 -3.38 115.11 115.96 1cw4 h GLN 287 Ca -0.00 -0.30 0.01 0.00 0.06 0.00 0.00 58.65 58.41 1cw4 h GLN 287 Cb 0.26 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1cw4 h GLN 287 CO 0.01 1.15 0.13 1.96 -0.67 0.00 0.00 178.83 181.40 1cw4 h GLN 288 N -0.44 0.25 0.00 1.46 1.08 -0.34 -0.92 115.11 116.19 1cw4 h GLN 288 Ca -0.32 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 56.83 1cw4 h GLN 288 Cb 1.66 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 29.03 1cw4 h GLN 288 CO -0.00 0.16 -0.16 -0.84 -0.95 0.00 0.00 178.83 177.04 1cw4 h ILE 289 N 0.25 0.70 0.09 2.54 3.07 -1.37 0.39 117.51 123.18 1cw4 h ILE 289 Ca 0.07 -0.68 -0.26 0.00 1.55 0.00 0.00 64.86 65.54 1cw4 h ILE 289 Cb -0.00 1.42 -0.01 0.00 -0.27 0.00 0.00 36.82 37.95 1cw4 h ILE 289 CO -0.02 0.16 -1.39 -0.07 -1.05 0.00 0.00 178.15 175.78 1cw4 h LEU 290 N 0.00 0.28 0.12 0.16 -0.00 -1.41 -3.29 115.31 111.18 1cw4 h LEU 290 Ca -0.00 -0.80 -0.29 0.00 -0.00 0.00 0.00 57.88 56.79 1cw4 h LEU 290 Cb 0.41 -0.09 0.02 0.00 -0.00 0.00 0.00 40.66 41.00 1cw4 h LEU 290 CO 0.02 1.59 -1.27 -0.07 -0.00 0.00 0.00 178.44 178.72 1cw4 h LEU 291 N -0.44 0.65 -5.55 1.67 4.07 -1.08 -3.41 115.31 111.22 1cw4 h LEU 291 Ca -0.32 -0.65 -0.42 0.00 0.08 0.00 0.00 57.88 56.57 1cw4 h LEU 291 Cb 1.66 -0.21 -0.39 0.00 1.08 0.00 0.00 40.66 42.80 1cw4 h LEU 291 CO -0.00 1.49 -1.15 0.54 -1.08 0.00 0.00 178.44 178.23 1cw4 n ARG 292 N -3.67 1.04 -0.16 1.13 1.74 0.14 -4.97 116.66 111.91 1cw4 n ARG 292 Ca -0.12 -3.24 0.08 0.00 -0.77 0.00 0.00 57.85 53.80 1cw4 n ARG 292 Cb 1.01 -1.46 0.39 0.00 -1.02 0.00 0.00 32.46 31.38 1cw4 n ARG 292 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1cw4 h PRO 293 N 2.98 0.64 0.00 5.56 0.13 -1.59 -2.31 132.00 137.41 1cw4 h PRO 293 Ca 0.01 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1cw4 h PRO 293 Cb 1.06 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1cw4 h PRO 293 CO 0.47 0.42 0.00 0.00 -0.23 0.00 0.00 178.00 178.67 1cw4 h ALA 294 N 1.63 1.00 -0.00 -0.56 0.00 -1.90 -1.84 119.26 117.60 1cw4 h ALA 294 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1cw4 h ALA 294 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1cw4 h ALA 294 CO -0.10 0.00 -0.04 0.39 0.00 0.00 0.00 179.25 179.49 1cw4 n GLU 295 N -3.02 0.67 -4.37 0.00 1.02 -0.87 -4.87 120.64 109.20 1cw4 n GLU 295 Ca -0.03 -0.12 -0.28 0.00 -0.02 0.00 0.00 57.16 56.71 1cw4 n GLU 295 Cb 0.07 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.88 1cw4 n GLU 295 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1cw4 s TYR 296 N -2.41 2.40 0.00 -0.32 2.02 -0.69 -5.02 117.35 113.32 1cw4 s TYR 296 Ca 0.32 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.70 1cw4 s TYR 296 Cb 0.21 -1.23 0.00 0.00 -0.40 0.00 0.00 41.96 40.53 1cw4 s TYR 296 CO 0.45 0.43 0.00 -3.47 -1.57 0.00 0.00 175.55 171.39 1cw4 n ASP 297 N 0.53 0.00 -4.74 2.29 -0.08 -1.26 -4.70 116.55 108.58 1cw4 n ASP 297 Ca -0.14 0.00 -0.40 0.00 -1.51 0.00 0.00 54.79 52.74 1cw4 n ASP 297 Cb 0.54 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.95 1cw4 n ASP 297 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1cw4 s VAL 298 N 0.49 4.72 -0.05 5.18 1.01 -0.56 -1.06 120.40 130.13 1cw4 s VAL 298 Ca 0.00 1.65 0.06 0.00 0.00 0.00 0.00 61.98 63.68 1cw4 s VAL 298 Cb 0.00 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 1cw4 s VAL 298 CO 0.00 0.36 -0.23 -0.63 0.00 0.00 0.00 175.10 174.60 1cw4 s ILE 299 N -0.06 1.89 -0.13 2.22 -1.09 0.07 -0.30 121.20 123.79 1cw4 s ILE 299 Ca 0.39 -0.98 0.01 0.00 -2.23 0.00 0.00 60.65 57.84 1cw4 s ILE 299 Cb -0.21 -1.60 0.02 0.00 -1.58 0.00 0.00 42.46 39.09 1cw4 s ILE 299 CO 0.23 0.53 -0.13 0.00 -1.23 0.00 0.00 174.94 174.34 1cw4 s ALA 300 N -0.14 1.71 0.28 9.38 0.00 0.01 0.32 121.76 133.32 1cw4 s ALA 300 Ca -0.03 -0.78 -0.12 0.00 0.00 0.00 0.00 51.96 51.03 1cw4 s ALA 300 Cb -0.13 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 22.04 1cw4 s ALA 300 CO 0.03 -0.28 0.52 0.00 0.00 0.00 0.00 175.76 176.02 1cw4 s MET 302 N -3.69 1.21 0.07 0.00 -1.94 -1.26 -1.06 119.30 112.63 1cw4 s MET 302 Ca 0.23 0.22 -0.20 0.00 -1.71 0.00 0.00 55.69 54.23 1cw4 s MET 302 Cb -0.01 -1.85 -0.07 0.00 2.01 0.00 0.00 34.83 34.90 1cw4 s MET 302 CO 0.11 -2.14 1.33 -0.97 -0.01 0.00 0.00 175.02 173.34 1cw4 h ASN 303 N -1.45 -1.06 0.01 3.03 -0.73 -1.79 0.31 115.58 113.91 1cw4 h ASN 303 Ca -0.49 0.13 -0.00 0.00 1.87 0.00 0.00 56.30 57.80 1cw4 h ASN 303 Cb 1.33 0.42 0.00 0.00 0.27 0.00 0.00 38.32 40.33 1cw4 h ASN 303 CO 0.61 -0.28 -0.01 0.25 -0.37 0.00 0.00 177.43 177.64 1cw4 h LEU 304 N -0.32 -0.01 -1.17 0.34 5.85 -1.90 -1.48 115.31 116.61 1cw4 h LEU 304 Ca 0.03 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.74 1cw4 h LEU 304 Cb 0.39 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1cw4 h LEU 304 CO -0.29 0.03 0.57 0.78 -0.34 0.00 0.00 178.44 179.19 1cw4 h ASN 305 N -0.06 0.93 -0.68 1.25 2.35 -1.94 -1.50 115.58 115.93 1cw4 h ASN 305 Ca -0.00 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.69 1cw4 h ASN 305 Cb 0.05 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1cw4 h ASN 305 CO 0.00 0.63 0.23 1.23 -1.65 0.00 0.00 177.43 177.87 1cw4 h GLY 306 N 1.07 1.16 0.97 2.83 0.00 -0.57 0.87 103.07 109.40 1cw4 h GLY 306 Ca 0.35 -0.66 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1cw4 h GLY 306 CO -0.10 0.62 0.22 -1.80 0.00 0.00 0.00 176.54 175.48 1cw4 h ASP 307 N 1.04 0.54 -0.03 0.19 -0.00 -0.30 -0.37 116.42 117.48 1cw4 h ASP 307 Ca 0.23 -0.10 -0.01 0.00 -0.00 0.00 0.00 57.03 57.15 1cw4 h ASP 307 Cb 0.28 -0.14 -0.00 0.00 -0.00 0.00 0.00 39.33 39.47 1cw4 h ASP 307 CO -0.01 0.48 -0.00 1.88 -0.00 0.00 0.00 179.24 181.59 1cw4 h TYR 308 N 0.55 0.06 -0.35 0.28 0.05 -0.86 -2.51 116.97 114.20 1cw4 h TYR 308 Ca 0.15 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.94 1cw4 h TYR 308 Cb 0.07 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 1cw4 h TYR 308 CO -0.02 0.37 0.18 0.82 -1.05 0.00 0.00 178.16 178.46 1cw4 h ILE 309 N -0.27 1.00 -0.67 -2.88 2.04 -0.79 -0.09 117.51 115.85 1cw4 h ILE 309 Ca 0.01 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1cw4 h ILE 309 Cb 0.35 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 1cw4 h ILE 309 CO 0.00 0.07 0.43 0.28 0.00 0.00 0.00 178.15 178.93 1cw4 h SER 310 N 0.37 0.79 -0.25 1.72 0.02 -1.08 -0.25 113.55 114.88 1cw4 h SER 310 Ca 0.14 -0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 60.97 1cw4 h SER 310 Cb 0.04 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 1cw4 h SER 310 CO -0.09 0.59 -0.20 0.44 -1.14 0.00 0.00 176.83 176.43 1cw4 h ASP 311 N 0.91 0.60 -0.50 3.07 3.32 -1.16 -1.58 116.42 121.09 1cw4 h ASP 311 Ca 0.25 -0.45 -0.00 0.00 0.02 0.00 0.00 57.03 56.84 1cw4 h ASP 311 Cb -0.08 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 1cw4 h ASP 311 CO -0.05 0.93 0.30 0.00 -1.72 0.00 0.00 179.24 178.69 1cw4 h ALA 312 N 0.69 0.63 -0.43 3.45 0.00 -0.84 -1.48 119.26 121.28 1cw4 h ALA 312 Ca 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1cw4 h ALA 312 Cb 0.74 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1cw4 h ALA 312 CO 0.05 0.12 0.16 -0.07 0.00 0.00 0.00 179.25 179.51 1cw4 h LEU 313 N 0.66 0.61 -0.87 0.00 4.07 -1.04 -2.36 115.31 116.39 1cw4 h LEU 313 Ca 0.18 -0.18 0.02 0.00 0.08 0.00 0.00 57.88 57.98 1cw4 h LEU 313 Cb -0.00 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.53 1cw4 h LEU 313 CO -0.03 0.63 0.56 0.00 -1.08 0.00 0.00 178.44 178.52 1cw4 h ALA 314 N 1.00 1.12 -0.02 1.53 0.00 -1.02 -2.93 119.26 118.94 1cw4 h ALA 314 Ca 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1cw4 h ALA 314 Cb 0.22 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1cw4 h ALA 314 CO -0.01 0.44 0.01 0.00 0.00 0.00 0.00 179.25 179.70 1cw4 h ALA 315 N 1.34 0.03 0.00 0.00 0.00 -0.99 0.24 119.26 119.88 1cw4 h ALA 315 Ca 0.33 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1cw4 h ALA 315 Cb -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1cw4 h ALA 315 CO -0.10 -0.41 -0.08 -0.56 0.00 0.00 0.00 179.25 178.11 1cw4 h GLN 316 N -0.08 0.00 -0.46 0.00 3.07 -1.26 -1.23 115.11 115.16 1cw4 h GLN 316 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.75 1cw4 h GLN 316 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.68 1cw4 h GLN 316 CO -0.00 0.08 0.00 1.33 0.09 0.00 0.00 178.83 180.32 1cw4 n VAL 317 N -4.20 0.61 -1.25 1.86 0.24 -1.14 -4.17 118.33 110.27 1cw4 n VAL 317 Ca -0.03 -0.64 -0.09 0.00 -2.04 0.00 0.00 64.34 61.55 1cw4 n VAL 317 Cb 0.16 0.39 -0.04 0.00 -1.47 0.00 0.00 33.84 32.88 1cw4 n VAL 317 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cw4 n GLY 318 N 1.30 1.05 1.62 7.63 0.00 -0.46 -4.72 105.19 111.60 1cw4 n GLY 318 Ca 0.17 -0.62 -0.05 0.00 0.00 0.00 0.00 46.02 45.52 1cw4 n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cw4 n GLY 319 N -1.88 4.13 0.38 -0.02 0.00 0.82 -4.64 105.19 103.98 1cw4 n GLY 319 Ca -0.09 -1.07 0.14 0.00 0.00 0.00 0.00 46.02 45.00 1cw4 n GLY 319 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1cw4 h ILE 320 N 1.91 0.75 -0.03 -0.61 2.10 -1.79 -1.35 117.51 118.50 1cw4 h ILE 320 Ca 0.25 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.97 1cw4 h ILE 320 Cb 2.08 0.04 0.00 0.00 -1.09 0.00 0.00 36.82 37.85 1cw4 h ILE 320 CO 0.60 0.12 -0.00 0.61 -1.08 0.00 0.00 178.15 178.40 1cw4 n GLY 321 N -1.42 0.78 0.70 8.18 0.00 -1.26 -4.41 105.19 107.77 1cw4 n GLY 321 Ca 0.20 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.64 1cw4 n GLY 321 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1cw4 n ILE 322 N 1.23 1.18 -2.82 -0.61 -5.35 -0.58 -2.88 119.36 109.53 1cw4 n ILE 322 Ca 0.13 -1.89 -0.42 0.00 -0.27 0.00 0.00 62.75 60.29 1cw4 n ILE 322 Cb 0.55 0.21 -0.04 0.00 -1.74 0.00 0.00 39.64 38.62 1cw4 n ILE 322 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1cw4 s ALA 323 N -1.76 3.63 0.59 -1.28 0.00 -0.77 -4.25 121.76 117.93 1cw4 s ALA 323 Ca 0.29 -0.09 -0.13 0.00 0.00 0.00 0.00 51.96 52.03 1cw4 s ALA 323 Cb 0.29 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.98 1cw4 s ALA 323 CO -0.06 -1.05 1.02 -1.25 0.00 0.00 0.00 175.76 174.42 1cw4 s PRO 324 N 3.02 3.65 -0.01 0.00 0.04 -1.26 -3.96 135.00 136.48 1cw4 s PRO 324 Ca 0.38 0.83 -0.25 0.00 0.04 0.00 0.00 61.00 62.00 1cw4 s PRO 324 Cb -0.15 -2.09 0.05 0.00 0.04 0.00 0.00 34.50 32.36 1cw4 s PRO 324 CO 0.08 -0.53 0.55 0.20 0.04 0.00 0.00 177.00 177.35 1cw4 s GLY 325 N -3.81 -0.44 0.00 0.56 0.00 -1.24 -4.33 107.32 98.08 1cw4 s GLY 325 Ca 0.57 0.86 -0.04 0.00 0.00 0.00 0.00 44.72 46.11 1cw4 s GLY 325 CO 0.47 0.56 0.08 0.00 0.00 0.00 0.00 173.10 174.21 1cw4 s ALA 326 N -1.63 -0.17 -0.27 3.20 0.00 -0.52 -1.99 121.76 120.38 1cw4 s ALA 326 Ca -0.10 -0.21 0.03 0.00 0.00 0.00 0.00 51.96 51.68 1cw4 s ALA 326 Cb -0.01 0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.25 1cw4 s ALA 326 CO 0.05 -0.17 -0.08 -0.80 0.00 0.00 0.00 175.76 174.76 1cw4 s ASN 327 N -1.17 4.41 -0.07 0.00 0.01 -0.18 -0.27 114.94 117.65 1cw4 s ASN 327 Ca -0.13 -1.47 0.02 0.00 -0.71 0.00 0.00 52.86 50.58 1cw4 s ASN 327 Cb -0.07 -1.51 -0.02 0.00 0.41 0.00 0.00 41.25 40.06 1cw4 s ASN 327 CO 0.01 -0.22 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.61 1cw4 s ILE 328 N 1.12 3.13 0.22 0.60 1.01 0.67 -0.74 121.20 127.20 1cw4 s ILE 328 Ca -0.06 -0.68 0.02 0.00 0.00 0.00 0.00 60.65 59.93 1cw4 s ILE 328 Cb -0.20 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.01 1cw4 s ILE 328 CO -0.06 0.57 0.07 0.61 0.00 0.00 0.00 174.94 176.13 1cw4 n GLY 329 N 2.61 3.68 0.16 6.18 0.00 -0.35 -1.55 105.19 115.91 1cw4 n GLY 329 Ca -0.17 -2.06 0.04 0.00 0.00 0.00 0.00 46.02 43.82 1cw4 n GLY 329 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1cw4 h ASP 330 N 0.83 0.00 0.00 1.61 3.32 -1.91 -3.36 116.42 116.92 1cw4 h ASP 330 Ca -0.18 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.68 1cw4 h ASP 330 Cb 0.65 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.16 1cw4 h ASP 330 CO 0.28 0.46 -1.94 -0.62 -1.72 0.00 0.00 179.24 175.70 1cw4 n GLU 331 N -3.35 1.25 -3.91 3.56 -0.58 -1.26 -4.99 120.64 111.35 1cw4 n GLU 331 Ca 0.01 -0.05 -0.11 0.00 -0.42 0.00 0.00 57.16 56.59 1cw4 n GLU 331 Cb 0.64 -1.38 0.00 0.00 -0.57 0.00 0.00 31.44 30.13 1cw4 n GLU 331 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1cw4 s ALA 333 N -2.54 -0.95 -0.20 0.00 0.00 -0.28 -1.22 121.76 116.57 1cw4 s ALA 333 Ca 0.21 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1cw4 s ALA 333 Cb -0.03 -0.50 0.05 0.00 0.00 0.00 0.00 23.12 22.64 1cw4 s ALA 333 CO 0.15 -0.20 -0.06 -1.17 0.00 0.00 0.00 175.76 174.48 1cw4 s LEU 334 N -0.09 2.12 0.21 0.00 2.96 0.08 -1.91 118.68 122.06 1cw4 s LEU 334 Ca -0.03 -0.94 -0.12 0.00 -0.22 0.00 0.00 54.13 52.82 1cw4 s LEU 334 Cb -0.03 -1.07 -0.07 0.00 0.50 0.00 0.00 46.19 45.52 1cw4 s LEU 334 CO 0.01 -0.21 0.58 -0.36 -1.32 0.00 0.00 176.35 175.05 1cw4 s PHE 335 N 1.50 3.49 0.02 5.38 0.40 0.24 -1.02 117.98 128.00 1cw4 s PHE 335 Ca -0.03 1.00 -0.17 0.00 -0.60 0.00 0.00 56.93 57.14 1cw4 s PHE 335 Cb -0.17 -2.34 0.03 0.00 0.51 0.00 0.00 43.02 41.04 1cw4 s PHE 335 CO -0.07 0.31 0.37 -1.83 0.70 0.00 0.00 175.22 174.70 1cw4 s GLU 336 N -2.48 0.83 0.32 0.44 -1.05 -0.84 -0.79 118.70 115.13 1cw4 s GLU 336 Ca 0.44 -0.32 -0.29 0.00 -0.15 0.00 0.00 54.97 54.65 1cw4 s GLU 336 Cb -0.13 0.37 -0.10 0.00 -0.44 0.00 0.00 34.13 33.84 1cw4 s GLU 336 CO 0.20 -0.27 1.20 0.00 0.95 0.00 0.00 175.26 177.34 1cw4 s ALA 337 N -2.13 3.42 -1.36 -0.84 0.00 -0.78 -3.58 121.76 116.48 1cw4 s ALA 337 Ca -0.08 1.06 0.21 0.00 0.00 0.00 0.00 51.96 53.15 1cw4 s ALA 337 Cb -0.02 -3.40 -0.14 0.00 0.00 0.00 0.00 23.12 19.56 1cw4 s ALA 337 CO -0.00 -0.41 0.95 0.25 0.00 0.00 0.00 175.76 176.55 1cw4 n THR 338 N 0.89 0.00 -2.23 0.00 -2.24 -1.25 -4.57 114.28 104.88 1cw4 n THR 338 Ca -0.00 -0.11 -0.26 0.00 -2.27 0.00 0.00 64.05 61.41 1cw4 n THR 338 Cb 0.44 1.10 0.16 0.00 -2.10 0.00 0.00 70.33 69.92 1cw4 n THR 338 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cw4 n HIS 339 N -0.93 -3.51 -1.50 4.78 1.44 -1.26 -5.08 115.22 109.17 1cw4 n HIS 339 Ca 0.06 -1.41 -0.13 0.00 -2.01 0.00 0.00 57.72 54.22 1cw4 n HIS 339 Cb 0.37 -0.86 0.09 0.00 0.12 0.00 0.00 29.99 29.71 1cw4 n HIS 339 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1cw4 n GLY 340 N -2.99 -1.14 0.08 -1.39 0.00 -1.26 -4.72 105.19 93.77 1cw4 n GLY 340 Ca 0.16 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.59 1cw4 n GLY 340 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1cw4 h THR 341 N -1.28 0.00 -7.08 2.61 1.35 -1.87 -3.45 112.91 103.19 1cw4 h THR 341 Ca -0.19 -0.50 -0.34 0.00 -0.55 0.00 0.00 66.41 64.82 1cw4 h THR 341 Cb 0.54 1.18 -0.02 0.00 -1.73 0.00 0.00 68.15 68.12 1cw4 h THR 341 CO 0.14 0.00 -0.57 0.00 -0.25 0.00 0.00 175.52 174.84 1cw4 n ALA 342 N -1.83 -1.87 0.06 6.62 0.00 -1.26 -0.96 120.51 121.27 1cw4 n ALA 342 Ca 0.04 -0.33 0.21 0.00 0.00 0.00 0.00 53.44 53.36 1cw4 n ALA 342 Cb 0.44 -1.32 0.71 0.00 0.00 0.00 0.00 19.45 19.28 1cw4 n ALA 342 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1cw4 h PRO 343 N -0.16 0.00 -0.52 0.00 0.13 -1.94 -1.48 132.00 128.04 1cw4 h PRO 343 Ca -0.40 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1cw4 h PRO 343 Cb 0.78 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.89 1cw4 h PRO 343 CO 0.30 0.00 0.31 0.87 -0.23 0.00 0.00 178.00 179.25 1cw4 h LYS 344 N 0.00 0.70 -0.02 0.86 6.56 -2.00 -2.66 116.57 120.00 1cw4 h LYS 344 Ca 0.23 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.76 1cw4 h LYS 344 Cb 1.31 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.82 1cw4 h LYS 344 CO -0.00 0.49 -0.24 0.66 -2.06 0.00 0.00 179.45 178.29 1cw4 n TYR 345 N -4.43 0.00 -1.62 -1.35 0.53 -0.56 -4.98 117.16 104.75 1cw4 n TYR 345 Ca 0.05 0.00 -0.51 0.00 -1.02 0.00 0.00 57.90 56.42 1cw4 n TYR 345 Cb 0.08 -0.01 -0.06 0.00 -1.03 0.00 0.00 39.34 38.32 1cw4 n TYR 345 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1cw4 n ALA 346 N 0.53 -0.41 -0.50 -0.72 0.00 -1.01 -1.21 120.51 117.20 1cw4 n ALA 346 Ca 0.12 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1cw4 n ALA 346 Cb 0.51 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1cw4 n ALA 346 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cw4 n GLY 347 N 2.85 1.77 0.19 0.00 0.00 -1.26 -4.88 105.19 103.85 1cw4 n GLY 347 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.36 1cw4 n GLY 347 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cw4 n GLN 348 N -2.00 1.14 -3.90 1.61 6.02 -0.35 -4.91 117.38 114.98 1cw4 n GLN 348 Ca 0.00 -0.39 -0.28 0.00 -0.01 0.00 0.00 57.00 56.33 1cw4 n GLN 348 Cb 0.00 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.78 1cw4 n GLN 348 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1cw4 n ASP 349 N -0.59 -2.99 -0.01 1.08 2.03 -1.26 -4.88 116.55 109.92 1cw4 n ASP 349 Ca 0.20 -0.85 -0.02 0.00 0.52 0.00 0.00 54.79 54.64 1cw4 n ASP 349 Cb 0.24 -3.67 -0.02 0.00 -0.72 0.00 0.00 41.12 36.95 1cw4 n ASP 349 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1cw4 n LYS 350 N -4.50 1.76 -1.10 -0.67 4.81 -1.26 -0.52 118.16 116.68 1cw4 n LYS 350 Ca -0.10 0.01 -0.31 0.00 -0.87 0.00 0.00 58.31 57.05 1cw4 n LYS 350 Cb 0.59 -1.07 0.12 0.00 0.02 0.00 0.00 35.03 34.69 1cw4 n LYS 350 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 1cw4 s VAL 351 N -2.06 2.89 -0.23 3.15 -7.23 -1.26 -4.22 120.40 111.43 1cw4 s VAL 351 Ca -0.03 0.29 -0.29 0.00 -1.81 0.00 0.00 61.98 60.14 1cw4 s VAL 351 Cb 0.01 -2.65 -0.00 0.00 0.56 0.00 0.00 36.38 34.29 1cw4 s VAL 351 CO 0.09 -0.38 1.23 0.21 -0.31 0.00 0.00 175.10 175.94 1cw4 s ASN 352 N -3.21 6.89 0.00 4.85 3.84 -1.26 -4.22 114.94 121.83 1cw4 s ASN 352 Ca 0.63 1.46 0.15 0.00 0.21 0.00 0.00 52.86 55.31 1cw4 s ASN 352 Cb -0.19 -2.54 0.64 0.00 -0.55 0.00 0.00 41.25 38.61 1cw4 s ASN 352 CO 0.57 -0.85 1.45 -0.81 -2.79 0.00 0.00 177.10 174.66 1cw4 n PRO 353 N 6.80 1.46 -0.36 0.43 -0.04 -1.26 -4.39 135.00 137.64 1cw4 n PRO 353 Ca 0.14 -0.70 0.07 0.00 -0.04 0.00 0.00 63.50 62.97 1cw4 n PRO 353 Cb 0.46 -1.28 0.24 0.00 -0.04 0.00 0.00 33.50 32.87 1cw4 n PRO 353 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1cw4 h GLY 354 N 5.31 1.62 0.90 0.55 0.00 -1.91 -1.98 103.07 107.55 1cw4 h GLY 354 Ca 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 1cw4 h GLY 354 CO 0.00 0.17 -0.29 0.23 0.00 0.00 0.00 176.54 176.65 1cw4 h SER 355 N 1.00 -0.68 -0.34 0.19 0.87 -1.70 -0.83 113.55 112.05 1cw4 h SER 355 Ca 0.49 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 61.00 1cw4 h SER 355 Cb 0.48 0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1cw4 h SER 355 CO -0.26 -0.41 0.10 -0.29 -0.53 0.00 0.00 176.83 175.44 1cw4 h ILE 356 N -0.92 1.18 -0.19 2.23 2.10 -1.83 -0.60 117.51 119.49 1cw4 h ILE 356 Ca -0.08 -0.65 -0.02 0.00 1.08 0.00 0.00 64.86 65.18 1cw4 h ILE 356 Cb 0.66 0.76 -0.01 0.00 -1.09 0.00 0.00 36.82 37.14 1cw4 h ILE 356 CO 0.14 0.24 0.02 0.40 -1.08 0.00 0.00 178.15 177.87 1cw4 h ILE 357 N 0.60 1.23 0.00 2.19 2.04 -1.31 -0.05 117.51 122.20 1cw4 h ILE 357 Ca 0.14 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1cw4 h ILE 357 Cb 0.22 1.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1cw4 h ILE 357 CO -0.00 0.23 -0.23 -0.07 0.00 0.00 0.00 178.15 178.08 1cw4 h LEU 358 N 0.09 0.00 -0.57 1.44 4.07 -0.84 0.28 115.31 119.78 1cw4 h LEU 358 Ca 0.06 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.86 1cw4 h LEU 358 Cb 0.33 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 1cw4 h LEU 358 CO 0.01 0.23 -0.70 0.28 -1.08 0.00 0.00 178.44 177.18 1cw4 h SER 359 N 0.00 0.13 0.45 -0.43 0.02 -0.67 -1.56 113.55 111.49 1cw4 h SER 359 Ca -0.00 -0.08 -0.13 0.00 -0.84 0.00 0.00 61.79 60.73 1cw4 h SER 359 Cb 0.51 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1cw4 h SER 359 CO 0.03 0.78 -0.57 0.00 -1.14 0.00 0.00 176.83 175.94 1cw4 h ALA 360 N 1.21 0.98 -0.46 3.77 0.00 0.47 -0.99 119.26 124.24 1cw4 h ALA 360 Ca -0.01 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 1cw4 h ALA 360 Cb 1.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1cw4 h ALA 360 CO 0.10 0.71 0.19 1.49 0.00 0.00 0.00 179.25 181.73 1cw4 h GLU 361 N 0.09 0.69 -0.84 0.00 4.22 -0.46 0.49 114.58 118.77 1cw4 h GLU 361 Ca -0.00 -0.12 -0.04 0.00 0.08 0.00 0.00 59.36 59.28 1cw4 h GLU 361 Cb 1.03 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.13 1cw4 h GLU 361 CO 0.08 0.62 0.39 0.52 -2.18 0.00 0.00 179.01 178.44 1cw4 h MET 362 N 0.60 1.23 -0.04 1.92 2.86 -0.95 -1.74 114.93 118.80 1cw4 h MET 362 Ca 0.15 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1cw4 h MET 362 Cb 0.19 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 1cw4 h MET 362 CO -0.01 0.95 0.02 1.98 1.06 0.00 0.00 176.91 180.92 1cw4 h MET 363 N 1.21 0.06 -0.63 1.72 1.85 -0.54 -0.15 114.93 118.44 1cw4 h MET 363 Ca 0.29 -0.01 0.04 0.00 -0.61 0.00 0.00 59.70 59.40 1cw4 h MET 363 Cb 0.15 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 32.12 1cw4 h MET 363 CO -0.03 0.13 0.38 -0.07 -0.40 0.00 0.00 176.91 176.92 1cw4 h LEU 364 N -0.02 0.61 -0.72 3.39 4.07 -0.73 -0.88 115.31 121.02 1cw4 h LEU 364 Ca 0.02 0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.94 1cw4 h LEU 364 Cb 0.09 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.68 1cw4 h LEU 364 CO -0.00 0.42 0.27 -0.09 -1.08 0.00 0.00 178.44 177.95 1cw4 h ARG 365 N 0.74 1.09 -0.48 1.13 2.43 -1.11 -0.13 114.38 118.06 1cw4 h ARG 365 Ca 0.26 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1cw4 h ARG 365 Cb 0.06 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1cw4 h ARG 365 CO -0.12 0.91 0.26 1.25 -1.51 0.00 0.00 179.97 180.76 1cw4 h HIS 366 N 1.05 0.63 0.00 2.20 2.76 -0.23 -0.29 115.15 121.27 1cw4 h HIS 366 Ca 0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 1cw4 h HIS 366 Cb 0.24 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.00 1cw4 h HIS 366 CO 0.02 0.45 0.00 -1.33 -1.30 0.00 0.00 177.93 175.77 1cw4 n MET 367 N -4.41 0.43 -0.51 5.26 2.81 -0.41 -4.88 117.12 115.41 1cw4 n MET 367 Ca 0.04 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1cw4 n MET 367 Cb 0.10 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 1cw4 n MET 367 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cw4 n GLY 368 N 1.02 0.75 2.57 3.03 0.00 -0.12 -4.79 105.19 107.64 1cw4 n GLY 368 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1cw4 n GLY 368 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1cw4 n TRP 369 N -2.17 2.65 0.17 1.61 7.02 -0.12 -4.77 117.44 121.83 1cw4 n TRP 369 Ca 0.00 -2.80 0.06 0.00 -1.02 0.00 0.00 57.50 53.74 1cw4 n TRP 369 Cb 0.00 -1.81 0.54 0.00 -2.42 0.00 0.00 31.31 27.63 1cw4 n TRP 369 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 1cw4 h THR 370 N 2.80 1.06 -0.01 -0.99 1.35 -1.83 -2.47 112.91 112.83 1cw4 h THR 370 Ca 0.63 -0.18 -0.00 0.00 -0.55 0.00 0.00 66.41 66.31 1cw4 h THR 370 Cb 0.37 0.89 -0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1cw4 h THR 370 CO 1.49 0.07 0.00 -0.33 -0.25 0.00 0.00 175.52 176.50 1cw4 h GLU 371 N 0.19 0.01 -0.76 4.72 3.07 -1.95 0.18 114.58 120.04 1cw4 h GLU 371 Ca 0.05 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.90 1cw4 h GLU 371 Cb 0.04 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.91 1cw4 h GLU 371 CO -0.01 0.18 0.44 0.00 -1.40 0.00 0.00 179.01 178.22 1cw4 h ALA 372 N 0.83 0.97 -0.48 3.43 0.00 -1.77 -0.80 119.26 121.45 1cw4 h ALA 372 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1cw4 h ALA 372 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1cw4 h ALA 372 CO -0.00 0.46 0.25 0.00 0.00 0.00 0.00 179.25 179.96 1cw4 h ALA 373 N 1.23 0.62 -0.82 0.00 0.00 -1.23 -1.91 119.26 117.15 1cw4 h ALA 373 Ca 0.27 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1cw4 h ALA 373 Cb 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1cw4 h ALA 373 CO -0.05 0.16 0.54 -0.44 0.00 0.00 0.00 179.25 179.46 1cw4 h ASP 374 N 0.63 0.94 -0.72 0.00 3.45 -0.11 -1.49 116.42 119.13 1cw4 h ASP 374 Ca 0.17 -0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.56 1cw4 h ASP 374 Cb 0.08 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.59 1cw4 h ASP 374 CO -0.02 0.68 0.28 -0.07 -1.57 0.00 0.00 179.24 178.54 1cw4 h LEU 375 N 1.11 0.99 -0.35 1.55 4.07 -0.55 -0.46 115.31 121.67 1cw4 h LEU 375 Ca 0.30 -0.17 -0.05 0.00 0.08 0.00 0.00 57.88 58.04 1cw4 h LEU 375 Cb -0.13 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.34 1cw4 h LEU 375 CO -0.07 0.90 0.03 0.40 -1.08 0.00 0.00 178.44 178.62 1cw4 h ILE 376 N 1.03 1.25 -0.64 1.22 2.04 -0.65 0.38 117.51 122.13 1cw4 h ILE 376 Ca 0.24 -0.90 0.03 0.00 1.00 0.00 0.00 64.86 65.23 1cw4 h ILE 376 Cb 0.22 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1cw4 h ILE 376 CO -0.02 0.30 0.39 0.58 0.00 0.00 0.00 178.15 179.40 1cw4 h VAL 377 N 0.42 1.06 -0.42 1.67 2.07 -1.05 -0.03 116.25 119.96 1cw4 h VAL 377 Ca 0.10 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1cw4 h VAL 377 Cb 0.40 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1cw4 h VAL 377 CO 0.01 0.14 0.20 0.50 0.02 0.00 0.00 177.57 178.44 1cw4 h LYS 378 N 0.76 0.60 -0.68 1.57 3.64 -0.82 -1.29 116.57 120.35 1cw4 h LYS 378 Ca 0.26 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1cw4 h LYS 378 Cb 0.05 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1cw4 h LYS 378 CO -0.12 0.52 0.34 0.78 -2.27 0.00 0.00 179.45 178.70 1cw4 h GLY 379 N 0.53 1.04 0.87 5.01 0.00 -0.28 -1.12 103.07 109.12 1cw4 h GLY 379 Ca 0.14 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1cw4 h GLY 379 CO -0.02 0.48 0.06 1.98 0.00 0.00 0.00 176.54 179.05 1cw4 h MET 380 N 0.94 0.35 -0.56 4.80 1.85 -0.85 -0.73 114.93 120.74 1cw4 h MET 380 Ca 0.24 -0.08 0.02 0.00 -0.61 0.00 0.00 59.70 59.27 1cw4 h MET 380 Cb 0.09 -0.05 -0.04 0.00 0.43 0.00 0.00 31.60 32.04 1cw4 h MET 380 CO -0.03 0.45 0.34 0.93 -0.40 0.00 0.00 176.91 178.20 1cw4 h GLU 381 N 0.19 0.66 -0.18 0.39 5.08 -1.04 -1.44 114.58 118.23 1cw4 h GLU 381 Ca 0.07 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1cw4 h GLU 381 Cb 0.25 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1cw4 h GLU 381 CO -0.00 0.44 0.02 0.78 -1.00 0.00 0.00 179.01 179.24 1cw4 h GLY 382 N 0.68 0.33 1.00 -3.84 0.00 -1.07 -1.18 103.07 98.99 1cw4 h GLY 382 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cw4 h GLY 382 CO -0.09 0.21 0.20 0.00 0.00 0.00 0.00 176.54 176.86 1cw4 h ALA 383 N 0.80 0.38 -0.27 3.60 0.00 -0.99 0.14 119.26 122.92 1cw4 h ALA 383 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1cw4 h ALA 383 Cb 0.34 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1cw4 h ALA 383 CO 0.01 -0.15 0.06 0.82 0.00 0.00 0.00 179.25 179.98 1cw4 h ILE 384 N 0.41 1.22 0.00 0.00 2.04 -1.28 -2.62 117.51 117.28 1cw4 h ILE 384 Ca 0.11 -0.74 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 1cw4 h ILE 384 Cb -0.05 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1cw4 h ILE 384 CO -0.03 0.24 -0.18 -1.13 0.00 0.00 0.00 178.15 177.06 1cw4 h ASN 385 N 0.26 0.00 0.62 1.72 -0.73 -1.00 -1.00 115.58 115.46 1cw4 h ASN 385 Ca 0.08 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.25 1cw4 h ASN 385 Cb 0.31 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1cw4 h ASN 385 CO 0.00 0.18 0.00 0.00 -0.37 0.00 0.00 177.43 177.24 1cw4 n ALA 386 N -2.45 2.17 -1.91 1.57 0.00 0.47 -4.89 120.51 115.47 1cw4 n ALA 386 Ca -0.02 -0.10 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 1cw4 n ALA 386 Cb 0.25 -1.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.27 1cw4 n ALA 386 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cw4 n LYS 387 N -1.38 -1.21 -3.42 0.00 5.02 -0.38 -4.85 118.16 111.94 1cw4 n LYS 387 Ca 0.09 0.91 -0.44 0.00 -2.02 0.00 0.00 58.31 56.85 1cw4 n LYS 387 Cb 0.23 -5.21 -0.05 0.00 -0.02 0.00 0.00 35.03 29.98 1cw4 n LYS 387 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1cw4 s THR 388 N -2.71 4.92 0.23 -0.18 -4.23 -1.13 -0.32 115.64 112.23 1cw4 s THR 388 Ca 0.00 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1cw4 s THR 388 Cb 0.00 -4.14 -0.04 0.00 1.34 0.00 0.00 72.50 69.66 1cw4 s THR 388 CO 0.00 -0.90 0.14 0.68 -0.54 0.00 0.00 174.62 174.00 1cw4 s VAL 389 N 0.86 0.12 0.87 2.29 -7.23 -0.40 -4.61 120.40 112.31 1cw4 s VAL 389 Ca 0.10 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.15 1cw4 s VAL 389 Cb -0.21 -2.52 0.12 0.00 0.56 0.00 0.00 36.38 34.32 1cw4 s VAL 389 CO -0.03 0.00 1.12 0.42 -0.31 0.00 0.00 175.10 176.30 1cw4 s THR 390 N -3.99 2.44 0.28 5.32 -4.23 -1.25 0.08 115.64 114.30 1cw4 s THR 390 Ca 0.39 0.14 0.02 0.00 -1.18 0.00 0.00 61.69 61.06 1cw4 s THR 390 Cb 0.07 -2.85 0.27 0.00 1.34 0.00 0.00 72.50 71.32 1cw4 s THR 390 CO 0.14 -0.19 1.75 0.10 -0.54 0.00 0.00 174.62 175.89 1cw4 h TYR 391 N -1.38 0.85 -0.10 3.99 -0.00 -1.75 -1.37 116.97 117.21 1cw4 h TYR 391 Ca -0.49 0.04 0.03 0.00 0.00 0.00 0.00 58.73 58.30 1cw4 h TYR 391 Cb 1.31 -0.24 -0.00 0.00 0.00 0.00 0.00 36.73 37.80 1cw4 h TYR 391 CO 0.36 0.15 0.08 0.38 -0.00 0.00 0.00 178.16 179.14 1cw4 h ASP 392 N 0.62 0.00 0.00 0.10 2.03 -1.93 0.03 116.42 117.28 1cw4 h ASP 392 Ca 0.53 0.00 -0.16 0.00 -0.73 0.00 0.00 57.03 56.66 1cw4 h ASP 392 Cb 0.83 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.31 1cw4 h ASP 392 CO -0.41 0.00 -1.07 0.49 -1.03 0.00 0.00 179.24 177.22 1cw4 n PHE 393 N -4.27 0.91 -0.32 4.15 3.01 -0.74 -4.47 117.46 115.74 1cw4 n PHE 393 Ca -0.01 0.40 0.15 0.00 1.01 0.00 0.00 57.45 59.00 1cw4 n PHE 393 Cb 0.20 -0.97 0.33 0.00 -0.01 0.00 0.00 39.48 39.03 1cw4 n PHE 393 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1cw4 h GLU 394 N -1.00 0.42 0.00 -1.08 4.22 -1.05 -0.16 114.58 115.93 1cw4 h GLU 394 Ca -0.24 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.17 1cw4 h GLU 394 Cb 1.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1cw4 h GLU 394 CO -0.15 0.28 0.00 0.07 -2.18 0.00 0.00 179.01 177.03 1cw4 h ARG 395 N 0.43 0.00 -0.45 1.92 0.11 -1.21 -1.56 114.38 113.62 1cw4 h ARG 395 Ca 0.59 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.67 1cw4 h ARG 395 Cb 1.14 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.22 1cw4 h ARG 395 CO -0.52 0.00 0.00 1.28 0.10 0.00 0.00 179.97 180.83 1cw4 n LEU 396 N -2.75 3.39 -4.33 0.08 4.77 -0.08 -4.99 117.00 113.09 1cw4 n LEU 396 Ca -0.01 -1.69 -0.17 0.00 -0.03 0.00 0.00 56.01 54.11 1cw4 n LEU 396 Cb 0.16 -0.29 -0.10 0.00 -2.33 0.00 0.00 43.42 40.85 1cw4 n LEU 396 CO 0.20 0.78 -0.39 -0.04 -1.33 0.00 0.00 177.39 176.61 1cw4 s MET 397 N -1.21 1.30 -0.02 3.23 -1.94 -0.59 -4.93 119.30 115.13 1cw4 s MET 397 Ca 0.37 -1.61 0.06 0.00 -1.71 0.00 0.00 55.69 52.80 1cw4 s MET 397 Cb 0.20 -0.86 -0.02 0.00 2.01 0.00 0.00 34.83 36.16 1cw4 s MET 397 CO 0.28 0.05 -0.20 -0.51 -0.01 0.00 0.00 175.02 174.63 1cw4 s ASP 398 N -3.30 3.59 -0.69 3.03 1.01 -1.26 -4.66 116.67 114.40 1cw4 s ASP 398 Ca 0.24 -0.35 0.00 0.00 0.71 0.00 0.00 52.55 53.14 1cw4 s ASP 398 Cb 0.03 -0.59 0.00 0.00 1.01 0.00 0.00 42.92 43.36 1cw4 s ASP 398 CO 0.06 0.32 0.00 0.61 0.21 0.00 0.00 175.17 176.37 1cw4 n GLY 399 N 2.21 0.11 3.75 0.21 0.00 -1.26 -5.04 105.19 105.18 1cw4 n GLY 399 Ca -0.17 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 1cw4 n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cw4 s ALA 400 N -2.39 3.45 -0.27 4.61 0.00 -1.26 -4.98 121.76 120.92 1cw4 s ALA 400 Ca 0.00 -1.25 -0.11 0.00 0.00 0.00 0.00 51.96 50.60 1cw4 s ALA 400 Cb 0.00 -1.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.82 1cw4 s ALA 400 CO 0.00 0.51 0.19 0.21 0.00 0.00 0.00 175.76 176.68 1cw4 s LYS 401 N -3.01 3.97 0.04 0.00 2.20 0.57 -5.01 119.74 118.50 1cw4 s LYS 401 Ca 0.30 -0.30 -0.30 0.00 -0.36 0.00 0.00 55.97 55.30 1cw4 s LYS 401 Cb -0.10 -3.65 -0.05 0.00 -1.51 0.00 0.00 37.83 32.52 1cw4 s LYS 401 CO 0.22 -0.15 1.23 -1.17 -0.36 0.00 0.00 175.35 175.12 1cw4 s LEU 402 N 1.69 4.35 0.08 5.43 2.96 -1.26 -1.27 118.68 130.65 1cw4 s LEU 402 Ca 0.07 2.02 0.06 0.00 -0.22 0.00 0.00 54.13 56.06 1cw4 s LEU 402 Cb -0.16 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.93 1cw4 s LEU 402 CO 0.10 -0.53 -0.17 -0.76 -1.32 0.00 0.00 176.35 173.68 1cw4 s LEU 403 N 1.39 2.27 0.89 -0.68 1.43 0.11 -4.90 118.68 119.19 1cw4 s LEU 403 Ca 0.59 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 52.95 1cw4 s LEU 403 Cb -0.29 -0.67 0.12 0.00 0.03 0.00 0.00 46.19 45.38 1cw4 s LEU 403 CO 0.28 -0.01 1.13 -0.54 0.23 0.00 0.00 176.35 177.44 1cw4 s LYS 404 N -1.71 1.33 0.12 1.70 1.02 -1.26 -3.91 119.74 117.04 1cw4 s LYS 404 Ca 0.02 0.36 -0.24 0.00 0.02 0.00 0.00 55.97 56.12 1cw4 s LYS 404 Cb -0.10 -1.86 -0.05 0.00 -0.52 0.00 0.00 37.83 35.30 1cw4 s LYS 404 CO 0.03 -2.08 1.66 0.00 -0.92 0.00 0.00 175.35 174.04 1cw4 h SER 406 N -0.28 1.09 -0.18 0.00 4.64 -1.89 -1.95 113.55 114.98 1cw4 h SER 406 Ca 0.06 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1cw4 h SER 406 Cb 0.37 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 1cw4 h SER 406 CO -0.19 0.83 -0.06 -0.33 -0.87 0.00 0.00 176.83 176.21 1cw4 h GLU 407 N 1.25 0.51 -0.10 4.77 5.08 -1.81 -1.55 114.58 122.73 1cw4 h GLU 407 Ca 0.33 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.43 1cw4 h GLU 407 Cb -0.06 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1cw4 h GLU 407 CO -0.06 0.58 -0.53 0.35 -1.00 0.00 0.00 179.01 178.35 1cw4 h PHE 408 N 0.48 0.35 -0.44 4.33 3.57 -0.56 -0.54 116.94 124.14 1cw4 h PHE 408 Ca 0.10 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1cw4 h PHE 408 Cb 0.41 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1cw4 h PHE 408 CO 0.01 0.75 0.26 0.78 -2.23 0.00 0.00 178.31 177.88 1cw4 h GLY 409 N 1.34 0.64 1.02 2.40 0.00 -0.60 -1.40 103.07 106.47 1cw4 h GLY 409 Ca 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 1cw4 h GLY 409 CO 0.08 0.26 0.37 -0.55 0.00 0.00 0.00 176.54 176.71 1cw4 h ASP 410 N 0.58 0.99 -0.92 0.19 3.45 -0.90 -2.11 116.42 117.69 1cw4 h ASP 410 Ca 0.16 -0.13 0.04 0.00 0.43 0.00 0.00 57.03 57.53 1cw4 h ASP 410 Cb 0.01 -0.25 -0.06 0.00 -0.56 0.00 0.00 39.33 38.47 1cw4 h ASP 410 CO -0.03 0.84 0.60 0.00 -1.57 0.00 0.00 179.24 179.08 1cw4 h ALA 411 N 1.19 1.24 0.05 3.45 0.00 -0.61 0.24 119.26 124.82 1cw4 h ALA 411 Ca 0.26 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1cw4 h ALA 411 Cb 0.11 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1cw4 h ALA 411 CO -0.03 0.43 -0.02 0.82 0.00 0.00 0.00 179.25 180.44 1cw4 h ILE 412 N 1.13 1.00 -0.48 0.00 2.04 -0.71 -1.67 117.51 118.82 1cw4 h ILE 412 Ca 0.38 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 66.14 1cw4 h ILE 412 Cb 0.06 1.11 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1cw4 h ILE 412 CO -0.14 0.04 0.18 0.40 0.00 0.00 0.00 178.15 178.63 1cw4 h ILE 413 N -0.14 0.86 0.00 -0.67 2.04 -0.73 -1.12 117.51 117.75 1cw4 h ILE 413 Ca -0.01 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1cw4 h ILE 413 Cb 0.12 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1cw4 h ILE 413 CO 0.01 0.07 -0.03 -0.33 0.00 0.00 0.00 178.15 177.87 1cw4 h GLU 414 N 0.36 0.00 -0.21 2.37 5.08 -0.28 -1.70 114.58 120.20 1cw4 h GLU 414 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1cw4 h GLU 414 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1cw4 h GLU 414 CO -0.22 0.03 0.00 0.09 -1.00 0.00 0.00 179.01 177.91 1cw4 n ASN 415 N -3.70 2.79 0.00 1.42 3.02 -0.46 -5.08 115.26 113.26 1cw4 n ASN 415 Ca -0.03 -1.89 0.08 0.00 -0.03 0.00 0.00 54.58 52.71 1cw4 n ASN 415 Cb 0.12 -0.13 0.46 0.00 -0.61 0.00 0.00 39.78 39.62 1cw4 n ASN 415 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87