#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cm5 s GLU 2 N 0.00 3.58 0.26 1.43 0.41 -1.26 -5.00 118.70 118.12 1cm5 s GLU 2 Ca 0.00 0.38 -0.30 0.00 -0.41 0.00 0.00 54.97 54.64 1cm5 s GLU 2 Cb 0.00 -3.98 -0.10 0.00 -1.78 0.00 0.00 34.13 28.27 1cm5 s GLU 2 CO 0.00 -1.58 1.40 -0.51 -0.49 0.00 0.00 175.26 174.08 1cm5 s LEU 3 N 4.83 4.40 -0.09 1.80 1.43 -1.26 -4.89 118.68 124.90 1cm5 s LEU 3 Ca 0.45 2.63 -0.39 0.00 -1.03 0.00 0.00 54.13 55.80 1cm5 s LEU 3 Cb -0.07 -3.63 -0.17 0.00 0.03 0.00 0.00 46.19 42.35 1cm5 s LEU 3 CO 0.28 -0.65 1.46 -3.20 0.23 0.00 0.00 176.35 174.47 1cm5 n ASN 4 N 2.11 1.66 -0.25 2.29 5.15 -1.26 -4.69 115.26 120.27 1cm5 n ASN 4 Ca 0.05 1.11 0.26 0.00 -0.60 0.00 0.00 54.58 55.41 1cm5 n ASN 4 Cb 0.41 -1.12 0.63 0.00 -0.53 0.00 0.00 39.78 39.17 1cm5 n ASN 4 CO 0.00 0.00 0.00 1.05 1.40 0.00 0.00 177.26 179.71 1cm5 h GLU 5 N 5.27 0.18 -0.64 1.20 4.11 -1.99 -0.17 114.58 122.54 1cm5 h GLU 5 Ca -0.47 -0.01 -0.07 0.00 0.07 0.00 0.00 59.36 58.88 1cm5 h GLU 5 Cb 1.34 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.53 1cm5 h GLU 5 CO 0.84 0.12 0.14 0.87 0.07 0.00 0.00 179.01 181.04 1cm5 h LYS 6 N 0.18 1.03 -0.11 1.06 6.56 -2.00 -1.46 116.57 121.83 1cm5 h LYS 6 Ca 0.50 -0.26 -0.05 0.00 -1.06 0.00 0.00 60.65 59.78 1cm5 h LYS 6 Cb 1.63 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 33.16 1cm5 h LYS 6 CO -0.11 0.94 -0.12 -0.07 -2.06 0.00 0.00 179.45 178.04 1cm5 h LEU 7 N 0.95 0.29 -0.56 2.94 3.38 -1.41 -2.63 115.31 118.28 1cm5 h LEU 7 Ca 0.20 -0.49 0.05 0.00 0.09 0.00 0.00 57.88 57.73 1cm5 h LEU 7 Cb 0.39 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1cm5 h LEU 7 CO 0.01 0.72 0.28 0.00 0.09 0.00 0.00 178.44 179.54 1cm5 h ALA 8 N 0.58 0.72 0.19 1.53 0.00 -1.21 0.59 119.26 121.66 1cm5 h ALA 8 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1cm5 h ALA 8 Cb 0.64 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1cm5 h ALA 8 CO 0.03 -0.07 -0.09 1.15 0.00 0.00 0.00 179.25 180.27 1cm5 h THR 9 N 0.53 0.91 -0.29 0.00 2.02 -1.33 -2.62 112.91 112.13 1cm5 h THR 9 Ca 0.25 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 66.89 1cm5 h THR 9 Cb 0.17 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1cm5 h THR 9 CO -0.18 0.13 0.19 0.00 0.37 0.00 0.00 175.52 176.03 1cm5 h ALA 10 N 0.21 1.85 -0.53 6.16 0.00 -1.28 -2.24 119.26 123.43 1cm5 h ALA 10 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1cm5 h ALA 10 Cb 0.40 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1cm5 h ALA 10 CO 0.04 0.12 0.00 0.91 0.00 0.00 0.00 179.25 180.33 1cm5 n TRP 11 N -4.49 1.12 -1.68 0.00 8.01 0.18 -4.75 117.44 115.84 1cm5 n TRP 11 Ca 0.02 -0.46 -0.47 0.00 -1.31 0.00 0.00 57.50 55.28 1cm5 n TRP 11 Cb 0.11 -0.17 -0.04 0.00 -2.01 0.00 0.00 31.31 29.20 1cm5 n TRP 11 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.69 174.77 1cm5 n GLU 12 N 0.92 2.31 0.00 -0.99 4.07 -0.84 -1.44 120.64 124.67 1cm5 n GLU 12 Ca 0.20 0.85 0.00 0.00 -0.06 0.00 0.00 57.16 58.15 1cm5 n GLU 12 Cb 0.69 -2.71 0.00 0.00 -0.06 0.00 0.00 31.44 29.36 1cm5 n GLU 12 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1cm5 n GLY 13 N 4.42 2.78 3.78 8.31 0.00 -1.26 -5.07 105.19 118.15 1cm5 n GLY 13 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 1cm5 n GLY 13 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cm5 s PHE 14 N -2.76 3.28 0.13 1.61 2.99 -0.52 -5.01 117.98 117.69 1cm5 s PHE 14 Ca 0.00 1.65 -0.30 0.00 0.00 0.00 0.00 56.93 58.27 1cm5 s PHE 14 Cb 0.00 -3.12 -0.07 0.00 0.00 0.00 0.00 43.02 39.83 1cm5 s PHE 14 CO 0.00 -0.61 1.10 0.99 -0.00 0.00 0.00 175.22 176.70 1cm5 s THR 15 N -1.66 4.03 0.85 0.64 2.01 -1.26 -5.02 115.64 115.23 1cm5 s THR 15 Ca 0.57 1.65 -0.11 0.00 0.31 0.00 0.00 61.69 64.12 1cm5 s THR 15 Cb -0.22 -4.06 0.11 0.00 0.01 0.00 0.00 72.50 68.34 1cm5 s THR 15 CO 0.28 0.24 1.13 -0.54 -0.69 0.00 0.00 174.62 175.04 1cm5 s LYS 16 N 0.06 1.55 0.00 4.92 1.02 -1.26 -4.86 119.74 121.17 1cm5 s LYS 16 Ca 0.51 1.44 0.00 0.00 0.02 0.00 0.00 55.97 57.94 1cm5 s LYS 16 Cb -0.28 -1.80 0.00 0.00 -0.52 0.00 0.00 37.83 35.23 1cm5 s LYS 16 CO 0.33 -2.22 0.00 0.41 -0.92 0.00 0.00 175.35 172.95 1cm5 n GLY 17 N -0.26 -0.50 0.38 -3.33 0.00 -1.26 -4.98 105.19 95.23 1cm5 n GLY 17 Ca 0.11 -1.05 0.20 0.00 0.00 0.00 0.00 46.02 45.27 1cm5 n GLY 17 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1cm5 h ASP 18 N 0.00 0.00 -0.10 1.61 3.32 -1.96 -2.11 116.42 117.18 1cm5 h ASP 18 Ca 0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1cm5 h ASP 18 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1cm5 h ASP 18 CO 0.00 0.00 0.28 4.11 -1.72 0.00 0.00 179.24 181.91 1cm5 h TRP 19 N 0.00 0.00 0.00 4.55 5.08 -1.80 0.37 115.95 124.14 1cm5 h TRP 19 Ca 0.22 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.19 1cm5 h TRP 19 Cb 0.94 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.10 1cm5 h TRP 19 CO 0.00 0.00 -0.27 1.96 -1.28 0.00 0.00 178.44 178.85 1cm5 h GLN 20 N 0.00 0.00 -0.00 0.12 4.20 -1.74 -3.35 115.11 114.34 1cm5 h GLN 20 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1cm5 h GLN 20 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1cm5 h GLN 20 CO -0.00 0.00 -0.51 0.09 -0.67 0.00 0.00 178.83 177.74 1cm5 n ASN 21 N -2.36 0.52 -3.77 1.46 3.02 0.08 -5.04 115.26 109.17 1cm5 n ASN 21 Ca 0.04 -0.76 -0.10 0.00 -0.03 0.00 0.00 54.58 53.74 1cm5 n ASN 21 Cb 0.46 0.99 -0.04 0.00 -0.61 0.00 0.00 39.78 40.58 1cm5 n ASN 21 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1cm5 s GLU 22 N -2.02 1.34 -0.28 3.52 -1.05 -0.93 -5.11 118.70 114.17 1cm5 s GLU 22 Ca 0.04 -0.91 -0.29 0.00 -0.15 0.00 0.00 54.97 53.66 1cm5 s GLU 22 Cb 0.08 0.50 -0.01 0.00 -0.44 0.00 0.00 34.13 34.26 1cm5 s GLU 22 CO 0.45 -0.56 1.42 0.08 0.95 0.00 0.00 175.26 177.60 1cm5 s VAL 23 N -3.89 3.96 -0.51 1.83 1.01 -1.26 -4.43 120.40 117.11 1cm5 s VAL 23 Ca 0.10 1.08 0.07 0.00 0.00 0.00 0.00 61.98 63.23 1cm5 s VAL 23 Cb -0.00 -4.00 0.19 0.00 0.00 0.00 0.00 36.38 32.56 1cm5 s VAL 23 CO -0.02 -0.43 0.73 0.21 0.00 0.00 0.00 175.10 175.58 1cm5 s ASN 24 N 3.41 -1.44 0.32 3.32 3.84 -1.26 -5.02 114.94 118.10 1cm5 s ASN 24 Ca 0.62 -1.67 0.01 0.00 0.21 0.00 0.00 52.86 52.03 1cm5 s ASN 24 Cb -0.19 1.89 0.54 0.00 -0.55 0.00 0.00 41.25 42.93 1cm5 s ASN 24 CO 0.26 -0.06 1.91 0.58 -2.79 0.00 0.00 177.10 177.00 1cm5 h VAL 25 N 4.97 1.19 -0.47 -5.21 2.07 -1.93 -2.83 116.25 114.05 1cm5 h VAL 25 Ca 0.06 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1cm5 h VAL 25 Cb 1.11 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1cm5 h VAL 25 CO 0.01 0.24 0.30 -0.09 0.02 0.00 0.00 177.57 178.05 1cm5 h ARG 26 N 0.75 0.62 -0.78 1.57 1.12 -1.96 -1.72 114.38 113.99 1cm5 h ARG 26 Ca 0.18 -0.04 -0.03 0.00 -1.11 0.00 0.00 59.98 58.98 1cm5 h ARG 26 Cb 0.15 -0.14 -0.04 0.00 -0.01 0.00 0.00 29.97 29.93 1cm5 h ARG 26 CO -0.02 0.43 0.36 0.22 -3.11 0.00 0.00 179.97 177.85 1cm5 h ASP 27 N 0.63 1.02 -0.49 -3.80 1.82 -1.94 -0.25 116.42 113.42 1cm5 h ASP 27 Ca 0.17 -0.13 -0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1cm5 h ASP 27 Cb -0.06 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 39.67 1cm5 h ASP 27 CO -0.04 0.87 0.26 0.15 -1.61 0.00 0.00 179.24 178.88 1cm5 h PHE 28 N 1.11 0.68 -0.01 0.28 3.57 -1.25 -0.43 116.94 120.89 1cm5 h PHE 28 Ca 0.27 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1cm5 h PHE 28 Cb 0.13 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.65 1cm5 h PHE 28 CO 0.01 0.51 0.01 0.82 -2.23 0.00 0.00 178.31 177.43 1cm5 h ILE 29 N 0.65 1.10 -0.96 1.41 2.04 -0.82 -1.60 117.51 119.34 1cm5 h ILE 29 Ca 0.17 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.77 1cm5 h ILE 29 Cb 0.06 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 1cm5 h ILE 29 CO -0.03 0.08 0.63 1.56 0.00 0.00 0.00 178.15 180.39 1cm5 h GLN 30 N -0.11 1.16 0.00 2.37 1.08 -0.82 -0.20 115.11 118.59 1cm5 h GLN 30 Ca 0.00 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1cm5 h GLN 30 Cb 0.13 -0.26 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 1cm5 h GLN 30 CO -0.00 0.76 -0.17 1.63 -0.95 0.00 0.00 178.83 180.10 1cm5 n LYS 31 N -4.45 0.15 0.00 1.46 4.76 -0.19 -4.55 118.16 115.34 1cm5 n LYS 31 Ca 0.13 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.67 1cm5 n LYS 31 Cb 0.12 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.66 1cm5 n LYS 31 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1cm5 n ASN 32 N -1.89 3.33 -4.75 4.39 3.02 -0.61 -4.52 115.26 114.23 1cm5 n ASN 32 Ca 0.06 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.26 1cm5 n ASN 32 Cb 0.39 0.53 0.05 0.00 -0.61 0.00 0.00 39.78 40.14 1cm5 n ASN 32 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 1cm5 s TYR 33 N -1.47 2.39 -0.33 3.10 -0.85 -0.15 -4.89 117.35 115.16 1cm5 s TYR 33 Ca 0.00 1.55 -0.06 0.00 -0.52 0.00 0.00 57.07 58.04 1cm5 s TYR 33 Cb 0.00 -3.38 0.04 0.00 0.38 0.00 0.00 41.96 39.00 1cm5 s TYR 33 CO 0.00 -2.12 0.09 0.99 -1.52 0.00 0.00 175.55 172.99 1cm5 s THR 34 N -1.91 3.70 0.43 -3.49 2.01 -1.26 -5.02 115.64 110.10 1cm5 s THR 34 Ca 0.73 -1.10 -0.26 0.00 0.31 0.00 0.00 61.69 61.38 1cm5 s THR 34 Cb -0.27 -3.07 -0.09 0.00 0.01 0.00 0.00 72.50 69.09 1cm5 s THR 34 CO 0.38 -0.13 1.41 -2.84 -0.69 0.00 0.00 174.62 172.75 1cm5 s PRO 35 N 1.40 3.81 -0.10 4.92 0.02 -1.26 -4.68 135.00 139.10 1cm5 s PRO 35 Ca -0.01 2.39 0.02 0.00 0.02 0.00 0.00 61.00 63.41 1cm5 s PRO 35 Cb -0.19 -2.73 0.01 0.00 0.02 0.00 0.00 34.50 31.62 1cm5 s PRO 35 CO 0.02 -0.71 -0.15 -0.47 -0.33 0.00 0.00 177.00 175.37 1cm5 s TYR 36 N -1.20 1.89 -0.54 6.54 5.04 -0.65 -4.98 117.35 123.45 1cm5 s TYR 36 Ca 0.59 -0.87 0.04 0.00 -2.44 0.00 0.00 57.07 54.39 1cm5 s TYR 36 Cb -0.43 -1.37 0.05 0.00 0.35 0.00 0.00 41.96 40.55 1cm5 s TYR 36 CO 0.56 -0.45 0.71 0.39 -1.34 0.00 0.00 175.55 175.42 1cm5 n GLU 37 N 4.18 0.10 -1.11 4.97 1.02 -1.26 -4.57 120.64 123.97 1cm5 n GLU 37 Ca -0.19 -0.91 -0.21 0.00 -0.02 0.00 0.00 57.16 55.83 1cm5 n GLU 37 Cb 0.51 -1.09 0.16 0.00 -0.02 0.00 0.00 31.44 31.00 1cm5 n GLU 37 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1cm5 n GLY 38 N 0.20 -1.90 0.00 0.62 0.00 -1.26 -4.67 105.19 98.19 1cm5 n GLY 38 Ca 0.03 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1cm5 n GLY 38 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1cm5 n ASP 39 N -3.89 0.00 -0.55 1.61 3.85 -1.26 -4.59 116.55 111.72 1cm5 n ASP 39 Ca 0.11 -0.34 0.12 0.00 -0.71 0.00 0.00 54.79 53.98 1cm5 n ASP 39 Cb 0.41 0.00 0.43 0.00 -1.35 0.00 0.00 41.12 40.61 1cm5 n ASP 39 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1cm5 n GLU 40 N -0.34 1.75 0.32 0.11 4.71 -1.26 -4.43 120.64 121.50 1cm5 n GLU 40 Ca 0.00 -1.10 0.19 0.00 -0.01 0.00 0.00 57.16 56.23 1cm5 n GLU 40 Cb 0.00 -1.44 0.99 0.00 -1.01 0.00 0.00 31.44 29.98 1cm5 n GLU 40 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1cm5 h SER 41 N 2.42 0.00 1.74 1.62 4.64 -2.02 -1.75 113.55 120.19 1cm5 h SER 41 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1cm5 h SER 41 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 1cm5 h SER 41 CO 0.00 0.00 -0.26 2.19 -0.87 0.00 0.00 176.83 177.89 1cm5 h PHE 42 N 0.00 0.00 -2.18 4.77 -5.15 -2.02 -3.47 116.94 108.89 1cm5 h PHE 42 Ca 0.01 0.00 -0.63 0.00 -0.20 0.00 0.00 57.97 57.15 1cm5 h PHE 42 Cb 0.38 0.00 0.08 0.00 0.22 0.00 0.00 35.95 36.63 1cm5 h PHE 42 CO 0.00 0.21 0.40 1.28 -2.00 0.00 0.00 178.31 178.21 1cm5 n LEU 43 N -3.13 2.09 -4.99 2.10 4.77 -0.66 -5.00 117.00 112.18 1cm5 n LEU 43 Ca 0.03 1.14 -0.19 0.00 -0.03 0.00 0.00 56.01 56.95 1cm5 n LEU 43 Cb 0.62 -1.29 -0.00 0.00 -2.33 0.00 0.00 43.42 40.42 1cm5 n LEU 43 CO 0.37 -1.00 0.09 0.00 -1.33 0.00 0.00 177.39 175.52 1cm5 s ALA 44 N -0.09 4.19 0.72 -1.18 0.00 -1.26 -5.11 121.76 119.03 1cm5 s ALA 44 Ca 0.72 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 51.28 1cm5 s ALA 44 Cb -0.78 -1.73 0.14 0.00 0.00 0.00 0.00 23.12 20.74 1cm5 s ALA 44 CO 0.51 -0.08 0.99 0.20 0.00 0.00 0.00 175.76 177.38 1cm5 s GLY 45 N -4.18 1.74 0.57 0.00 0.00 -1.26 -4.96 107.32 99.23 1cm5 s GLY 45 Ca 0.46 -1.90 -0.18 0.00 0.00 0.00 0.00 44.72 43.10 1cm5 s GLY 45 CO 0.32 -1.30 1.10 0.00 0.00 0.00 0.00 173.10 173.21 1cm5 s ALA 46 N -3.11 2.67 0.49 3.20 0.00 -1.26 -4.89 121.76 118.86 1cm5 s ALA 46 Ca 0.67 0.64 0.01 0.00 0.00 0.00 0.00 51.96 53.28 1cm5 s ALA 46 Cb -0.04 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.78 1cm5 s ALA 46 CO 0.44 -0.83 0.71 0.95 0.00 0.00 0.00 175.76 177.03 1cm5 s THR 47 N -2.07 3.41 0.25 0.00 -4.23 -1.26 -4.96 115.64 106.77 1cm5 s THR 47 Ca 0.69 -0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 60.57 1cm5 s THR 47 Cb -0.20 -3.26 0.20 0.00 1.34 0.00 0.00 72.50 70.58 1cm5 s THR 47 CO 0.31 -0.18 1.86 -0.33 -0.54 0.00 0.00 174.62 175.74 1cm5 h GLU 48 N 0.26 1.14 -0.46 3.99 5.08 -1.99 -2.35 114.58 120.25 1cm5 h GLU 48 Ca -0.44 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 57.79 1cm5 h GLU 48 Cb 1.27 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.27 1cm5 h GLU 48 CO 0.55 0.86 0.28 0.00 -1.00 0.00 0.00 179.01 179.69 1cm5 h ALA 49 N 1.32 0.59 0.21 3.43 0.00 -1.94 -0.00 119.26 122.86 1cm5 h ALA 49 Ca 0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1cm5 h ALA 49 Cb 0.07 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1cm5 h ALA 49 CO -0.04 -0.02 -0.12 1.15 0.00 0.00 0.00 179.25 180.21 1cm5 h THR 50 N 0.56 0.74 -0.86 0.00 2.02 -1.83 -0.76 112.91 112.79 1cm5 h THR 50 Ca 0.18 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.37 1cm5 h THR 50 Cb -0.00 0.74 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 1cm5 h THR 50 CO -0.08 0.00 0.56 0.74 0.37 0.00 0.00 175.52 177.11 1cm5 h THR 51 N -0.32 1.22 -0.04 3.16 2.02 -1.24 0.82 112.91 118.53 1cm5 h THR 51 Ca -0.02 -0.42 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 1cm5 h THR 51 Cb 0.26 -0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1cm5 h THR 51 CO 0.03 0.22 0.02 0.74 0.37 0.00 0.00 175.52 176.89 1cm5 h THR 52 N 1.16 1.10 0.23 3.16 2.02 -0.82 -1.01 112.91 118.75 1cm5 h THR 52 Ca 0.31 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1cm5 h THR 52 Cb -0.12 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1cm5 h THR 52 CO -0.07 0.08 -0.15 -0.07 0.37 0.00 0.00 175.52 175.69 1cm5 h LEU 53 N -0.05 -0.37 -0.71 2.58 3.38 -0.70 -2.42 115.31 117.02 1cm5 h LEU 53 Ca 0.01 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1cm5 h LEU 53 Cb 0.11 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1cm5 h LEU 53 CO -0.00 -0.24 0.32 -0.25 0.09 0.00 0.00 178.44 178.37 1cm5 h TRP 54 N -0.37 1.04 -0.51 1.13 -0.00 -0.83 -2.15 115.95 114.27 1cm5 h TRP 54 Ca -0.02 -0.06 -0.01 0.00 -0.00 0.00 0.00 58.89 58.79 1cm5 h TRP 54 Cb 0.31 -0.32 -0.03 0.00 -0.00 0.00 0.00 29.16 29.12 1cm5 h TRP 54 CO -0.09 0.78 0.26 -0.44 -0.00 0.00 0.00 178.44 178.95 1cm5 h ASP 55 N 1.00 0.63 -0.43 2.65 3.45 -1.11 0.93 116.42 123.55 1cm5 h ASP 55 Ca 0.24 -0.05 -0.12 0.00 0.43 0.00 0.00 57.03 57.53 1cm5 h ASP 55 Cb 0.15 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.75 1cm5 h ASP 55 CO -0.03 0.53 -0.22 0.50 -1.57 0.00 0.00 179.24 178.45 1cm5 h LYS 56 N 0.71 0.90 -0.20 3.56 1.63 -1.06 -3.01 116.57 119.09 1cm5 h LYS 56 Ca 0.18 -0.40 -0.13 0.00 -0.85 0.00 0.00 60.65 59.45 1cm5 h LYS 56 Cb 0.05 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1cm5 h LYS 56 CO -0.03 1.05 -0.43 0.28 -3.45 0.00 0.00 179.45 176.88 1cm5 h VAL 57 N 0.73 1.31 0.00 2.00 2.07 -0.74 -2.80 116.25 118.82 1cm5 h VAL 57 Ca 0.09 -1.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.00 1cm5 h VAL 57 Cb 0.79 1.62 -0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1cm5 h VAL 57 CO 0.06 0.50 -0.02 0.24 0.02 0.00 0.00 177.57 178.37 1cm5 h MET 58 N 0.40 0.00 -0.36 1.57 2.86 -0.71 -0.69 114.93 118.00 1cm5 h MET 58 Ca 0.03 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.59 1cm5 h MET 58 Cb 0.92 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.56 1cm5 h MET 58 CO 0.08 0.02 -0.12 0.93 1.06 0.00 0.00 176.91 178.88 1cm5 h GLU 59 N 0.00 0.64 -0.06 1.72 4.39 -1.42 -0.07 114.58 119.78 1cm5 h GLU 59 Ca -0.00 -0.20 -0.20 0.00 0.34 0.00 0.00 59.36 59.30 1cm5 h GLU 59 Cb 0.06 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1cm5 h GLU 59 CO 0.00 0.74 -0.81 0.78 -1.16 0.00 0.00 179.01 178.56 1cm5 h GLY 60 N 0.96 0.51 1.00 -3.84 0.00 -1.26 -2.90 103.07 97.54 1cm5 h GLY 60 Ca 0.10 -0.78 -0.04 0.00 0.00 0.00 0.00 47.33 46.61 1cm5 h GLY 60 CO 0.03 0.69 0.21 -2.08 0.00 0.00 0.00 176.54 175.39 1cm5 h VAL 61 N 0.30 1.24 -0.69 4.60 2.07 -0.99 -1.17 116.25 121.60 1cm5 h VAL 61 Ca -0.05 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 1cm5 h VAL 61 Cb 1.42 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 1cm5 h VAL 61 CO 0.14 0.29 0.37 0.11 0.02 0.00 0.00 177.57 178.51 1cm5 h LYS 62 N 0.82 0.97 -0.83 1.57 1.57 -1.02 -1.37 116.57 118.28 1cm5 h LYS 62 Ca 0.19 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1cm5 h LYS 62 Cb 0.25 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 1cm5 h LYS 62 CO -0.01 0.74 0.40 1.25 -0.57 0.00 0.00 179.45 181.25 1cm5 h LEU 63 N 0.95 1.09 0.24 2.94 5.85 -1.26 -0.15 115.31 124.97 1cm5 h LEU 63 Ca 0.24 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1cm5 h LEU 63 Cb 0.05 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1cm5 h LEU 63 CO -0.04 0.92 -0.11 -0.33 -0.34 0.00 0.00 178.44 178.54 1cm5 h GLU 64 N 1.19 -0.31 -0.81 1.25 5.08 -0.67 -0.97 114.58 119.35 1cm5 h GLU 64 Ca 0.29 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1cm5 h GLU 64 Cb 0.12 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 1cm5 h GLU 64 CO -0.04 -0.11 0.50 -0.91 -1.00 0.00 0.00 179.01 177.46 1cm5 h ASN 65 N -0.45 0.95 -0.12 1.42 2.35 -1.07 0.51 115.58 119.17 1cm5 h ASN 65 Ca -0.03 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1cm5 h ASN 65 Cb 0.34 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1cm5 h ASN 65 CO 0.05 0.72 0.04 -0.09 -1.65 0.00 0.00 177.43 176.51 1cm5 h ARG 66 N 1.10 0.18 0.00 0.81 2.43 -0.93 -3.19 114.38 114.79 1cm5 h ARG 66 Ca 0.29 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1cm5 h ARG 66 Cb -0.07 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1cm5 h ARG 66 CO -0.06 0.31 -0.50 0.25 -1.51 0.00 0.00 179.97 178.46 1cm5 n THR 67 N -4.89 0.24 -3.84 0.20 -2.24 -0.38 -4.94 114.28 98.42 1cm5 n THR 67 Ca -0.05 -0.17 -0.30 0.00 -2.27 0.00 0.00 64.05 61.26 1cm5 n THR 67 Cb 0.13 -0.08 0.02 0.00 -2.10 0.00 0.00 70.33 68.30 1cm5 n THR 67 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1cm5 n HIS 68 N -1.89 -2.23 -3.82 4.78 -0.00 0.18 -4.96 115.22 107.27 1cm5 n HIS 68 Ca 0.04 0.85 -0.10 0.00 0.46 0.00 0.00 57.72 58.98 1cm5 n HIS 68 Cb 0.40 -3.87 -0.06 0.00 -0.12 0.00 0.00 29.99 26.34 1cm5 n HIS 68 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1cm5 s ALA 69 N -3.26 -0.43 0.65 1.57 0.00 -1.16 -5.06 121.76 114.07 1cm5 s ALA 69 Ca 0.64 -0.52 -0.17 0.00 0.00 0.00 0.00 51.96 51.91 1cm5 s ALA 69 Cb -0.32 0.73 -0.01 0.00 0.00 0.00 0.00 23.12 23.53 1cm5 s ALA 69 CO 0.79 -0.64 1.20 -2.14 0.00 0.00 0.00 175.76 174.96 1cm5 s PRO 70 N -3.89 2.68 0.23 0.00 0.02 -1.26 -4.43 135.00 128.35 1cm5 s PRO 70 Ca 0.10 1.76 -0.01 0.00 0.02 0.00 0.00 61.00 62.87 1cm5 s PRO 70 Cb 0.03 -1.90 0.23 0.00 0.02 0.00 0.00 34.50 32.88 1cm5 s PRO 70 CO -0.06 -1.42 1.60 0.28 -0.33 0.00 0.00 177.00 177.08 1cm5 h VAL 71 N 0.40 1.30 -1.42 3.83 2.07 -1.91 -3.47 116.25 117.05 1cm5 h VAL 71 Ca -0.49 -1.56 0.28 0.00 0.82 0.00 0.00 66.70 65.75 1cm5 h VAL 71 Cb 1.29 1.56 -0.17 0.00 -1.52 0.00 0.00 31.29 32.45 1cm5 h VAL 71 CO 0.53 0.49 0.83 -0.62 0.02 0.00 0.00 177.57 178.83 1cm5 s ASP 72 N -6.85 -0.11 0.01 0.57 3.68 -1.26 -5.06 116.67 107.65 1cm5 s ASP 72 Ca -0.07 -0.03 -0.28 0.00 2.13 0.00 0.00 52.55 54.30 1cm5 s ASP 72 Cb 0.12 0.13 0.09 0.00 -1.45 0.00 0.00 42.92 41.82 1cm5 s ASP 72 CO 0.82 -0.22 0.78 0.72 0.13 0.00 0.00 175.17 177.39 1cm5 s PHE 73 N -2.38 -0.47 0.61 -5.34 -0.12 -1.26 -0.96 117.98 108.06 1cm5 s PHE 73 Ca 0.11 0.50 -0.19 0.00 -0.05 0.00 0.00 56.93 57.30 1cm5 s PHE 73 Cb 0.00 0.50 -0.03 0.00 -0.63 0.00 0.00 43.02 42.87 1cm5 s PHE 73 CO -0.04 -0.61 1.24 -0.51 -0.05 0.00 0.00 175.22 175.24 1cm5 s ASP 74 N -2.08 5.03 0.00 1.98 -0.00 0.55 -4.89 116.67 117.26 1cm5 s ASP 74 Ca -0.00 2.48 0.00 0.00 -0.00 0.00 0.00 52.55 55.02 1cm5 s ASP 74 Cb -0.01 -2.61 0.00 0.00 -0.00 0.00 0.00 42.92 40.31 1cm5 s ASP 74 CO -0.05 -1.71 0.00 0.41 -0.00 0.00 0.00 175.17 173.82 1cm5 n THR 75 N -1.64 0.00 -0.81 -1.27 -1.04 -1.26 -4.69 114.28 103.56 1cm5 n THR 75 Ca 0.14 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1cm5 n THR 75 Cb 0.49 0.53 0.00 0.00 -1.82 0.00 0.00 70.33 69.53 1cm5 n THR 75 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cm5 n ALA 76 N -0.74 0.58 -3.27 2.41 0.00 -1.26 -0.85 120.51 117.37 1cm5 n ALA 76 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 53.44 52.93 1cm5 n ALA 76 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1cm5 n ALA 76 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1cm5 s VAL 77 N -0.03 3.08 -0.31 0.00 1.01 -1.26 -4.90 120.40 117.98 1cm5 s VAL 77 Ca 0.00 -0.63 -0.25 0.00 0.00 0.00 0.00 61.98 61.10 1cm5 s VAL 77 Cb 0.00 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 34.06 1cm5 s VAL 77 CO 0.00 0.50 0.87 0.00 0.00 0.00 0.00 175.10 176.47 1cm5 s ALA 78 N 0.73 3.51 0.23 5.51 0.00 -1.26 -4.17 121.76 126.32 1cm5 s ALA 78 Ca -0.05 -0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.28 1cm5 s ALA 78 Cb -0.15 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.47 1cm5 s ALA 78 CO 0.02 -1.30 1.12 0.45 0.00 0.00 0.00 175.76 176.04 1cm5 s SER 79 N 1.64 7.24 0.22 0.00 0.15 0.10 -4.86 113.70 118.20 1cm5 s SER 79 Ca 0.36 2.21 0.02 0.00 0.70 0.00 0.00 55.95 59.24 1cm5 s SER 79 Cb -0.13 -2.62 -0.01 0.00 -1.71 0.00 0.00 66.02 61.55 1cm5 s SER 79 CO 0.14 -0.21 0.25 0.35 1.20 0.00 0.00 173.24 174.97 1cm5 n THR 80 N 1.79 0.00 -0.09 6.45 -2.24 -1.24 -4.81 114.28 114.14 1cm5 n THR 80 Ca 0.01 -1.39 -0.01 0.00 -2.27 0.00 0.00 64.05 60.39 1cm5 n THR 80 Cb 0.45 0.76 0.24 0.00 -2.10 0.00 0.00 70.33 69.68 1cm5 n THR 80 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1cm5 h ILE 81 N 1.69 1.21 -0.17 2.28 2.04 -1.85 -3.23 117.51 119.48 1cm5 h ILE 81 Ca -0.17 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1cm5 h ILE 81 Cb 0.79 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1cm5 h ILE 81 CO 0.23 0.27 0.00 0.35 0.00 0.00 0.00 178.15 179.00 1cm5 n THR 82 N -4.30 0.44 -0.31 -0.27 -2.24 -1.26 -4.72 114.28 101.61 1cm5 n THR 82 Ca 0.04 -0.72 -0.04 0.00 -2.27 0.00 0.00 64.05 61.06 1cm5 n THR 82 Cb 0.20 0.91 0.08 0.00 -2.10 0.00 0.00 70.33 69.42 1cm5 n THR 82 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1cm5 h SER 83 N 2.16 0.98 -3.07 3.42 4.64 -1.89 -3.45 113.55 116.34 1cm5 h SER 83 Ca 0.00 -0.03 -0.56 0.00 -0.47 0.00 0.00 61.79 60.73 1cm5 h SER 83 Cb 0.59 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.41 1cm5 h SER 83 CO 0.00 0.71 -0.31 -1.00 -0.87 0.00 0.00 176.83 175.36 1cm5 s HIS 84 N -6.11 3.48 0.86 4.77 3.76 -1.26 -5.01 115.29 115.77 1cm5 s HIS 84 Ca -0.13 0.49 -0.13 0.00 -0.15 0.00 0.00 55.06 55.14 1cm5 s HIS 84 Cb 0.16 -1.96 0.11 0.00 1.11 0.00 0.00 32.58 32.00 1cm5 s HIS 84 CO 0.80 0.41 1.19 -0.51 -0.85 0.00 0.00 174.74 175.77 1cm5 s ASP 85 N -2.69 4.05 0.32 1.40 1.01 -1.26 -4.99 116.67 114.51 1cm5 s ASP 85 Ca 0.40 0.74 -0.29 0.00 0.71 0.00 0.00 52.55 54.12 1cm5 s ASP 85 Cb -0.12 -1.19 -0.10 0.00 1.01 0.00 0.00 42.92 42.52 1cm5 s ASP 85 CO 0.26 -2.19 1.37 0.00 0.21 0.00 0.00 175.17 174.83 1cm5 s ALA 86 N -3.55 3.54 0.07 5.23 0.00 -1.26 -4.26 121.76 121.52 1cm5 s ALA 86 Ca 0.64 1.34 0.07 0.00 0.00 0.00 0.00 51.96 54.01 1cm5 s ALA 86 Cb -0.11 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 1cm5 s ALA 86 CO 0.51 -0.75 -0.19 0.20 0.00 0.00 0.00 175.76 175.53 1cm5 s GLY 87 N -0.23 1.08 0.10 0.00 0.00 -1.26 -4.81 107.32 102.20 1cm5 s GLY 87 Ca 0.52 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 44.14 1cm5 s GLY 87 CO 0.53 -1.05 0.05 -0.19 0.00 0.00 0.00 173.10 172.43 1cm5 s TYR 88 N -0.98 0.65 -0.18 1.90 1.51 -1.26 -4.28 117.35 114.71 1cm5 s TYR 88 Ca 0.05 -1.09 -0.14 0.00 -1.01 0.00 0.00 57.07 54.88 1cm5 s TYR 88 Cb -0.09 -0.39 -0.21 0.00 -0.11 0.00 0.00 41.96 41.16 1cm5 s TYR 88 CO 0.03 -0.48 0.22 -0.89 -1.11 0.00 0.00 175.55 173.32 1cm5 n ILE 89 N -0.02 1.64 -3.12 2.71 5.41 -1.26 -4.52 119.36 120.19 1cm5 n ILE 89 Ca -0.10 -0.33 0.04 0.00 1.00 0.00 0.00 62.75 63.37 1cm5 n ILE 89 Cb 0.62 -1.88 -0.00 0.00 -0.71 0.00 0.00 39.64 37.67 1cm5 n ILE 89 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1cm5 s ASN 90 N -6.96 -0.97 0.40 4.38 3.84 -1.26 -5.06 114.94 109.31 1cm5 s ASN 90 Ca -0.27 0.02 0.15 0.00 0.21 0.00 0.00 52.86 52.97 1cm5 s ASN 90 Cb 0.07 1.55 1.01 0.00 -0.55 0.00 0.00 41.25 43.33 1cm5 s ASN 90 CO 0.66 -0.17 1.86 0.50 -2.79 0.00 0.00 177.10 177.16 1cm5 h LYS 91 N 7.37 0.46 0.00 0.43 3.64 -1.95 -1.47 116.57 125.06 1cm5 h LYS 91 Ca -0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1cm5 h LYS 91 Cb 1.19 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1cm5 h LYS 91 CO 0.02 0.31 0.00 1.96 -2.27 0.00 0.00 179.45 179.46 1cm5 h GLN 92 N 0.48 0.00 0.00 1.90 7.50 -2.03 -3.29 115.11 119.67 1cm5 h GLN 92 Ca 0.46 0.00 -0.14 0.00 0.50 0.00 0.00 58.65 59.47 1cm5 h GLN 92 Cb 1.04 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.54 1cm5 h GLN 92 CO -0.19 0.00 -1.80 1.28 -1.50 0.00 0.00 178.83 176.62 1cm5 n LEU 93 N -3.05 0.00 -4.69 1.46 4.77 -0.57 -5.01 117.00 109.91 1cm5 n LEU 93 Ca -0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.55 1cm5 n LEU 93 Cb 0.23 0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1cm5 n LEU 93 CO 0.25 0.19 1.05 -1.61 -1.33 0.00 0.00 177.39 175.94 1cm5 s GLU 94 N -2.59 4.32 0.02 3.23 2.02 -1.07 -4.89 118.70 119.74 1cm5 s GLU 94 Ca -0.06 1.89 0.13 0.00 0.02 0.00 0.00 54.97 56.95 1cm5 s GLU 94 Cb 0.06 -3.51 -0.19 0.00 0.10 0.00 0.00 34.13 30.59 1cm5 s GLU 94 CO 0.56 -0.50 0.84 0.87 0.02 0.00 0.00 175.26 177.05 1cm5 h LYS 95 N 7.53 0.00 -4.63 1.61 1.79 -1.92 -3.44 116.57 117.50 1cm5 h LYS 95 Ca -0.38 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.51 1cm5 h LYS 95 Cb 1.18 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 31.48 1cm5 h LYS 95 CO 0.88 0.52 -0.83 0.42 -1.08 0.00 0.00 179.45 179.36 1cm5 s ILE 96 N -2.71 1.45 0.36 1.86 -1.09 -1.26 -4.99 121.20 114.82 1cm5 s ILE 96 Ca -0.03 -0.58 0.08 0.00 -2.23 0.00 0.00 60.65 57.89 1cm5 s ILE 96 Cb 0.08 -1.36 -0.04 0.00 -1.58 0.00 0.00 42.46 39.57 1cm5 s ILE 96 CO 0.82 0.44 0.19 0.68 -1.23 0.00 0.00 174.94 175.83 1cm5 s VAL 97 N 1.28 2.96 0.00 2.92 -7.23 -1.26 -4.85 120.40 114.22 1cm5 s VAL 97 Ca -0.01 -1.61 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 1cm5 s VAL 97 Cb -0.14 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 33.79 1cm5 s VAL 97 CO -0.06 -0.14 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1cm5 n GLY 98 N -1.23 3.33 3.22 2.32 0.00 -1.26 -4.89 105.19 106.67 1cm5 n GLY 98 Ca -0.02 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.05 1cm5 n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cm5 s LEU 99 N 0.00 2.36 0.14 0.99 1.43 -1.26 -5.00 118.68 117.34 1cm5 s LEU 99 Ca 0.00 -0.75 -0.17 0.00 -1.03 0.00 0.00 54.13 52.18 1cm5 s LEU 99 Cb 0.00 -0.53 -0.00 0.00 0.03 0.00 0.00 46.19 45.69 1cm5 s LEU 99 CO 0.00 -0.13 1.79 1.56 0.23 0.00 0.00 176.35 179.81 1cm5 h GLN 100 N 3.77 0.41 0.00 1.70 4.20 -1.91 -3.45 115.11 119.83 1cm5 h GLN 100 Ca -0.40 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1cm5 h GLN 100 Cb 1.19 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.88 1cm5 h GLN 100 CO 0.47 0.27 0.00 0.25 -0.67 0.00 0.00 178.83 179.15 1cm5 n THR 101 N -4.88 0.00 1.67 -0.54 -2.24 -1.26 -4.82 114.28 102.21 1cm5 n THR 101 Ca -0.00 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.92 1cm5 n THR 101 Cb 0.04 -0.25 0.69 0.00 -2.10 0.00 0.00 70.33 68.72 1cm5 n THR 101 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1cm5 n GLU 102 N -0.06 1.25 -3.91 -0.78 0.00 -1.26 -4.11 120.64 111.77 1cm5 n GLU 102 Ca 0.00 -0.49 -0.10 0.00 0.00 0.00 0.00 57.16 56.57 1cm5 n GLU 102 Cb 0.00 -1.49 -0.11 0.00 0.00 0.00 0.00 31.44 29.84 1cm5 n GLU 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1cm5 s ALA 103 N -2.08 -0.08 0.10 -1.84 0.00 -1.26 -4.16 121.76 112.43 1cm5 s ALA 103 Ca 0.40 -0.25 -0.33 0.00 0.00 0.00 0.00 51.96 51.78 1cm5 s ALA 103 Cb 0.21 0.07 -0.13 0.00 0.00 0.00 0.00 23.12 23.28 1cm5 s ALA 103 CO 0.37 -0.14 1.72 -2.30 0.00 0.00 0.00 175.76 175.41 1cm5 n PRO 104 N 1.96 2.35 -0.77 0.00 -0.02 -1.26 -2.19 135.00 135.07 1cm5 n PRO 104 Ca -0.20 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1cm5 n PRO 104 Cb 0.56 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1cm5 n PRO 104 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1cm5 n LEU 105 N 4.67 0.65 -4.67 2.45 4.77 -1.26 -4.97 117.00 118.64 1cm5 n LEU 105 Ca 0.18 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.74 1cm5 n LEU 105 Cb 0.31 -1.20 -0.02 0.00 -2.33 0.00 0.00 43.42 40.18 1cm5 n LEU 105 CO 0.66 -0.41 0.98 -0.75 -1.33 0.00 0.00 177.39 176.54 1cm5 s LYS 106 N -0.83 4.30 0.30 3.23 2.20 -0.93 -4.45 119.74 123.56 1cm5 s LYS 106 Ca 0.00 1.59 -0.18 0.00 -0.36 0.00 0.00 55.97 57.02 1cm5 s LYS 106 Cb 0.00 -3.65 -0.09 0.00 -1.51 0.00 0.00 37.83 32.58 1cm5 s LYS 106 CO 0.00 -0.57 0.78 1.03 -0.36 0.00 0.00 175.35 176.24 1cm5 s ARG 107 N 2.86 4.18 0.49 4.03 0.52 -0.13 -4.42 118.95 126.48 1cm5 s ARG 107 Ca 0.53 0.86 0.07 0.00 -0.52 0.00 0.00 55.73 56.67 1cm5 s ARG 107 Cb -0.21 -2.59 0.04 0.00 0.52 0.00 0.00 34.95 32.71 1cm5 s ARG 107 CO 0.16 0.22 0.68 0.00 0.02 0.00 0.00 175.30 176.39 1cm5 s ALA 108 N -1.82 4.44 -0.24 2.13 0.00 -1.26 -0.33 121.76 124.68 1cm5 s ALA 108 Ca 0.51 -1.75 -0.07 0.00 0.00 0.00 0.00 51.96 50.66 1cm5 s ALA 108 Cb -0.13 -1.67 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 1cm5 s ALA 108 CO 0.19 -0.56 0.06 -0.51 0.00 0.00 0.00 175.76 174.93 1cm5 s LEU 109 N -4.53 3.40 -0.75 0.00 1.43 -1.26 -4.33 118.68 112.63 1cm5 s LEU 109 Ca 0.58 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.49 1cm5 s LEU 109 Cb -0.09 -1.90 0.18 0.00 0.03 0.00 0.00 46.19 44.41 1cm5 s LEU 109 CO 0.36 -0.02 0.57 -0.63 0.23 0.00 0.00 176.35 176.85 1cm5 s ILE 110 N 1.53 3.32 0.36 -0.59 -1.09 -1.26 -0.72 121.20 122.75 1cm5 s ILE 110 Ca 0.06 -4.11 0.30 0.00 -2.23 0.00 0.00 60.65 54.67 1cm5 s ILE 110 Cb -0.15 -3.14 0.31 0.00 -1.58 0.00 0.00 42.46 37.91 1cm5 s ILE 110 CO 0.03 -1.02 2.06 1.55 -1.23 0.00 0.00 174.94 176.33 1cm5 h PRO 111 N 5.64 0.00 -0.11 2.79 0.13 -1.89 -3.27 132.00 135.30 1cm5 h PRO 111 Ca 0.14 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.30 1cm5 h PRO 111 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.90 1cm5 h PRO 111 CO 0.76 0.11 0.16 0.74 -0.23 0.00 0.00 178.00 179.53 1cm5 h PHE 112 N 0.00 0.00 0.00 1.56 -1.00 -1.93 -0.31 116.94 115.27 1cm5 h PHE 112 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1cm5 h PHE 112 Cb 0.38 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.94 1cm5 h PHE 112 CO 0.00 0.00 -0.24 0.78 -1.61 0.00 0.00 178.31 177.24 1cm5 h GLY 113 N 0.00 0.00 0.00 -1.45 0.00 -1.86 -2.29 103.07 97.47 1cm5 h GLY 113 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1cm5 h GLY 113 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1cm5 n GLY 114 N 1.24 4.57 0.10 4.60 0.00 -0.12 -1.57 105.19 114.01 1cm5 n GLY 114 Ca 0.04 -0.70 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 1cm5 n GLY 114 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1cm5 h ILE 115 N 0.00 0.80 -0.81 -0.61 6.09 -1.79 -3.37 117.51 117.83 1cm5 h ILE 115 Ca 0.00 -2.31 -0.01 0.00 -1.37 0.00 0.00 64.86 61.17 1cm5 h ILE 115 Cb 0.00 2.30 -0.04 0.00 0.47 0.00 0.00 36.82 39.55 1cm5 h ILE 115 CO 0.00 0.46 0.46 0.11 -3.07 0.00 0.00 178.15 176.11 1cm5 h LYS 116 N 0.00 1.11 -0.42 2.19 1.57 -1.95 -1.34 116.57 117.73 1cm5 h LYS 116 Ca -0.10 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.48 1cm5 h LYS 116 Cb 1.58 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.65 1cm5 h LYS 116 CO 0.07 0.79 -0.10 0.52 -0.57 0.00 0.00 179.45 180.16 1cm5 h MET 117 N 1.12 0.73 -0.50 3.15 2.86 -1.92 -1.14 114.93 119.23 1cm5 h MET 117 Ca 0.29 -0.23 -0.10 0.00 -2.06 0.00 0.00 59.70 57.60 1cm5 h MET 117 Cb -0.01 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 1cm5 h MET 117 CO -0.05 0.81 -0.08 0.82 1.06 0.00 0.00 176.91 179.47 1cm5 h ILE 118 N 0.67 1.26 -0.51 -1.22 2.04 -1.57 -1.14 117.51 117.03 1cm5 h ILE 118 Ca 0.12 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 64.74 1cm5 h ILE 118 Cb 0.55 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1cm5 h ILE 118 CO 0.03 0.42 0.12 -0.33 0.00 0.00 0.00 178.15 178.39 1cm5 h GLU 119 N 0.82 0.82 -0.78 2.37 5.08 -0.94 -0.40 114.58 121.56 1cm5 h GLU 119 Ca 0.14 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1cm5 h GLU 119 Cb 0.60 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1cm5 h GLU 119 CO 0.04 0.79 0.48 0.78 -1.00 0.00 0.00 179.01 180.10 1cm5 h GLY 120 N 0.72 1.13 0.84 -3.84 0.00 -0.91 -0.68 103.07 100.33 1cm5 h GLY 120 Ca 0.16 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1cm5 h GLY 120 CO 0.00 0.45 0.04 1.76 0.00 0.00 0.00 176.54 178.79 1cm5 h SER 121 N 1.07 0.27 -0.60 0.19 0.02 -0.89 -0.20 113.55 113.41 1cm5 h SER 121 Ca 0.28 -0.24 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1cm5 h SER 121 Cb -0.06 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.36 1cm5 h SER 121 CO -0.05 0.44 0.28 0.00 -1.14 0.00 0.00 176.83 176.36 1cm5 h LYS 123 N 0.52 0.87 -0.28 0.00 3.64 -0.95 0.27 116.57 120.64 1cm5 h LYS 123 Ca 0.28 -0.27 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1cm5 h LYS 123 Cb 0.25 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1cm5 h LYS 123 CO -0.22 0.90 -0.24 0.00 -2.27 0.00 0.00 179.45 177.63 1cm5 h ALA 124 N 0.94 1.07 -0.62 5.00 0.00 -0.45 -3.15 119.26 122.04 1cm5 h ALA 124 Ca 0.14 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1cm5 h ALA 124 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1cm5 h ALA 124 CO 0.02 0.57 0.00 0.66 0.00 0.00 0.00 179.25 180.50 1cm5 n TYR 125 N -4.12 1.25 -3.30 0.00 0.53 -0.07 -4.99 117.16 106.46 1cm5 n TYR 125 Ca -0.00 -0.59 -0.16 0.00 -1.02 0.00 0.00 57.90 56.13 1cm5 n TYR 125 Cb 0.40 -0.18 0.07 0.00 -1.03 0.00 0.00 39.34 38.61 1cm5 n TYR 125 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1cm5 n ASN 126 N 1.08 -5.70 -3.95 7.72 5.15 -0.80 -5.04 115.26 113.72 1cm5 n ASN 126 Ca 0.24 -0.70 -0.09 0.00 -0.60 0.00 0.00 54.58 53.43 1cm5 n ASN 126 Cb 0.79 -5.16 -0.10 0.00 -0.53 0.00 0.00 39.78 34.79 1cm5 n ASN 126 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1cm5 s ARG 127 N -4.62 0.55 -0.18 1.20 1.81 0.02 -5.05 118.95 112.68 1cm5 s ARG 127 Ca 0.37 -0.78 -0.04 0.00 -1.72 0.00 0.00 55.73 53.56 1cm5 s ARG 127 Cb -0.05 0.21 -0.02 0.00 -0.45 0.00 0.00 34.95 34.64 1cm5 s ARG 127 CO 0.74 -0.13 -0.04 -1.21 -0.68 0.00 0.00 175.30 173.98 1cm5 s GLU 128 N -2.60 3.54 0.03 3.54 2.02 -1.26 -4.04 118.70 119.94 1cm5 s GLU 128 Ca -0.05 -0.57 -0.30 0.00 0.02 0.00 0.00 54.97 54.06 1cm5 s GLU 128 Cb -0.01 -2.94 -0.06 0.00 0.10 0.00 0.00 34.13 31.22 1cm5 s GLU 128 CO -0.05 0.08 1.42 -1.17 0.02 0.00 0.00 175.26 175.56 1cm5 s LEU 129 N 0.79 4.33 0.14 1.80 2.96 -1.26 -4.88 118.68 122.56 1cm5 s LEU 129 Ca -0.02 2.19 -0.34 0.00 -0.22 0.00 0.00 54.13 55.74 1cm5 s LEU 129 Cb -0.15 -3.57 -0.14 0.00 0.50 0.00 0.00 46.19 42.83 1cm5 s LEU 129 CO 0.02 -0.71 1.55 -0.67 -1.32 0.00 0.00 176.35 175.22 1cm5 n ASP 130 N 5.04 2.86 -0.17 3.68 -0.08 -0.03 -4.87 116.55 122.98 1cm5 n ASP 130 Ca 0.13 1.08 0.06 0.00 -1.51 0.00 0.00 54.79 54.56 1cm5 n ASP 130 Cb 0.43 -1.38 0.36 0.00 2.34 0.00 0.00 41.12 42.87 1cm5 n ASP 130 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1cm5 h PRO 131 N 5.82 0.71 -0.71 -0.67 0.13 -1.92 -2.56 132.00 132.81 1cm5 h PRO 131 Ca -0.45 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 64.57 1cm5 h PRO 131 Cb 1.27 -0.16 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1cm5 h PRO 131 CO 0.87 0.47 0.21 1.98 -0.23 0.00 0.00 178.00 181.30 1cm5 h MET 132 N 0.73 1.11 -0.47 0.86 4.05 -1.98 -0.80 114.93 118.43 1cm5 h MET 132 Ca 0.30 -0.25 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 1cm5 h MET 132 Cb 0.25 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 30.87 1cm5 h MET 132 CO -0.10 0.96 0.23 0.82 0.23 0.00 0.00 176.91 179.05 1cm5 h ILE 133 N 1.05 1.19 -0.60 1.77 1.08 -1.81 -1.51 117.51 118.67 1cm5 h ILE 133 Ca 0.23 -0.52 -0.01 0.00 -0.39 0.00 0.00 64.86 64.16 1cm5 h ILE 133 Cb 0.32 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 34.71 1cm5 h ILE 133 CO -0.00 0.20 0.34 0.50 -0.69 0.00 0.00 178.15 178.50 1cm5 h LYS 134 N 0.62 0.82 -0.18 2.37 3.64 -1.19 -2.34 116.57 120.32 1cm5 h LYS 134 Ca 0.16 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 1cm5 h LYS 134 Cb 0.11 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1cm5 h LYS 134 CO -0.02 0.61 0.09 -0.22 -2.27 0.00 0.00 179.45 177.64 1cm5 h LYS 135 N 0.81 0.26 -0.24 1.90 3.64 -0.90 -2.79 116.57 119.24 1cm5 h LYS 135 Ca 0.21 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.59 1cm5 h LYS 135 Cb 0.01 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1cm5 h LYS 135 CO -0.04 0.28 0.03 0.82 -2.27 0.00 0.00 179.45 178.28 1cm5 h ILE 136 N 0.17 0.86 -0.26 2.00 2.04 -1.13 -1.12 117.51 120.07 1cm5 h ILE 136 Ca 0.06 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 1cm5 h ILE 136 Cb 0.11 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1cm5 h ILE 136 CO -0.01 0.02 0.03 0.49 0.00 0.00 0.00 178.15 178.68 1cm5 n PHE 137 N -5.11 0.91 0.00 1.37 3.01 -0.89 -0.78 117.46 115.97 1cm5 n PHE 137 Ca -0.01 -0.38 0.00 0.00 1.01 0.00 0.00 57.45 58.07 1cm5 n PHE 137 Cb 0.12 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1cm5 n PHE 137 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1cm5 n THR 138 N 0.22 0.00 -0.03 4.37 -2.24 -1.04 -4.49 114.28 111.07 1cm5 n THR 138 Ca 0.13 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.87 1cm5 n THR 138 Cb 0.68 -0.47 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 1cm5 n THR 138 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1cm5 n GLU 139 N -1.25 2.09 -0.14 -0.78 1.02 -0.45 -4.90 120.64 116.24 1cm5 n GLU 139 Ca 0.00 0.01 -0.29 0.00 -0.02 0.00 0.00 57.16 56.87 1cm5 n GLU 139 Cb 0.24 -1.14 -0.10 0.00 -0.02 0.00 0.00 31.44 30.42 1cm5 n GLU 139 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1cm5 n TYR 140 N -2.38 0.11 -3.78 -0.32 4.01 -0.59 -4.88 117.16 109.32 1cm5 n TYR 140 Ca -0.10 0.05 -0.36 0.00 -0.16 0.00 0.00 57.90 57.32 1cm5 n TYR 140 Cb 0.67 -1.01 -0.12 0.00 -0.31 0.00 0.00 39.34 38.57 1cm5 n TYR 140 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1cm5 s ARG 141 N -2.50 2.22 0.43 -0.72 6.06 0.04 -5.04 118.95 119.44 1cm5 s ARG 141 Ca -0.38 -1.60 -0.25 0.00 -2.50 0.00 0.00 55.73 51.00 1cm5 s ARG 141 Cb 0.14 -3.51 -0.08 0.00 0.06 0.00 0.00 34.95 31.56 1cm5 s ARG 141 CO 0.51 -0.92 1.35 0.21 -2.50 0.00 0.00 175.30 173.95 1cm5 s LYS 142 N 1.22 3.80 0.39 5.12 2.20 -1.26 -4.33 119.74 126.89 1cm5 s LYS 142 Ca 0.04 2.26 0.08 0.00 -0.36 0.00 0.00 55.97 57.98 1cm5 s LYS 142 Cb -0.22 -2.68 -0.03 0.00 -1.51 0.00 0.00 37.83 33.39 1cm5 s LYS 142 CO -0.02 -0.67 0.31 0.95 -0.36 0.00 0.00 175.35 175.56 1cm5 s THR 143 N -1.25 2.79 0.16 3.43 -4.23 -1.26 -4.93 115.64 110.35 1cm5 s THR 143 Ca 0.59 -1.44 -0.15 0.00 -1.18 0.00 0.00 61.69 59.51 1cm5 s THR 143 Cb -0.40 -3.03 0.04 0.00 1.34 0.00 0.00 72.50 70.45 1cm5 s THR 143 CO 0.52 -0.05 1.77 -0.74 -0.54 0.00 0.00 174.62 175.57 1cm5 h HIS 144 N 1.19 0.33 -0.07 3.99 2.76 -1.48 -1.92 115.15 119.95 1cm5 h HIS 144 Ca -0.42 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 57.80 1cm5 h HIS 144 Cb 1.26 -0.09 -0.04 0.00 1.55 0.00 0.00 27.41 30.09 1cm5 h HIS 144 CO 0.55 0.16 -0.19 -0.97 -1.30 0.00 0.00 177.93 176.18 1cm5 h ASN 145 N 0.37 -0.57 0.38 3.26 -0.73 -1.46 -1.25 115.58 115.58 1cm5 h ASN 145 Ca 0.18 0.09 -0.07 0.00 1.87 0.00 0.00 56.30 58.37 1cm5 h ASN 145 Cb 0.12 0.25 -0.01 0.00 0.27 0.00 0.00 38.32 38.96 1cm5 h ASN 145 CO -0.15 -0.24 -0.34 0.06 -0.37 0.00 0.00 177.43 176.38 1cm5 h GLN 146 N -0.27 0.00 -0.30 6.67 3.07 -1.82 -2.19 115.11 120.28 1cm5 h GLN 146 Ca 0.08 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.71 1cm5 h GLN 146 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.93 1cm5 h GLN 146 CO -0.23 0.34 -0.25 0.78 0.09 0.00 0.00 178.83 179.57 1cm5 h GLY 147 N 1.10 0.76 0.80 0.06 0.00 -0.85 -2.40 103.07 102.54 1cm5 h GLY 147 Ca -0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 47.33 46.57 1cm5 h GLY 147 CO 0.04 0.68 -0.08 -2.08 0.00 0.00 0.00 176.54 175.10 1cm5 h VAL 148 N 0.45 0.92 0.00 4.60 2.07 -1.06 -2.96 116.25 120.27 1cm5 h VAL 148 Ca 0.05 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1cm5 h VAL 148 Cb 0.81 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1cm5 h VAL 148 CO 0.06 0.10 0.00 0.49 0.02 0.00 0.00 177.57 178.24 1cm5 n PHE 149 N -5.10 0.67 0.14 1.57 3.01 -0.84 -1.28 117.46 115.64 1cm5 n PHE 149 Ca -0.09 0.30 0.02 0.00 1.01 0.00 0.00 57.45 58.69 1cm5 n PHE 149 Cb 0.19 -0.98 0.02 0.00 -0.01 0.00 0.00 39.48 38.70 1cm5 n PHE 149 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1cm5 h ASP 150 N 0.00 0.00 0.00 4.37 3.45 -1.26 -3.34 116.42 119.64 1cm5 h ASP 150 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1cm5 h ASP 150 Cb 0.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.97 1cm5 h ASP 150 CO 0.00 0.50 -1.21 0.52 -1.57 0.00 0.00 179.24 177.48 1cm5 n VAL 151 N -3.22 0.00 -1.44 -1.35 0.31 -0.60 -5.03 118.33 107.01 1cm5 n VAL 151 Ca 0.02 -0.26 -0.37 0.00 -0.01 0.00 0.00 64.34 63.72 1cm5 n VAL 151 Cb 0.74 0.53 0.07 0.00 -0.91 0.00 0.00 33.84 34.27 1cm5 n VAL 151 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1cm5 n TYR 152 N -1.70 0.26 -3.61 3.52 4.01 -0.40 -5.01 117.16 114.22 1cm5 n TYR 152 Ca -0.00 0.40 -0.24 0.00 -0.16 0.00 0.00 57.90 57.90 1cm5 n TYR 152 Cb 0.30 -2.05 -0.02 0.00 -0.31 0.00 0.00 39.34 37.26 1cm5 n TYR 152 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1cm5 s THR 153 N -1.73 5.17 0.31 -0.72 -4.23 -1.26 -4.99 115.64 108.19 1cm5 s THR 153 Ca 0.72 -0.56 0.33 0.00 -1.18 0.00 0.00 61.69 61.00 1cm5 s THR 153 Cb -0.38 -3.83 0.36 0.00 1.34 0.00 0.00 72.50 69.99 1cm5 s THR 153 CO 0.51 -0.40 2.07 1.55 -0.54 0.00 0.00 174.62 177.81 1cm5 h PRO 154 N 1.19 0.00 -0.25 3.99 0.13 -1.99 -2.36 132.00 132.71 1cm5 h PRO 154 Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 1cm5 h PRO 154 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1cm5 h PRO 154 CO 0.63 0.06 -0.05 -0.44 -0.23 0.00 0.00 178.00 177.97 1cm5 h ASP 155 N 0.00 0.48 -0.79 1.44 3.32 -1.97 -1.06 116.42 117.84 1cm5 h ASP 155 Ca -0.00 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 1cm5 h ASP 155 Cb 0.38 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 1cm5 h ASP 155 CO 0.01 0.72 0.31 0.40 -1.72 0.00 0.00 179.24 178.96 1cm5 h ILE 156 N 0.23 1.26 -0.71 0.35 2.04 -1.85 -0.87 117.51 117.96 1cm5 h ILE 156 Ca 0.07 -0.84 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1cm5 h ILE 156 Cb 0.51 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 1cm5 h ILE 156 CO 0.02 0.34 0.35 -0.07 0.00 0.00 0.00 178.15 178.80 1cm5 h LEU 157 N 1.16 0.92 -0.19 1.44 -0.00 -1.25 -0.11 115.31 117.28 1cm5 h LEU 157 Ca 0.26 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 58.01 1cm5 h LEU 157 Cb 0.23 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 40.64 1cm5 h LEU 157 CO -0.02 0.78 0.09 0.03 -0.00 0.00 0.00 178.44 179.32 1cm5 h ARG 158 N 0.99 0.28 -0.35 1.13 3.08 -0.80 -0.67 114.38 118.04 1cm5 h ARG 158 Ca 0.25 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 1cm5 h ARG 158 Cb 0.10 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1cm5 h ARG 158 CO -0.03 0.33 0.21 0.00 -1.07 0.00 0.00 179.97 179.40 1cm5 h ARG 160 N 0.49 0.69 -0.18 0.00 2.43 -0.63 -1.96 114.38 115.22 1cm5 h ARG 160 Ca 0.13 -0.36 -0.16 0.00 -0.81 0.00 0.00 59.98 58.77 1cm5 h ARG 160 Cb -0.01 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1cm5 h ARG 160 CO -0.02 0.98 -0.57 -0.22 -1.51 0.00 0.00 179.97 178.62 1cm5 h LYS 161 N 0.43 0.56 0.00 0.20 3.64 -0.55 -3.25 116.57 117.59 1cm5 h LYS 161 Ca 0.04 -0.36 -0.02 0.00 -1.27 0.00 0.00 60.65 59.05 1cm5 h LYS 161 Cb 0.85 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1cm5 h LYS 161 CO 0.07 0.98 -0.07 0.66 -2.27 0.00 0.00 179.45 178.81 1cm5 h SER 162 N 0.43 0.00 0.00 4.20 4.64 -1.06 -3.48 113.55 118.28 1cm5 h SER 162 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cm5 h SER 162 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1cm5 h SER 162 CO 0.11 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 1cm5 n GLY 163 N 0.89 1.33 0.08 -0.77 0.00 -1.08 -4.89 105.19 100.75 1cm5 n GLY 163 Ca 0.03 -0.22 -0.06 0.00 0.00 0.00 0.00 46.02 45.77 1cm5 n GLY 163 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1cm5 n VAL 164 N -1.90 1.06 -3.38 1.61 3.14 -0.80 -4.72 118.33 113.35 1cm5 n VAL 164 Ca 0.00 -0.74 -0.23 0.00 -2.96 0.00 0.00 64.34 60.41 1cm5 n VAL 164 Cb 0.07 -0.41 -0.09 0.00 -1.06 0.00 0.00 33.84 32.35 1cm5 n VAL 164 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1cm5 s LEU 165 N -5.21 0.52 0.05 6.55 1.43 -0.84 -1.11 118.68 120.07 1cm5 s LEU 165 Ca -0.09 -2.07 0.04 0.00 -1.03 0.00 0.00 54.13 50.98 1cm5 s LEU 165 Cb 0.07 0.08 -0.02 0.00 0.03 0.00 0.00 46.19 46.34 1cm5 s LEU 165 CO 0.78 -0.26 -0.12 -0.89 0.23 0.00 0.00 176.35 176.09 1cm5 s THR 166 N 1.04 0.93 0.00 5.49 2.01 -1.26 -3.16 115.64 120.69 1cm5 s THR 166 Ca 0.20 -1.10 0.00 0.00 0.31 0.00 0.00 61.69 61.10 1cm5 s THR 166 Cb -0.15 -0.89 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1cm5 s THR 166 CO -0.04 -0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.32 1cm5 n GLY 167 N 1.59 0.47 3.76 4.40 0.00 -1.26 -4.74 105.19 109.41 1cm5 n GLY 167 Ca -0.20 -0.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 1cm5 n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1cm5 s LEU 168 N 0.00 3.21 -0.68 0.99 1.02 -1.26 -4.83 118.68 117.13 1cm5 s LEU 168 Ca 0.00 1.95 -0.05 0.00 0.02 0.00 0.00 54.13 56.05 1cm5 s LEU 168 Cb 0.00 -4.54 -0.04 0.00 0.02 0.00 0.00 46.19 41.63 1cm5 s LEU 168 CO 0.00 -1.90 1.83 -0.81 0.02 0.00 0.00 176.35 175.48 1cm5 n PRO 169 N -2.99 1.54 0.00 1.29 -0.04 -1.26 -4.05 135.00 129.49 1cm5 n PRO 169 Ca 0.10 -1.23 0.06 0.00 -0.04 0.00 0.00 63.50 62.40 1cm5 n PRO 169 Cb 0.52 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.62 1cm5 n PRO 169 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1cm5 n ASP 170 N 4.52 1.34 -0.67 3.54 3.85 -1.26 -4.56 116.55 123.31 1cm5 n ASP 170 Ca 0.34 -1.17 0.03 0.00 -0.71 0.00 0.00 54.79 53.27 1cm5 n ASP 170 Cb 0.11 0.53 0.04 0.00 -1.35 0.00 0.00 41.12 40.44 1cm5 n ASP 170 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1cm5 n ALA 171 N -0.31 2.21 -3.53 2.12 0.00 -1.26 -4.20 120.51 115.54 1cm5 n ALA 171 Ca 0.05 -1.67 -0.08 0.00 0.00 0.00 0.00 53.44 51.74 1cm5 n ALA 171 Cb 0.27 -0.53 -0.02 0.00 0.00 0.00 0.00 19.45 19.17 1cm5 n ALA 171 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1cm5 s TYR 172 N -0.59 -0.30 0.30 0.00 -0.85 -1.26 -4.92 117.35 109.72 1cm5 s TYR 172 Ca 0.14 0.22 -0.30 0.00 -0.52 0.00 0.00 57.07 56.62 1cm5 s TYR 172 Cb 0.15 0.53 -0.12 0.00 0.38 0.00 0.00 41.96 42.89 1cm5 s TYR 172 CO -0.04 -0.45 1.42 0.41 -1.52 0.00 0.00 175.55 175.37 1cm5 n GLY 173 N -0.12 0.87 0.22 5.49 0.00 -1.20 -4.81 105.19 105.63 1cm5 n GLY 173 Ca -0.07 0.41 -0.02 0.00 0.00 0.00 0.00 46.02 46.35 1cm5 n GLY 173 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1cm5 h ARG 174 N 3.68 0.31 0.00 1.61 0.11 -1.87 -1.94 114.38 116.27 1cm5 h ARG 174 Ca -0.46 -0.12 0.00 0.00 0.10 0.00 0.00 59.98 59.50 1cm5 h ARG 174 Cb 1.26 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1cm5 h ARG 174 CO 0.71 0.59 0.00 0.41 0.10 0.00 0.00 179.97 181.79 1cm5 n GLY 175 N -0.36 2.83 2.41 0.08 0.00 -1.26 -4.35 105.19 104.54 1cm5 n GLY 175 Ca -0.01 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 1cm5 n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cm5 n ARG 176 N 13.86 -1.84 -4.55 1.61 5.12 -1.20 -4.69 116.66 124.97 1cm5 n ARG 176 Ca 0.00 0.89 -0.24 0.00 -1.93 0.00 0.00 57.85 56.57 1cm5 n ARG 176 Cb 0.00 -5.51 -0.16 0.00 -1.16 0.00 0.00 32.46 25.62 1cm5 n ARG 176 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1cm5 s ILE 177 N -2.88 1.07 -0.29 0.55 1.01 -1.26 -2.61 121.20 116.78 1cm5 s ILE 177 Ca 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.22 1cm5 s ILE 177 Cb 0.00 -0.98 0.08 0.00 0.01 0.00 0.00 42.46 41.58 1cm5 s ILE 177 CO 0.00 0.34 0.00 -0.63 0.00 0.00 0.00 174.94 174.65 1cm5 s ILE 178 N 0.59 1.85 0.47 2.92 1.01 -1.26 -4.49 121.20 122.28 1cm5 s ILE 178 Ca -0.12 -1.78 -0.22 0.00 0.00 0.00 0.00 60.65 58.53 1cm5 s ILE 178 Cb -0.15 -2.22 -0.08 0.00 0.01 0.00 0.00 42.46 40.02 1cm5 s ILE 178 CO 0.03 -0.38 1.10 -0.83 0.00 0.00 0.00 174.94 174.85 1cm5 s GLY 179 N 1.18 2.66 -1.03 6.18 0.00 -1.26 -4.23 107.32 110.81 1cm5 s GLY 179 Ca 0.03 0.77 -0.22 0.00 0.00 0.00 0.00 44.72 45.29 1cm5 s GLY 179 CO -0.10 1.15 1.44 -0.35 0.00 0.00 0.00 173.10 175.24 1cm5 s ASP 180 N -1.67 6.54 0.58 1.64 -1.08 -0.53 -4.78 116.67 117.36 1cm5 s ASP 180 Ca 0.66 -1.59 0.37 0.00 -0.52 0.00 0.00 52.55 51.47 1cm5 s ASP 180 Cb -0.23 -2.55 1.77 0.00 -1.46 0.00 0.00 42.92 40.45 1cm5 s ASP 180 CO 0.27 -1.44 2.12 1.88 0.52 0.00 0.00 175.17 178.52 1cm5 h TYR 181 N 9.53 0.00 0.00 -5.34 -1.99 -1.86 -2.06 116.97 115.25 1cm5 h TYR 181 Ca 0.21 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.92 1cm5 h TYR 181 Cb 1.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.73 1cm5 h TYR 181 CO 1.28 0.00 -0.14 0.00 -0.00 0.00 0.00 178.16 179.30 1cm5 h ARG 182 N 0.00 0.00 -0.72 4.88 3.08 -1.86 -2.58 114.38 117.17 1cm5 h ARG 182 Ca 0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 1cm5 h ARG 182 Cb 0.29 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 1cm5 h ARG 182 CO 0.00 0.14 0.48 0.00 -1.07 0.00 0.00 179.97 179.51 1cm5 h ARG 183 N 0.00 0.73 -0.59 0.04 3.08 -1.76 -1.25 114.38 114.63 1cm5 h ARG 183 Ca -0.00 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 1cm5 h ARG 183 Cb 0.26 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1cm5 h ARG 183 CO 0.02 0.48 0.21 0.28 -1.07 0.00 0.00 179.97 179.89 1cm5 h VAL 184 N 0.75 1.23 -0.08 2.04 2.07 -1.65 -1.07 116.25 119.54 1cm5 h VAL 184 Ca 0.31 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1cm5 h VAL 184 Cb 0.27 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1cm5 h VAL 184 CO -0.10 0.29 -0.03 0.00 0.02 0.00 0.00 177.57 177.75 1cm5 h ALA 185 N 1.07 0.11 0.00 1.67 0.00 -1.48 -0.74 119.26 119.90 1cm5 h ALA 185 Ca 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1cm5 h ALA 185 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1cm5 h ALA 185 CO -0.01 -0.15 -0.00 1.25 0.00 0.00 0.00 179.25 180.33 1cm5 h LEU 186 N -0.19 -0.01 0.00 0.00 6.46 -1.21 -0.51 115.31 119.85 1cm5 h LEU 186 Ca 0.02 -0.22 -0.08 0.00 -0.12 0.00 0.00 57.88 57.48 1cm5 h LEU 186 Cb 0.45 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1cm5 h LEU 186 CO 0.01 0.22 -1.83 -1.22 -0.62 0.00 0.00 178.44 174.99 1cm5 n TYR 187 N -4.99 0.00 0.00 1.25 4.02 -0.41 -4.65 117.16 112.38 1cm5 n TYR 187 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 1cm5 n TYR 187 Cb 0.13 -0.48 0.00 0.00 -0.02 0.00 0.00 39.34 38.97 1cm5 n TYR 187 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cm5 n GLY 188 N 1.71 -1.62 0.05 2.72 0.00 -0.28 -3.86 105.19 103.91 1cm5 n GLY 188 Ca -0.09 -1.50 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 1cm5 n GLY 188 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1cm5 h ILE 189 N 0.00 0.97 -0.68 -0.61 1.08 -1.09 -3.07 117.51 114.10 1cm5 h ILE 189 Ca 0.00 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.61 1cm5 h ILE 189 Cb 0.00 0.97 -0.10 0.00 -3.07 0.00 0.00 36.82 34.62 1cm5 h ILE 189 CO 0.00 0.00 0.16 0.44 -0.69 0.00 0.00 178.15 178.06 1cm5 h ASP 190 N -0.03 0.01 -0.67 1.72 5.19 -1.56 0.03 116.42 121.12 1cm5 h ASP 190 Ca 0.00 0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 56.52 1cm5 h ASP 190 Cb 0.03 0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.68 1cm5 h ASP 190 CO -0.01 -0.01 0.33 0.22 -3.12 0.00 0.00 179.24 176.65 1cm5 h TYR 191 N 0.27 0.96 -0.51 4.55 5.03 -1.73 -1.39 116.97 124.15 1cm5 h TYR 191 Ca 0.37 -0.04 -0.07 0.00 2.58 0.00 0.00 58.73 61.57 1cm5 h TYR 191 Cb 0.60 -0.30 -0.02 0.00 1.55 0.00 0.00 36.73 38.56 1cm5 h TYR 191 CO -0.26 0.71 0.04 -0.07 -1.32 0.00 0.00 178.16 177.26 1cm5 h LEU 192 N 0.93 0.79 -0.51 2.82 3.38 -1.02 -1.66 115.31 120.05 1cm5 h LEU 192 Ca 0.23 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1cm5 h LEU 192 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1cm5 h LEU 192 CO -0.03 0.84 0.02 0.24 0.09 0.00 0.00 178.44 179.60 1cm5 h MET 193 N 0.78 0.88 -0.84 1.13 2.86 -0.61 -0.43 114.93 118.70 1cm5 h MET 193 Ca 0.16 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1cm5 h MET 193 Cb 0.42 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.96 1cm5 h MET 193 CO 0.01 0.90 0.42 -0.22 1.06 0.00 0.00 176.91 179.08 1cm5 h LYS 194 N 0.75 1.19 -0.51 1.72 3.64 -1.03 -0.17 116.57 122.17 1cm5 h LYS 194 Ca 0.15 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 1cm5 h LYS 194 Cb 0.49 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1cm5 h LYS 194 CO 0.02 0.90 -0.12 0.22 -2.27 0.00 0.00 179.45 178.20 1cm5 h ASP 195 N 1.19 0.98 -0.40 4.20 1.82 -1.01 -2.31 116.42 120.88 1cm5 h ASP 195 Ca 0.29 -0.32 -0.11 0.00 -0.39 0.00 0.00 57.03 56.49 1cm5 h ASP 195 Cb 0.09 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.82 1cm5 h ASP 195 CO -0.04 1.10 -0.17 0.11 -1.61 0.00 0.00 179.24 178.63 1cm5 h LYS 196 N 0.86 0.89 -0.87 0.28 1.79 -0.54 -1.87 116.57 117.12 1cm5 h LYS 196 Ca 0.13 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.26 1cm5 h LYS 196 Cb 0.68 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.24 1cm5 h LYS 196 CO 0.05 0.99 0.55 1.25 -1.08 0.00 0.00 179.45 181.21 1cm5 h LEU 197 N 0.78 1.01 -0.61 2.94 5.85 -0.85 0.59 115.31 125.02 1cm5 h LEU 197 Ca 0.11 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 1cm5 h LEU 197 Cb 0.71 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1cm5 h LEU 197 CO 0.05 0.75 0.05 0.00 -0.34 0.00 0.00 178.44 178.95 1cm5 h ALA 198 N 1.43 0.81 -0.72 1.25 0.00 -1.06 -0.96 119.26 120.01 1cm5 h ALA 198 Ca 0.32 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1cm5 h ALA 198 Cb -0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1cm5 h ALA 198 CO -0.06 0.61 0.30 1.96 0.00 0.00 0.00 179.25 182.06 1cm5 h GLN 199 N 0.94 1.07 0.06 0.00 4.20 -0.47 -0.86 115.11 120.05 1cm5 h GLN 199 Ca 0.18 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1cm5 h GLN 199 Cb 0.50 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1cm5 h GLN 199 CO 0.02 0.87 -0.03 0.35 -0.67 0.00 0.00 178.83 179.38 1cm5 h PHE 200 N 1.03 -0.07 0.00 2.96 3.57 -0.53 -2.74 116.94 121.15 1cm5 h PHE 200 Ca 0.24 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 1cm5 h PHE 200 Cb 0.19 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.95 1cm5 h PHE 200 CO 0.01 -0.02 -0.15 1.15 -2.23 0.00 0.00 178.31 177.07 1cm5 h THR 201 N -0.10 1.08 0.00 4.41 2.02 -0.92 -2.50 112.91 116.90 1cm5 h THR 201 Ca -0.01 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1cm5 h THR 201 Cb 0.08 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1cm5 h THR 201 CO 0.01 0.15 0.00 -1.54 0.37 0.00 0.00 175.52 174.51 1cm5 n SER 202 N -4.31 0.37 0.00 4.18 3.41 -0.35 -1.96 113.62 114.96 1cm5 n SER 202 Ca -0.03 0.61 0.11 0.00 -0.26 0.00 0.00 58.87 59.30 1cm5 n SER 202 Cb 0.22 -0.68 0.04 0.00 -0.26 0.00 0.00 64.21 63.53 1cm5 n SER 202 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1cm5 n LEU 203 N -1.93 0.78 -0.09 1.04 4.77 -0.94 -4.50 117.00 116.12 1cm5 n LEU 203 Ca 0.02 -0.28 -0.06 0.00 -0.03 0.00 0.00 56.01 55.66 1cm5 n LEU 203 Cb 0.15 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1cm5 n LEU 203 CO 0.14 0.19 0.84 -0.61 -1.33 0.00 0.00 177.39 176.62 1cm5 h GLN 204 N 0.00 0.06 -0.16 3.23 4.15 -1.51 -2.17 115.11 118.70 1cm5 h GLN 204 Ca 0.00 -0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.47 1cm5 h GLN 204 Cb 0.50 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.12 1cm5 h GLN 204 CO 0.00 0.04 -0.24 0.00 -1.93 0.00 0.00 178.83 176.70 1cm5 h ALA 205 N 1.30 -0.19 -0.93 3.38 0.00 -1.79 -0.45 119.26 120.57 1cm5 h ALA 205 Ca 0.16 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1cm5 h ALA 205 Cb 0.22 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 1cm5 h ALA 205 CO -0.29 -0.69 0.61 -0.44 0.00 0.00 0.00 179.25 178.44 1cm5 h ASP 206 N -0.29 1.04 0.41 0.00 3.45 -1.82 -0.19 116.42 119.02 1cm5 h ASP 206 Ca 0.11 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.54 1cm5 h ASP 206 Cb 0.46 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 1cm5 h ASP 206 CO -0.33 0.74 -0.31 0.25 -1.57 0.00 0.00 179.24 178.02 1cm5 h LEU 207 N 1.23 -0.81 -1.21 1.55 5.85 -0.68 -1.03 115.31 120.20 1cm5 h LEU 207 Ca 0.35 0.06 0.02 0.00 0.84 0.00 0.00 57.88 59.14 1cm5 h LEU 207 Cb -0.10 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1cm5 h LEU 207 CO -0.09 -0.47 0.54 -0.33 -0.34 0.00 0.00 178.44 177.75 1cm5 h GLU 208 N -0.71 1.04 -0.01 1.25 5.08 -0.83 -2.34 114.58 118.05 1cm5 h GLU 208 Ca -0.04 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1cm5 h GLU 208 Cb 0.61 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1cm5 h GLU 208 CO 0.00 0.69 0.00 0.09 -1.00 0.00 0.00 179.01 178.79 1cm5 n ASN 209 N -4.42 0.43 -1.95 1.42 3.02 -0.11 -4.93 115.26 108.72 1cm5 n ASN 209 Ca 0.09 -1.22 -0.16 0.00 -0.03 0.00 0.00 54.58 53.26 1cm5 n ASN 209 Cb 0.05 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 1cm5 n ASN 209 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1cm5 n GLY 210 N 1.01 -0.27 3.57 7.41 0.00 -0.58 -4.98 105.19 111.35 1cm5 n GLY 210 Ca 0.21 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1cm5 n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cm5 s VAL 211 N -2.86 4.91 -1.36 1.61 1.01 -0.50 -4.16 120.40 119.07 1cm5 s VAL 211 Ca 0.07 0.57 -0.01 0.00 0.00 0.00 0.00 61.98 62.61 1cm5 s VAL 211 Cb -0.03 -4.05 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 1cm5 s VAL 211 CO 0.08 -0.28 0.52 0.59 0.00 0.00 0.00 175.10 176.01 1cm5 n ASN 212 N 5.98 -0.87 -0.28 3.32 3.02 -1.26 -4.65 115.26 120.52 1cm5 n ASN 212 Ca -0.02 -0.95 -0.07 0.00 -0.03 0.00 0.00 54.58 53.51 1cm5 n ASN 212 Cb 0.49 -3.37 -0.07 0.00 -0.61 0.00 0.00 39.78 36.22 1cm5 n ASN 212 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1cm5 n LEU 213 N -4.35 -0.71 -0.14 3.41 7.94 -1.26 -0.86 117.00 121.04 1cm5 n LEU 213 Ca -0.30 1.42 -0.03 0.00 -1.11 0.00 0.00 56.01 55.99 1cm5 n LEU 213 Cb 0.68 -0.27 0.18 0.00 0.53 0.00 0.00 43.42 44.54 1cm5 n LEU 213 CO 0.73 -1.08 0.97 -0.33 -1.11 0.00 0.00 177.39 176.56 1cm5 h GLU 214 N 0.00 0.84 -0.29 1.96 5.08 -1.96 -1.18 114.58 119.03 1cm5 h GLU 214 Ca 0.11 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 1cm5 h GLU 214 Cb 0.27 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1cm5 h GLU 214 CO -0.63 0.76 -0.27 1.96 -1.00 0.00 0.00 179.01 179.83 1cm5 h GLN 215 N 0.81 0.57 -0.18 2.33 7.50 -1.73 -1.14 115.11 123.27 1cm5 h GLN 215 Ca 0.18 -0.23 -0.08 0.00 0.50 0.00 0.00 58.65 59.01 1cm5 h GLN 215 Cb 0.30 -0.03 -0.00 0.00 0.05 0.00 0.00 27.48 27.81 1cm5 h GLN 215 CO -0.00 0.79 -0.22 1.15 -1.50 0.00 0.00 178.83 179.05 1cm5 h THR 216 N 0.50 1.34 -0.68 -0.54 2.02 -0.61 -1.67 112.91 113.27 1cm5 h THR 216 Ca 0.07 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 65.80 1cm5 h THR 216 Cb 0.73 1.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.95 1cm5 h THR 216 CO 0.06 0.43 0.30 0.40 0.37 0.00 0.00 175.52 177.08 1cm5 h ILE 217 N 0.11 1.23 -0.10 3.11 2.04 -1.15 -0.53 117.51 122.23 1cm5 h ILE 217 Ca 0.02 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 1cm5 h ILE 217 Cb 0.78 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1cm5 h ILE 217 CO 0.05 0.28 0.06 -0.09 0.00 0.00 0.00 178.15 178.45 1cm5 h ARG 218 N 0.96 0.13 -0.75 2.37 2.43 -1.14 -1.82 114.38 116.56 1cm5 h ARG 218 Ca 0.23 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1cm5 h ARG 218 Cb 0.16 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1cm5 h ARG 218 CO -0.02 0.13 0.29 1.25 -1.51 0.00 0.00 179.97 180.10 1cm5 h LEU 219 N 0.09 1.03 -0.40 3.80 5.85 -1.12 -1.27 115.31 123.30 1cm5 h LEU 219 Ca 0.03 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1cm5 h LEU 219 Cb 0.04 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1cm5 h LEU 219 CO -0.01 0.92 0.20 0.03 -0.34 0.00 0.00 178.44 179.24 1cm5 h ARG 220 N 1.09 0.57 -0.83 1.25 3.08 -0.81 -0.39 114.38 118.34 1cm5 h ARG 220 Ca 0.25 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 1cm5 h ARG 220 Cb 0.22 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 1cm5 h ARG 220 CO -0.02 0.48 0.41 1.49 -1.07 0.00 0.00 179.97 181.27 1cm5 h GLU 221 N 0.50 1.18 -0.55 0.04 4.81 -1.08 -0.49 114.58 119.00 1cm5 h GLU 221 Ca 0.14 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1cm5 h GLU 221 Cb 0.10 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 1cm5 h GLU 221 CO -0.02 0.90 0.26 0.93 -0.73 0.00 0.00 179.01 180.35 1cm5 h GLU 222 N 1.17 0.79 -0.36 1.92 5.08 -0.89 -0.57 114.58 121.72 1cm5 h GLU 222 Ca 0.29 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1cm5 h GLU 222 Cb 0.10 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1cm5 h GLU 222 CO -0.04 0.65 -0.07 0.82 -1.00 0.00 0.00 179.01 179.37 1cm5 h ILE 223 N 0.74 1.23 -0.60 3.13 2.04 -0.58 0.20 117.51 123.67 1cm5 h ILE 223 Ca 0.19 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 64.97 1cm5 h ILE 223 Cb 0.13 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1cm5 h ILE 223 CO -0.02 0.34 0.05 0.00 0.00 0.00 0.00 178.15 178.51 1cm5 h ALA 224 N 1.37 0.94 -0.37 1.87 0.00 -0.58 -0.25 119.26 122.23 1cm5 h ALA 224 Ca 0.11 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1cm5 h ALA 224 Cb 0.47 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1cm5 h ALA 224 CO 0.02 0.65 -0.20 0.93 0.00 0.00 0.00 179.25 180.66 1cm5 h GLU 225 N 0.95 0.71 -0.21 0.00 4.39 -0.39 -1.65 114.58 118.38 1cm5 h GLU 225 Ca 0.18 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 1cm5 h GLU 225 Cb 0.49 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1cm5 h GLU 225 CO 0.02 0.86 0.06 1.96 -1.16 0.00 0.00 179.01 180.75 1cm5 h GLN 226 N 0.63 0.33 -0.34 2.33 4.20 -0.50 -0.67 115.11 121.07 1cm5 h GLN 226 Ca 0.09 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.75 1cm5 h GLN 226 Cb 0.68 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1cm5 h GLN 226 CO 0.05 0.42 0.19 1.25 -0.67 0.00 0.00 178.83 180.07 1cm5 h HIS 227 N 0.16 0.35 -0.75 2.96 2.76 -0.87 -0.89 115.15 118.87 1cm5 h HIS 227 Ca 0.07 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1cm5 h HIS 227 Cb 0.24 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.05 1cm5 h HIS 227 CO 0.00 0.20 0.41 -0.09 -1.30 0.00 0.00 177.93 177.15 1cm5 h ARG 228 N 0.38 1.04 -0.65 5.26 2.43 -1.20 -2.51 114.38 119.14 1cm5 h ARG 228 Ca 0.14 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 1cm5 h ARG 228 Cb 0.03 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 1cm5 h ARG 228 CO -0.08 0.76 0.09 0.00 -1.51 0.00 0.00 179.97 179.23 1cm5 h ALA 229 N 1.40 0.92 -0.95 2.80 0.00 -0.30 -2.20 119.26 120.93 1cm5 h ALA 229 Ca 0.27 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1cm5 h ALA 229 Cb 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1cm5 h ALA 229 CO -0.04 0.66 0.63 -0.07 0.00 0.00 0.00 179.25 180.43 1cm5 h LEU 230 N 1.01 1.06 -0.99 0.00 3.38 -0.76 -1.04 115.31 117.97 1cm5 h LEU 230 Ca 0.20 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1cm5 h LEU 230 Cb 0.46 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1cm5 h LEU 230 CO 0.02 0.75 0.13 1.23 0.09 0.00 0.00 178.44 180.65 1cm5 h GLY 231 N 1.24 0.92 2.00 0.83 0.00 -1.19 -2.06 103.07 104.81 1cm5 h GLY 231 Ca 0.36 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 1cm5 h GLY 231 CO -0.10 0.50 -0.28 1.46 0.00 0.00 0.00 176.54 178.12 1cm5 h GLN 232 N 0.82 0.00 -0.74 4.80 4.20 -0.63 -2.55 115.11 121.01 1cm5 h GLN 232 Ca 0.18 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.83 1cm5 h GLN 232 Cb 0.31 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 1cm5 h GLN 232 CO -0.00 0.28 0.25 0.52 -0.67 0.00 0.00 178.83 179.21 1cm5 h MET 233 N 0.00 1.13 -0.42 1.46 2.86 -0.53 0.04 114.93 119.47 1cm5 h MET 233 Ca -0.00 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.38 1cm5 h MET 233 Cb 0.57 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 1cm5 h MET 233 CO 0.04 0.96 0.19 0.87 1.06 0.00 0.00 176.91 180.02 1cm5 h LYS 234 N 1.08 0.61 -0.75 1.72 1.57 -1.36 -0.96 116.57 118.48 1cm5 h LYS 234 Ca 0.24 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 1cm5 h LYS 234 Cb 0.29 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.46 1cm5 h LYS 234 CO -0.01 0.55 0.35 0.93 -0.57 0.00 0.00 179.45 180.69 1cm5 h GLU 235 N 0.53 1.09 -0.11 3.15 5.08 -1.25 0.15 114.58 123.22 1cm5 h GLU 235 Ca 0.14 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1cm5 h GLU 235 Cb 0.15 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1cm5 h GLU 235 CO -0.02 0.86 0.06 1.98 -1.00 0.00 0.00 179.01 180.89 1cm5 h MET 236 N 1.06 0.15 -0.68 2.33 4.05 -0.74 -2.60 114.93 118.49 1cm5 h MET 236 Ca 0.26 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.61 1cm5 h MET 236 Cb 0.14 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.88 1cm5 h MET 236 CO -0.03 0.16 0.23 0.00 0.23 0.00 0.00 176.91 177.50 1cm5 h ALA 237 N 0.98 1.12 -0.21 0.39 0.00 -0.93 -2.55 119.26 118.07 1cm5 h ALA 237 Ca 0.04 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1cm5 h ALA 237 Cb 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1cm5 h ALA 237 CO -0.01 0.61 0.14 0.00 0.00 0.00 0.00 179.25 180.00 1cm5 h ALA 238 N 1.25 1.99 0.00 0.00 0.00 -0.70 0.69 119.26 122.49 1cm5 h ALA 238 Ca 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1cm5 h ALA 238 Cb 0.25 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1cm5 h ALA 238 CO -0.01 -0.03 -0.06 0.87 0.00 0.00 0.00 179.25 180.02 1cm5 h LYS 239 N 0.16 0.00 -0.32 0.00 1.57 -1.07 -0.01 116.57 116.90 1cm5 h LYS 239 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1cm5 h LYS 239 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1cm5 h LYS 239 CO -0.01 0.06 0.00 0.66 -0.57 0.00 0.00 179.45 179.59 1cm5 n TYR 240 N -3.83 0.42 -0.85 -1.35 4.02 0.19 -4.57 117.16 111.19 1cm5 n TYR 240 Ca -0.02 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 1cm5 n TYR 240 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1cm5 n TYR 240 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1cm5 n GLY 241 N 1.34 0.48 3.54 2.72 0.00 -0.02 -5.06 105.19 108.20 1cm5 n GLY 241 Ca 0.18 -0.83 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 1cm5 n GLY 241 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cm5 s TYR 242 N -2.00 2.76 -0.35 1.61 1.51 -0.93 -4.98 117.35 114.98 1cm5 s TYR 242 Ca 0.00 -0.13 -0.01 0.00 -1.01 0.00 0.00 57.07 55.92 1cm5 s TYR 242 Cb 0.00 -1.55 0.08 0.00 -0.11 0.00 0.00 41.96 40.39 1cm5 s TYR 242 CO 0.00 0.33 0.08 0.34 -1.11 0.00 0.00 175.55 175.19 1cm5 s ASP 243 N -1.46 4.99 -0.21 2.29 -1.08 -1.26 -2.58 116.67 117.36 1cm5 s ASP 243 Ca 0.16 -1.71 0.15 0.00 -0.52 0.00 0.00 52.55 50.63 1cm5 s ASP 243 Cb -0.11 -1.74 0.72 0.00 -1.46 0.00 0.00 42.92 40.33 1cm5 s ASP 243 CO 0.07 -0.39 1.63 2.30 0.52 0.00 0.00 175.17 179.31 1cm5 n ILE 244 N 4.54 2.57 0.05 4.11 -5.35 -1.26 -4.52 119.36 119.50 1cm5 n ILE 244 Ca -0.06 -1.56 0.02 0.00 -0.27 0.00 0.00 62.75 60.87 1cm5 n ILE 244 Cb 0.42 -0.25 0.36 0.00 -1.74 0.00 0.00 39.64 38.44 1cm5 n ILE 244 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1cm5 h SER 245 N 3.25 0.39 -1.39 7.28 4.64 -1.94 -1.54 113.55 124.23 1cm5 h SER 245 Ca 0.00 -0.06 -0.45 0.00 -0.47 0.00 0.00 61.79 60.81 1cm5 h SER 245 Cb 1.78 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.77 1cm5 h SER 245 CO 0.39 0.44 -0.29 -0.83 -0.87 0.00 0.00 176.83 175.68 1cm5 s GLY 246 N -3.89 2.01 0.76 -0.77 0.00 -1.26 -1.66 107.32 102.51 1cm5 s GLY 246 Ca -0.07 -1.77 -0.12 0.00 0.00 0.00 0.00 44.72 42.76 1cm5 s GLY 246 CO 0.74 -1.58 1.11 -4.14 0.00 0.00 0.00 173.10 169.24 1cm5 s PRO 247 N -4.30 2.20 0.16 2.90 0.02 -1.25 -4.26 135.00 130.47 1cm5 s PRO 247 Ca 0.53 1.34 -0.31 0.00 0.02 0.00 0.00 61.00 62.57 1cm5 s PRO 247 Cb -0.07 -1.88 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 1cm5 s PRO 247 CO 0.31 -1.71 1.41 0.00 -0.33 0.00 0.00 177.00 176.69 1cm5 s ALA 248 N -2.64 3.62 -0.77 -1.55 0.00 -0.20 -4.92 121.76 115.30 1cm5 s ALA 248 Ca 0.65 1.19 0.23 0.00 0.00 0.00 0.00 51.96 54.03 1cm5 s ALA 248 Cb -0.20 -3.54 0.09 0.00 0.00 0.00 0.00 23.12 19.47 1cm5 s ALA 248 CO 0.52 -0.64 1.08 0.25 0.00 0.00 0.00 175.76 176.96 1cm5 n THR 249 N 3.45 0.09 -3.90 0.00 -2.24 -1.26 -4.83 114.28 105.59 1cm5 n THR 249 Ca 0.10 -0.14 -0.11 0.00 -2.27 0.00 0.00 64.05 61.63 1cm5 n THR 249 Cb 0.41 0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 69.01 1cm5 n THR 249 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1cm5 n ASN 250 N -1.77 -1.38 0.02 3.42 0.23 -1.26 -4.93 115.26 109.59 1cm5 n ASN 250 Ca 0.03 -2.55 -0.11 0.00 -0.53 0.00 0.00 54.58 51.42 1cm5 n ASN 250 Cb 0.39 2.48 -0.05 0.00 -2.08 0.00 0.00 39.78 40.52 1cm5 n ASN 250 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1cm5 h ALA 251 N 1.96 -0.00 -0.53 -2.53 0.00 -1.95 0.05 119.26 116.25 1cm5 h ALA 251 Ca -0.25 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.75 1cm5 h ALA 251 Cb 1.03 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1cm5 h ALA 251 CO 0.33 -0.53 0.24 0.37 0.00 0.00 0.00 179.25 179.67 1cm5 h GLN 252 N -0.07 0.45 -0.20 0.00 4.15 -1.98 -1.45 115.11 116.01 1cm5 h GLN 252 Ca 0.05 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.33 1cm5 h GLN 252 Cb 0.13 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1cm5 h GLN 252 CO -0.10 0.30 -0.35 0.93 -1.93 0.00 0.00 178.83 177.68 1cm5 h GLU 253 N 0.47 0.43 -0.45 1.69 5.08 -1.90 -0.63 114.58 119.26 1cm5 h GLU 253 Ca 0.25 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1cm5 h GLU 253 Cb 0.20 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1cm5 h GLU 253 CO -0.20 0.73 0.13 0.00 -1.00 0.00 0.00 179.01 178.66 1cm5 h ALA 254 N 1.26 0.60 -0.12 3.43 0.00 -0.30 0.36 119.26 124.49 1cm5 h ALA 254 Ca 0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1cm5 h ALA 254 Cb 0.79 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1cm5 h ALA 254 CO 0.06 0.27 -0.03 0.82 0.00 0.00 0.00 179.25 180.37 1cm5 h ILE 255 N 0.60 1.29 -0.39 0.00 2.04 -1.20 -2.24 117.51 117.59 1cm5 h ILE 255 Ca 0.14 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 1cm5 h ILE 255 Cb 0.30 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1cm5 h ILE 255 CO -0.00 0.27 0.22 -0.61 0.00 0.00 0.00 178.15 178.03 1cm5 h GLN 256 N -0.09 0.55 -0.38 2.37 5.75 -0.95 -1.09 115.11 121.27 1cm5 h GLN 256 Ca 0.03 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1cm5 h GLN 256 Cb 0.44 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 1cm5 h GLN 256 CO 0.01 0.44 0.23 -1.49 -2.65 0.00 0.00 178.83 175.37 1cm5 h TRP 257 N 0.51 0.49 -0.19 3.99 -0.00 -0.31 -0.12 115.95 120.32 1cm5 h TRP 257 Ca 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 59.03 1cm5 h TRP 257 Cb 0.05 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.16 29.04 1cm5 h TRP 257 CO -0.03 0.34 0.11 1.15 -0.00 0.00 0.00 178.44 180.01 1cm5 h THR 258 N 0.49 1.10 -0.92 1.49 2.02 -1.24 -2.38 112.91 113.48 1cm5 h THR 258 Ca 0.14 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1cm5 h THR 258 Cb -0.01 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.30 1cm5 h THR 258 CO -0.03 0.10 0.55 0.22 0.37 0.00 0.00 175.52 176.74 1cm5 h TYR 259 N 0.21 1.21 -0.54 3.16 3.20 -1.03 -1.77 116.97 121.41 1cm5 h TYR 259 Ca 0.07 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1cm5 h TYR 259 Cb 0.07 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 37.91 1cm5 h TYR 259 CO -0.04 0.81 0.36 0.74 -1.64 0.00 0.00 178.16 178.39 1cm5 h PHE 260 N 1.27 0.65 -0.49 -3.82 0.05 -0.65 0.57 116.94 114.53 1cm5 h PHE 260 Ca 0.33 0.02 -0.04 0.00 3.82 0.00 0.00 57.97 62.09 1cm5 h PHE 260 Cb -0.05 -0.22 -0.02 0.00 2.00 0.00 0.00 35.95 37.66 1cm5 h PHE 260 CO 0.01 0.40 0.13 0.78 -0.18 0.00 0.00 178.31 179.45 1cm5 h GLY 261 N 0.69 0.83 1.33 -1.45 0.00 -0.83 -2.14 103.07 101.49 1cm5 h GLY 261 Ca 0.21 -0.51 -0.14 0.00 0.00 0.00 0.00 47.33 46.88 1cm5 h GLY 261 CO -0.05 0.48 -0.39 -1.82 0.00 0.00 0.00 176.54 174.76 1cm5 h TYR 262 N 0.66 0.88 -0.81 5.60 3.20 -0.89 -3.10 116.97 122.51 1cm5 h TYR 262 Ca 0.15 -0.26 0.02 0.00 3.14 0.00 0.00 58.73 61.78 1cm5 h TYR 262 Cb 0.31 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.35 1cm5 h TYR 262 CO 0.02 1.01 0.53 1.25 -1.64 0.00 0.00 178.16 179.33 1cm5 h LEU 263 N 0.61 0.90 -1.16 2.82 5.85 0.36 -1.20 115.31 123.50 1cm5 h LEU 263 Ca 0.05 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1cm5 h LEU 263 Cb 0.94 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1cm5 h LEU 263 CO 0.09 0.65 0.53 0.00 -0.34 0.00 0.00 178.44 179.36 1cm5 h ALA 264 N 1.31 1.38 0.23 1.25 0.00 -1.33 -1.44 119.26 120.66 1cm5 h ALA 264 Ca 0.30 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1cm5 h ALA 264 Cb -0.08 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.37 1cm5 h ALA 264 CO -0.08 0.56 -0.11 0.00 0.00 0.00 0.00 179.25 179.62 1cm5 h ALA 265 N 1.46 -0.31 0.00 0.00 0.00 -1.20 -2.48 119.26 116.73 1cm5 h ALA 265 Ca 0.30 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1cm5 h ALA 265 Cb -0.10 0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1cm5 h ALA 265 CO -0.06 -0.60 0.00 1.33 0.00 0.00 0.00 179.25 179.92 1cm5 n VAL 266 N -5.16 0.19 0.03 0.00 0.24 -0.60 -0.91 118.33 112.12 1cm5 n VAL 266 Ca -0.09 0.05 0.10 0.00 -2.04 0.00 0.00 64.34 62.35 1cm5 n VAL 266 Cb 0.19 -0.67 -0.10 0.00 -1.47 0.00 0.00 33.84 31.79 1cm5 n VAL 266 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1cm5 n LYS 267 N -1.19 0.64 -0.02 7.34 5.02 -0.57 -4.55 118.16 124.83 1cm5 n LYS 267 Ca 0.13 -0.04 0.02 0.00 -2.02 0.00 0.00 58.31 56.40 1cm5 n LYS 267 Cb 0.15 -1.66 -0.08 0.00 -0.02 0.00 0.00 35.03 33.42 1cm5 n LYS 267 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1cm5 n SER 268 N -2.48 2.72 -4.22 4.39 3.41 -0.81 -3.65 113.62 112.98 1cm5 n SER 268 Ca -0.04 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.38 1cm5 n SER 268 Cb 0.60 1.23 -0.12 0.00 -0.26 0.00 0.00 64.21 65.67 1cm5 n SER 268 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1cm5 s GLN 269 N -2.55 0.95 -0.33 4.33 -1.52 -0.09 -4.96 119.66 115.48 1cm5 s GLN 269 Ca -0.04 -1.09 0.09 0.00 -1.95 0.00 0.00 55.36 52.37 1cm5 s GLN 269 Cb 0.05 -0.96 0.45 0.00 -0.22 0.00 0.00 33.01 32.34 1cm5 s GLN 269 CO 0.40 0.20 1.14 0.27 -0.25 0.00 0.00 175.29 177.06 1cm5 n ASN 270 N 0.97 4.25 -4.65 5.90 6.94 -1.26 -4.52 115.26 122.90 1cm5 n ASN 270 Ca -0.19 -3.48 -0.39 0.00 -0.02 0.00 0.00 54.58 50.51 1cm5 n ASN 270 Cb 0.55 -0.40 0.04 0.00 -2.36 0.00 0.00 39.78 37.61 1cm5 n ASN 270 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cm5 n GLY 271 N -0.59 -0.04 0.23 4.83 0.00 -1.26 -3.25 105.19 105.12 1cm5 n GLY 271 Ca 0.36 -0.05 0.01 0.00 0.00 0.00 0.00 46.02 46.33 1cm5 n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cm5 h ALA 272 N 0.88 0.76 -3.14 4.61 0.00 -1.54 -3.37 119.26 117.46 1cm5 h ALA 272 Ca -0.48 0.11 -0.67 0.00 0.00 0.00 0.00 54.91 53.87 1cm5 h ALA 272 Cb 1.35 0.12 -0.32 0.00 0.00 0.00 0.00 17.79 18.94 1cm5 h ALA 272 CO 0.53 -0.26 -0.82 0.00 0.00 0.00 0.00 179.25 178.71 1cm5 s ALA 273 N -6.10 2.46 -0.67 0.00 0.00 -1.26 -4.58 121.76 111.62 1cm5 s ALA 273 Ca -0.13 -1.11 0.05 0.00 0.00 0.00 0.00 51.96 50.77 1cm5 s ALA 273 Cb 0.18 -1.24 0.19 0.00 0.00 0.00 0.00 23.12 22.24 1cm5 s ALA 273 CO 0.74 -0.16 0.54 -1.33 0.00 0.00 0.00 175.76 175.55 1cm5 n MET 274 N 4.29 1.83 -2.34 0.00 2.81 -0.74 -3.22 117.12 119.76 1cm5 n MET 274 Ca -0.20 -4.40 -0.34 0.00 -1.81 0.00 0.00 57.70 50.95 1cm5 n MET 274 Cb 0.51 -2.21 -0.01 0.00 -0.71 0.00 0.00 33.22 30.80 1cm5 n MET 274 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1cm5 s SER 275 N -1.56 5.95 0.00 7.83 0.01 -1.11 -4.05 113.70 120.78 1cm5 s SER 275 Ca 0.29 2.04 -0.14 0.00 1.31 0.00 0.00 55.95 59.45 1cm5 s SER 275 Cb 0.01 -2.57 -0.34 0.00 0.21 0.00 0.00 66.02 63.33 1cm5 s SER 275 CO -0.14 -1.05 0.89 0.15 0.41 0.00 0.00 173.24 173.49 1cm5 h PHE 276 N 1.25 0.90 0.00 2.43 -0.00 -1.48 -3.45 116.94 116.59 1cm5 h PHE 276 Ca -0.49 -0.66 0.00 0.00 -0.00 0.00 0.00 57.97 56.82 1cm5 h PHE 276 Cb 1.24 -0.04 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 1cm5 h PHE 276 CO 0.54 1.61 0.00 0.41 -0.00 0.00 0.00 178.31 180.87 1cm5 n GLY 277 N 1.77 0.16 3.01 2.40 0.00 -0.25 -4.76 105.19 107.51 1cm5 n GLY 277 Ca -0.20 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.51 1cm5 n GLY 277 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cm5 s ARG 278 N 0.00 2.60 -0.05 1.61 6.06 -1.26 -0.40 118.95 127.52 1cm5 s ARG 278 Ca 0.00 -3.01 0.06 0.00 -2.50 0.00 0.00 55.73 50.29 1cm5 s ARG 278 Cb 0.00 -3.61 -0.09 0.00 0.06 0.00 0.00 34.95 31.31 1cm5 s ARG 278 CO 0.00 -1.22 0.07 0.25 -2.50 0.00 0.00 175.30 171.90 1cm5 n THR 279 N 2.62 0.30 -0.13 4.11 -2.24 -1.26 -4.67 114.28 113.01 1cm5 n THR 279 Ca 0.15 -0.24 -0.05 0.00 -2.27 0.00 0.00 64.05 61.64 1cm5 n THR 279 Cb 0.35 -0.42 0.02 0.00 -2.10 0.00 0.00 70.33 68.18 1cm5 n THR 279 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1cm5 h SER 280 N 0.00 -0.50 -0.63 3.42 4.64 -1.91 0.09 113.55 118.66 1cm5 h SER 280 Ca -0.12 0.14 -0.09 0.00 -0.47 0.00 0.00 61.79 61.25 1cm5 h SER 280 Cb 1.03 0.30 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 1cm5 h SER 280 CO 0.01 -0.17 0.05 0.74 -0.87 0.00 0.00 176.83 176.58 1cm5 h THR 281 N -0.05 1.26 -0.31 2.95 2.02 -1.87 -2.07 112.91 114.85 1cm5 h THR 281 Ca 0.20 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.30 1cm5 h THR 281 Cb 0.36 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1cm5 h THR 281 CO -0.46 0.41 0.13 0.15 0.37 0.00 0.00 175.52 176.13 1cm5 h PHE 282 N 1.00 0.25 0.00 3.16 3.57 -1.67 -1.42 116.94 121.83 1cm5 h PHE 282 Ca 0.19 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 1cm5 h PHE 282 Cb 0.51 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 1cm5 h PHE 282 CO 0.04 0.13 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.04 1cm5 h LEU 283 N 0.29 0.00 -1.53 0.59 3.38 -0.79 -2.66 115.31 114.60 1cm5 h LEU 283 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1cm5 h LEU 283 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1cm5 h LEU 283 CO -0.11 0.14 0.25 -0.78 0.09 0.00 0.00 178.44 178.02 1cm5 h ASP 284 N 0.00 0.49 -1.01 -0.43 1.82 -0.54 -1.89 116.42 114.87 1cm5 h ASP 284 Ca -0.00 -0.02 0.08 0.00 -0.39 0.00 0.00 57.03 56.69 1cm5 h ASP 284 Cb 0.43 -0.12 -0.07 0.00 0.68 0.00 0.00 39.33 40.24 1cm5 h ASP 284 CO 0.02 0.39 0.65 0.58 -1.61 0.00 0.00 179.24 179.26 1cm5 h VAL 285 N 0.57 1.06 0.10 2.25 2.07 -1.45 0.38 116.25 121.23 1cm5 h VAL 285 Ca 0.15 -0.39 -0.26 0.00 0.82 0.00 0.00 66.70 67.02 1cm5 h VAL 285 Cb -0.01 -0.19 0.00 0.00 -1.52 0.00 0.00 31.29 29.57 1cm5 h VAL 285 CO -0.03 0.21 -1.17 1.88 0.02 0.00 0.00 177.57 178.48 1cm5 h TYR 286 N 1.15 0.51 -0.34 1.57 -1.99 -1.52 -2.93 116.97 113.42 1cm5 h TYR 286 Ca 0.45 -0.35 -0.08 0.00 2.00 0.00 0.00 58.73 60.75 1cm5 h TYR 286 Cb 0.23 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 1cm5 h TYR 286 CO -0.00 1.24 -0.10 0.82 -0.00 0.00 0.00 178.16 180.12 1cm5 h ILE 287 N 0.10 1.28 -0.21 -2.88 2.04 -0.79 -2.52 117.51 114.54 1cm5 h ILE 287 Ca -0.12 -1.18 0.02 0.00 1.00 0.00 0.00 64.86 64.58 1cm5 h ILE 287 Cb 1.88 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 39.27 1cm5 h ILE 287 CO 0.19 0.38 0.08 -0.33 0.00 0.00 0.00 178.15 178.47 1cm5 h GLU 288 N 0.46 0.17 -0.68 2.37 4.39 -0.33 -0.95 114.58 120.01 1cm5 h GLU 288 Ca 0.08 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.83 1cm5 h GLU 288 Cb 0.61 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.17 1cm5 h GLU 288 CO 0.04 0.11 0.39 -0.09 -1.16 0.00 0.00 179.01 178.30 1cm5 h ARG 289 N 0.18 0.70 -0.30 2.33 2.43 -1.47 -0.43 114.38 117.81 1cm5 h ARG 289 Ca 0.09 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.10 1cm5 h ARG 289 Cb 0.05 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1cm5 h ARG 289 CO -0.09 0.46 -0.31 -0.44 -1.51 0.00 0.00 179.97 178.09 1cm5 h ASP 290 N 0.72 0.66 -0.03 -3.80 3.45 -1.09 -1.74 116.42 114.60 1cm5 h ASP 290 Ca 0.30 -0.26 -0.00 0.00 0.43 0.00 0.00 57.03 57.49 1cm5 h ASP 290 Cb 0.16 -0.18 -0.00 0.00 -0.56 0.00 0.00 39.33 38.74 1cm5 h ASP 290 CO -0.17 0.93 -0.00 -0.07 -1.57 0.00 0.00 179.24 178.36 1cm5 h LEU 291 N 0.55 0.05 -1.61 1.55 3.38 -0.64 0.29 115.31 118.89 1cm5 h LEU 291 Ca 0.07 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1cm5 h LEU 291 Cb 0.80 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1cm5 h LEU 291 CO 0.07 0.36 0.28 0.11 0.09 0.00 0.00 178.44 179.35 1cm5 h LYS 292 N -0.27 0.52 -0.03 1.13 6.56 -1.05 0.70 116.57 124.13 1cm5 h LYS 292 Ca 0.01 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1cm5 h LYS 292 Cb 0.34 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1cm5 h LYS 292 CO 0.00 0.34 0.00 0.00 -2.06 0.00 0.00 179.45 177.74 1cm5 n ALA 293 N -2.48 2.61 -1.46 3.86 0.00 -0.66 -4.91 120.51 117.47 1cm5 n ALA 293 Ca 0.04 -0.35 -0.16 0.00 0.00 0.00 0.00 53.44 52.97 1cm5 n ALA 293 Cb 0.09 -1.28 -0.07 0.00 0.00 0.00 0.00 19.45 18.20 1cm5 n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cm5 n GLY 294 N 1.08 1.57 0.07 0.00 0.00 0.24 -4.86 105.19 103.29 1cm5 n GLY 294 Ca 0.20 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1cm5 n GLY 294 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cm5 n LYS 295 N -2.32 0.21 -3.81 1.61 5.02 0.03 -4.86 118.16 114.04 1cm5 n LYS 295 Ca -0.16 0.12 -0.12 0.00 -2.02 0.00 0.00 58.31 56.13 1cm5 n LYS 295 Cb 0.54 -1.69 -0.11 0.00 -0.02 0.00 0.00 35.03 33.75 1cm5 n LYS 295 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1cm5 s ILE 296 N -3.10 0.02 0.55 -0.18 1.10 -1.12 -5.01 121.20 113.46 1cm5 s ILE 296 Ca 0.10 -0.18 -0.02 0.00 -0.51 0.00 0.00 60.65 60.04 1cm5 s ILE 296 Cb 0.14 -0.34 0.02 0.00 0.15 0.00 0.00 42.46 42.43 1cm5 s ILE 296 CO 0.63 -0.10 0.81 0.42 -2.11 0.00 0.00 174.94 174.59 1cm5 s THR 297 N -0.30 3.20 0.24 4.00 -4.23 -1.26 -4.33 115.64 112.95 1cm5 s THR 297 Ca -0.04 -0.41 -0.04 0.00 -1.18 0.00 0.00 61.69 60.02 1cm5 s THR 297 Cb -0.03 -3.24 0.08 0.00 1.34 0.00 0.00 72.50 70.66 1cm5 s THR 297 CO 0.01 -0.20 1.71 -0.08 -0.54 0.00 0.00 174.62 175.52 1cm5 h GLU 298 N 0.01 0.83 -0.75 3.99 4.57 -1.98 -1.92 114.58 119.33 1cm5 h GLU 298 Ca -0.44 -0.26 -0.06 0.00 -1.18 0.00 0.00 59.36 57.42 1cm5 h GLU 298 Cb 1.28 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.76 1cm5 h GLU 298 CO 0.57 0.87 0.25 0.37 -1.18 0.00 0.00 179.01 179.89 1cm5 h GLN 299 N 0.76 1.16 -0.01 1.92 4.15 -1.94 -1.60 115.11 119.54 1cm5 h GLN 299 Ca 0.14 -0.24 -0.06 0.00 0.77 0.00 0.00 58.65 59.25 1cm5 h GLN 299 Cb 0.55 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 1cm5 h GLN 299 CO 0.03 0.97 -0.29 0.93 -1.93 0.00 0.00 178.83 178.54 1cm5 h GLU 300 N 1.11 0.02 -0.21 1.69 5.08 -1.88 -0.82 114.58 119.57 1cm5 h GLU 300 Ca 0.24 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1cm5 h GLU 300 Cb 0.29 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1cm5 h GLU 300 CO -0.01 0.31 -0.15 0.00 -1.00 0.00 0.00 179.01 178.16 1cm5 h ALA 301 N 1.69 0.30 -0.73 3.43 0.00 -0.74 -2.33 119.26 120.88 1cm5 h ALA 301 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 1cm5 h ALA 301 Cb 0.53 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1cm5 h ALA 301 CO 0.04 0.19 0.31 0.37 0.00 0.00 0.00 179.25 180.16 1cm5 h GLN 302 N 0.16 1.08 -0.34 0.00 5.75 -0.92 -2.14 115.11 118.69 1cm5 h GLN 302 Ca 0.04 -0.18 -0.01 0.00 -0.15 0.00 0.00 58.65 58.35 1cm5 h GLN 302 Cb 0.68 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 1cm5 h GLN 302 CO 0.04 0.86 0.17 1.49 -2.65 0.00 0.00 178.83 178.74 1cm5 h GLU 303 N 1.06 0.49 -0.28 1.69 4.81 -1.08 0.30 114.58 121.56 1cm5 h GLU 303 Ca 0.25 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1cm5 h GLU 303 Cb 0.17 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1cm5 h GLU 303 CO -0.02 0.43 0.13 0.52 -0.73 0.00 0.00 179.01 179.34 1cm5 h MET 304 N 0.42 0.26 -0.63 1.92 2.86 -1.11 0.80 114.93 119.46 1cm5 h MET 304 Ca 0.12 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1cm5 h MET 304 Cb 0.10 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.68 1cm5 h MET 304 CO -0.02 0.18 0.29 0.28 1.06 0.00 0.00 176.91 178.69 1cm5 h VAL 305 N 0.27 1.22 -0.89 -2.22 2.07 -1.11 -1.10 116.25 114.50 1cm5 h VAL 305 Ca 0.12 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1cm5 h VAL 305 Cb 0.05 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.27 1cm5 h VAL 305 CO -0.10 0.26 0.52 0.44 0.02 0.00 0.00 177.57 178.72 1cm5 h ASP 306 N 0.86 1.08 0.30 0.57 3.32 0.13 0.41 116.42 123.09 1cm5 h ASP 306 Ca 0.21 -0.08 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 1cm5 h ASP 306 Cb 0.15 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1cm5 h ASP 306 CO -0.02 0.84 -0.51 0.45 -1.72 0.00 0.00 179.24 178.27 1cm5 h HIS 307 N 1.22 0.29 0.40 4.55 3.86 -0.45 0.31 115.15 125.33 1cm5 h HIS 307 Ca 0.32 -0.10 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 1cm5 h HIS 307 Cb -0.03 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1cm5 h HIS 307 CO 0.00 0.70 -0.19 1.25 0.86 0.00 0.00 177.93 180.55 1cm5 h LEU 308 N 0.19 -0.45 -1.18 2.43 5.85 -0.65 -2.55 115.31 118.95 1cm5 h LEU 308 Ca 0.01 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.67 1cm5 h LEU 308 Cb 0.97 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.06 1cm5 h LEU 308 CO 0.08 -0.06 0.57 0.58 -0.34 0.00 0.00 178.44 179.27 1cm5 h VAL 309 N -0.93 1.05 -0.93 1.05 2.07 -0.89 -0.67 116.25 117.01 1cm5 h VAL 309 Ca -0.05 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.15 1cm5 h VAL 309 Cb 0.55 -0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1cm5 h VAL 309 CO 0.09 0.18 0.61 -0.03 0.02 0.00 0.00 177.57 178.44 1cm5 h MET 310 N 0.98 1.17 -0.38 1.57 1.85 -0.33 -0.73 114.93 119.06 1cm5 h MET 310 Ca 0.38 -0.07 -0.09 0.00 -0.61 0.00 0.00 59.70 59.31 1cm5 h MET 310 Cb 0.22 -0.26 -0.02 0.00 0.43 0.00 0.00 31.60 31.97 1cm5 h MET 310 CO -0.14 0.77 -0.14 0.87 -0.40 0.00 0.00 176.91 177.87 1cm5 h LYS 311 N 1.21 0.68 0.00 0.39 1.79 -0.70 -2.02 116.57 117.92 1cm5 h LYS 311 Ca 0.36 -0.23 -0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1cm5 h LYS 311 Cb -0.04 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.55 1cm5 h LYS 311 CO -0.10 0.79 -0.04 -0.07 -1.08 0.00 0.00 179.45 178.95 1cm5 h LEU 312 N 0.62 0.00 -0.09 2.94 3.38 -0.64 -0.57 115.31 120.95 1cm5 h LEU 312 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1cm5 h LEU 312 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1cm5 h LEU 312 CO 0.04 0.04 -0.09 0.54 0.09 0.00 0.00 178.44 179.06 1cm5 n ARG 313 N -3.17 0.40 -0.05 1.13 1.74 -0.40 -3.67 116.66 112.64 1cm5 n ARG 313 Ca 0.00 -0.09 0.06 0.00 -0.77 0.00 0.00 57.85 57.06 1cm5 n ARG 313 Cb 0.31 -1.50 0.08 0.00 -1.02 0.00 0.00 32.46 30.33 1cm5 n ARG 313 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1cm5 n MET 314 N -1.23 1.26 -2.19 5.56 2.81 -0.23 -4.98 117.12 118.12 1cm5 n MET 314 Ca 0.12 -1.45 -0.42 0.00 -1.81 0.00 0.00 57.70 54.14 1cm5 n MET 314 Cb 0.28 -1.25 -0.03 0.00 -0.71 0.00 0.00 33.22 31.52 1cm5 n MET 314 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1cm5 s VAL 315 N -1.00 3.25 0.02 2.03 1.01 -1.18 -4.56 120.40 119.97 1cm5 s VAL 315 Ca 0.17 0.96 -0.02 0.00 0.00 0.00 0.00 61.98 63.09 1cm5 s VAL 315 Cb 0.11 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 1cm5 s VAL 315 CO 0.16 0.11 0.01 -0.13 0.00 0.00 0.00 175.10 175.24 1cm5 s ARG 316 N 0.51 0.37 -0.02 2.72 1.81 -1.26 -4.95 118.95 118.13 1cm5 s ARG 316 Ca 0.61 -0.60 0.01 0.00 -1.72 0.00 0.00 55.73 54.02 1cm5 s ARG 316 Cb -0.37 0.14 0.01 0.00 -0.45 0.00 0.00 34.95 34.28 1cm5 s ARG 316 CO 0.34 -0.07 -0.01 -0.06 -0.68 0.00 0.00 175.30 174.82 1cm5 s PHE 317 N -1.62 0.25 -0.20 -0.53 0.40 -1.26 -4.70 117.98 110.32 1cm5 s PHE 317 Ca -0.14 -0.01 -0.29 0.00 -0.60 0.00 0.00 56.93 55.88 1cm5 s PHE 317 Cb -0.08 -0.27 -0.03 0.00 0.51 0.00 0.00 43.02 43.15 1cm5 s PHE 317 CO -0.01 -0.06 1.58 -1.17 0.70 0.00 0.00 175.22 176.25 1cm5 s LEU 318 N 0.48 3.96 0.20 -0.37 2.96 -1.26 -5.00 118.68 119.65 1cm5 s LEU 318 Ca -0.05 1.67 0.10 0.00 -0.22 0.00 0.00 54.13 55.64 1cm5 s LEU 318 Cb -0.07 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 1cm5 s LEU 318 CO -0.01 -1.17 -0.20 -0.13 -1.32 0.00 0.00 176.35 173.52 1cm5 s ARG 319 N 4.49 1.42 0.54 1.98 1.81 -1.26 -5.02 118.95 122.90 1cm5 s ARG 319 Ca 0.70 -1.53 -0.05 0.00 -1.72 0.00 0.00 55.73 53.13 1cm5 s ARG 319 Cb -0.25 -1.52 -0.01 0.00 -0.45 0.00 0.00 34.95 32.71 1cm5 s ARG 319 CO 0.28 0.31 0.84 0.95 -0.68 0.00 0.00 175.30 177.00 1cm5 s THR 320 N -2.13 4.26 0.48 0.02 -4.23 -1.26 -4.80 115.64 107.98 1cm5 s THR 320 Ca 0.20 0.10 0.14 0.00 -1.18 0.00 0.00 61.69 60.95 1cm5 s THR 320 Cb -0.06 -3.65 0.24 0.00 1.34 0.00 0.00 72.50 70.37 1cm5 s THR 320 CO 0.09 -0.65 2.09 -0.65 -0.54 0.00 0.00 174.62 174.95 1cm5 h PRO 321 N 0.02 0.07 -0.49 3.99 0.11 -1.97 -0.60 132.00 133.13 1cm5 h PRO 321 Ca -0.46 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 1cm5 h PRO 321 Cb 1.23 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1cm5 h PRO 321 CO 0.61 0.10 0.05 1.49 -0.21 0.00 0.00 178.00 180.04 1cm5 h GLU 322 N 0.07 0.83 -0.59 1.05 4.81 -2.00 -2.55 114.58 116.20 1cm5 h GLU 322 Ca 0.02 -0.24 -0.06 0.00 -0.13 0.00 0.00 59.36 58.95 1cm5 h GLU 322 Cb 0.10 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1cm5 h GLU 322 CO 0.00 0.85 0.14 -0.92 -0.73 0.00 0.00 179.01 178.35 1cm5 h TYR 323 N 0.69 1.00 -0.73 0.92 3.20 -1.67 -2.87 116.97 117.51 1cm5 h TYR 323 Ca 0.14 -0.12 0.15 0.00 3.14 0.00 0.00 58.73 62.05 1cm5 h TYR 323 Cb 0.44 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.38 1cm5 h TYR 323 CO 0.03 0.85 0.49 0.22 -1.64 0.00 0.00 178.16 178.11 1cm5 h ASP 324 N 0.86 0.34 1.40 -2.11 1.82 -0.76 0.17 116.42 118.15 1cm5 h ASP 324 Ca 0.19 0.02 -0.08 0.00 -0.39 0.00 0.00 57.03 56.76 1cm5 h ASP 324 Cb 0.35 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 40.30 1cm5 h ASP 324 CO 0.00 0.18 -0.62 1.05 -1.61 0.00 0.00 179.24 178.24 1cm5 h GLU 325 N 0.36 0.00 0.13 0.28 4.11 -1.25 -2.96 114.58 115.25 1cm5 h GLU 325 Ca 0.36 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.49 1cm5 h GLU 325 Cb 0.88 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.13 1cm5 h GLU 325 CO -0.10 0.30 -1.46 -0.07 0.07 0.00 0.00 179.01 177.74 1cm5 h LEU 326 N 0.00 0.44 -6.79 3.06 3.38 -1.08 -3.41 115.31 110.91 1cm5 h LEU 326 Ca -0.03 -0.56 -0.60 0.00 0.09 0.00 0.00 57.88 56.78 1cm5 h LEU 326 Cb 1.30 -0.14 -0.40 0.00 0.09 0.00 0.00 40.66 41.51 1cm5 h LEU 326 CO 0.04 1.46 -0.79 -0.36 0.09 0.00 0.00 178.44 178.88 1cm5 s PHE 327 N -2.62 1.82 0.64 1.13 0.40 0.48 -1.82 117.98 118.01 1cm5 s PHE 327 Ca -0.08 -2.42 -0.11 0.00 -0.60 0.00 0.00 56.93 53.71 1cm5 s PHE 327 Cb 0.07 -1.63 -0.03 0.00 0.51 0.00 0.00 43.02 41.93 1cm5 s PHE 327 CO 0.87 -0.76 1.04 -1.54 0.70 0.00 0.00 175.22 175.52 1cm5 s SER 328 N 0.11 6.00 0.00 1.36 1.04 -1.12 -4.41 113.70 116.68 1cm5 s SER 328 Ca 0.23 1.49 0.00 0.00 0.48 0.00 0.00 55.95 58.15 1cm5 s SER 328 Cb -0.14 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.50 1cm5 s SER 328 CO -0.07 -1.02 0.00 0.61 0.98 0.00 0.00 173.24 173.74 1cm5 n GLY 329 N -2.45 0.45 3.77 7.32 0.00 -1.26 -4.19 105.19 108.83 1cm5 n GLY 329 Ca 0.06 -0.96 -0.27 0.00 0.00 0.00 0.00 46.02 44.85 1cm5 n GLY 329 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cm5 n ASP 330 N 1.82 -2.85 -4.85 1.61 4.64 -1.26 -4.66 116.55 111.01 1cm5 n ASP 330 Ca 0.00 -0.97 -0.31 0.00 -1.38 0.00 0.00 54.79 52.13 1cm5 n ASP 330 Cb 0.09 -3.43 0.02 0.00 -1.04 0.00 0.00 41.12 36.75 1cm5 n ASP 330 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 1cm5 s PRO 331 N -6.14 3.35 0.00 -0.67 0.04 -1.26 -5.01 135.00 125.31 1cm5 s PRO 331 Ca 0.22 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.12 1cm5 s PRO 331 Cb -0.08 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1cm5 s PRO 331 CO 0.86 -0.77 0.00 -0.89 0.04 0.00 0.00 177.00 176.24 1cm5 n ILE 332 N -2.81 0.00 -3.31 0.56 2.08 -1.26 -4.94 119.36 109.68 1cm5 n ILE 332 Ca 0.07 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.21 1cm5 n ILE 332 Cb 0.54 -0.27 0.07 0.00 -0.75 0.00 0.00 39.64 39.24 1cm5 n ILE 332 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 1cm5 n TRP 333 N -1.32 -2.10 -1.88 1.39 8.01 -1.26 -1.79 117.44 118.50 1cm5 n TRP 333 Ca 0.00 0.84 -0.42 0.00 -1.31 0.00 0.00 57.50 56.60 1cm5 n TRP 333 Cb 0.17 -4.61 0.00 0.00 -2.01 0.00 0.00 31.31 24.86 1cm5 n TRP 333 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1cm5 n ALA 334 N -4.03 5.22 -2.37 6.99 0.00 -1.26 -2.75 120.51 122.31 1cm5 n ALA 334 Ca -0.16 -3.88 -0.42 0.00 0.00 0.00 0.00 53.44 48.98 1cm5 n ALA 334 Cb 0.61 -3.54 -0.03 0.00 0.00 0.00 0.00 19.45 16.49 1cm5 n ALA 334 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1cm5 s THR 335 N 3.32 4.01 -0.14 0.00 2.01 -1.26 -1.20 115.64 122.38 1cm5 s THR 335 Ca 0.48 1.49 0.02 0.00 0.31 0.00 0.00 61.69 63.99 1cm5 s THR 335 Cb 0.12 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.69 1cm5 s THR 335 CO -0.06 0.14 -0.21 -0.70 -0.69 0.00 0.00 174.62 173.09 1cm5 s GLU 336 N 0.82 3.05 -0.37 4.92 -6.30 -1.05 -1.09 118.70 118.67 1cm5 s GLU 336 Ca 0.57 -0.84 -0.16 0.00 -2.50 0.00 0.00 54.97 52.04 1cm5 s GLU 336 Cb -0.29 -2.44 -0.00 0.00 0.00 0.00 0.00 34.13 31.39 1cm5 s GLU 336 CO 0.30 0.02 0.38 -1.12 0.02 0.00 0.00 175.26 174.86 1cm5 s SER 337 N 0.75 6.18 -0.10 -1.70 0.01 0.47 -0.96 113.70 118.36 1cm5 s SER 337 Ca -0.08 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.76 1cm5 s SER 337 Cb -0.16 -2.20 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 1cm5 s SER 337 CO -0.00 -0.42 0.04 -0.63 0.41 0.00 0.00 173.24 172.64 1cm5 s ILE 338 N 2.05 4.62 0.00 1.44 1.01 0.42 -4.41 121.20 126.33 1cm5 s ILE 338 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.64 1cm5 s ILE 338 Cb -0.17 -2.97 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1cm5 s ILE 338 CO 0.12 0.60 0.00 0.61 0.00 0.00 0.00 174.94 176.28 1cm5 n GLY 339 N 2.16 1.61 0.00 6.18 0.00 -1.26 -0.91 105.19 112.96 1cm5 n GLY 339 Ca -0.19 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1cm5 n GLY 339 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cm5 n GLY 340 N 0.00 -1.08 3.33 -0.02 0.00 -0.98 -4.42 105.19 102.02 1cm5 n GLY 340 Ca 0.00 -1.62 -0.27 0.00 0.00 0.00 0.00 46.02 44.14 1cm5 n GLY 340 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1cm5 s MET 341 N -1.09 1.34 0.78 1.61 -1.94 -1.26 -0.46 119.30 118.28 1cm5 s MET 341 Ca 0.00 -1.20 -0.11 0.00 -1.71 0.00 0.00 55.69 52.67 1cm5 s MET 341 Cb 0.00 -1.67 0.07 0.00 2.01 0.00 0.00 34.83 35.24 1cm5 s MET 341 CO 0.00 0.40 1.14 0.20 -0.01 0.00 0.00 175.02 176.75 1cm5 s GLY 342 N -1.78 1.61 0.42 -0.03 0.00 0.17 -4.79 107.32 102.91 1cm5 s GLY 342 Ca 0.10 -0.66 0.21 0.00 0.00 0.00 0.00 44.72 44.37 1cm5 s GLY 342 CO 0.04 -0.20 1.82 1.41 0.00 0.00 0.00 173.10 176.17 1cm5 h LEU 343 N -0.93 0.00 0.00 0.66 3.38 -1.93 -2.92 115.31 113.57 1cm5 h LEU 343 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1cm5 h LEU 343 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1cm5 h LEU 343 CO 0.65 0.29 0.00 -0.90 0.09 0.00 0.00 178.44 178.57 1cm5 n ASP 344 N -3.56 0.00 0.00 -0.43 5.68 -1.26 -4.93 116.55 112.05 1cm5 n ASP 344 Ca -0.01 0.32 0.00 0.00 -0.50 0.00 0.00 54.79 54.61 1cm5 n ASP 344 Cb 0.43 -0.44 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1cm5 n ASP 344 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1cm5 n GLY 345 N 1.20 2.00 3.80 6.12 0.00 -1.10 -5.09 105.19 112.13 1cm5 n GLY 345 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1cm5 n GLY 345 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1cm5 s ARG 346 N -0.14 3.10 0.38 1.61 1.70 -1.26 -4.75 118.95 119.58 1cm5 s ARG 346 Ca 0.00 1.15 -0.23 0.00 -0.47 0.00 0.00 55.73 56.18 1cm5 s ARG 346 Cb 0.00 -2.00 -0.10 0.00 -0.57 0.00 0.00 34.95 32.27 1cm5 s ARG 346 CO 0.00 -0.99 0.94 -0.08 -1.08 0.00 0.00 175.30 174.09 1cm5 s THR 347 N -2.64 4.32 -2.37 4.99 -1.32 -1.26 -0.65 115.64 116.71 1cm5 s THR 347 Ca 0.62 1.62 0.22 0.00 -1.21 0.00 0.00 61.69 62.94 1cm5 s THR 347 Cb -0.16 -3.78 0.45 0.00 -1.51 0.00 0.00 72.50 67.50 1cm5 s THR 347 CO 0.44 -0.11 1.53 0.18 -2.21 0.00 0.00 174.62 174.45 1cm5 n LEU 348 N -0.09 1.99 -4.75 9.08 7.99 0.39 -4.69 117.00 126.93 1cm5 n LEU 348 Ca 0.05 -0.81 -0.41 0.00 -0.01 0.00 0.00 56.01 54.82 1cm5 n LEU 348 Cb 0.52 -0.11 -0.03 0.00 -0.11 0.00 0.00 43.42 43.69 1cm5 n LEU 348 CO 0.40 0.41 0.96 -0.69 -1.51 0.00 0.00 177.39 176.96 1cm5 s VAL 349 N -1.78 3.04 0.36 4.08 1.01 -1.25 -4.54 120.40 121.33 1cm5 s VAL 349 Ca 0.34 0.95 0.05 0.00 0.00 0.00 0.00 61.98 63.32 1cm5 s VAL 349 Cb 0.19 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 1cm5 s VAL 349 CO 0.28 0.18 0.21 0.42 0.00 0.00 0.00 175.10 176.19 1cm5 s THR 350 N -0.51 0.25 0.42 3.92 -4.23 -1.26 -1.64 115.64 112.59 1cm5 s THR 350 Ca 0.52 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.14 1cm5 s THR 350 Cb -0.37 -2.42 0.20 0.00 1.34 0.00 0.00 72.50 71.25 1cm5 s THR 350 CO 0.44 0.00 1.99 0.11 -0.54 0.00 0.00 174.62 176.62 1cm5 h LYS 351 N 2.00 0.25 0.00 3.99 1.57 -1.90 -1.73 116.57 120.74 1cm5 h LYS 351 Ca -0.30 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.40 1cm5 h LYS 351 Cb 1.25 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1cm5 h LYS 351 CO 0.45 0.30 -0.21 -0.97 -0.57 0.00 0.00 179.45 178.45 1cm5 h ASN 352 N 0.25 0.00 -0.32 0.86 -1.24 -1.95 -1.71 115.58 111.47 1cm5 h ASN 352 Ca 0.06 0.00 0.02 0.00 0.71 0.00 0.00 56.30 57.08 1cm5 h ASN 352 Cb 0.21 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 1cm5 h ASN 352 CO 0.01 0.21 0.18 0.28 -1.29 0.00 0.00 177.43 176.81 1cm5 h SER 353 N 0.00 0.28 -0.55 1.15 0.02 -1.60 -1.00 113.55 111.85 1cm5 h SER 353 Ca -0.00 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.86 1cm5 h SER 353 Cb 0.48 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 1cm5 h SER 353 CO 0.03 0.20 -0.03 -0.26 -1.14 0.00 0.00 176.83 175.63 1cm5 h PHE 354 N 0.36 1.09 -0.95 3.45 -1.00 -1.44 -2.78 116.94 115.68 1cm5 h PHE 354 Ca 0.13 -0.20 0.02 0.00 2.81 0.00 0.00 57.97 60.73 1cm5 h PHE 354 Cb 0.02 -0.28 -0.05 0.00 3.61 0.00 0.00 35.95 39.25 1cm5 h PHE 354 CO -0.08 1.00 0.62 0.00 -1.61 0.00 0.00 178.31 178.23 1cm5 h ARG 355 N 0.87 1.20 -0.13 1.51 3.08 -0.80 0.38 114.38 120.49 1cm5 h ARG 355 Ca 0.15 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1cm5 h ARG 355 Cb 0.58 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1cm5 h ARG 355 CO 0.03 0.79 0.02 0.74 -1.07 0.00 0.00 179.97 180.48 1cm5 h PHE 356 N 1.23 0.24 -0.74 3.04 -1.00 -1.09 -2.81 116.94 115.81 1cm5 h PHE 356 Ca 0.37 -0.04 -0.00 0.00 2.81 0.00 0.00 57.97 61.11 1cm5 h PHE 356 Cb -0.06 -0.06 -0.04 0.00 3.61 0.00 0.00 35.95 39.40 1cm5 h PHE 356 CO -0.01 0.42 0.46 -0.07 -1.61 0.00 0.00 178.31 177.50 1cm5 h LEU 357 N -0.01 0.87 -2.00 1.54 4.07 -1.23 -2.02 115.31 116.53 1cm5 h LEU 357 Ca 0.04 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1cm5 h LEU 357 Cb 0.32 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.84 1cm5 h LEU 357 CO 0.00 0.66 0.00 -1.13 -1.08 0.00 0.00 178.44 176.90 1cm5 h ASN 358 N 1.01 0.00 0.36 -0.43 -1.24 -0.67 -1.37 115.58 113.26 1cm5 h ASN 358 Ca 0.27 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.26 1cm5 h ASN 358 Cb -0.06 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 38.99 1cm5 h ASN 358 CO -0.05 0.00 -0.10 0.71 -1.29 0.00 0.00 177.43 176.69 1cm5 h THR 359 N 0.00 0.52 0.00 -3.57 1.35 -1.22 0.29 112.91 110.27 1cm5 h THR 359 Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1cm5 h THR 359 Cb 0.04 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 1cm5 h THR 359 CO 0.00 0.10 0.00 -0.07 -0.25 0.00 0.00 175.52 175.30 1cm5 h LEU 360 N 0.00 0.00 0.00 3.87 -0.00 -1.41 -1.04 115.31 116.74 1cm5 h LEU 360 Ca -0.00 0.00 -0.44 0.00 -0.00 0.00 0.00 57.88 57.44 1cm5 h LEU 360 Cb 0.31 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.91 1cm5 h LEU 360 CO 0.01 0.00 -2.41 -1.22 -0.00 0.00 0.00 178.44 174.82 1cm5 n TYR 361 N -2.94 0.09 -0.11 1.13 0.53 -0.10 -2.66 117.16 113.10 1cm5 n TYR 361 Ca 0.00 0.04 0.02 0.00 -1.02 0.00 0.00 57.90 56.94 1cm5 n TYR 361 Cb 0.25 -1.00 0.34 0.00 -1.03 0.00 0.00 39.34 37.91 1cm5 n TYR 361 CO 0.00 0.00 0.00 1.79 -1.02 0.00 0.00 176.86 177.63 1cm5 h THR 362 N -1.00 1.15 0.00 -0.72 1.35 -1.05 -3.11 112.91 109.53 1cm5 h THR 362 Ca -0.66 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1cm5 h THR 362 Cb 1.58 0.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 1cm5 h THR 362 CO -0.40 0.14 -0.02 0.23 -0.25 0.00 0.00 175.52 175.22 1cm5 n MET 363 N -4.45 2.16 -0.24 4.72 2.81 -0.40 -4.68 117.12 117.04 1cm5 n MET 363 Ca 0.06 -1.57 0.03 0.00 -1.81 0.00 0.00 57.70 54.41 1cm5 n MET 363 Cb 0.05 -1.02 -0.01 0.00 -0.71 0.00 0.00 33.22 31.53 1cm5 n MET 363 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1cm5 n GLY 364 N -0.61 -1.59 3.76 3.03 0.00 -1.09 -4.89 105.19 103.81 1cm5 n GLY 364 Ca 0.03 -1.46 -0.39 0.00 0.00 0.00 0.00 46.02 44.20 1cm5 n GLY 364 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1cm5 s PRO 365 N -1.51 3.60 -0.18 1.61 0.02 -1.17 -4.17 135.00 133.20 1cm5 s PRO 365 Ca 0.00 2.12 -0.20 0.00 0.02 0.00 0.00 61.00 62.94 1cm5 s PRO 365 Cb 0.00 -2.49 0.05 0.00 0.02 0.00 0.00 34.50 32.08 1cm5 s PRO 365 CO 0.00 -0.78 0.54 0.45 -0.33 0.00 0.00 177.00 176.88 1cm5 s SER 366 N -0.94 -0.55 0.14 2.53 0.15 -1.26 -4.84 113.70 108.93 1cm5 s SER 366 Ca 0.64 0.98 -0.11 0.00 0.70 0.00 0.00 55.95 58.16 1cm5 s SER 366 Cb -0.37 1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 64.89 1cm5 s SER 366 CO 0.46 -0.25 1.48 -0.65 1.20 0.00 0.00 173.24 175.48 1cm5 h PRO 367 N 4.97 0.93 -6.45 5.44 0.11 -1.87 -3.44 132.00 131.69 1cm5 h PRO 367 Ca -0.28 -0.48 -0.69 0.00 0.11 0.00 0.00 66.00 64.66 1cm5 h PRO 367 Cb 1.17 0.01 -0.24 0.00 0.11 0.00 0.00 31.00 32.05 1cm5 h PRO 367 CO 0.20 1.14 -0.80 -1.21 -0.21 0.00 0.00 178.00 177.12 1cm5 s GLU 368 N -4.42 2.30 0.77 1.05 0.41 -1.26 -3.80 118.70 113.75 1cm5 s GLU 368 Ca -0.11 -0.82 -0.12 0.00 -0.41 0.00 0.00 54.97 53.51 1cm5 s GLU 368 Cb 0.11 -2.26 0.06 0.00 -1.78 0.00 0.00 34.13 30.26 1cm5 s GLU 368 CO 0.88 0.59 1.12 -2.14 -0.49 0.00 0.00 175.26 175.21 1cm5 s PRO 369 N -0.93 2.16 -1.21 0.39 0.02 -1.26 -4.33 135.00 129.84 1cm5 s PRO 369 Ca 0.12 1.34 -0.16 0.00 0.02 0.00 0.00 61.00 62.33 1cm5 s PRO 369 Cb -0.10 -1.87 0.13 0.00 0.02 0.00 0.00 34.50 32.67 1cm5 s PRO 369 CO 0.02 -1.74 1.52 1.21 -0.33 0.00 0.00 177.00 177.68 1cm5 s ASN 370 N -2.95 6.94 -0.15 2.53 2.47 -0.34 -4.96 114.94 118.48 1cm5 s ASN 370 Ca 0.65 -2.69 -0.29 0.00 0.42 0.00 0.00 52.86 50.95 1cm5 s ASN 370 Cb -0.20 -2.47 -0.03 0.00 -1.45 0.00 0.00 41.25 37.10 1cm5 s ASN 370 CO 0.52 -0.94 1.53 -0.04 -3.72 0.00 0.00 177.10 174.45 1cm5 s MET 371 N 2.69 4.05 -0.19 0.43 -1.94 -1.26 -2.53 119.30 120.55 1cm5 s MET 371 Ca 0.46 1.84 -0.02 0.00 -1.71 0.00 0.00 55.69 56.26 1cm5 s MET 371 Cb -0.00 -3.95 -0.00 0.00 2.01 0.00 0.00 34.83 32.88 1cm5 s MET 371 CO 0.02 -0.98 -0.09 0.99 -0.01 0.00 0.00 175.02 174.94 1cm5 s THR 372 N 4.34 3.04 -0.24 2.05 2.01 -0.13 -2.72 115.64 123.99 1cm5 s THR 372 Ca 0.68 -0.62 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 1cm5 s THR 372 Cb -0.27 -2.34 -0.02 0.00 0.01 0.00 0.00 72.50 69.88 1cm5 s THR 372 CO 0.26 0.47 0.67 -0.63 -0.69 0.00 0.00 174.62 174.70 1cm5 s ILE 373 N 1.15 4.96 -0.81 1.82 -1.09 -0.20 -0.44 121.20 126.60 1cm5 s ILE 373 Ca 0.01 1.23 -0.24 0.00 -2.23 0.00 0.00 60.65 59.42 1cm5 s ILE 373 Cb -0.14 -3.97 0.05 0.00 -1.58 0.00 0.00 42.46 36.81 1cm5 s ILE 373 CO -0.03 0.03 1.25 -0.76 -1.23 0.00 0.00 174.94 174.19 1cm5 s LEU 374 N 2.43 3.64 0.34 2.97 1.43 -0.09 -1.34 118.68 128.07 1cm5 s LEU 374 Ca 0.29 -0.93 -0.26 0.00 -1.03 0.00 0.00 54.13 52.20 1cm5 s LEU 374 Cb -0.16 -2.52 -0.10 0.00 0.03 0.00 0.00 46.19 43.45 1cm5 s LEU 374 CO 0.09 -1.62 0.96 0.86 0.23 0.00 0.00 176.35 176.87 1cm5 s TRP 375 N 4.97 3.62 -0.13 0.29 -0.11 0.14 -2.32 118.94 125.41 1cm5 s TRP 375 Ca 0.35 1.76 -0.19 0.00 1.22 0.00 0.00 56.10 59.24 1cm5 s TRP 375 Cb -0.08 -2.95 0.05 0.00 -1.50 0.00 0.00 33.47 28.99 1cm5 s TRP 375 CO 0.06 0.09 0.49 0.45 -4.62 0.00 0.00 176.95 173.42 1cm5 s SER 376 N -1.63 -0.47 0.52 5.86 0.15 -1.26 0.34 113.70 117.21 1cm5 s SER 376 Ca 0.52 0.76 0.24 0.00 0.70 0.00 0.00 55.95 58.17 1cm5 s SER 376 Cb -0.19 0.79 1.41 0.00 -1.71 0.00 0.00 66.02 66.33 1cm5 s SER 376 CO 0.24 -0.30 2.09 -0.33 1.20 0.00 0.00 173.24 176.14 1cm5 h GLU 377 N 4.66 0.00 -0.02 5.44 5.08 -1.93 -2.26 114.58 125.56 1cm5 h GLU 377 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1cm5 h GLU 377 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1cm5 h GLU 377 CO 0.27 0.11 0.00 1.63 -1.00 0.00 0.00 179.01 180.02 1cm5 n LYS 378 N -3.87 1.14 -1.77 2.33 4.76 -1.26 -4.91 118.16 114.59 1cm5 n LYS 378 Ca -0.02 -0.21 -0.35 0.00 -2.87 0.00 0.00 58.31 54.86 1cm5 n LYS 378 Cb 0.21 -1.39 0.06 0.00 -1.84 0.00 0.00 35.03 32.06 1cm5 n LYS 378 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1cm5 s LEU 379 N -1.75 3.48 0.19 -0.35 1.43 -0.85 -4.92 118.68 115.92 1cm5 s LEU 379 Ca 0.36 2.27 -0.32 0.00 -1.03 0.00 0.00 54.13 55.41 1cm5 s LEU 379 Cb 0.17 -4.58 -0.11 0.00 0.03 0.00 0.00 46.19 41.69 1cm5 s LEU 379 CO 0.28 -1.81 1.70 -2.84 0.23 0.00 0.00 176.35 173.92 1cm5 s PRO 380 N -3.71 4.14 0.48 1.29 0.02 -1.26 -4.85 135.00 131.11 1cm5 s PRO 380 Ca 0.74 2.56 0.22 0.00 0.02 0.00 0.00 61.00 64.53 1cm5 s PRO 380 Cb -0.27 -3.15 1.24 0.00 0.02 0.00 0.00 34.50 32.34 1cm5 s PRO 380 CO 0.39 -0.73 1.94 1.25 -0.33 0.00 0.00 177.00 179.51 1cm5 h LEU 381 N 7.00 0.20 -0.99 -5.54 5.85 -1.91 0.79 115.31 120.70 1cm5 h LEU 381 Ca -0.43 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.32 1cm5 h LEU 381 Cb 1.20 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.15 1cm5 h LEU 381 CO 0.95 0.10 0.66 0.78 -0.34 0.00 0.00 178.44 180.58 1cm5 h ASN 382 N 0.21 1.12 0.26 1.25 2.35 -1.87 -0.82 115.58 118.08 1cm5 h ASN 382 Ca 0.34 -0.02 -0.26 0.00 -0.55 0.00 0.00 56.30 55.81 1cm5 h ASN 382 Cb 1.05 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 39.17 1cm5 h ASN 382 CO -0.07 0.79 -1.11 0.15 -1.65 0.00 0.00 177.43 175.55 1cm5 h PHE 383 N 1.31 0.80 -0.49 1.19 3.57 -1.13 -2.78 116.94 119.40 1cm5 h PHE 383 Ca 0.38 -0.48 0.03 0.00 3.53 0.00 0.00 57.97 61.43 1cm5 h PHE 383 Cb -0.10 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.54 1cm5 h PHE 383 CO -0.00 1.32 0.28 0.87 -2.23 0.00 0.00 178.31 178.55 1cm5 h LYS 384 N 0.25 0.54 -0.39 1.11 1.57 -0.91 -1.20 116.57 117.53 1cm5 h LYS 384 Ca -0.13 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 1cm5 h LYS 384 Cb 1.77 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.95 1cm5 h LYS 384 CO 0.20 0.35 -0.10 0.87 -0.57 0.00 0.00 179.45 180.21 1cm5 h LYS 385 N 0.55 0.75 -0.54 3.15 1.57 -1.22 -2.41 116.57 118.42 1cm5 h LYS 385 Ca 0.20 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1cm5 h LYS 385 Cb 0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1cm5 h LYS 385 CO -0.11 0.90 0.04 0.35 -0.57 0.00 0.00 179.45 180.06 1cm5 h PHE 386 N 0.56 0.93 -0.16 -1.35 3.57 -1.24 0.68 116.94 119.93 1cm5 h PHE 386 Ca 0.10 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1cm5 h PHE 386 Cb 0.62 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1cm5 h PHE 386 CO 0.05 0.83 0.06 0.00 -2.23 0.00 0.00 178.31 177.02 1cm5 h ALA 387 N 1.21 0.21 -0.96 2.41 0.00 -1.19 -1.04 119.26 119.90 1cm5 h ALA 387 Ca 0.16 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1cm5 h ALA 387 Cb 0.43 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1cm5 h ALA 387 CO 0.02 -0.21 0.63 0.00 0.00 0.00 0.00 179.25 179.69 1cm5 h ALA 388 N 0.91 1.39 -0.16 0.00 0.00 -1.09 -0.93 119.26 119.37 1cm5 h ALA 388 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1cm5 h ALA 388 Cb 0.17 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1cm5 h ALA 388 CO -0.00 0.51 0.11 -0.22 0.00 0.00 0.00 179.25 179.64 1cm5 h LYS 389 N 1.20 0.21 -0.63 0.00 3.11 -0.42 -0.63 116.57 119.42 1cm5 h LYS 389 Ca 0.39 -0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 58.20 1cm5 h LYS 389 Cb 0.03 -0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 31.18 1cm5 h LYS 389 CO -0.12 0.14 0.31 0.28 -2.81 0.00 0.00 179.45 177.25 1cm5 h VAL 390 N 0.22 1.20 -0.30 2.00 2.07 -0.40 0.04 116.25 121.08 1cm5 h VAL 390 Ca 0.06 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 1cm5 h VAL 390 Cb -0.02 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1cm5 h VAL 390 CO -0.01 0.23 0.05 0.28 0.02 0.00 0.00 177.57 178.13 1cm5 h SER 391 N 0.88 0.47 -0.85 0.57 0.02 -0.62 0.29 113.55 114.31 1cm5 h SER 391 Ca 0.22 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 1cm5 h SER 391 Cb 0.07 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.44 1cm5 h SER 391 CO -0.03 0.61 0.44 0.40 -1.14 0.00 0.00 176.83 177.11 1cm5 h ILE 392 N 0.31 1.25 0.05 3.27 2.04 -0.63 0.30 117.51 124.10 1cm5 h ILE 392 Ca 0.09 -0.66 -0.23 0.00 1.00 0.00 0.00 64.86 65.05 1cm5 h ILE 392 Cb 0.34 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1cm5 h ILE 392 CO 0.01 0.29 -1.05 0.44 0.00 0.00 0.00 178.15 177.84 1cm5 h ASP 393 N 1.19 0.30 0.00 1.72 3.32 -0.81 -3.42 116.42 118.72 1cm5 h ASP 393 Ca 0.29 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1cm5 h ASP 393 Cb 0.07 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1cm5 h ASP 393 CO -0.04 1.17 -0.70 0.35 -1.72 0.00 0.00 179.24 178.29 1cm5 n THR 394 N -3.56 0.00 -2.79 0.35 -2.24 0.10 -5.02 114.28 101.12 1cm5 n THR 394 Ca -0.05 -0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.53 1cm5 n THR 394 Cb 0.92 0.37 0.01 0.00 -2.10 0.00 0.00 70.33 69.53 1cm5 n THR 394 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1cm5 n SER 395 N -1.07 -4.99 -0.74 3.42 7.64 0.10 -4.54 113.62 113.44 1cm5 n SER 395 Ca 0.00 -0.12 0.08 0.00 1.01 0.00 0.00 58.87 59.84 1cm5 n SER 395 Cb 0.00 -4.13 0.13 0.00 -1.01 0.00 0.00 64.21 59.20 1cm5 n SER 395 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1cm5 n SER 396 N -2.17 2.71 -4.60 6.43 7.64 -1.26 -3.57 113.62 118.80 1cm5 n SER 396 Ca -0.13 -1.79 -0.24 0.00 1.01 0.00 0.00 58.87 57.71 1cm5 n SER 396 Cb 0.62 -0.13 -0.08 0.00 -1.01 0.00 0.00 64.21 63.61 1cm5 n SER 396 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1cm5 s LEU 397 N -1.20 3.04 0.13 -3.43 1.43 -1.26 -4.55 118.68 112.84 1cm5 s LEU 397 Ca 0.24 -0.68 0.06 0.00 -1.03 0.00 0.00 54.13 52.72 1cm5 s LEU 397 Cb 0.15 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 1cm5 s LEU 397 CO 0.21 0.04 -0.15 0.00 0.23 0.00 0.00 176.35 176.68 1cm5 s GLN 398 N -3.41 1.07 -0.03 1.70 -2.07 -1.10 -3.37 119.66 112.45 1cm5 s GLN 398 Ca 0.29 -1.27 0.05 0.00 -1.82 0.00 0.00 55.36 52.62 1cm5 s GLN 398 Cb -0.07 -0.98 -0.01 0.00 -1.09 0.00 0.00 33.01 30.86 1cm5 s GLN 398 CO 0.18 0.19 -0.19 0.71 -1.32 0.00 0.00 175.29 174.86 1cm5 s TYR 399 N -2.13 1.77 -0.01 9.60 1.51 0.19 -1.03 117.35 127.26 1cm5 s TYR 399 Ca 0.10 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.77 1cm5 s TYR 399 Cb -0.05 -1.16 -0.00 0.00 -0.11 0.00 0.00 41.96 40.64 1cm5 s TYR 399 CO 0.04 -0.09 -0.07 -1.21 -1.11 0.00 0.00 175.55 173.11 1cm5 s GLU 400 N -0.28 0.59 -0.64 -0.62 2.02 -0.45 -0.06 118.70 119.26 1cm5 s GLU 400 Ca 0.03 -0.23 -0.26 0.00 0.02 0.00 0.00 54.97 54.54 1cm5 s GLU 400 Cb -0.09 -0.57 -0.08 0.00 0.10 0.00 0.00 34.13 33.48 1cm5 s GLU 400 CO 0.00 0.12 2.30 1.21 0.02 0.00 0.00 175.26 178.92 1cm5 s ASN 401 N -0.02 4.41 0.33 -0.19 3.84 -0.28 -0.68 114.94 122.35 1cm5 s ASN 401 Ca 0.01 0.49 0.15 0.00 0.21 0.00 0.00 52.86 53.72 1cm5 s ASN 401 Cb -0.04 -2.53 0.56 0.00 -0.55 0.00 0.00 41.25 38.69 1cm5 s ASN 401 CO -0.00 -3.15 1.70 -0.78 -2.79 0.00 0.00 177.10 172.08 1cm5 h ASP 402 N 16.04 0.00 0.73 -4.21 3.58 -0.39 -1.80 116.42 130.37 1cm5 h ASP 402 Ca -0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.32 1cm5 h ASP 402 Cb 1.14 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.19 1cm5 h ASP 402 CO 1.12 0.48 0.00 0.47 -2.88 0.00 0.00 179.24 178.43 1cm5 n ASP 403 N -3.71 0.69 -0.12 2.28 8.00 -1.18 -1.84 116.55 120.66 1cm5 n ASP 403 Ca -0.01 0.67 -0.22 0.00 0.71 0.00 0.00 54.79 55.94 1cm5 n ASP 403 Cb 0.54 -0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 40.73 1cm5 n ASP 403 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1cm5 n LEU 404 N -2.26 2.24 -0.00 0.64 7.94 -0.95 -4.56 117.00 120.05 1cm5 n LEU 404 Ca 0.02 0.13 -0.17 0.00 -1.11 0.00 0.00 56.01 54.88 1cm5 n LEU 404 Cb 0.23 -0.76 -0.10 0.00 0.53 0.00 0.00 43.42 43.32 1cm5 n LEU 404 CO 0.20 0.67 0.26 0.24 -1.11 0.00 0.00 177.39 177.65 1cm5 h MET 405 N -0.53 0.51 -0.17 1.96 2.86 -1.36 -2.98 114.93 115.21 1cm5 h MET 405 Ca -0.58 -0.49 0.05 0.00 -2.06 0.00 0.00 59.70 56.61 1cm5 h MET 405 Cb 1.65 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 33.39 1cm5 h MET 405 CO -0.26 1.13 -0.13 -0.09 1.06 0.00 0.00 176.91 178.62 1cm5 h ARG 406 N 0.07 -0.13 -0.27 1.72 2.43 -1.61 -1.03 114.38 115.56 1cm5 h ARG 406 Ca -0.07 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 1cm5 h ARG 406 Cb 1.33 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.89 1cm5 h ARG 406 CO 0.13 -0.09 -0.24 -1.35 -1.51 0.00 0.00 179.97 176.91 1cm5 h PRO 407 N -0.14 0.51 -0.89 0.20 0.11 -1.77 0.78 132.00 130.80 1cm5 h PRO 407 Ca 0.11 -0.19 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 1cm5 h PRO 407 Cb 0.29 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.33 1cm5 h PRO 407 CO -0.26 0.72 0.48 0.22 -0.21 0.00 0.00 178.00 178.95 1cm5 h ASP 408 N 0.45 1.12 0.74 -2.05 3.58 -1.26 -2.80 116.42 116.21 1cm5 h ASP 408 Ca 0.07 -0.10 -0.19 0.00 0.42 0.00 0.00 57.03 57.22 1cm5 h ASP 408 Cb 0.67 -0.29 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 1cm5 h ASP 408 CO 0.05 0.91 -1.38 -0.26 -2.88 0.00 0.00 179.24 175.68 1cm5 h PHE 409 N 1.25 0.00 -5.71 0.28 0.04 -1.04 -3.48 116.94 108.29 1cm5 h PHE 409 Ca 0.31 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.74 1cm5 h PHE 409 Cb 0.04 0.00 0.16 0.00 2.20 0.00 0.00 35.95 38.34 1cm5 h PHE 409 CO 0.01 0.70 -0.77 -1.71 -0.60 0.00 0.00 178.31 175.94 1cm5 n ASN 410 N -2.98 -2.40 -3.70 2.17 4.05 0.27 -5.00 115.26 107.67 1cm5 n ASN 410 Ca -0.10 -0.63 -0.13 0.00 0.45 0.00 0.00 54.58 54.17 1cm5 n ASN 410 Cb 0.89 -5.02 -0.09 0.00 1.23 0.00 0.00 39.78 36.78 1cm5 n ASN 410 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 1cm5 s ASN 411 N -4.25 -0.53 -0.18 1.20 3.84 -1.04 -5.04 114.94 108.94 1cm5 s ASN 411 Ca 0.06 1.01 0.16 0.00 0.21 0.00 0.00 52.86 54.30 1cm5 s ASN 411 Cb -0.03 1.02 0.58 0.00 -0.55 0.00 0.00 41.25 42.27 1cm5 s ASN 411 CO 0.74 -0.18 1.49 -0.90 -2.79 0.00 0.00 177.10 175.46 1cm5 n ASP 412 N 2.92 4.24 -2.42 -4.21 3.85 -1.26 -4.55 116.55 115.11 1cm5 n ASP 412 Ca -0.14 -2.91 -0.14 0.00 -0.71 0.00 0.00 54.79 50.89 1cm5 n ASP 412 Cb 0.57 -0.56 0.03 0.00 -1.35 0.00 0.00 41.12 39.81 1cm5 n ASP 412 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 1cm5 n ASP 413 N -0.15 3.34 -4.95 -1.12 2.03 -1.26 -4.93 116.55 109.51 1cm5 n ASP 413 Ca 0.22 -2.98 -0.23 0.00 0.52 0.00 0.00 54.79 52.32 1cm5 n ASP 413 Cb 0.93 -0.42 -0.02 0.00 -0.72 0.00 0.00 41.12 40.89 1cm5 n ASP 413 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1cm5 s TYR 414 N -3.65 3.47 0.13 -0.67 -0.85 -1.26 -2.10 117.35 112.41 1cm5 s TYR 414 Ca 0.40 0.15 0.03 0.00 -0.52 0.00 0.00 57.07 57.13 1cm5 s TYR 414 Cb 0.38 -1.71 -0.04 0.00 0.38 0.00 0.00 41.96 40.96 1cm5 s TYR 414 CO -0.01 0.35 -0.09 0.00 -1.52 0.00 0.00 175.55 174.28 1cm5 s ALA 415 N -2.04 1.29 -0.31 9.51 0.00 0.11 -4.83 121.76 125.49 1cm5 s ALA 415 Ca 0.36 -1.45 -0.18 0.00 0.00 0.00 0.00 51.96 50.70 1cm5 s ALA 415 Cb -0.10 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1cm5 s ALA 415 CO 0.31 -0.15 0.52 0.42 0.00 0.00 0.00 175.76 176.86 1cm5 s ILE 416 N -3.44 5.03 0.01 0.00 -1.09 -1.26 -1.30 121.20 119.15 1cm5 s ILE 416 Ca 0.15 0.63 -0.17 0.00 -2.23 0.00 0.00 60.65 59.03 1cm5 s ILE 416 Cb 0.04 -3.90 -0.06 0.00 -1.58 0.00 0.00 42.46 36.96 1cm5 s ILE 416 CO -0.01 -0.07 0.49 0.00 -1.23 0.00 0.00 174.94 174.12 1cm5 s ALA 417 N 2.38 3.61 0.00 9.38 0.00 0.14 -4.77 121.76 132.49 1cm5 s ALA 417 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1cm5 s ALA 417 Cb -0.15 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.43 1cm5 s ALA 417 CO 0.11 0.36 0.00 0.00 0.00 0.00 0.00 175.76 176.23 1cm5 n ALA 418 N 2.11 0.00 -0.09 0.00 0.00 -1.26 -2.32 120.51 118.94 1cm5 n ALA 418 Ca -0.11 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 1cm5 n ALA 418 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 1cm5 n ALA 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cm5 n ALA 419 N 11.97 0.73 -1.99 0.00 0.00 -1.26 -4.73 120.51 125.23 1cm5 n ALA 419 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1cm5 n ALA 419 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1cm5 n ALA 419 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1cm5 n VAL 420 N -4.48 0.00 -3.33 0.00 0.24 -1.24 -4.92 118.33 104.59 1cm5 n VAL 420 Ca -0.22 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.63 1cm5 n VAL 420 Cb 0.52 0.40 -0.07 0.00 -1.47 0.00 0.00 33.84 33.22 1cm5 n VAL 420 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1cm5 s SER 421 N -0.78 6.17 0.37 -1.34 0.01 -0.98 -3.93 113.70 113.22 1cm5 s SER 421 Ca 0.00 -1.22 -0.25 0.00 1.31 0.00 0.00 55.95 55.79 1cm5 s SER 421 Cb 0.00 -2.21 -0.09 0.00 0.21 0.00 0.00 66.02 63.93 1cm5 s SER 421 CO 0.00 -0.71 1.02 -2.16 0.41 0.00 0.00 173.24 171.80 1cm5 s PRO 422 N 1.89 4.33 -0.20 12.44 0.04 -1.26 0.24 135.00 152.47 1cm5 s PRO 422 Ca 0.07 1.45 -0.19 0.00 0.04 0.00 0.00 61.00 62.37 1cm5 s PRO 422 Cb -0.23 -2.64 0.05 0.00 0.04 0.00 0.00 34.50 31.72 1cm5 s PRO 422 CO 0.08 0.02 0.55 0.00 0.04 0.00 0.00 177.00 177.68 1cm5 s MET 423 N -2.34 0.65 -0.15 4.56 0.23 -0.42 -4.91 119.30 116.93 1cm5 s MET 423 Ca 0.55 0.72 -0.29 0.00 -1.03 0.00 0.00 55.69 55.64 1cm5 s MET 423 Cb -0.21 0.32 -0.02 0.00 -1.53 0.00 0.00 34.83 33.39 1cm5 s MET 423 CO 0.26 -0.09 1.36 0.42 -2.03 0.00 0.00 175.02 174.95 1cm5 s ILE 424 N 0.21 4.10 -0.12 3.16 1.01 -1.26 0.05 121.20 128.34 1cm5 s ILE 424 Ca -0.01 1.32 -0.36 0.00 0.00 0.00 0.00 60.65 61.60 1cm5 s ILE 424 Cb -0.04 -3.88 -0.13 0.00 0.01 0.00 0.00 42.46 38.42 1cm5 s ILE 424 CO 0.01 -0.15 1.78 0.52 0.00 0.00 0.00 174.94 177.11 1cm5 n VAL 425 N 5.48 0.41 -0.63 2.92 0.31 -0.89 -1.65 118.33 124.28 1cm5 n VAL 425 Ca 0.15 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1cm5 n VAL 425 Cb 0.44 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 1cm5 n VAL 425 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1cm5 n GLY 426 N 4.15 1.68 0.00 2.92 0.00 -1.26 -4.81 105.19 107.88 1cm5 n GLY 426 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1cm5 n GLY 426 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cm5 n LYS 427 N -2.00 -0.61 -3.64 1.61 5.02 -0.66 -0.57 118.16 117.31 1cm5 n LYS 427 Ca 0.00 -0.39 -0.16 0.00 -2.02 0.00 0.00 58.31 55.74 1cm5 n LYS 427 Cb 0.00 -0.86 -0.07 0.00 -0.02 0.00 0.00 35.03 34.07 1cm5 n LYS 427 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1cm5 s GLN 428 N -0.03 0.85 0.26 1.97 0.74 -0.93 -2.05 119.66 120.46 1cm5 s GLN 428 Ca 0.00 0.09 -0.06 0.00 0.05 0.00 0.00 55.36 55.44 1cm5 s GLN 428 Cb 0.00 0.39 -0.02 0.00 1.10 0.00 0.00 33.01 34.49 1cm5 s GLN 428 CO 0.00 -0.24 0.35 0.00 -0.55 0.00 0.00 175.29 174.85 1cm5 s MET 429 N -1.14 1.52 0.04 1.67 0.23 -0.03 -4.69 119.30 116.90 1cm5 s MET 429 Ca -0.11 -1.52 0.05 0.00 -1.03 0.00 0.00 55.69 53.08 1cm5 s MET 429 Cb -0.03 0.39 -0.02 0.00 -1.53 0.00 0.00 34.83 33.64 1cm5 s MET 429 CO 0.07 -0.59 -0.15 -0.65 -2.03 0.00 0.00 175.02 171.66 1cm5 s GLN 430 N -3.83 1.02 -0.58 3.16 -0.21 -1.07 -2.99 119.66 115.16 1cm5 s GLN 430 Ca 0.31 -0.81 -0.21 0.00 0.02 0.00 0.00 55.36 54.67 1cm5 s GLN 430 Cb 0.02 -1.06 0.07 0.00 1.00 0.00 0.00 33.01 33.04 1cm5 s GLN 430 CO 0.13 0.26 0.80 -0.06 -2.12 0.00 0.00 175.29 174.30 1cm5 s PHE 431 N -0.86 2.88 0.33 0.91 2.99 0.15 -4.71 117.98 119.68 1cm5 s PHE 431 Ca 0.03 -0.54 -0.29 0.00 0.00 0.00 0.00 56.93 56.13 1cm5 s PHE 431 Cb -0.08 -3.96 -0.12 0.00 0.00 0.00 0.00 43.02 38.86 1cm5 s PHE 431 CO 0.01 -1.33 1.50 0.34 -0.00 0.00 0.00 175.22 175.75 1cm5 n PHE 432 N 6.88 2.82 -0.45 0.36 7.35 -1.26 -2.04 117.46 131.12 1cm5 n PHE 432 Ca -0.05 0.39 0.00 0.00 -0.76 0.00 0.00 57.45 57.03 1cm5 n PHE 432 Cb 0.45 -2.54 0.00 0.00 0.35 0.00 0.00 39.48 37.74 1cm5 n PHE 432 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1cm5 n GLY 433 N 1.21 -0.00 7.00 7.13 0.00 -0.91 -4.76 105.19 114.86 1cm5 n GLY 433 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1cm5 n GLY 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cm5 n ALA 434 N -0.15 0.00 -2.95 4.61 0.00 -1.26 -4.62 120.51 116.13 1cm5 n ALA 434 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1cm5 n ALA 434 Cb 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.62 1cm5 n ALA 434 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1cm5 s ARG 435 N 0.00 0.74 0.10 0.00 3.03 -1.26 -1.99 118.95 119.56 1cm5 s ARG 435 Ca 0.00 -0.55 0.02 0.00 2.03 0.00 0.00 55.73 57.24 1cm5 s ARG 435 Cb 0.00 0.32 -0.04 0.00 -1.03 0.00 0.00 34.95 34.20 1cm5 s ARG 435 CO 0.00 -0.23 0.16 0.00 -1.13 0.00 0.00 175.30 174.11 1cm5 s ALA 436 N -2.47 3.77 -0.86 7.88 0.00 0.16 -4.47 121.76 125.78 1cm5 s ALA 436 Ca -0.06 -0.99 -0.22 0.00 0.00 0.00 0.00 51.96 50.70 1cm5 s ALA 436 Cb -0.01 -1.60 0.08 0.00 0.00 0.00 0.00 23.12 21.59 1cm5 s ALA 436 CO -0.03 0.71 1.18 1.21 0.00 0.00 0.00 175.76 178.83 1cm5 s ASN 437 N -2.66 6.43 0.23 0.00 3.84 -0.27 -0.41 114.94 122.10 1cm5 s ASN 437 Ca 0.32 -1.45 -0.03 0.00 0.21 0.00 0.00 52.86 51.92 1cm5 s ASN 437 Cb -0.12 -2.46 0.24 0.00 -0.55 0.00 0.00 41.25 38.36 1cm5 s ASN 437 CO 0.25 -1.36 1.65 0.25 -2.79 0.00 0.00 177.10 175.10 1cm5 h LEU 438 N 11.52 0.70 -0.22 3.21 6.46 -1.75 -2.88 115.31 132.35 1cm5 h LEU 438 Ca 0.00 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.50 1cm5 h LEU 438 Cb 1.04 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1cm5 h LEU 438 CO 1.22 0.93 0.12 0.00 -0.62 0.00 0.00 178.44 180.09 1cm5 h ALA 439 N 1.13 0.29 -0.05 1.25 0.00 -1.76 -2.27 119.26 117.84 1cm5 h ALA 439 Ca 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1cm5 h ALA 439 Cb 0.73 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1cm5 h ALA 439 CO 0.06 -0.17 -0.13 -0.22 0.00 0.00 0.00 179.25 178.78 1cm5 h LYS 440 N 0.25 0.07 -0.65 0.00 3.64 -1.92 -1.34 116.57 116.63 1cm5 h LYS 440 Ca 0.08 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1cm5 h LYS 440 Cb 0.08 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1cm5 h LYS 440 CO -0.01 0.21 0.30 1.15 -2.27 0.00 0.00 179.45 178.82 1cm5 h THR 441 N 0.07 1.21 -0.53 1.00 2.02 -1.19 -1.15 112.91 114.33 1cm5 h THR 441 Ca 0.01 -0.61 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 1cm5 h THR 441 Cb 0.28 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.06 1cm5 h THR 441 CO 0.02 0.25 -0.06 -0.03 0.37 0.00 0.00 175.52 176.07 1cm5 h MET 442 N 0.92 0.98 -0.49 6.66 1.85 -0.89 -2.31 114.93 121.65 1cm5 h MET 442 Ca 0.22 -0.34 -0.05 0.00 -0.61 0.00 0.00 59.70 58.92 1cm5 h MET 442 Cb 0.11 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.05 1cm5 h MET 442 CO -0.03 1.01 0.09 -0.07 -0.40 0.00 0.00 176.91 177.51 1cm5 h LEU 443 N 0.85 0.70 -1.00 3.39 3.38 -1.13 -2.50 115.31 119.00 1cm5 h LEU 443 Ca 0.14 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1cm5 h LEU 443 Cb 0.61 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1cm5 h LEU 443 CO 0.04 0.72 0.03 1.88 0.09 0.00 0.00 178.44 181.19 1cm5 h TYR 444 N 0.72 0.79 -0.59 1.13 -1.99 -0.95 0.12 116.97 116.20 1cm5 h TYR 444 Ca 0.16 -0.10 -0.01 0.00 2.00 0.00 0.00 58.73 60.78 1cm5 h TYR 444 Cb 0.32 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 38.80 1cm5 h TYR 444 CO 0.02 0.72 0.33 0.00 -0.00 0.00 0.00 178.16 179.23 1cm5 h ALA 445 N 1.32 0.75 0.00 3.88 0.00 -0.99 0.24 119.26 124.47 1cm5 h ALA 445 Ca 0.14 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1cm5 h ALA 445 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1cm5 h ALA 445 CO 0.01 0.26 -0.72 0.82 0.00 0.00 0.00 179.25 179.61 1cm5 h ILE 446 N 0.79 1.45 -0.49 0.00 2.04 -1.18 -3.29 117.51 116.84 1cm5 h ILE 446 Ca 0.21 -2.54 -0.02 0.00 1.00 0.00 0.00 64.86 63.51 1cm5 h ILE 446 Cb 0.02 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.48 1cm5 h ILE 446 CO -0.04 0.71 0.02 0.59 0.00 0.00 0.00 178.15 179.44 1cm5 n ASN 447 N -3.58 5.04 -3.52 1.72 3.02 0.38 -2.60 115.26 115.73 1cm5 n ASN 447 Ca -0.00 -3.00 -0.26 0.00 -0.03 0.00 0.00 54.58 51.28 1cm5 n ASN 447 Cb 0.73 -0.65 0.03 0.00 -0.61 0.00 0.00 39.78 39.29 1cm5 n ASN 447 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1cm5 n GLY 448 N 0.16 -0.51 3.03 7.41 0.00 -0.20 -2.26 105.19 112.82 1cm5 n GLY 448 Ca 0.27 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.46 1cm5 n GLY 448 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cm5 n GLY 449 N -1.63 2.21 3.75 -0.02 0.00 0.69 -3.45 105.19 106.73 1cm5 n GLY 449 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1cm5 n GLY 449 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cm5 s VAL 450 N -3.33 4.69 -0.17 1.61 1.01 -0.96 -1.61 120.40 121.64 1cm5 s VAL 450 Ca 0.00 1.66 -0.29 0.00 0.00 0.00 0.00 61.98 63.35 1cm5 s VAL 450 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1cm5 s VAL 450 CO 0.00 0.37 1.51 -0.62 0.00 0.00 0.00 175.10 176.36 1cm5 s ASP 451 N -0.12 6.62 0.00 3.32 -1.08 -0.16 -4.79 116.67 120.46 1cm5 s ASP 451 Ca 0.39 1.76 0.00 0.00 -0.52 0.00 0.00 52.55 54.18 1cm5 s ASP 451 Cb -0.21 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 1cm5 s ASP 451 CO 0.24 -1.03 0.84 -1.84 0.52 0.00 0.00 175.17 173.89 1cm5 n GLU 452 N 7.24 0.00 0.00 4.34 0.00 -1.26 0.23 120.64 131.18 1cm5 n GLU 452 Ca 0.17 0.35 0.00 0.00 0.00 0.00 0.00 57.16 57.68 1cm5 n GLU 452 Cb 0.45 -1.59 0.00 0.00 0.00 0.00 0.00 31.44 30.29 1cm5 n GLU 452 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1cm5 n LYS 453 N -1.34 1.95 -0.00 3.44 4.81 -1.26 -4.76 118.16 121.00 1cm5 n LYS 453 Ca 0.00 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.54 1cm5 n LYS 453 Cb 0.09 -0.99 -0.10 0.00 0.02 0.00 0.00 35.03 34.05 1cm5 n LYS 453 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1cm5 n LEU 454 N -2.22 0.86 -3.22 3.14 4.32 -1.00 -4.99 117.00 113.89 1cm5 n LEU 454 Ca 0.00 -0.41 -0.23 0.00 -0.02 0.00 0.00 56.01 55.35 1cm5 n LEU 454 Cb 0.49 -0.02 0.02 0.00 -1.62 0.00 0.00 43.42 42.29 1cm5 n LEU 454 CO 0.00 0.21 -0.01 0.29 -1.22 0.00 0.00 177.39 176.66 1cm5 n LYS 455 N -1.59 -4.26 -4.39 3.23 5.02 0.13 -4.95 118.16 111.35 1cm5 n LYS 455 Ca 0.03 0.69 -0.26 0.00 -2.02 0.00 0.00 58.31 56.75 1cm5 n LYS 455 Cb 0.36 -5.48 -0.12 0.00 -0.02 0.00 0.00 35.03 29.77 1cm5 n LYS 455 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cm5 s MET 456 N -5.89 1.43 -0.63 1.97 0.23 -1.26 -4.83 119.30 110.32 1cm5 s MET 456 Ca 0.36 -1.46 -0.27 0.00 -1.03 0.00 0.00 55.69 53.29 1cm5 s MET 456 Cb -0.18 -1.72 0.02 0.00 -1.53 0.00 0.00 34.83 31.42 1cm5 s MET 456 CO 0.45 0.38 1.39 -1.14 -2.03 0.00 0.00 175.02 174.07 1cm5 s GLN 457 N -2.58 3.21 -0.17 3.16 2.00 -1.26 -0.98 119.66 123.05 1cm5 s GLN 457 Ca 0.18 0.21 -0.17 0.00 -2.00 0.00 0.00 55.36 53.59 1cm5 s GLN 457 Cb -0.08 -4.16 -0.06 0.00 0.80 0.00 0.00 33.01 29.51 1cm5 s GLN 457 CO 0.08 -2.07 -0.33 0.28 -0.50 0.00 0.00 175.29 172.76 1cm5 n VAL 458 N 6.71 1.48 -1.65 1.34 0.31 -0.74 -5.00 118.33 120.79 1cm5 n VAL 458 Ca 0.10 0.12 -0.30 0.00 -0.01 0.00 0.00 64.34 64.25 1cm5 n VAL 458 Cb 0.49 -2.27 0.20 0.00 -0.91 0.00 0.00 33.84 31.35 1cm5 n VAL 458 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1cm5 s GLY 459 N -4.89 1.71 0.26 2.92 0.00 -0.63 -4.93 107.32 101.75 1cm5 s GLY 459 Ca -0.28 -1.09 -0.30 0.00 0.00 0.00 0.00 44.72 43.06 1cm5 s GLY 459 CO 0.41 -0.29 1.48 2.56 0.00 0.00 0.00 173.10 177.26 1cm5 s PRO 460 N -5.71 4.23 -0.17 2.90 0.04 -1.26 -4.78 135.00 130.24 1cm5 s PRO 460 Ca 0.72 2.38 -0.29 0.00 0.04 0.00 0.00 61.00 63.86 1cm5 s PRO 460 Cb -0.06 -3.08 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 1cm5 s PRO 460 CO 0.54 -0.48 2.02 0.21 0.04 0.00 0.00 177.00 179.33 1cm5 s LYS 461 N -0.41 3.49 0.18 4.56 2.20 -1.26 -4.35 119.74 124.16 1cm5 s LYS 461 Ca 0.60 2.04 -0.06 0.00 -0.36 0.00 0.00 55.97 58.19 1cm5 s LYS 461 Cb -0.44 -4.25 -0.02 0.00 -1.51 0.00 0.00 37.83 31.61 1cm5 s LYS 461 CO 0.45 -1.69 0.24 -1.54 -0.36 0.00 0.00 175.35 172.45 1cm5 s SER 462 N 6.53 0.09 0.02 1.43 1.04 -1.22 -5.08 113.70 116.51 1cm5 s SER 462 Ca 0.91 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 55.96 1cm5 s SER 462 Cb -0.33 0.43 -0.05 0.00 0.10 0.00 0.00 66.02 66.17 1cm5 s SER 462 CO 0.36 -0.90 1.25 -1.61 0.98 0.00 0.00 173.24 173.32 1cm5 s GLU 463 N -4.04 4.38 0.65 4.02 0.41 -1.26 -4.48 118.70 118.37 1cm5 s GLU 463 Ca 0.25 1.80 -0.13 0.00 -0.41 0.00 0.00 54.97 56.48 1cm5 s GLU 463 Cb 0.04 -3.44 -0.01 0.00 -1.78 0.00 0.00 34.13 28.95 1cm5 s GLU 463 CO 0.05 -0.38 1.06 -1.25 -0.49 0.00 0.00 175.26 174.25 1cm5 s PRO 464 N 1.61 3.07 0.11 0.39 0.04 -1.26 -4.60 135.00 134.35 1cm5 s PRO 464 Ca 0.59 1.10 -0.31 0.00 0.04 0.00 0.00 61.00 62.42 1cm5 s PRO 464 Cb -0.29 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 1cm5 s PRO 464 CO 0.27 -1.00 1.88 -0.89 0.04 0.00 0.00 177.00 177.29 1cm5 n ILE 465 N -2.61 0.47 0.65 0.56 -0.00 -1.07 -4.88 119.36 112.47 1cm5 n ILE 465 Ca 0.08 -0.08 0.12 0.00 -0.00 0.00 0.00 62.75 62.87 1cm5 n ILE 465 Cb 0.53 -2.19 0.14 0.00 -0.00 0.00 0.00 39.64 38.12 1cm5 n ILE 465 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 1cm5 n LYS 466 N 6.12 0.24 -1.59 0.38 4.76 -1.26 -4.98 118.16 121.83 1cm5 n LYS 466 Ca 0.18 0.04 -0.41 0.00 -2.87 0.00 0.00 58.31 55.26 1cm5 n LYS 466 Cb 0.38 -1.62 0.02 0.00 -1.84 0.00 0.00 35.03 31.97 1cm5 n LYS 466 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cm5 n GLY 467 N 1.38 -0.40 0.12 0.72 0.00 -1.26 -4.92 105.19 100.83 1cm5 n GLY 467 Ca 0.03 0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 1cm5 n GLY 467 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1cm5 h ASP 468 N 1.27 0.00 -3.82 1.61 3.04 -1.96 -3.44 116.42 113.11 1cm5 h ASP 468 Ca -0.45 0.00 -0.43 0.00 -3.24 0.00 0.00 57.03 52.91 1cm5 h ASP 468 Cb 1.35 0.00 -0.31 0.00 -1.04 0.00 0.00 39.33 39.33 1cm5 h ASP 468 CO 0.55 0.66 -0.79 -0.69 -2.04 0.00 0.00 179.24 176.93 1cm5 s VAL 469 N -3.10 0.81 0.14 4.15 1.01 -1.26 -4.23 120.40 117.91 1cm5 s VAL 469 Ca 0.01 -0.38 -0.31 0.00 0.00 0.00 0.00 61.98 61.31 1cm5 s VAL 469 Cb 0.10 -0.72 -0.08 0.00 0.00 0.00 0.00 36.38 35.68 1cm5 s VAL 469 CO 0.76 0.25 1.29 -0.76 0.00 0.00 0.00 175.10 176.64 1cm5 s LEU 470 N 0.18 4.40 -0.13 3.92 1.43 -0.92 -5.03 118.68 122.53 1cm5 s LEU 470 Ca -0.03 2.25 -0.02 0.00 -1.03 0.00 0.00 54.13 55.31 1cm5 s LEU 470 Cb -0.09 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.52 1cm5 s LEU 470 CO 0.01 -0.52 -0.07 0.21 0.23 0.00 0.00 176.35 176.20 1cm5 s ASN 471 N 0.71 4.56 0.16 2.29 3.84 -1.26 -4.73 114.94 120.51 1cm5 s ASN 471 Ca 0.59 -0.16 -0.17 0.00 0.21 0.00 0.00 52.86 53.33 1cm5 s ASN 471 Cb -0.34 -1.61 0.07 0.00 -0.55 0.00 0.00 41.25 38.81 1cm5 s ASN 471 CO 0.33 0.21 1.69 0.22 -2.79 0.00 0.00 177.10 176.76 1cm5 h TYR 472 N 6.41 -0.12 -0.70 0.43 3.20 -1.94 -1.49 116.97 122.76 1cm5 h TYR 472 Ca -0.33 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.58 1cm5 h TYR 472 Cb 1.19 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.53 1cm5 h TYR 472 CO 0.53 -0.12 0.46 -0.44 -1.64 0.00 0.00 178.16 176.95 1cm5 h ASP 473 N 0.04 0.79 -0.20 -2.11 5.19 -1.96 -0.63 116.42 117.54 1cm5 h ASP 473 Ca 0.17 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.48 1cm5 h ASP 473 Cb 0.25 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.56 1cm5 h ASP 473 CO -0.33 0.57 -0.20 -0.08 -3.12 0.00 0.00 179.24 176.08 1cm5 h GLU 474 N 0.93 0.50 0.07 3.56 4.81 -1.93 -2.39 114.58 120.13 1cm5 h GLU 474 Ca 0.26 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1cm5 h GLU 474 Cb -0.08 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1cm5 h GLU 474 CO -0.07 0.84 -0.03 0.28 -0.73 0.00 0.00 179.01 179.30 1cm5 h VAL 475 N 0.17 1.10 -0.36 0.32 2.07 -1.22 -2.91 116.25 115.42 1cm5 h VAL 475 Ca 0.03 -0.57 0.02 0.00 0.82 0.00 0.00 66.70 67.00 1cm5 h VAL 475 Cb 0.75 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1cm5 h VAL 475 CO 0.05 0.14 0.24 -0.03 0.02 0.00 0.00 177.57 178.00 1cm5 h MET 476 N -0.34 0.41 0.11 1.57 1.85 -1.19 0.12 114.93 117.45 1cm5 h MET 476 Ca -0.01 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.05 1cm5 h MET 476 Cb 0.30 -0.09 0.00 0.00 0.43 0.00 0.00 31.60 32.24 1cm5 h MET 476 CO 0.01 0.27 -0.05 1.49 -0.40 0.00 0.00 176.91 178.23 1cm5 h GLU 477 N 0.42 -0.14 -0.30 0.39 4.57 -1.31 0.33 114.58 118.54 1cm5 h GLU 477 Ca 0.14 0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.21 1cm5 h GLU 477 Cb 0.06 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1cm5 h GLU 477 CO -0.03 -0.08 -0.32 0.00 -1.18 0.00 0.00 179.01 177.39 1cm5 h ARG 478 N -0.16 0.64 -0.62 1.92 2.47 -1.23 -2.66 114.38 114.73 1cm5 h ARG 478 Ca -0.02 -0.29 0.08 0.00 -1.26 0.00 0.00 59.98 58.50 1cm5 h ARG 478 Cb 0.12 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.37 1cm5 h ARG 478 CO 0.02 0.88 0.28 1.98 0.56 0.00 0.00 179.97 183.70 1cm5 h MET 479 N 0.54 0.49 -0.54 0.04 1.85 -0.36 0.81 114.93 117.76 1cm5 h MET 479 Ca 0.06 -0.03 -0.05 0.00 -0.61 0.00 0.00 59.70 59.07 1cm5 h MET 479 Cb 0.82 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.72 1cm5 h MET 479 CO 0.07 0.32 0.15 0.22 -0.40 0.00 0.00 176.91 177.28 1cm5 h ASP 480 N 0.50 0.80 -0.74 1.39 3.58 -0.73 -0.90 116.42 120.33 1cm5 h ASP 480 Ca 0.30 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 1cm5 h ASP 480 Cb 0.31 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 1cm5 h ASP 480 CO -0.26 0.81 0.29 -0.74 -2.88 0.00 0.00 179.24 176.46 1cm5 h HIS 481 N 0.75 1.14 0.00 0.28 2.76 -0.95 -2.48 115.15 116.64 1cm5 h HIS 481 Ca 0.17 -0.08 -0.08 0.00 -2.20 0.00 0.00 60.37 58.17 1cm5 h HIS 481 Cb 0.30 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 1cm5 h HIS 481 CO 0.02 0.87 -0.40 0.74 -1.30 0.00 0.00 177.93 177.86 1cm5 h PHE 482 N 1.09 0.00 0.00 5.26 0.04 -0.64 -2.96 116.94 119.73 1cm5 h PHE 482 Ca 0.25 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.91 1cm5 h PHE 482 Cb 0.22 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 1cm5 h PHE 482 CO 0.02 0.40 -0.54 0.52 -0.60 0.00 0.00 178.31 178.11 1cm5 h MET 483 N 0.00 0.00 -0.26 1.51 2.86 -0.80 0.13 114.93 118.37 1cm5 h MET 483 Ca -0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.57 1cm5 h MET 483 Cb 1.14 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.79 1cm5 h MET 483 CO 0.05 0.54 -0.08 -0.44 1.06 0.00 0.00 176.91 178.04 1cm5 h ASP 484 N 0.00 0.52 -0.21 1.22 3.45 -1.31 -1.13 116.42 118.95 1cm5 h ASP 484 Ca -0.01 -0.38 -0.01 0.00 0.43 0.00 0.00 57.03 57.07 1cm5 h ASP 484 Cb 1.09 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.71 1cm5 h ASP 484 CO 0.07 0.78 0.10 -0.25 -1.57 0.00 0.00 179.24 178.37 1cm5 h TRP 485 N 0.25 0.30 -0.56 4.55 7.01 -1.34 -1.99 115.95 124.16 1cm5 h TRP 485 Ca 0.06 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.09 1cm5 h TRP 485 Cb 0.56 -0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 27.49 1cm5 h TRP 485 CO 0.05 0.30 0.32 1.25 -2.79 0.00 0.00 178.44 177.57 1cm5 h LEU 486 N 0.21 0.50 -0.64 0.65 5.85 -0.90 -1.76 115.31 119.22 1cm5 h LEU 486 Ca 0.07 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1cm5 h LEU 486 Cb 0.11 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1cm5 h LEU 486 CO -0.01 0.34 0.39 0.00 -0.34 0.00 0.00 178.44 178.82 1cm5 h ALA 487 N 1.27 0.84 -0.15 1.25 0.00 -1.00 0.23 119.26 121.70 1cm5 h ALA 487 Ca 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1cm5 h ALA 487 Cb 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1cm5 h ALA 487 CO -0.13 0.12 0.02 -0.22 0.00 0.00 0.00 179.25 179.04 1cm5 h LYS 488 N 0.75 0.25 -0.67 0.00 3.64 -0.95 -1.37 116.57 118.23 1cm5 h LYS 488 Ca 0.26 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1cm5 h LYS 488 Cb 0.06 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 1cm5 h LYS 488 CO -0.12 0.45 0.17 1.96 -2.27 0.00 0.00 179.45 179.64 1cm5 h GLN 489 N 0.01 1.05 -0.05 1.90 1.08 -1.12 -1.61 115.11 116.37 1cm5 h GLN 489 Ca 0.04 -0.24 -0.01 0.00 -1.45 0.00 0.00 58.65 57.00 1cm5 h GLN 489 Cb 0.33 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.61 1cm5 h GLN 489 CO 0.00 0.92 0.00 -0.92 -0.95 0.00 0.00 178.83 177.89 1cm5 h TYR 490 N 1.00 0.10 -0.68 2.96 3.20 -0.89 -0.89 116.97 121.77 1cm5 h TYR 490 Ca 0.21 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.99 1cm5 h TYR 490 Cb 0.34 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 1cm5 h TYR 490 CO 0.02 0.36 0.12 0.82 -1.64 0.00 0.00 178.16 177.85 1cm5 h ILE 491 N -0.19 1.27 -0.54 1.81 1.08 -1.22 -1.69 117.51 118.03 1cm5 h ILE 491 Ca 0.02 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.43 1cm5 h ILE 491 Cb 0.32 0.61 -0.03 0.00 -3.07 0.00 0.00 36.82 34.66 1cm5 h ILE 491 CO 0.00 0.39 0.28 0.74 -0.69 0.00 0.00 178.15 178.88 1cm5 h THR 492 N 1.06 1.19 -0.71 -0.27 2.02 -1.23 0.16 112.91 115.12 1cm5 h THR 492 Ca 0.21 -0.49 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1cm5 h THR 492 Cb 0.44 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1cm5 h THR 492 CO 0.01 0.20 0.33 0.00 0.37 0.00 0.00 175.52 176.44 1cm5 h ALA 493 N 1.12 0.92 -0.15 6.16 0.00 -0.91 -2.40 119.26 124.00 1cm5 h ALA 493 Ca 0.19 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1cm5 h ALA 493 Cb 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1cm5 h ALA 493 CO -0.03 0.49 -0.55 -0.07 0.00 0.00 0.00 179.25 179.09 1cm5 h LEU 494 N 0.99 0.50 -0.63 0.00 3.38 -0.89 -1.58 115.31 117.08 1cm5 h LEU 494 Ca 0.24 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1cm5 h LEU 494 Cb 0.13 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1cm5 h LEU 494 CO -0.03 0.95 0.42 0.78 0.09 0.00 0.00 178.44 180.65 1cm5 h ASN 495 N 0.34 0.73 0.08 -0.43 2.35 -0.43 -0.74 115.58 117.49 1cm5 h ASN 495 Ca 0.01 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1cm5 h ASN 495 Cb 1.07 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.26 1cm5 h ASN 495 CO 0.10 0.54 -0.04 0.40 -1.65 0.00 0.00 177.43 176.77 1cm5 h ILE 496 N 0.86 1.09 -0.16 2.81 2.04 -1.34 -2.70 117.51 120.12 1cm5 h ILE 496 Ca 0.23 -0.60 0.05 0.00 1.00 0.00 0.00 64.86 65.54 1cm5 h ILE 496 Cb -0.09 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 1cm5 h ILE 496 CO -0.05 0.15 -0.21 0.40 0.00 0.00 0.00 178.15 178.44 1cm5 h ILE 497 N -0.38 0.47 0.00 -0.67 2.04 -0.91 -1.79 117.51 116.28 1cm5 h ILE 497 Ca -0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 1cm5 h ILE 497 Cb 0.32 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1cm5 h ILE 497 CO 0.02 0.00 -0.18 0.45 0.00 0.00 0.00 178.15 178.43 1cm5 h HIS 498 N -0.25 0.00 -0.12 1.37 3.86 -1.22 0.14 115.15 118.94 1cm5 h HIS 498 Ca 0.11 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1cm5 h HIS 498 Cb 0.41 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.88 1cm5 h HIS 498 CO -0.33 0.18 -0.06 -0.92 0.86 0.00 0.00 177.93 177.67 1cm5 h TYR 499 N 0.00 0.29 -0.19 2.45 3.20 -1.12 -1.91 116.97 119.68 1cm5 h TYR 499 Ca -0.00 -0.07 -0.11 0.00 3.14 0.00 0.00 58.73 61.69 1cm5 h TYR 499 Cb 0.78 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1cm5 h TYR 499 CO 0.00 0.59 -0.35 0.52 -1.64 0.00 0.00 178.16 177.28 1cm5 h MET 500 N -0.11 0.40 -0.26 1.82 2.86 -1.04 -2.29 114.93 116.31 1cm5 h MET 500 Ca 0.03 -0.18 -0.15 0.00 -2.06 0.00 0.00 59.70 57.34 1cm5 h MET 500 Cb 0.52 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 1cm5 h MET 500 CO 0.02 0.70 -0.45 1.25 1.06 0.00 0.00 176.91 179.49 1cm5 h HIS 501 N 0.34 0.82 -0.26 -0.22 2.76 -0.89 0.31 115.15 118.00 1cm5 h HIS 501 Ca 0.04 -0.26 -0.10 0.00 -2.20 0.00 0.00 60.37 57.86 1cm5 h HIS 501 Cb 0.78 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.56 1cm5 h HIS 501 CO 0.02 1.00 -0.24 -0.44 -1.30 0.00 0.00 177.93 176.97 1cm5 h ASP 502 N 0.54 0.50 0.05 3.26 3.32 -1.26 -0.69 116.42 122.14 1cm5 h ASP 502 Ca 0.03 -0.17 -0.15 0.00 0.02 0.00 0.00 57.03 56.77 1cm5 h ASP 502 Cb 0.99 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 40.42 1cm5 h ASP 502 CO 0.09 0.74 -0.61 0.50 -1.72 0.00 0.00 179.24 178.25 1cm5 h LYS 503 N 0.45 0.33 0.00 3.56 3.64 -0.99 -3.34 116.57 120.21 1cm5 h LYS 503 Ca 0.07 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1cm5 h LYS 503 Cb 0.66 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1cm5 h LYS 503 CO 0.05 1.12 -0.73 0.66 -2.27 0.00 0.00 179.45 178.28 1cm5 n TYR 504 N -4.24 0.00 -2.72 1.91 4.01 0.10 -4.71 117.16 111.52 1cm5 n TYR 504 Ca -0.11 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.54 1cm5 n TYR 504 Cb 0.70 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.78 1cm5 n TYR 504 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1cm5 n SER 505 N -1.37 -0.43 -4.69 7.72 2.88 -0.30 -4.62 113.62 112.81 1cm5 n SER 505 Ca 0.03 -2.69 -0.42 0.00 -1.33 0.00 0.00 58.87 54.45 1cm5 n SER 505 Cb 0.24 0.36 -0.03 0.00 -0.75 0.00 0.00 64.21 64.03 1cm5 n SER 505 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1cm5 s TYR 506 N -1.29 2.54 -1.24 0.66 5.04 -1.02 -4.76 117.35 117.27 1cm5 s TYR 506 Ca 0.25 0.40 -0.15 0.00 -2.44 0.00 0.00 57.07 55.14 1cm5 s TYR 506 Cb 0.41 -3.93 -0.04 0.00 0.35 0.00 0.00 41.96 38.75 1cm5 s TYR 506 CO -0.03 -3.67 2.24 0.39 -1.34 0.00 0.00 175.55 173.13 1cm5 n GLU 507 N 5.39 2.53 -0.15 4.97 4.71 -1.26 -4.81 120.64 132.02 1cm5 n GLU 507 Ca 0.15 -2.23 -0.04 0.00 -0.01 0.00 0.00 57.16 55.04 1cm5 n GLU 507 Cb 0.41 -3.04 0.02 0.00 -1.01 0.00 0.00 31.44 27.82 1cm5 n GLU 507 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1cm5 h ALA 508 N 6.40 0.18 0.00 0.62 0.00 -1.91 -0.18 119.26 124.38 1cm5 h ALA 508 Ca 0.57 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.60 1cm5 h ALA 508 Cb 0.55 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1cm5 h ALA 508 CO 1.85 -0.53 -0.21 0.66 0.00 0.00 0.00 179.25 181.02 1cm5 h SER 509 N -0.09 0.00 0.10 0.00 4.64 -1.87 -0.74 113.55 115.59 1cm5 h SER 509 Ca 0.23 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.36 1cm5 h SER 509 Cb 0.44 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1cm5 h SER 509 CO -0.53 0.21 -0.89 -0.07 -0.87 0.00 0.00 176.83 174.68 1cm5 h LEU 510 N 0.00 0.35 -2.10 5.97 4.07 -1.75 -3.30 115.31 118.55 1cm5 h LEU 510 Ca -0.00 -0.91 -0.01 0.00 0.08 0.00 0.00 57.88 57.04 1cm5 h LEU 510 Cb 0.38 -0.11 -0.00 0.00 1.08 0.00 0.00 40.66 42.01 1cm5 h LEU 510 CO 0.03 1.40 -0.05 0.24 -1.08 0.00 0.00 178.44 178.98 1cm5 h MET 511 N -0.48 0.00 0.00 1.13 2.86 -0.96 -1.21 114.93 116.26 1cm5 h MET 511 Ca -0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1cm5 h MET 511 Cb 1.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.22 1cm5 h MET 511 CO 0.08 0.05 0.00 0.00 1.06 0.00 0.00 176.91 178.11 1cm5 h ALA 512 N 1.95 1.00 -0.77 6.32 0.00 -1.20 -2.46 119.26 124.09 1cm5 h ALA 512 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.47 1cm5 h ALA 512 Cb 0.29 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.83 1cm5 h ALA 512 CO 0.01 0.00 0.36 1.28 0.00 0.00 0.00 179.25 180.90 1cm5 n LEU 513 N -3.04 5.94 -4.40 0.00 4.77 -0.46 -4.94 117.00 114.87 1cm5 n LEU 513 Ca -0.01 -3.85 -0.20 0.00 -0.03 0.00 0.00 56.01 51.93 1cm5 n LEU 513 Cb 0.22 -0.77 -0.10 0.00 -2.33 0.00 0.00 43.42 40.44 1cm5 n LEU 513 CO 0.24 1.26 -0.28 -1.00 -1.33 0.00 0.00 177.39 176.28 1cm5 s HIS 514 N -3.39 1.81 1.12 -1.77 3.76 -0.93 -1.45 115.29 114.44 1cm5 s HIS 514 Ca 0.54 -0.99 -0.17 0.00 -0.15 0.00 0.00 55.06 54.29 1cm5 s HIS 514 Cb 0.46 -1.14 0.25 0.00 1.11 0.00 0.00 32.58 33.26 1cm5 s HIS 514 CO 0.05 -0.06 1.12 -0.51 -0.85 0.00 0.00 174.74 174.48 1cm5 s ASP 515 N -3.42 1.59 0.14 1.40 -0.00 0.27 -4.95 116.67 111.71 1cm5 s ASP 515 Ca 0.35 0.78 -0.17 0.00 -0.00 0.00 0.00 52.55 53.52 1cm5 s ASP 515 Cb 0.08 -1.16 -0.00 0.00 -0.00 0.00 0.00 42.92 41.84 1cm5 s ASP 515 CO 0.14 -3.72 1.79 -0.09 -0.00 0.00 0.00 175.17 173.28 1cm5 h ARG 516 N -2.31 0.49 -5.19 8.23 2.43 -1.94 -3.40 114.38 112.70 1cm5 h ARG 516 Ca -0.48 -0.04 -0.64 0.00 -0.81 0.00 0.00 59.98 58.01 1cm5 h ARG 516 Cb 1.30 -0.11 -0.22 0.00 -0.42 0.00 0.00 29.97 30.53 1cm5 h ARG 516 CO 0.43 0.35 -0.66 -0.51 -1.51 0.00 0.00 179.97 178.07 1cm5 s ASP 517 N -5.57 4.86 -0.09 -3.80 -0.00 -1.26 -5.09 116.67 105.71 1cm5 s ASP 517 Ca -0.13 -0.16 0.03 0.00 -0.00 0.00 0.00 52.55 52.29 1cm5 s ASP 517 Cb 0.10 -1.82 -0.01 0.00 -0.00 0.00 0.00 42.92 41.20 1cm5 s ASP 517 CO 0.72 0.11 -0.20 -0.69 -0.00 0.00 0.00 175.17 175.11 1cm5 s VAL 518 N 0.75 2.46 0.14 -1.27 1.01 -1.26 -4.91 120.40 117.32 1cm5 s VAL 518 Ca -0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 1cm5 s VAL 518 Cb -0.14 -1.96 -0.07 0.00 0.00 0.00 0.00 36.38 34.20 1cm5 s VAL 518 CO 0.02 0.55 1.24 -0.63 0.00 0.00 0.00 175.10 176.28 1cm5 s ILE 519 N 0.10 3.63 -0.02 2.22 1.01 -0.87 -4.90 121.20 122.38 1cm5 s ILE 519 Ca -0.09 1.27 0.06 0.00 0.00 0.00 0.00 60.65 61.88 1cm5 s ILE 519 Cb -0.16 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.49 1cm5 s ILE 519 CO 0.06 0.16 -0.19 -0.13 0.00 0.00 0.00 174.94 174.84 1cm5 s ARG 520 N 0.33 1.52 0.10 2.79 0.52 -1.26 -0.85 118.95 122.10 1cm5 s ARG 520 Ca 0.57 -0.66 0.09 0.00 -0.52 0.00 0.00 55.73 55.20 1cm5 s ARG 520 Cb -0.33 -1.47 -0.03 0.00 0.52 0.00 0.00 34.95 33.64 1cm5 s ARG 520 CO 0.34 0.40 -0.24 0.95 0.02 0.00 0.00 175.30 176.76 1cm5 s THR 521 N -0.42 1.96 -0.78 0.02 -4.23 -1.16 -1.84 115.64 109.20 1cm5 s THR 521 Ca 0.07 -1.55 -0.15 0.00 -1.18 0.00 0.00 61.69 58.88 1cm5 s THR 521 Cb -0.07 -1.74 0.20 0.00 1.34 0.00 0.00 72.50 72.23 1cm5 s THR 521 CO -0.01 0.09 0.74 -0.32 -0.54 0.00 0.00 174.62 174.58 1cm5 s MET 522 N -1.77 3.48 -0.46 3.99 1.75 0.03 0.32 119.30 126.64 1cm5 s MET 522 Ca 0.10 -2.26 -0.29 0.00 -1.25 0.00 0.00 55.69 51.99 1cm5 s MET 522 Cb -0.10 -4.43 0.01 0.00 2.84 0.00 0.00 34.83 33.15 1cm5 s MET 522 CO 0.04 -1.33 1.39 0.00 -0.65 0.00 0.00 175.02 174.47 1cm5 s ALA 523 N 0.62 2.98 -0.22 4.11 0.00 -0.86 -1.26 121.76 127.13 1cm5 s ALA 523 Ca 0.16 -0.33 -0.09 0.00 0.00 0.00 0.00 51.96 51.70 1cm5 s ALA 523 Cb -0.14 -3.99 -0.04 0.00 0.00 0.00 0.00 23.12 18.95 1cm5 s ALA 523 CO -0.06 -2.55 0.11 0.00 0.00 0.00 0.00 175.76 173.25 1cm5 s GLY 525 N 0.86 2.06 -0.13 0.00 0.00 -0.84 -1.24 107.32 108.02 1cm5 s GLY 525 Ca 0.06 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.90 1cm5 s GLY 525 CO 0.03 -0.88 -0.21 -0.42 0.00 0.00 0.00 173.10 171.61 1cm5 s ILE 526 N -1.56 1.96 0.08 0.90 -1.09 0.02 0.41 121.20 121.91 1cm5 s ILE 526 Ca 0.35 -0.92 0.06 0.00 -2.23 0.00 0.00 60.65 57.90 1cm5 s ILE 526 Cb -0.12 -1.74 -0.04 0.00 -1.58 0.00 0.00 42.46 38.98 1cm5 s ILE 526 CO 0.28 0.53 -0.07 0.00 -1.23 0.00 0.00 174.94 174.45 1cm5 s ALA 527 N 0.82 3.04 -0.64 9.38 0.00 0.45 -3.44 121.76 131.37 1cm5 s ALA 527 Ca -0.07 -1.17 -0.00 0.00 0.00 0.00 0.00 51.96 50.71 1cm5 s ALA 527 Cb -0.16 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 21.96 1cm5 s ALA 527 CO -0.01 0.65 0.00 0.41 0.00 0.00 0.00 175.76 176.81 1cm5 n GLY 528 N 0.83 0.06 0.18 0.00 0.00 -1.26 -2.14 105.19 102.85 1cm5 n GLY 528 Ca -0.13 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 1cm5 n GLY 528 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1cm5 h LEU 529 N -0.01 -0.40 -1.41 0.99 6.46 -1.83 -1.43 115.31 117.67 1cm5 h LEU 529 Ca -0.18 0.08 -0.05 0.00 -0.12 0.00 0.00 57.88 57.61 1cm5 h LEU 529 Cb 1.13 0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.25 1cm5 h LEU 529 CO 0.21 -0.17 -0.16 0.77 -0.62 0.00 0.00 178.44 178.48 1cm5 h SER 530 N -0.15 0.18 -0.45 1.25 4.64 -1.88 0.12 113.55 117.26 1cm5 h SER 530 Ca 0.09 -0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.26 1cm5 h SER 530 Cb 0.28 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1cm5 h SER 530 CO -0.22 0.36 -0.13 0.58 -0.87 0.00 0.00 176.83 176.56 1cm5 h VAL 531 N 0.18 1.27 -0.20 0.95 2.07 -1.76 -1.11 116.25 117.66 1cm5 h VAL 531 Ca 0.04 -1.25 -0.09 0.00 0.82 0.00 0.00 66.70 66.21 1cm5 h VAL 531 Cb 0.39 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1cm5 h VAL 531 CO 0.02 0.43 -0.23 0.00 0.02 0.00 0.00 177.57 177.81 1cm5 h ALA 532 N 0.87 0.29 -0.13 1.67 0.00 -0.75 -1.83 119.26 119.38 1cm5 h ALA 532 Ca 0.11 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1cm5 h ALA 532 Cb 0.67 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1cm5 h ALA 532 CO 0.05 0.26 0.06 0.00 0.00 0.00 0.00 179.25 179.62 1cm5 h ALA 533 N 0.63 0.16 -0.37 0.00 0.00 -0.76 -1.60 119.26 117.32 1cm5 h ALA 533 Ca 0.03 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1cm5 h ALA 533 Cb 0.79 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1cm5 h ALA 533 CO 0.06 -0.28 -0.02 -0.44 0.00 0.00 0.00 179.25 178.57 1cm5 h ASP 534 N 0.09 0.57 -0.60 0.00 3.32 -1.25 -1.66 116.42 116.89 1cm5 h ASP 534 Ca 0.04 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 1cm5 h ASP 534 Cb 0.11 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1cm5 h ASP 534 CO -0.01 0.65 0.20 0.28 -1.72 0.00 0.00 179.24 178.64 1cm5 h SER 535 N 0.57 0.86 0.32 6.45 0.02 -1.08 -0.37 113.55 120.31 1cm5 h SER 535 Ca 0.12 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 1cm5 h SER 535 Cb 0.39 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1cm5 h SER 535 CO 0.02 0.83 -0.28 -0.07 -1.14 0.00 0.00 176.83 176.19 1cm5 h LEU 536 N 0.84 0.00 -0.24 5.07 3.38 -0.81 -2.51 115.31 121.03 1cm5 h LEU 536 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 1cm5 h LEU 536 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1cm5 h LEU 536 CO -0.01 0.28 -0.82 -1.28 0.09 0.00 0.00 178.44 176.69 1cm5 h SER 537 N 0.00 0.67 0.67 -0.43 0.87 -0.60 -2.15 113.55 112.58 1cm5 h SER 537 Ca -0.00 -0.47 -0.01 0.00 -1.23 0.00 0.00 61.79 60.07 1cm5 h SER 537 Cb 0.51 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1cm5 h SER 537 CO 0.04 1.25 -0.07 0.00 -0.53 0.00 0.00 176.83 177.52 1cm5 h ALA 538 N 0.73 1.07 0.00 6.23 0.00 -0.66 -0.88 119.26 125.75 1cm5 h ALA 538 Ca -0.06 -0.06 -0.26 0.00 0.00 0.00 0.00 54.91 54.53 1cm5 h ALA 538 Cb 1.43 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.17 1cm5 h ALA 538 CO 0.15 0.09 -1.73 -0.89 0.00 0.00 0.00 179.25 176.87 1cm5 n ILE 539 N -3.28 1.39 1.00 0.00 5.41 -1.05 -2.94 119.36 119.89 1cm5 n ILE 539 Ca -0.01 -0.76 0.11 0.00 1.00 0.00 0.00 62.75 63.09 1cm5 n ILE 539 Cb 0.27 -0.82 0.04 0.00 -0.71 0.00 0.00 39.64 38.42 1cm5 n ILE 539 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1cm5 n LYS 540 N -2.92 0.02 0.00 0.38 4.81 -0.82 -4.24 118.16 115.39 1cm5 n LYS 540 Ca -0.17 -0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.26 1cm5 n LYS 540 Cb 0.99 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.54 1cm5 n LYS 540 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1cm5 n TYR 541 N -1.48 0.00 -3.28 5.64 4.02 -0.36 -5.06 117.16 116.64 1cm5 n TYR 541 Ca 0.05 -0.07 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1cm5 n TYR 541 Cb 0.33 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.65 1cm5 n TYR 541 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1cm5 n ALA 542 N -0.07 0.00 -4.04 -0.72 0.00 -1.15 -4.72 120.51 109.81 1cm5 n ALA 542 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1cm5 n ALA 542 Cb 0.33 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.62 1cm5 n ALA 542 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1cm5 s LYS 543 N -0.94 2.19 -0.23 0.00 1.02 -0.96 -4.69 119.74 116.13 1cm5 s LYS 543 Ca 0.00 -1.14 -0.07 0.00 0.02 0.00 0.00 55.97 54.78 1cm5 s LYS 543 Cb 0.00 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.56 1cm5 s LYS 543 CO 0.00 -0.51 0.07 0.08 -0.92 0.00 0.00 175.35 174.07 1cm5 s VAL 544 N 1.22 4.47 -0.34 3.17 1.01 -1.25 -1.07 120.40 127.62 1cm5 s VAL 544 Ca -0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 61.73 1cm5 s VAL 544 Cb -0.18 -3.07 0.04 0.00 0.00 0.00 0.00 36.38 33.17 1cm5 s VAL 544 CO -0.07 0.37 0.11 -0.75 0.00 0.00 0.00 175.10 174.76 1cm5 s LYS 545 N 1.22 2.67 -0.07 2.72 2.20 0.84 -2.16 119.74 127.16 1cm5 s LYS 545 Ca 0.05 -1.15 -0.30 0.00 -0.36 0.00 0.00 55.97 54.21 1cm5 s LYS 545 Cb -0.14 -3.47 -0.05 0.00 -1.51 0.00 0.00 37.83 32.66 1cm5 s LYS 545 CO 0.03 -0.65 1.63 -2.14 -0.36 0.00 0.00 175.35 173.86 1cm5 s PRO 546 N 1.42 4.15 -0.50 4.03 0.02 -1.26 -0.42 135.00 142.43 1cm5 s PRO 546 Ca -0.01 2.12 -0.20 0.00 0.02 0.00 0.00 61.00 62.93 1cm5 s PRO 546 Cb -0.19 -3.98 0.05 0.00 0.02 0.00 0.00 34.50 30.40 1cm5 s PRO 546 CO 0.03 -0.87 0.68 0.42 -0.33 0.00 0.00 177.00 176.93 1cm5 s ILE 547 N 4.10 4.79 0.28 2.83 1.01 0.66 -4.97 121.20 129.90 1cm5 s ILE 547 Ca 0.72 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 61.14 1cm5 s ILE 547 Cb -0.32 -4.32 -0.03 0.00 0.01 0.00 0.00 42.46 37.80 1cm5 s ILE 547 CO 0.29 -0.83 0.43 -0.13 0.00 0.00 0.00 174.94 174.70 1cm5 s ARG 548 N 2.88 3.42 0.01 2.79 0.52 -1.26 -1.13 118.95 126.17 1cm5 s ARG 548 Ca 0.19 -0.65 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 1cm5 s ARG 548 Cb -0.17 -2.81 0.00 0.00 0.52 0.00 0.00 34.95 32.49 1cm5 s ARG 548 CO 0.14 0.30 0.01 -0.40 0.02 0.00 0.00 175.30 175.37 1cm5 n ASP 549 N -1.56 0.11 0.00 0.23 5.75 -1.03 -4.91 116.55 115.15 1cm5 n ASP 549 Ca -0.07 -1.02 0.02 0.00 -0.01 0.00 0.00 54.79 53.72 1cm5 n ASP 549 Cb 0.57 -0.00 0.14 0.00 -1.03 0.00 0.00 41.12 40.79 1cm5 n ASP 549 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1cm5 n GLU 550 N -0.97 0.14 0.00 0.11 0.28 -1.26 -1.38 120.64 117.56 1cm5 n GLU 550 Ca 0.00 0.03 0.00 0.00 -0.16 0.00 0.00 57.16 57.03 1cm5 n GLU 550 Cb 0.01 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.38 1cm5 n GLU 550 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1cm5 n ASP 551 N -1.03 0.95 0.00 -1.84 8.00 -1.26 -5.00 116.55 116.38 1cm5 n ASP 551 Ca 0.03 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.55 1cm5 n ASP 551 Cb 0.02 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.15 1cm5 n ASP 551 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cm5 n GLY 552 N 0.04 0.75 3.67 0.44 0.00 -0.48 -5.03 105.19 104.57 1cm5 n GLY 552 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1cm5 n GLY 552 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1cm5 s LEU 553 N 0.00 4.14 -0.27 0.99 2.96 -1.26 -4.74 118.68 120.50 1cm5 s LEU 553 Ca 0.00 1.39 -0.29 0.00 -0.22 0.00 0.00 54.13 55.01 1cm5 s LEU 553 Cb 0.00 -3.51 -0.03 0.00 0.50 0.00 0.00 46.19 43.15 1cm5 s LEU 553 CO 0.00 -0.59 1.83 0.00 -1.32 0.00 0.00 176.35 176.27 1cm5 s ALA 554 N 2.84 2.98 -1.14 5.97 0.00 -1.26 -2.45 121.76 128.69 1cm5 s ALA 554 Ca 0.44 0.45 0.11 0.00 0.00 0.00 0.00 51.96 52.95 1cm5 s ALA 554 Cb -0.16 -3.98 0.19 0.00 0.00 0.00 0.00 23.12 19.17 1cm5 s ALA 554 CO 0.09 -2.44 1.03 0.44 0.00 0.00 0.00 175.76 174.89 1cm5 n ILE 555 N 7.16 0.47 -3.67 0.00 -5.35 -0.28 -4.91 119.36 112.77 1cm5 n ILE 555 Ca 0.23 -0.74 -0.02 0.00 -0.27 0.00 0.00 62.75 61.95 1cm5 n ILE 555 Cb 0.46 0.88 -0.01 0.00 -1.74 0.00 0.00 39.64 39.23 1cm5 n ILE 555 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1cm5 s ASP 556 N -0.95 -0.15 -0.01 7.28 -1.08 -1.11 -4.48 116.67 116.17 1cm5 s ASP 556 Ca 0.17 -0.24 -0.06 0.00 -0.52 0.00 0.00 52.55 51.90 1cm5 s ASP 556 Cb 0.10 0.33 0.00 0.00 -1.46 0.00 0.00 42.92 41.90 1cm5 s ASP 556 CO 0.14 -0.60 0.13 -0.36 0.52 0.00 0.00 175.17 175.00 1cm5 s PHE 557 N -2.89 -0.00 -0.16 -5.34 0.40 -1.26 -0.24 117.98 108.49 1cm5 s PHE 557 Ca 0.12 -0.02 -0.03 0.00 -0.60 0.00 0.00 56.93 56.40 1cm5 s PHE 557 Cb 0.01 -0.03 -0.02 0.00 0.51 0.00 0.00 43.02 43.49 1cm5 s PHE 557 CO -0.02 -0.23 -0.06 -1.21 0.70 0.00 0.00 175.22 174.40 1cm5 s GLU 558 N -1.03 3.58 -0.22 0.44 2.02 0.43 -4.89 118.70 119.04 1cm5 s GLU 558 Ca -0.11 -0.57 -0.04 0.00 0.02 0.00 0.00 54.97 54.27 1cm5 s GLU 558 Cb -0.06 -2.86 -0.01 0.00 0.10 0.00 0.00 34.13 31.30 1cm5 s GLU 558 CO 0.01 0.20 -0.04 0.42 0.02 0.00 0.00 175.26 175.87 1cm5 s ILE 559 N 0.46 3.42 -0.31 -1.63 1.01 -1.26 -0.11 121.20 122.78 1cm5 s ILE 559 Ca -0.05 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.12 1cm5 s ILE 559 Cb -0.15 -2.56 0.06 0.00 0.01 0.00 0.00 42.46 39.83 1cm5 s ILE 559 CO 0.03 0.42 -0.00 -0.70 0.00 0.00 0.00 174.94 174.69 1cm5 s GLU 560 N 1.45 2.25 0.00 2.79 2.12 -0.23 -4.98 118.70 122.10 1cm5 s GLU 560 Ca 0.05 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 53.98 1cm5 s GLU 560 Cb -0.14 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.09 1cm5 s GLU 560 CO -0.03 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 1cm5 n GLY 561 N 4.54 2.89 3.80 -1.50 0.00 -1.26 -2.26 105.19 111.40 1cm5 n GLY 561 Ca -0.11 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 43.93 1cm5 n GLY 561 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cm5 s GLU 562 N -4.46 3.24 0.01 1.61 0.41 -1.26 -4.77 118.70 113.48 1cm5 s GLU 562 Ca 0.00 1.22 -0.08 0.00 -0.41 0.00 0.00 54.97 55.70 1cm5 s GLU 562 Cb 0.00 -2.02 0.00 0.00 -1.78 0.00 0.00 34.13 30.33 1cm5 s GLU 562 CO 0.00 -0.88 0.16 1.52 -0.49 0.00 0.00 175.26 175.58 1cm5 s TYR 563 N -2.45 0.04 0.29 1.61 1.13 -1.26 -4.62 117.35 112.10 1cm5 s TYR 563 Ca 0.64 -0.18 -0.30 0.00 -1.41 0.00 0.00 57.07 55.82 1cm5 s TYR 563 Cb -0.17 -0.04 -0.11 0.00 -1.10 0.00 0.00 41.96 40.54 1cm5 s TYR 563 CO 0.38 -0.34 1.58 -2.14 -2.51 0.00 0.00 175.55 172.51 1cm5 s PRO 564 N -1.82 4.14 -0.03 -3.49 0.02 -1.26 -4.98 135.00 127.56 1cm5 s PRO 564 Ca -0.11 2.55 0.07 0.00 0.02 0.00 0.00 61.00 63.53 1cm5 s PRO 564 Cb -0.05 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.42 1cm5 s PRO 564 CO -0.00 -0.61 -0.24 -0.65 -0.33 0.00 0.00 177.00 175.17 1cm5 s GLN 565 N -0.52 2.28 0.28 5.54 -0.21 -1.26 -4.73 119.66 121.03 1cm5 s GLN 565 Ca 0.63 -0.89 -0.30 0.00 0.02 0.00 0.00 55.36 54.81 1cm5 s GLN 565 Cb -0.47 -2.12 -0.12 0.00 1.00 0.00 0.00 33.01 31.30 1cm5 s GLN 565 CO 0.48 0.52 1.63 0.34 -2.12 0.00 0.00 175.29 176.14 1cm5 n PHE 566 N 2.55 2.86 0.00 0.91 7.35 -1.26 -3.69 117.46 126.18 1cm5 n PHE 566 Ca -0.16 0.21 0.00 0.00 -0.76 0.00 0.00 57.45 56.73 1cm5 n PHE 566 Cb 0.51 -2.62 0.00 0.00 0.35 0.00 0.00 39.48 37.73 1cm5 n PHE 566 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1cm5 n GLY 567 N 2.51 1.24 0.11 7.13 0.00 -1.26 -4.47 105.19 110.46 1cm5 n GLY 567 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.18 1cm5 n GLY 567 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1cm5 n ASN 568 N 0.00 1.89 -2.81 1.61 3.02 -1.24 -3.35 115.26 114.38 1cm5 n ASN 568 Ca 0.00 -2.69 -0.22 0.00 -0.03 0.00 0.00 54.58 51.64 1cm5 n ASN 568 Cb 0.00 -0.31 0.02 0.00 -0.61 0.00 0.00 39.78 38.88 1cm5 n ASN 568 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1cm5 n ASN 569 N -1.04 -6.08 -4.26 6.41 5.15 -1.24 -4.91 115.26 109.29 1cm5 n ASN 569 Ca 0.11 -0.21 -0.42 0.00 -0.60 0.00 0.00 54.58 53.46 1cm5 n ASN 569 Cb 0.58 -4.95 -0.08 0.00 -0.53 0.00 0.00 39.78 34.80 1cm5 n ASN 569 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1cm5 s ASP 570 N -2.52 5.82 0.60 1.20 -1.08 -1.26 -4.97 116.67 114.47 1cm5 s ASP 570 Ca 0.21 -1.72 0.27 0.00 -0.52 0.00 0.00 52.55 50.80 1cm5 s ASP 570 Cb -0.09 -2.06 1.24 0.00 -1.46 0.00 0.00 42.92 40.55 1cm5 s ASP 570 CO 0.26 -0.68 1.65 -0.65 0.52 0.00 0.00 175.17 176.28 1cm5 h PRO 571 N 8.55 0.00 -0.28 4.34 0.11 -1.96 -1.46 132.00 141.30 1cm5 h PRO 571 Ca -0.24 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.82 1cm5 h PRO 571 Cb 1.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1cm5 h PRO 571 CO 0.87 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.61 1cm5 h ARG 572 N 0.00 0.43 0.00 1.05 3.08 -1.99 -1.12 114.38 115.83 1cm5 h ARG 572 Ca 0.30 -0.10 -0.32 0.00 0.07 0.00 0.00 59.98 59.93 1cm5 h ARG 572 Cb 1.82 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 31.75 1cm5 h ARG 572 CO -0.00 0.50 -2.21 1.55 -1.07 0.00 0.00 179.97 178.74 1cm5 n VAL 573 N -4.28 1.21 -0.26 2.04 3.14 -0.63 -4.38 118.33 115.17 1cm5 n VAL 573 Ca 0.01 -0.63 -0.03 0.00 -2.96 0.00 0.00 64.34 60.72 1cm5 n VAL 573 Cb 0.26 -0.84 0.13 0.00 -1.06 0.00 0.00 33.84 32.32 1cm5 n VAL 573 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 1cm5 h ASP 574 N 0.00 1.01 0.54 6.55 5.19 -1.35 -2.04 116.42 126.32 1cm5 h ASP 574 Ca -0.48 -0.11 -0.02 0.00 -0.62 0.00 0.00 57.03 55.80 1cm5 h ASP 574 Cb 1.94 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 41.19 1cm5 h ASP 574 CO -0.02 0.85 -0.09 0.44 -3.12 0.00 0.00 179.24 177.30 1cm5 h ASP 575 N 1.11 0.00 0.16 6.45 5.19 -1.42 -1.60 116.42 126.31 1cm5 h ASP 575 Ca 0.27 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.40 1cm5 h ASP 575 Cb 0.10 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.64 1cm5 h ASP 575 CO -0.04 0.09 -1.14 -0.07 -3.12 0.00 0.00 179.24 174.97 1cm5 h LEU 576 N 0.00 0.80 -0.14 1.55 3.38 -1.58 -1.73 115.31 117.60 1cm5 h LEU 576 Ca -0.00 -0.70 -0.02 0.00 0.09 0.00 0.00 57.88 57.25 1cm5 h LEU 576 Cb 0.39 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1cm5 h LEU 576 CO 0.01 1.51 0.01 0.00 0.09 0.00 0.00 178.44 180.07 1cm5 h ALA 577 N 0.42 0.19 -0.84 1.53 0.00 -1.21 -0.94 119.26 118.40 1cm5 h ALA 577 Ca -0.15 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.61 1cm5 h ALA 577 Cb 1.81 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 19.50 1cm5 h ALA 577 CO 0.22 -0.14 0.54 0.28 0.00 0.00 0.00 179.25 180.15 1cm5 h VAL 578 N -0.00 1.15 -0.43 0.00 2.07 -1.37 -2.03 116.25 115.64 1cm5 h VAL 578 Ca 0.04 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1cm5 h VAL 578 Cb 0.33 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 1cm5 h VAL 578 CO 0.00 0.20 0.18 -0.78 0.02 0.00 0.00 177.57 177.19 1cm5 h ASP 579 N 1.07 0.59 -0.54 0.57 3.58 -1.10 -2.27 116.42 118.31 1cm5 h ASP 579 Ca 0.33 -0.16 0.01 0.00 0.42 0.00 0.00 57.03 57.62 1cm5 h ASP 579 Cb -0.03 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 40.84 1cm5 h ASP 579 CO -0.10 0.59 0.36 -0.07 -2.88 0.00 0.00 179.24 177.13 1cm5 h LEU 580 N 0.55 0.62 -0.73 2.28 3.38 -0.70 0.13 115.31 120.84 1cm5 h LEU 580 Ca 0.14 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1cm5 h LEU 580 Cb 0.18 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 1cm5 h LEU 580 CO -0.01 0.45 0.47 0.58 0.09 0.00 0.00 178.44 180.02 1cm5 h VAL 581 N 0.73 1.13 -0.35 1.22 2.07 -1.26 -2.18 116.25 117.61 1cm5 h VAL 581 Ca 0.20 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 67.34 1cm5 h VAL 581 Cb -0.08 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.80 1cm5 h VAL 581 CO -0.05 0.17 -0.01 -0.33 0.02 0.00 0.00 177.57 177.38 1cm5 h GLU 582 N 0.93 0.63 0.33 1.57 5.08 -0.81 -2.87 114.58 119.45 1cm5 h GLU 582 Ca 0.28 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 1cm5 h GLU 582 Cb -0.03 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1cm5 h GLU 582 CO -0.09 0.75 -0.20 0.00 -1.00 0.00 0.00 179.01 178.47 1cm5 h ARG 583 N 0.44 -0.49 -0.87 2.33 3.08 -0.32 -2.23 114.38 116.32 1cm5 h ARG 583 Ca 0.10 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 1cm5 h ARG 583 Cb 0.47 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1cm5 h ARG 583 CO 0.02 -0.32 0.49 0.35 -1.07 0.00 0.00 179.97 179.44 1cm5 h PHE 584 N -0.51 1.18 -0.37 3.04 3.57 -1.49 -2.50 116.94 119.86 1cm5 h PHE 584 Ca -0.04 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.46 1cm5 h PHE 584 Cb 0.41 -0.38 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 1cm5 h PHE 584 CO -0.08 0.81 0.22 1.98 -2.23 0.00 0.00 178.31 179.01 1cm5 h MET 585 N 1.22 0.44 0.00 1.11 4.05 -1.35 -1.57 114.93 118.83 1cm5 h MET 585 Ca 0.31 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.68 1cm5 h MET 585 Cb 0.00 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 30.70 1cm5 h MET 585 CO -0.05 0.29 -0.13 0.87 0.23 0.00 0.00 176.91 178.12 1cm5 h LYS 586 N 0.46 0.00 0.01 0.39 1.57 -1.14 -2.20 116.57 115.66 1cm5 h LYS 586 Ca 0.15 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1cm5 h LYS 586 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1cm5 h LYS 586 CO -0.06 0.13 -0.00 0.87 -0.57 0.00 0.00 179.45 179.81 1cm5 h LYS 587 N 0.00 -0.01 0.00 3.15 1.57 -0.88 -3.31 116.57 117.09 1cm5 h LYS 587 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1cm5 h LYS 587 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1cm5 h LYS 587 CO 0.02 0.80 -0.15 -0.84 -0.57 0.00 0.00 179.45 178.70 1cm5 h ILE 588 N -0.94 0.67 0.00 1.86 3.07 -1.32 -2.73 117.51 118.11 1cm5 h ILE 588 Ca -0.00 -0.63 -0.01 0.00 1.55 0.00 0.00 64.86 65.77 1cm5 h ILE 588 Cb 0.82 1.39 -0.00 0.00 -0.27 0.00 0.00 36.82 38.76 1cm5 h ILE 588 CO 0.00 0.15 -0.05 -0.61 -1.05 0.00 0.00 178.15 176.59 1cm5 h GLN 589 N 0.00 0.00 -0.00 0.16 4.15 -1.48 -2.54 115.11 115.40 1cm5 h GLN 589 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1cm5 h GLN 589 Cb 0.38 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1cm5 h GLN 589 CO 0.02 0.05 -0.29 1.63 -1.93 0.00 0.00 178.83 178.31 1cm5 n LYS 590 N -4.18 0.34 -3.40 1.69 5.02 -1.03 -4.93 118.16 111.66 1cm5 n LYS 590 Ca -0.03 -0.16 -0.35 0.00 -2.02 0.00 0.00 58.31 55.75 1cm5 n LYS 590 Cb 0.13 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 1cm5 n LYS 590 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cm5 s LEU 591 N -2.78 4.35 0.33 -0.35 1.43 -0.96 -5.06 118.68 115.65 1cm5 s LEU 591 Ca 0.18 1.02 -0.28 0.00 -1.03 0.00 0.00 54.13 54.03 1cm5 s LEU 591 Cb 0.19 -3.17 -0.10 0.00 0.03 0.00 0.00 46.19 43.14 1cm5 s LEU 591 CO 0.59 0.13 1.20 -1.00 0.23 0.00 0.00 176.35 177.50 1cm5 s HIS 592 N -1.42 3.23 0.12 0.29 3.76 -1.26 -4.97 115.29 115.04 1cm5 s HIS 592 Ca 0.36 1.54 0.07 0.00 -0.15 0.00 0.00 55.06 56.88 1cm5 s HIS 592 Cb -0.15 -3.48 -0.04 0.00 1.11 0.00 0.00 32.58 30.02 1cm5 s HIS 592 CO 0.19 -1.29 -0.16 0.95 -0.85 0.00 0.00 174.74 173.58 1cm5 s THR 593 N -1.21 1.45 0.31 1.30 -4.23 -1.26 -4.94 115.64 107.06 1cm5 s THR 593 Ca 0.49 -1.68 -0.30 0.00 -1.18 0.00 0.00 61.69 59.03 1cm5 s THR 593 Cb -0.35 -1.54 -0.11 0.00 1.34 0.00 0.00 72.50 71.84 1cm5 s THR 593 CO 0.46 -0.32 1.59 -0.47 -0.54 0.00 0.00 174.62 175.33 1cm5 s TYR 594 N -1.87 2.70 -1.28 3.99 6.14 -1.26 -1.86 117.35 123.91 1cm5 s TYR 594 Ca 0.09 0.82 0.00 0.00 0.64 0.00 0.00 57.07 58.62 1cm5 s TYR 594 Cb -0.06 -4.08 0.00 0.00 0.42 0.00 0.00 41.96 38.23 1cm5 s TYR 594 CO 0.04 -3.57 0.00 -2.13 0.64 0.00 0.00 175.55 170.52 1cm5 n ARG 595 N 1.89 -1.64 -3.20 4.97 0.63 -1.26 -2.09 116.66 115.97 1cm5 n ARG 595 Ca 0.07 0.72 -0.23 0.00 -0.92 0.00 0.00 57.85 57.49 1cm5 n ARG 595 Cb 0.37 -5.10 0.03 0.00 0.45 0.00 0.00 32.46 28.21 1cm5 n ARG 595 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1cm5 n ASP 596 N -1.01 -5.45 -4.70 6.15 8.00 -0.78 -4.93 116.55 113.84 1cm5 n ASP 596 Ca -0.14 -0.36 -0.42 0.00 0.71 0.00 0.00 54.79 54.58 1cm5 n ASP 596 Cb 0.50 -4.41 -0.03 0.00 -0.02 0.00 0.00 41.12 37.16 1cm5 n ASP 596 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cm5 s ALA 597 N -3.13 3.65 -0.22 2.24 0.00 -0.89 -4.93 121.76 118.49 1cm5 s ALA 597 Ca 0.37 1.11 -0.29 0.00 0.00 0.00 0.00 51.96 53.15 1cm5 s ALA 597 Cb -0.17 -3.63 -0.03 0.00 0.00 0.00 0.00 23.12 19.29 1cm5 s ALA 597 CO 0.46 -0.94 1.60 0.42 0.00 0.00 0.00 175.76 177.30 1cm5 s ILE 598 N 2.17 3.72 0.24 0.00 1.01 -0.76 -4.23 121.20 123.34 1cm5 s ILE 598 Ca 0.69 0.81 -0.31 0.00 0.00 0.00 0.00 60.65 61.84 1cm5 s ILE 598 Cb -0.37 -3.72 -0.11 0.00 0.01 0.00 0.00 42.46 38.27 1cm5 s ILE 598 CO 0.30 -0.29 1.56 -2.16 0.00 0.00 0.00 174.94 174.35 1cm5 s PRO 599 N 4.62 4.19 0.23 2.79 0.04 -1.26 -0.79 135.00 144.82 1cm5 s PRO 599 Ca 0.71 2.44 0.03 0.00 0.04 0.00 0.00 61.00 64.23 1cm5 s PRO 599 Cb -0.25 -3.09 -0.05 0.00 0.04 0.00 0.00 34.50 31.15 1cm5 s PRO 599 CO 0.29 -0.58 -0.00 0.95 0.04 0.00 0.00 177.00 177.69 1cm5 s THR 600 N 0.45 1.02 0.13 1.26 -4.23 -0.39 -4.82 115.64 109.07 1cm5 s THR 600 Ca 0.65 -2.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.20 1cm5 s THR 600 Cb -0.45 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 1cm5 s THR 600 CO 0.40 -0.33 -0.16 -1.58 -0.54 0.00 0.00 174.62 172.41 1cm5 s GLN 601 N -3.86 1.12 -0.06 3.99 0.74 -1.26 -0.55 119.66 119.78 1cm5 s GLN 601 Ca 0.28 -1.28 -0.05 0.00 0.05 0.00 0.00 55.36 54.36 1cm5 s GLN 601 Cb 0.06 -1.11 0.02 0.00 1.10 0.00 0.00 33.01 33.07 1cm5 s GLN 601 CO 0.08 0.23 0.15 -1.54 -0.55 0.00 0.00 175.29 173.66 1cm5 s SER 602 N -2.44 -0.15 -1.05 6.67 1.04 -0.37 -0.22 113.70 117.18 1cm5 s SER 602 Ca 0.11 0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.72 1cm5 s SER 602 Cb -0.06 0.28 0.25 0.00 0.10 0.00 0.00 66.02 66.58 1cm5 s SER 602 CO 0.04 -0.07 1.07 -0.69 0.98 0.00 0.00 173.24 174.57 1cm5 s VAL 603 N 0.29 5.74 0.01 5.02 1.01 -0.56 -0.80 120.40 131.11 1cm5 s VAL 603 Ca -0.02 -3.02 -0.02 0.00 0.00 0.00 0.00 61.98 58.92 1cm5 s VAL 603 Cb -0.03 -4.62 -0.01 0.00 0.00 0.00 0.00 36.38 31.72 1cm5 s VAL 603 CO -0.01 -1.21 0.02 -0.22 0.00 0.00 0.00 175.10 173.67 1cm5 s LEU 604 N -0.42 2.00 0.00 3.92 2.96 -1.22 -2.18 118.68 123.74 1cm5 s LEU 604 Ca 0.29 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 1cm5 s LEU 604 Cb -0.09 0.20 0.00 0.00 0.50 0.00 0.00 46.19 46.80 1cm5 s LEU 604 CO -0.07 -0.21 0.00 0.35 -1.32 0.00 0.00 176.35 175.09 1cm5 n THR 605 N 2.08 0.00 -4.88 3.68 -2.24 -1.26 -4.22 114.28 107.45 1cm5 n THR 605 Ca -0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1cm5 n THR 605 Cb 0.57 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1cm5 n THR 605 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1cm5 n ILE 606 N -1.33 0.00 1.90 2.28 2.08 -1.26 -1.76 119.36 121.26 1cm5 n ILE 606 Ca 0.00 0.00 0.03 0.00 0.56 0.00 0.00 62.75 63.34 1cm5 n ILE 606 Cb 0.15 0.00 0.16 0.00 -0.75 0.00 0.00 39.64 39.20 1cm5 n ILE 606 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 1cm5 n THR 607 N 0.00 0.04 0.30 1.39 -1.04 -0.75 -3.47 114.28 110.75 1cm5 n THR 607 Ca 0.00 -0.04 0.18 0.00 -2.04 0.00 0.00 64.05 62.15 1cm5 n THR 607 Cb 0.00 -0.05 0.83 0.00 -1.82 0.00 0.00 70.33 69.30 1cm5 n THR 607 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1cm5 h SER 608 N 0.20 0.00 -0.52 8.00 0.02 -1.40 -1.67 113.55 118.19 1cm5 h SER 608 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1cm5 h SER 608 Cb 0.05 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1cm5 h SER 608 CO 0.00 0.00 0.29 -0.55 -1.14 0.00 0.00 176.83 175.43 1cm5 h ASN 609 N 0.00 0.67 0.00 3.07 -1.07 -1.76 0.15 115.58 116.65 1cm5 h ASN 609 Ca 0.00 -0.05 -0.00 0.00 0.07 0.00 0.00 56.30 56.32 1cm5 h ASN 609 Cb 0.31 -0.17 0.00 0.00 -2.07 0.00 0.00 38.32 36.39 1cm5 h ASN 609 CO 0.00 0.55 -0.00 0.58 0.07 0.00 0.00 177.43 178.63 1cm5 h VAL 610 N 0.76 1.65 0.21 6.14 2.07 -1.59 0.15 116.25 125.65 1cm5 h VAL 610 Ca 0.19 -2.06 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 1cm5 h VAL 610 Cb 0.04 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1cm5 h VAL 610 CO -0.03 0.53 -0.10 0.58 0.02 0.00 0.00 177.57 178.57 1cm5 h VAL 611 N -0.90 0.81 -0.58 2.57 2.07 -1.33 0.02 116.25 118.91 1cm5 h VAL 611 Ca -0.00 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 1cm5 h VAL 611 Cb 0.87 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1cm5 h VAL 611 CO 0.00 0.02 0.08 1.88 0.02 0.00 0.00 177.57 179.57 1cm5 h TYR 612 N -0.32 0.99 -0.94 1.57 0.99 -0.87 -2.42 116.97 115.96 1cm5 h TYR 612 Ca -0.03 -0.13 0.01 0.00 2.00 0.00 0.00 58.73 60.58 1cm5 h TYR 612 Cb 0.25 -0.28 -0.05 0.00 1.00 0.00 0.00 36.73 37.66 1cm5 h TYR 612 CO -0.05 0.85 0.61 0.78 -0.00 0.00 0.00 178.16 180.36 1cm5 h GLY 613 N 1.01 1.33 2.00 3.88 0.00 -1.25 -0.26 103.07 109.78 1cm5 h GLY 613 Ca 0.18 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 46.94 1cm5 h GLY 613 CO 0.01 0.50 -0.29 1.70 0.00 0.00 0.00 176.54 178.46 1cm5 h LYS 614 N 1.28 0.00 -0.24 4.80 3.64 -0.62 -2.62 116.57 122.82 1cm5 h LYS 614 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1cm5 h LYS 614 Cb -0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1cm5 h LYS 614 CO -0.07 0.29 0.00 1.63 -2.27 0.00 0.00 179.45 179.03 1cm5 n LYS 615 N -4.13 2.31 -4.52 1.90 5.02 -0.63 -4.33 118.16 113.78 1cm5 n LYS 615 Ca -0.02 -1.96 -0.33 0.00 -2.02 0.00 0.00 58.31 53.98 1cm5 n LYS 615 Cb 0.34 -1.48 -0.13 0.00 -0.02 0.00 0.00 35.03 33.74 1cm5 n LYS 615 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1cm5 s THR 616 N -1.71 3.67 0.00 -0.18 2.01 -0.20 -4.87 115.64 114.36 1cm5 s THR 616 Ca 0.35 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.90 1cm5 s THR 616 Cb 0.21 -2.58 0.00 0.00 0.01 0.00 0.00 72.50 70.14 1cm5 s THR 616 CO 0.31 0.51 0.00 0.61 -0.69 0.00 0.00 174.62 175.36 1cm5 n GLY 617 N 3.40 -1.86 3.71 4.40 0.00 -1.26 -2.02 105.19 111.56 1cm5 n GLY 617 Ca -0.18 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 1cm5 n GLY 617 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1cm5 n ASN 618 N -2.97 2.81 -4.43 1.61 3.02 -1.26 -4.38 115.26 109.67 1cm5 n ASN 618 Ca 0.00 1.19 -0.26 0.00 -0.03 0.00 0.00 54.58 55.48 1cm5 n ASN 618 Cb 0.00 -1.50 -0.12 0.00 -0.61 0.00 0.00 39.78 37.55 1cm5 n ASN 618 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1cm5 s THR 619 N -1.12 2.36 0.58 3.41 -4.23 -0.94 -4.77 115.64 110.93 1cm5 s THR 619 Ca 0.56 -2.07 0.30 0.00 -1.18 0.00 0.00 61.69 59.30 1cm5 s THR 619 Cb -0.55 -2.14 0.42 0.00 1.34 0.00 0.00 72.50 71.57 1cm5 s THR 619 CO 0.62 -0.15 1.82 -0.65 -0.54 0.00 0.00 174.62 175.72 1cm5 h PRO 620 N 3.10 0.00 0.00 3.99 0.11 -1.89 -0.14 132.00 137.16 1cm5 h PRO 620 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1cm5 h PRO 620 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1cm5 h PRO 620 CO 0.49 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 1cm5 n ASP 621 N -3.80 0.13 0.00 -2.05 3.85 -1.26 -4.79 116.55 108.63 1cm5 n ASP 621 Ca 0.14 0.52 0.00 0.00 -0.71 0.00 0.00 54.79 54.74 1cm5 n ASP 621 Cb 0.88 -0.56 0.00 0.00 -1.35 0.00 0.00 41.12 40.09 1cm5 n ASP 621 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1cm5 n GLY 622 N 0.57 0.44 3.73 6.12 0.00 -0.07 -4.90 105.19 111.08 1cm5 n GLY 622 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1cm5 n GLY 622 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cm5 s ARG 623 N -0.71 4.17 0.54 1.61 3.52 -1.25 -4.87 118.95 121.96 1cm5 s ARG 623 Ca 0.00 2.48 -0.16 0.00 -0.13 0.00 0.00 55.73 57.92 1cm5 s ARG 623 Cb 0.00 -3.09 -0.06 0.00 -1.56 0.00 0.00 34.95 30.24 1cm5 s ARG 623 CO 0.00 -0.62 1.01 1.03 -0.81 0.00 0.00 175.30 175.91 1cm5 s ARG 624 N 0.38 3.73 0.33 5.12 1.81 -1.26 -2.21 118.95 126.86 1cm5 s ARG 624 Ca 0.67 1.04 -0.29 0.00 -1.72 0.00 0.00 55.73 55.44 1cm5 s ARG 624 Cb -0.46 -2.10 -0.11 0.00 -0.45 0.00 0.00 34.95 31.82 1cm5 s ARG 624 CO 0.39 -0.46 1.51 0.00 -0.68 0.00 0.00 175.30 176.06 1cm5 n ALA 625 N -1.73 2.30 -0.05 2.13 0.00 -1.26 -2.36 120.51 119.53 1cm5 n ALA 625 Ca 0.07 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1cm5 n ALA 625 Cb 0.54 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1cm5 n ALA 625 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1cm5 n GLY 626 N 1.25 2.28 3.76 0.00 0.00 -0.86 -4.93 105.19 106.70 1cm5 n GLY 626 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1cm5 n GLY 626 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cm5 s ALA 627 N -2.85 3.35 0.55 4.61 0.00 -1.00 -3.62 121.76 122.80 1cm5 s ALA 627 Ca 0.00 0.77 -0.22 0.00 0.00 0.00 0.00 51.96 52.51 1cm5 s ALA 627 Cb 0.00 -3.27 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1cm5 s ALA 627 CO 0.00 -0.02 1.34 -2.14 0.00 0.00 0.00 175.76 174.95 1cm5 s PRO 628 N -1.46 3.15 0.85 0.00 0.02 -1.26 -4.32 135.00 131.98 1cm5 s PRO 628 Ca 0.44 2.20 -0.12 0.00 0.02 0.00 0.00 61.00 63.55 1cm5 s PRO 628 Cb -0.28 -2.25 0.14 0.00 0.02 0.00 0.00 34.50 32.13 1cm5 s PRO 628 CO 0.36 -1.17 1.20 -0.06 -0.33 0.00 0.00 177.00 177.00 1cm5 s PHE 629 N -1.32 2.13 0.50 6.54 0.08 0.51 -4.91 117.98 121.50 1cm5 s PHE 629 Ca 0.72 0.36 -0.19 0.00 0.12 0.00 0.00 56.93 57.94 1cm5 s PHE 629 Cb -0.40 -3.68 -0.08 0.00 -0.57 0.00 0.00 43.02 38.29 1cm5 s PHE 629 CO 0.47 -2.13 1.02 0.20 -0.10 0.00 0.00 175.22 174.68 1cm5 s GLY 630 N -4.74 2.36 0.16 4.36 0.00 -1.26 -4.68 107.32 103.51 1cm5 s GLY 630 Ca 0.68 0.48 -0.30 0.00 0.00 0.00 0.00 44.72 45.57 1cm5 s GLY 630 CO 0.50 0.79 1.28 2.56 0.00 0.00 0.00 173.10 178.23 1cm5 s PRO 631 N -3.50 4.40 5.19 2.90 0.04 -1.26 -4.70 135.00 138.07 1cm5 s PRO 631 Ca 0.65 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.67 1cm5 s PRO 631 Cb -0.14 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1cm5 s PRO 631 CO 0.24 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.44 1cm5 n GLY 632 N 2.66 3.51 1.25 0.56 0.00 -1.26 -1.15 105.19 110.75 1cm5 n GLY 632 Ca 0.07 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.33 1cm5 n GLY 632 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cm5 n ALA 633 N 11.48 2.66 -1.52 4.61 0.00 0.92 -4.59 120.51 134.08 1cm5 n ALA 633 Ca 0.00 -1.19 -0.34 0.00 0.00 0.00 0.00 53.44 51.91 1cm5 n ALA 633 Cb 0.00 -0.98 0.06 0.00 0.00 0.00 0.00 19.45 18.53 1cm5 n ALA 633 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1cm5 s ASN 634 N -0.93 4.82 0.70 0.00 -0.87 -0.30 -4.86 114.94 113.51 1cm5 s ASN 634 Ca 0.42 2.22 -0.12 0.00 -1.57 0.00 0.00 52.86 53.81 1cm5 s ASN 634 Cb 0.24 -2.58 0.02 0.00 -0.02 0.00 0.00 41.25 38.91 1cm5 s ASN 634 CO 0.25 -1.83 1.08 -2.84 -2.57 0.00 0.00 177.10 171.19 1cm5 s PRO 635 N -3.82 2.75 0.65 -0.60 0.02 -1.26 -4.48 135.00 128.26 1cm5 s PRO 635 Ca 0.72 1.15 -0.18 0.00 0.02 0.00 0.00 61.00 62.71 1cm5 s PRO 635 Cb -0.26 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.29 1cm5 s PRO 635 CO 0.40 -1.26 1.29 -1.64 -0.33 0.00 0.00 177.00 175.46 1cm5 s MET 636 N -4.66 2.56 -0.49 5.54 -1.94 -1.26 -4.71 119.30 114.33 1cm5 s MET 636 Ca 0.62 2.06 -0.47 0.00 -1.71 0.00 0.00 55.69 56.19 1cm5 s MET 636 Cb -0.17 -1.85 -0.20 0.00 2.01 0.00 0.00 34.83 34.63 1cm5 s MET 636 CO 0.50 -1.59 1.61 0.72 -0.01 0.00 0.00 175.02 176.25 1cm5 n HIS 637 N -1.89 1.76 -0.52 -0.03 -0.00 -1.26 -1.45 115.22 111.82 1cm5 n HIS 637 Ca 0.16 1.13 0.00 0.00 -0.00 0.00 0.00 57.72 59.01 1cm5 n HIS 637 Cb 0.48 -2.24 0.00 0.00 -0.00 0.00 0.00 29.99 28.23 1cm5 n HIS 637 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1cm5 n GLY 638 N 4.06 1.00 0.14 -1.41 0.00 -1.26 -4.88 105.19 102.84 1cm5 n GLY 638 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1cm5 n GLY 638 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1cm5 h ARG 639 N 1.56 0.00 -5.98 1.61 3.08 -1.58 -3.40 114.38 109.68 1cm5 h ARG 639 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1cm5 h ARG 639 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 1cm5 h ARG 639 CO 0.00 0.59 0.88 0.16 -1.07 0.00 0.00 179.97 180.53 1cm5 s ASP 640 N -6.70 6.19 -0.02 7.04 -4.77 -1.26 -4.83 116.67 112.32 1cm5 s ASP 640 Ca -0.00 -0.73 0.09 0.00 -3.30 0.00 0.00 52.55 48.61 1cm5 s ASP 640 Cb 0.12 -2.50 0.26 0.00 -1.09 0.00 0.00 42.92 39.70 1cm5 s ASP 640 CO 0.75 -1.66 1.21 0.00 0.70 0.00 0.00 175.17 176.17 1cm5 n GLN 641 N 8.67 2.87 -0.98 2.11 6.02 -1.26 -4.67 117.38 130.13 1cm5 n GLN 641 Ca 0.02 -2.02 -0.08 0.00 -0.01 0.00 0.00 57.00 54.90 1cm5 n GLN 641 Cb 0.48 -1.27 0.26 0.00 1.02 0.00 0.00 30.24 30.72 1cm5 n GLN 641 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1cm5 n LYS 642 N 0.16 3.02 0.00 -1.09 5.02 -1.26 -5.07 118.16 118.94 1cm5 n LYS 642 Ca 0.10 -3.07 0.00 0.00 -2.02 0.00 0.00 58.31 53.32 1cm5 n LYS 642 Cb 0.44 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.33 1cm5 n LYS 642 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1cm5 n GLY 643 N -0.57 -0.88 0.49 0.72 0.00 -1.26 -4.26 105.19 99.42 1cm5 n GLY 643 Ca 0.42 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.57 1cm5 n GLY 643 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cm5 h ALA 644 N 0.00 -1.17 -0.98 4.61 0.00 -1.13 -2.67 119.26 117.92 1cm5 h ALA 644 Ca 0.00 -0.24 0.21 0.00 0.00 0.00 0.00 54.91 54.88 1cm5 h ALA 644 Cb 0.00 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 18.25 1cm5 h ALA 644 CO 0.00 -1.17 0.62 0.28 0.00 0.00 0.00 179.25 178.98 1cm5 h VAL 645 N -1.13 0.67 0.14 0.00 2.07 -1.80 0.55 116.25 116.76 1cm5 h VAL 645 Ca -0.10 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1cm5 h VAL 645 Cb 0.90 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1cm5 h VAL 645 CO 0.11 0.11 -0.07 0.00 0.02 0.00 0.00 177.57 177.74 1cm5 h ALA 646 N 1.63 -0.19 -0.70 1.67 0.00 -1.72 -1.85 119.26 118.10 1cm5 h ALA 646 Ca 0.55 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 1cm5 h ALA 646 Cb 1.07 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1cm5 h ALA 646 CO -0.31 -0.41 0.17 0.66 0.00 0.00 0.00 179.25 179.36 1cm5 h SER 647 N -0.60 1.06 -0.66 0.00 4.64 -1.08 -2.24 113.55 114.67 1cm5 h SER 647 Ca -0.02 -0.23 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 1cm5 h SER 647 Cb 0.46 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 1cm5 h SER 647 CO 0.03 1.02 0.29 -0.07 -0.87 0.00 0.00 176.83 177.23 1cm5 h LEU 648 N 1.06 0.91 -0.67 5.97 3.38 -0.95 -2.49 115.31 122.53 1cm5 h LEU 648 Ca 0.22 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 1cm5 h LEU 648 Cb 0.38 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1cm5 h LEU 648 CO 0.00 0.80 -0.11 0.74 0.09 0.00 0.00 178.44 179.96 1cm5 h THR 649 N 0.98 1.26 -0.11 0.22 2.02 -0.98 -1.09 112.91 115.21 1cm5 h THR 649 Ca 0.23 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.17 1cm5 h THR 649 Cb 0.16 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.56 1cm5 h THR 649 CO -0.02 0.43 0.04 0.28 0.37 0.00 0.00 175.52 176.61 1cm5 h SER 650 N 0.83 0.16 -0.68 4.18 0.02 -1.06 -2.44 113.55 114.57 1cm5 h SER 650 Ca 0.13 -0.19 -0.05 0.00 -0.84 0.00 0.00 61.79 60.84 1cm5 h SER 650 Cb 0.64 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 1cm5 h SER 650 CO 0.04 0.31 0.21 0.58 -1.14 0.00 0.00 176.83 176.84 1cm5 h VAL 651 N -0.00 1.25 0.00 2.27 2.07 -1.41 -2.41 116.25 118.02 1cm5 h VAL 651 Ca 0.04 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.68 1cm5 h VAL 651 Cb 0.21 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1cm5 h VAL 651 CO -0.00 0.34 -0.04 0.00 0.02 0.00 0.00 177.57 177.88 1cm5 h ALA 652 N 1.09 1.49 0.00 1.67 0.00 -1.09 -1.40 119.26 121.02 1cm5 h ALA 652 Ca 0.22 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1cm5 h ALA 652 Cb 0.30 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1cm5 h ALA 652 CO -0.01 0.05 -0.31 0.87 0.00 0.00 0.00 179.25 179.86 1cm5 h LYS 653 N 0.00 0.00 -6.48 0.00 1.57 -0.93 -3.37 116.57 107.36 1cm5 h LYS 653 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1cm5 h LYS 653 Cb 0.11 0.00 0.05 0.00 0.08 0.00 0.00 32.23 32.47 1cm5 h LYS 653 CO 0.01 0.31 0.97 1.28 -0.57 0.00 0.00 179.45 181.44 1cm5 n LEU 654 N -3.90 3.54 -4.58 2.94 4.77 -0.53 -4.90 117.00 114.34 1cm5 n LEU 654 Ca -0.02 1.03 -0.42 0.00 -0.03 0.00 0.00 56.01 56.58 1cm5 n LEU 654 Cb 0.38 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 39.98 1cm5 n LEU 654 CO 0.36 -0.06 1.39 -2.16 -1.33 0.00 0.00 177.39 175.60 1cm5 s PRO 655 N 2.09 3.23 0.46 3.23 0.04 -1.26 -4.87 135.00 137.92 1cm5 s PRO 655 Ca 0.82 0.83 0.21 0.00 0.04 0.00 0.00 61.00 62.90 1cm5 s PRO 655 Cb -0.61 -4.18 1.13 0.00 0.04 0.00 0.00 34.50 30.89 1cm5 s PRO 655 CO 0.40 -2.01 1.97 0.35 0.04 0.00 0.00 177.00 177.75 1cm5 h PHE 656 N 12.26 0.00 0.00 0.56 3.57 -1.89 -1.10 116.94 130.34 1cm5 h PHE 656 Ca -0.28 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.22 1cm5 h PHE 656 Cb 1.13 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.87 1cm5 h PHE 656 CO 1.00 0.21 0.00 0.00 -2.23 0.00 0.00 178.31 177.29 1cm5 h ALA 657 N 1.79 1.00 -0.08 2.41 0.00 -2.00 -0.94 119.26 121.45 1cm5 h ALA 657 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1cm5 h ALA 657 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1cm5 h ALA 657 CO 0.03 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.94 1cm5 n TYR 658 N -2.96 0.10 -3.09 0.00 4.02 -0.46 -4.70 117.16 110.08 1cm5 n TYR 658 Ca -0.02 -0.26 -0.16 0.00 -0.01 0.00 0.00 57.90 57.44 1cm5 n TYR 658 Cb 0.12 -0.02 -0.01 0.00 -0.02 0.00 0.00 39.34 39.42 1cm5 n TYR 658 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1cm5 n ALA 659 N 0.08 1.40 0.25 -0.72 0.00 -0.40 -4.49 120.51 116.63 1cm5 n ALA 659 Ca 0.04 -2.98 0.17 0.00 0.00 0.00 0.00 53.44 50.67 1cm5 n ALA 659 Cb 0.22 -0.98 0.88 0.00 0.00 0.00 0.00 19.45 19.58 1cm5 n ALA 659 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1cm5 h LYS 660 N 3.05 0.00 -0.04 0.00 6.56 -1.25 -1.23 116.57 123.67 1cm5 h LYS 660 Ca 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 1cm5 h LYS 660 Cb 0.99 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.65 1cm5 h LYS 660 CO 0.42 0.00 0.00 -3.47 -2.06 0.00 0.00 179.45 174.34 1cm5 n ASP 661 N -2.66 0.73 0.00 0.86 4.64 0.69 -4.64 116.55 116.17 1cm5 n ASP 661 Ca -0.02 -1.36 0.00 0.00 -1.38 0.00 0.00 54.79 52.03 1cm5 n ASP 661 Cb 0.06 -0.02 0.00 0.00 -1.04 0.00 0.00 41.12 40.12 1cm5 n ASP 661 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1cm5 n GLY 662 N 1.03 2.74 2.77 0.27 0.00 -0.46 -3.69 105.19 107.84 1cm5 n GLY 662 Ca 0.19 -1.85 -0.28 0.00 0.00 0.00 0.00 46.02 44.07 1cm5 n GLY 662 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1cm5 s ILE 663 N -2.55 0.73 -0.03 -0.61 1.01 -1.26 -1.49 121.20 117.00 1cm5 s ILE 663 Ca 0.00 -0.80 -0.21 0.00 0.00 0.00 0.00 60.65 59.65 1cm5 s ILE 663 Cb 0.00 -1.25 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 1cm5 s ILE 663 CO 0.00 -0.27 0.61 -0.55 0.00 0.00 0.00 174.94 174.73 1cm5 s SER 664 N 1.75 6.95 -0.07 3.58 0.15 -0.93 -3.62 113.70 121.51 1cm5 s SER 664 Ca -0.00 1.13 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 1cm5 s SER 664 Cb -0.17 -2.37 0.03 0.00 -1.71 0.00 0.00 66.02 61.80 1cm5 s SER 664 CO -0.11 0.05 0.03 -0.47 1.20 0.00 0.00 173.24 173.94 1cm5 s TYR 665 N 0.10 0.46 -0.49 3.44 5.04 -1.26 -0.05 117.35 124.58 1cm5 s TYR 665 Ca 0.32 -0.06 -0.16 0.00 -2.44 0.00 0.00 57.07 54.73 1cm5 s TYR 665 Cb -0.18 -0.70 0.08 0.00 0.35 0.00 0.00 41.96 41.51 1cm5 s TYR 665 CO 0.17 -0.30 0.46 0.99 -1.34 0.00 0.00 175.55 175.52 1cm5 s THR 666 N 2.04 5.16 -0.25 4.34 2.01 -1.26 -0.84 115.64 126.84 1cm5 s THR 666 Ca 0.05 -1.03 -0.09 0.00 0.31 0.00 0.00 61.69 60.93 1cm5 s THR 666 Cb -0.12 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 1cm5 s THR 666 CO -0.05 -0.68 0.11 0.12 -0.69 0.00 0.00 174.62 173.44 1cm5 s PHE 667 N 1.84 3.16 -0.14 4.92 5.36 -0.70 -4.96 117.98 127.45 1cm5 s PHE 667 Ca 0.06 -0.15 0.02 0.00 -0.96 0.00 0.00 56.93 55.90 1cm5 s PHE 667 Cb -0.24 -2.26 0.01 0.00 -0.34 0.00 0.00 43.02 40.20 1cm5 s PHE 667 CO 0.07 -0.20 -0.19 -1.12 -1.46 0.00 0.00 175.22 172.32 1cm5 s SER 668 N 1.43 2.91 -0.02 6.13 0.01 -1.26 -0.91 113.70 122.00 1cm5 s SER 668 Ca 0.06 -0.56 0.04 0.00 1.31 0.00 0.00 55.95 56.80 1cm5 s SER 668 Cb -0.15 -1.34 -0.01 0.00 0.21 0.00 0.00 66.02 64.73 1cm5 s SER 668 CO 0.05 0.03 -0.14 -0.51 0.41 0.00 0.00 173.24 173.09 1cm5 s ILE 669 N 1.02 1.11 0.32 1.44 2.07 0.54 -0.37 121.20 127.34 1cm5 s ILE 669 Ca -0.03 -0.59 -0.28 0.00 -1.41 0.00 0.00 60.65 58.33 1cm5 s ILE 669 Cb -0.15 -0.94 -0.10 0.00 0.13 0.00 0.00 42.46 41.41 1cm5 s ILE 669 CO -0.05 0.32 1.18 -0.69 -1.91 0.00 0.00 174.94 173.79 1cm5 s VAL 670 N -0.23 3.16 0.21 4.00 1.01 -0.94 -1.84 120.40 125.77 1cm5 s VAL 670 Ca 0.03 1.13 -0.16 0.00 0.00 0.00 0.00 61.98 62.98 1cm5 s VAL 670 Cb -0.06 -3.70 0.23 0.00 0.00 0.00 0.00 36.38 32.84 1cm5 s VAL 670 CO -0.00 0.24 1.59 -0.65 0.00 0.00 0.00 175.10 176.28 1cm5 h PRO 671 N 3.43 -0.07 0.00 2.72 0.11 -1.87 -0.47 132.00 135.85 1cm5 h PRO 671 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1cm5 h PRO 671 Cb 1.22 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1cm5 h PRO 671 CO 0.66 -0.04 -0.01 -0.91 -0.21 0.00 0.00 178.00 177.48 1cm5 h ASN 672 N -0.07 0.00 0.76 -2.05 2.35 -1.93 -1.62 115.58 113.02 1cm5 h ASN 672 Ca 0.31 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.00 1cm5 h ASN 672 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1cm5 h ASN 672 CO -0.77 0.01 -0.27 0.00 -1.65 0.00 0.00 177.43 174.75 1cm5 h ALA 673 N 1.99 1.08 0.00 -0.83 0.00 -1.33 -2.95 119.26 117.22 1cm5 h ALA 673 Ca -0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1cm5 h ALA 673 Cb 0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1cm5 h ALA 673 CO 0.00 0.34 -0.97 -0.07 0.00 0.00 0.00 179.25 178.55 1cm5 h LEU 674 N 0.00 0.00 0.00 0.00 3.38 -1.34 -3.41 115.31 113.94 1cm5 h LEU 674 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1cm5 h LEU 674 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1cm5 h LEU 674 CO 0.04 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.27 1cm5 n GLY 675 N 1.21 0.07 0.12 0.83 0.00 -1.12 -3.75 105.19 102.54 1cm5 n GLY 675 Ca -0.01 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.68 1cm5 n GLY 675 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cm5 h LYS 676 N 0.00 0.00 -4.32 1.61 1.57 -1.88 -3.37 116.57 110.17 1cm5 h LYS 676 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1cm5 h LYS 676 Cb 0.00 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.16 1cm5 h LYS 676 CO 0.00 0.18 -0.62 0.16 -0.57 0.00 0.00 179.45 178.60 1cm5 s ASP 677 N -5.73 0.32 0.25 0.86 -4.77 -1.26 -5.08 116.67 101.25 1cm5 s ASP 677 Ca -0.00 -1.12 -0.04 0.00 -3.30 0.00 0.00 52.55 48.09 1cm5 s ASP 677 Cb 0.09 0.29 0.42 0.00 -1.09 0.00 0.00 42.92 42.63 1cm5 s ASP 677 CO 0.78 -0.72 1.80 0.44 0.70 0.00 0.00 175.17 178.18 1cm5 h ASP 678 N 2.89 0.67 -0.98 2.11 3.32 -1.99 -1.79 116.42 120.65 1cm5 h ASP 678 Ca -0.35 0.05 0.03 0.00 0.02 0.00 0.00 57.03 56.79 1cm5 h ASP 678 Cb 1.19 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 40.61 1cm5 h ASP 678 CO 0.59 0.37 0.64 -0.33 -1.72 0.00 0.00 179.24 178.80 1cm5 h GLU 679 N 0.78 1.22 -0.26 3.56 4.39 -1.99 0.17 114.58 122.44 1cm5 h GLU 679 Ca 0.41 -0.07 -0.17 0.00 0.34 0.00 0.00 59.36 59.87 1cm5 h GLU 679 Cb 0.41 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1cm5 h GLU 679 CO -0.26 0.81 -0.49 0.28 -1.16 0.00 0.00 179.01 178.19 1cm5 h VAL 680 N 1.26 1.29 -0.24 3.13 2.07 -1.81 -2.63 116.25 119.32 1cm5 h VAL 680 Ca 0.39 -1.68 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1cm5 h VAL 680 Cb -0.02 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1cm5 h VAL 680 CO -0.12 0.54 0.15 0.03 0.02 0.00 0.00 177.57 178.19 1cm5 h ARG 681 N 0.55 0.32 -0.19 1.57 3.08 -0.55 0.16 114.38 119.31 1cm5 h ARG 681 Ca 0.01 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.06 1cm5 h ARG 681 Cb 1.09 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.05 1cm5 h ARG 681 CO 0.11 0.23 0.07 0.87 -1.07 0.00 0.00 179.97 180.18 1cm5 h LYS 682 N 0.31 0.16 -0.44 0.04 1.57 -0.72 0.10 116.57 117.60 1cm5 h LYS 682 Ca 0.09 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1cm5 h LYS 682 Cb -0.02 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1cm5 h LYS 682 CO -0.02 0.11 0.23 1.15 -0.57 0.00 0.00 179.45 180.35 1cm5 h THR 683 N 0.17 1.17 -0.45 -0.16 2.02 -1.23 -1.91 112.91 112.52 1cm5 h THR 683 Ca 0.08 -0.47 -0.12 0.00 0.77 0.00 0.00 66.41 66.67 1cm5 h THR 683 Cb 0.04 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1cm5 h THR 683 CO -0.07 0.19 -0.19 0.78 0.37 0.00 0.00 175.52 176.59 1cm5 h ASN 684 N 0.58 0.95 -0.00 4.18 2.35 -0.40 -1.56 115.58 121.68 1cm5 h ASN 684 Ca 0.15 -0.39 -0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1cm5 h ASN 684 Cb 0.09 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 1cm5 h ASN 684 CO -0.02 1.13 0.00 0.25 -1.65 0.00 0.00 177.43 177.14 1cm5 h LEU 685 N 0.76 0.00 -1.43 1.61 5.85 -0.71 0.14 115.31 121.54 1cm5 h LEU 685 Ca 0.10 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.80 1cm5 h LEU 685 Cb 0.76 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 1cm5 h LEU 685 CO 0.06 0.07 0.43 0.00 -0.34 0.00 0.00 178.44 178.65 1cm5 h ALA 686 N 0.94 1.68 -0.41 1.25 0.00 -1.32 -1.34 119.26 120.06 1cm5 h ALA 686 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1cm5 h ALA 686 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1cm5 h ALA 686 CO -0.00 0.25 -0.18 0.78 0.00 0.00 0.00 179.25 180.10 1cm5 h GLY 687 N 0.74 0.91 0.97 0.00 0.00 -0.54 -0.87 103.07 104.28 1cm5 h GLY 687 Ca 0.26 -0.81 0.01 0.00 0.00 0.00 0.00 47.33 46.80 1cm5 h GLY 687 CO -0.08 0.73 0.35 1.41 0.00 0.00 0.00 176.54 178.96 1cm5 h LEU 688 N 0.65 0.59 -0.76 3.11 3.38 0.24 -2.17 115.31 120.36 1cm5 h LEU 688 Ca 0.09 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1cm5 h LEU 688 Cb 0.73 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1cm5 h LEU 688 CO 0.06 0.43 -0.34 0.24 0.09 0.00 0.00 178.44 178.91 1cm5 h MET 689 N 0.71 0.55 -0.66 1.13 2.86 -1.18 -1.00 114.93 117.34 1cm5 h MET 689 Ca 0.20 -0.25 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 1cm5 h MET 689 Cb -0.06 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.56 1cm5 h MET 689 CO -0.06 0.82 0.26 -0.44 1.06 0.00 0.00 176.91 178.55 1cm5 h ASP 690 N 0.47 0.88 -0.16 1.22 3.32 -0.80 0.11 116.42 121.45 1cm5 h ASP 690 Ca 0.05 -0.12 -0.22 0.00 0.02 0.00 0.00 57.03 56.76 1cm5 h ASP 690 Cb 0.81 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 40.15 1cm5 h ASP 690 CO 0.07 0.78 -0.77 1.23 -1.72 0.00 0.00 179.24 178.84 1cm5 h GLY 691 N 1.03 0.89 0.88 2.75 0.00 -1.13 -0.90 103.07 106.59 1cm5 h GLY 691 Ca 0.22 -1.24 -0.05 0.00 0.00 0.00 0.00 47.33 46.26 1cm5 h GLY 691 CO -0.02 1.11 0.01 -1.82 0.00 0.00 0.00 176.54 175.82 1cm5 h TYR 692 N 0.55 0.57 -0.01 5.60 3.20 -0.87 -3.02 116.97 122.99 1cm5 h TYR 692 Ca -0.05 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.73 1cm5 h TYR 692 Cb 1.40 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 39.52 1cm5 h TYR 692 CO 0.09 0.65 -0.10 1.19 -1.64 0.00 0.00 178.16 178.35 1cm5 n PHE 693 N -4.58 0.00 -1.58 -3.82 0.99 0.37 -1.10 117.46 107.74 1cm5 n PHE 693 Ca -0.03 0.00 -0.55 0.00 -0.00 0.00 0.00 57.45 56.87 1cm5 n PHE 693 Cb 0.25 -0.11 -0.08 0.00 -1.00 0.00 0.00 39.48 38.54 1cm5 n PHE 693 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.76 178.34 1cm5 n HIS 694 N -0.65 1.82 -4.56 1.38 -0.00 -0.35 -4.70 115.22 108.16 1cm5 n HIS 694 Ca 0.16 0.47 -0.33 0.00 0.46 0.00 0.00 57.72 58.47 1cm5 n HIS 694 Cb 0.29 -2.47 -0.13 0.00 -0.12 0.00 0.00 29.99 27.56 1cm5 n HIS 694 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1cm5 s HIS 695 N 5.05 2.94 0.13 1.57 5.04 -1.26 -4.12 115.29 124.63 1cm5 s HIS 695 Ca 1.04 -0.38 -0.04 0.00 -1.54 0.00 0.00 55.06 54.14 1cm5 s HIS 695 Cb -1.04 -1.89 -0.03 0.00 0.04 0.00 0.00 32.58 29.67 1cm5 s HIS 695 CO 0.60 -0.05 0.13 -2.00 -2.34 0.00 0.00 174.74 171.09 1cm5 s GLU 696 N 0.20 0.95 0.57 2.88 2.12 0.58 -4.99 118.70 121.01 1cm5 s GLU 696 Ca -0.04 -1.28 0.31 0.00 0.36 0.00 0.00 54.97 54.31 1cm5 s GLU 696 Cb -0.14 0.29 1.70 0.00 0.26 0.00 0.00 34.13 36.24 1cm5 s GLU 696 CO 0.04 -0.29 2.17 0.00 -0.54 0.00 0.00 175.26 176.63 1cm5 h ALA 697 N 2.79 1.31 -0.00 6.30 0.00 -1.99 -2.39 119.26 125.28 1cm5 h ALA 697 Ca -0.34 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1cm5 h ALA 697 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1cm5 h ALA 697 CO 0.56 0.07 -0.54 -1.13 0.00 0.00 0.00 179.25 178.22 1cm5 n SER 698 N -3.61 0.91 -3.85 0.00 3.41 -1.26 -4.87 113.62 104.35 1cm5 n SER 698 Ca -0.02 -0.95 -0.29 0.00 -0.26 0.00 0.00 58.87 57.34 1cm5 n SER 698 Cb 0.17 0.84 -0.16 0.00 -0.26 0.00 0.00 64.21 64.80 1cm5 n SER 698 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1cm5 s ILE 699 N -2.13 1.14 0.04 -1.33 -1.09 -0.90 -5.04 121.20 111.90 1cm5 s ILE 699 Ca 0.07 -1.06 -0.29 0.00 -2.23 0.00 0.00 60.65 57.14 1cm5 s ILE 699 Cb 0.11 -1.56 -0.17 0.00 -1.58 0.00 0.00 42.46 39.26 1cm5 s ILE 699 CO 0.50 -0.22 1.44 -0.08 -1.23 0.00 0.00 174.94 175.35 1cm5 h GLU 700 N 8.05 -0.66 0.00 2.79 4.81 -1.85 0.17 114.58 127.89 1cm5 h GLU 700 Ca -0.16 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1cm5 h GLU 700 Cb 1.08 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1cm5 h GLU 700 CO 0.40 -0.37 0.00 0.41 -0.73 0.00 0.00 179.01 178.71 1cm5 n GLY 701 N -0.96 0.73 3.80 1.92 0.00 -1.26 -4.52 105.19 104.89 1cm5 n GLY 701 Ca -0.12 -1.89 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1cm5 n GLY 701 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cm5 s GLY 702 N -0.99 1.96 -0.19 -0.02 0.00 -0.26 -4.84 107.32 102.98 1cm5 s GLY 702 Ca 0.00 0.33 0.03 0.00 0.00 0.00 0.00 44.72 45.08 1cm5 s GLY 702 CO 0.00 0.66 -0.14 -0.18 0.00 0.00 0.00 173.10 173.44 1cm5 n GLN 703 N -2.58 0.62 -3.98 2.90 0.00 -1.26 -4.49 117.38 108.58 1cm5 n GLN 703 Ca 0.09 0.10 -0.09 0.00 -0.00 0.00 0.00 57.00 57.10 1cm5 n GLN 703 Cb 0.53 -1.39 -0.10 0.00 0.00 0.00 0.00 30.24 29.28 1cm5 n GLN 703 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1cm5 s HIS 704 N -2.38 0.28 -0.22 3.69 5.04 -1.24 -1.13 115.29 119.32 1cm5 s HIS 704 Ca -0.24 -0.60 -0.05 0.00 -1.54 0.00 0.00 55.06 52.64 1cm5 s HIS 704 Cb 0.06 -0.21 0.11 0.00 0.04 0.00 0.00 32.58 32.59 1cm5 s HIS 704 CO 0.47 -0.27 0.42 -1.17 -2.34 0.00 0.00 174.74 171.85 1cm5 s LEU 705 N -1.87 -0.70 0.05 8.88 2.96 0.91 -4.17 118.68 124.73 1cm5 s LEU 705 Ca -0.09 0.72 -0.22 0.00 -0.22 0.00 0.00 54.13 54.31 1cm5 s LEU 705 Cb -0.04 1.34 -0.06 0.00 0.50 0.00 0.00 46.19 47.93 1cm5 s LEU 705 CO -0.03 -0.26 0.67 0.20 -1.32 0.00 0.00 176.35 175.61 1cm5 s ASN 706 N 2.61 7.12 -0.22 3.68 0.01 -0.02 -0.63 114.94 127.50 1cm5 s ASN 706 Ca 0.05 1.34 0.01 0.00 -0.71 0.00 0.00 52.86 53.55 1cm5 s ASN 706 Cb -0.13 -2.42 0.05 0.00 0.41 0.00 0.00 41.25 39.16 1cm5 s ASN 706 CO -0.15 0.11 -0.09 -0.69 -1.51 0.00 0.00 177.10 174.77 1cm5 s VAL 707 N -0.41 1.72 -0.16 1.60 1.01 -1.22 -1.72 120.40 121.22 1cm5 s VAL 707 Ca 0.34 -1.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1cm5 s VAL 707 Cb -0.20 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.33 1cm5 s VAL 707 CO 0.21 0.07 -0.09 0.20 0.00 0.00 0.00 175.10 175.49 1cm5 s ASN 708 N 1.34 4.22 -0.45 3.32 0.01 -0.08 -4.53 114.94 118.77 1cm5 s ASN 708 Ca -0.04 -0.31 0.02 0.00 -0.71 0.00 0.00 52.86 51.82 1cm5 s ASN 708 Cb -0.17 -1.67 0.12 0.00 0.41 0.00 0.00 41.25 39.93 1cm5 s ASN 708 CO -0.07 0.12 0.20 -0.69 -1.51 0.00 0.00 177.10 175.15 1cm5 s VAL 709 N 0.64 2.78 0.30 1.60 1.01 -1.26 -0.34 120.40 125.13 1cm5 s VAL 709 Ca -0.05 -2.68 -0.20 0.00 0.00 0.00 0.00 61.98 59.05 1cm5 s VAL 709 Cb -0.15 -2.94 0.03 0.00 0.00 0.00 0.00 36.38 33.32 1cm5 s VAL 709 CO 0.03 -0.72 0.75 0.00 0.00 0.00 0.00 175.10 175.16 1cm5 s MET 710 N 0.44 1.87 -0.08 2.72 0.23 -0.77 -4.80 119.30 118.91 1cm5 s MET 710 Ca 0.13 -1.08 0.01 0.00 -1.03 0.00 0.00 55.69 53.72 1cm5 s MET 710 Cb -0.22 0.60 -0.03 0.00 -1.53 0.00 0.00 34.83 33.66 1cm5 s MET 710 CO -0.04 -0.86 -0.08 -0.80 -2.03 0.00 0.00 175.02 171.21 1cm5 s ASN 711 N -2.96 4.57 0.36 -1.18 -0.87 -1.26 -3.66 114.94 109.94 1cm5 s ASN 711 Ca 0.12 -0.07 0.07 0.00 -1.57 0.00 0.00 52.86 51.41 1cm5 s ASN 711 Cb -0.06 -1.23 0.76 0.00 -0.02 0.00 0.00 41.25 40.70 1cm5 s ASN 711 CO 0.08 0.33 1.93 -0.09 -2.57 0.00 0.00 177.10 176.78 1cm5 h ARG 712 N 5.50 0.72 -0.79 -0.60 2.43 -1.99 -1.40 114.38 118.26 1cm5 h ARG 712 Ca -0.45 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 58.76 1cm5 h ARG 712 Cb 1.18 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.51 1cm5 h ARG 712 CO 0.53 0.48 0.52 0.93 -1.51 0.00 0.00 179.97 180.92 1cm5 h GLU 713 N 0.75 0.73 -0.56 0.20 3.07 -1.99 -1.44 114.58 115.32 1cm5 h GLU 713 Ca 0.36 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 59.13 1cm5 h GLU 713 Cb 0.41 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1cm5 h GLU 713 CO -0.13 0.48 0.18 1.98 -1.40 0.00 0.00 179.01 180.11 1cm5 h MET 714 N 0.75 0.88 -0.22 2.33 4.05 -1.67 -1.74 114.93 119.30 1cm5 h MET 714 Ca 0.36 -0.19 -0.12 0.00 -0.28 0.00 0.00 59.70 59.47 1cm5 h MET 714 Cb 0.41 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1cm5 h MET 714 CO -0.14 0.79 -0.37 -0.07 0.23 0.00 0.00 176.91 177.36 1cm5 h LEU 715 N 0.79 0.50 -0.89 3.39 3.38 -1.33 -1.68 115.31 119.47 1cm5 h LEU 715 Ca 0.18 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1cm5 h LEU 715 Cb 0.28 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1cm5 h LEU 715 CO -0.01 0.82 0.29 -0.07 0.09 0.00 0.00 178.44 179.57 1cm5 h LEU 716 N 0.40 1.02 -0.59 1.67 3.38 -0.95 -0.44 115.31 119.80 1cm5 h LEU 716 Ca 0.04 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1cm5 h LEU 716 Cb 0.83 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1cm5 h LEU 716 CO 0.07 0.91 -0.21 -0.78 0.09 0.00 0.00 178.44 178.51 1cm5 h ASP 717 N 1.08 0.92 -0.30 -0.43 -0.00 -1.05 -2.66 116.42 113.99 1cm5 h ASP 717 Ca 0.25 -0.34 -0.05 0.00 -0.00 0.00 0.00 57.03 56.89 1cm5 h ASP 717 Cb 0.21 -0.25 -0.02 0.00 -0.00 0.00 0.00 39.33 39.27 1cm5 h ASP 717 CO -0.02 1.10 0.02 0.00 -0.00 0.00 0.00 179.24 180.34 1cm5 h ALA 718 N 0.97 1.31 -0.69 -0.78 0.00 -0.70 0.35 119.26 119.71 1cm5 h ALA 718 Ca 0.11 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1cm5 h ALA 718 Cb 0.76 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1cm5 h ALA 718 CO 0.06 0.47 0.18 0.52 0.00 0.00 0.00 179.25 180.49 1cm5 h MET 719 N 0.59 1.10 0.15 0.00 2.86 -0.82 -2.76 114.93 116.06 1cm5 h MET 719 Ca 0.13 -0.26 -0.30 0.00 -2.06 0.00 0.00 59.70 57.21 1cm5 h MET 719 Cb 0.34 -0.15 0.02 0.00 0.06 0.00 0.00 31.60 31.88 1cm5 h MET 719 CO 0.01 0.97 -1.29 0.93 1.06 0.00 0.00 176.91 178.59 1cm5 h GLU 720 N 1.04 0.51 -3.04 1.72 4.39 -1.11 -3.40 114.58 114.69 1cm5 h GLU 720 Ca 0.22 -0.75 -0.62 0.00 0.34 0.00 0.00 59.36 58.55 1cm5 h GLU 720 Cb 0.35 0.26 -0.41 0.00 -0.10 0.00 0.00 28.75 28.85 1cm5 h GLU 720 CO -0.00 1.34 -0.64 -0.80 -1.16 0.00 0.00 179.01 177.75 1cm5 s ASN 721 N -7.39 4.27 0.09 1.42 0.01 0.12 -4.98 114.94 108.49 1cm5 s ASN 721 Ca -0.08 -3.56 -0.29 0.00 -0.71 0.00 0.00 52.86 48.22 1cm5 s ASN 721 Cb 0.06 -1.45 -0.15 0.00 0.41 0.00 0.00 41.25 40.11 1cm5 s ASN 721 CO 0.92 -0.13 1.65 -0.65 -1.51 0.00 0.00 177.10 177.39 1cm5 h PRO 722 N 5.67 -0.58 0.00 -0.60 0.11 -1.72 -2.94 132.00 131.94 1cm5 h PRO 722 Ca 0.12 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1cm5 h PRO 722 Cb 0.80 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1cm5 h PRO 722 CO 0.66 -0.38 0.43 0.93 -0.21 0.00 0.00 178.00 179.43 1cm5 h GLU 723 N -0.60 0.00 0.00 1.05 4.39 -1.93 0.14 114.58 117.63 1cm5 h GLU 723 Ca -0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1cm5 h GLU 723 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1cm5 h GLU 723 CO 0.03 0.00 -0.23 -0.22 -1.16 0.00 0.00 179.01 177.43 1cm5 h LYS 724 N 0.00 0.00 -2.14 2.33 3.64 -1.90 -3.38 116.57 115.12 1cm5 h LYS 724 Ca 0.00 0.00 -0.56 0.00 -1.27 0.00 0.00 60.65 58.82 1cm5 h LYS 724 Cb 0.87 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.28 1cm5 h LYS 724 CO 0.00 0.00 -0.85 0.66 -2.27 0.00 0.00 179.45 176.99 1cm5 n TYR 725 N -2.87 2.20 -0.31 1.91 4.02 0.51 -4.95 117.16 117.66 1cm5 n TYR 725 Ca 0.03 -3.91 0.02 0.00 -0.01 0.00 0.00 57.90 54.03 1cm5 n TYR 725 Cb 0.52 -0.46 0.20 0.00 -0.02 0.00 0.00 39.34 39.58 1cm5 n TYR 725 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1cm5 h PRO 726 N 3.46 1.09 -0.31 -0.72 0.11 -1.75 -3.07 132.00 130.81 1cm5 h PRO 726 Ca 0.13 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1cm5 h PRO 726 Cb 0.72 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 31.59 1cm5 h PRO 726 CO 0.68 0.72 0.00 1.04 -0.21 0.00 0.00 178.00 180.23 1cm5 n GLN 727 N -4.45 2.88 -1.68 1.05 6.02 -1.26 -4.94 117.38 115.00 1cm5 n GLN 727 Ca 0.12 -2.10 -0.46 0.00 -0.01 0.00 0.00 57.00 54.55 1cm5 n GLN 727 Cb 0.12 -1.32 -0.04 0.00 1.02 0.00 0.00 30.24 30.02 1cm5 n GLN 727 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1cm5 n LEU 728 N 0.31 3.59 -4.31 1.08 7.94 -1.16 -4.52 117.00 119.94 1cm5 n LEU 728 Ca 0.12 0.97 -0.29 0.00 -1.11 0.00 0.00 56.01 55.70 1cm5 n LEU 728 Cb 0.47 -1.42 -0.15 0.00 0.53 0.00 0.00 43.42 42.85 1cm5 n LEU 728 CO 0.08 -0.01 -0.55 -0.89 -1.11 0.00 0.00 177.39 174.91 1cm5 s THR 729 N 3.72 1.98 0.02 1.96 2.01 -1.26 -1.39 115.64 122.67 1cm5 s THR 729 Ca 0.90 -1.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.55 1cm5 s THR 729 Cb -0.63 -1.70 -0.01 0.00 0.01 0.00 0.00 72.50 70.17 1cm5 s THR 729 CO 0.47 0.32 0.05 0.27 -0.69 0.00 0.00 174.62 175.04 1cm5 s ILE 730 N -0.79 0.11 0.04 1.82 -4.36 -0.66 -4.62 121.20 112.74 1cm5 s ILE 730 Ca 0.10 -0.93 -0.25 0.00 -0.26 0.00 0.00 60.65 59.32 1cm5 s ILE 730 Cb -0.10 -0.51 -0.05 0.00 1.25 0.00 0.00 42.46 43.05 1cm5 s ILE 730 CO 0.02 -0.51 0.76 -0.13 0.24 0.00 0.00 174.94 175.31 1cm5 s ARG 731 N -1.81 4.48 0.00 0.37 1.81 -1.23 -1.43 118.95 121.15 1cm5 s ARG 731 Ca -0.12 1.04 0.00 0.00 -1.72 0.00 0.00 55.73 54.93 1cm5 s ARG 731 Cb -0.06 -3.36 0.00 0.00 -0.45 0.00 0.00 34.95 31.07 1cm5 s ARG 731 CO -0.01 0.28 0.00 1.33 -0.68 0.00 0.00 175.30 176.22 1cm5 n VAL 732 N 2.83 0.00 -0.95 3.52 0.24 -0.47 -4.95 118.33 118.55 1cm5 n VAL 732 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 1cm5 n VAL 732 Cb 0.50 0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 1cm5 n VAL 732 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1cm5 n SER 733 N -1.17 0.00 0.00 -1.34 2.88 -1.26 -4.88 113.62 107.85 1cm5 n SER 733 Ca 0.00 -0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.29 1cm5 n SER 733 Cb 0.09 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1cm5 n SER 733 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1cm5 n GLY 734 N 0.00 0.00 3.94 0.46 0.00 -1.26 -4.60 105.19 103.72 1cm5 n GLY 734 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1cm5 n GLY 734 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1cm5 s TYR 735 N 0.00 0.04 0.32 1.61 -0.85 -1.26 -4.23 117.35 112.99 1cm5 s TYR 735 Ca 0.00 -0.28 0.10 0.00 -0.52 0.00 0.00 57.07 56.38 1cm5 s TYR 735 Cb 0.00 0.62 -0.06 0.00 0.38 0.00 0.00 41.96 42.90 1cm5 s TYR 735 CO 0.00 -0.54 -0.11 0.00 -1.52 0.00 0.00 175.55 173.38 1cm5 s ALA 736 N -2.09 2.93 0.05 9.51 0.00 -1.26 -1.37 121.76 129.53 1cm5 s ALA 736 Ca 0.26 -2.00 -0.14 0.00 0.00 0.00 0.00 51.96 50.08 1cm5 s ALA 736 Cb -0.01 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.96 1cm5 s ALA 736 CO 0.02 0.15 0.31 0.14 0.00 0.00 0.00 175.76 176.37 1cm5 s VAL 737 N -2.56 0.08 0.02 0.00 -7.23 -0.51 -4.79 120.40 105.41 1cm5 s VAL 737 Ca 0.32 -0.69 -0.30 0.00 -1.81 0.00 0.00 61.98 59.50 1cm5 s VAL 737 Cb -0.00 -0.97 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 1cm5 s VAL 737 CO 0.16 -0.38 1.01 -0.13 -0.31 0.00 0.00 175.10 175.45 1cm5 s ARG 738 N -2.67 4.55 0.28 4.82 0.52 -1.26 -1.66 118.95 123.53 1cm5 s ARG 738 Ca -0.04 1.48 0.01 0.00 -0.52 0.00 0.00 55.73 56.66 1cm5 s ARG 738 Cb -0.00 -3.44 0.62 0.00 0.52 0.00 0.00 34.95 32.65 1cm5 s ARG 738 CO -0.04 -0.06 1.74 0.35 0.02 0.00 0.00 175.30 177.30 1cm5 h PHE 739 N 6.70 0.74 0.00 -0.53 3.57 -1.57 0.56 116.94 126.40 1cm5 h PHE 739 Ca -0.41 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.12 1cm5 h PHE 739 Cb 1.22 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.77 1cm5 h PHE 739 CO 0.68 0.09 0.00 0.09 -2.23 0.00 0.00 178.31 176.94 1cm5 n ASN 740 N -4.93 0.00 0.10 0.41 3.02 -1.26 -2.54 115.26 110.05 1cm5 n ASN 740 Ca 0.19 0.34 0.12 0.00 -0.03 0.00 0.00 54.58 55.21 1cm5 n ASN 740 Cb 0.53 -0.40 0.18 0.00 -0.61 0.00 0.00 39.78 39.48 1cm5 n ASN 740 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1cm5 h SER 741 N 0.00 0.00 -4.14 6.41 4.64 -1.18 -3.44 113.55 115.84 1cm5 h SER 741 Ca 0.00 -0.10 -0.50 0.00 -0.47 0.00 0.00 61.79 60.72 1cm5 h SER 741 Cb 0.13 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.28 1cm5 h SER 741 CO 0.00 0.05 0.33 -0.76 -0.87 0.00 0.00 176.83 175.58 1cm5 s LEU 742 N -4.79 3.29 0.78 5.97 1.43 -1.05 -4.39 118.68 119.91 1cm5 s LEU 742 Ca 0.06 1.22 -0.10 0.00 -1.03 0.00 0.00 54.13 54.28 1cm5 s LEU 742 Cb 0.11 -4.20 0.08 0.00 0.03 0.00 0.00 46.19 42.21 1cm5 s LEU 742 CO 0.70 -0.87 1.12 0.42 0.23 0.00 0.00 176.35 177.95 1cm5 s THR 743 N -3.08 2.12 0.15 5.49 -4.23 -1.26 -4.84 115.64 109.98 1cm5 s THR 743 Ca 0.53 -0.13 -0.16 0.00 -1.18 0.00 0.00 61.69 60.75 1cm5 s THR 743 Cb -0.11 -2.99 0.01 0.00 1.34 0.00 0.00 72.50 70.76 1cm5 s THR 743 CO 0.51 0.00 1.81 0.50 -0.54 0.00 0.00 174.62 176.90 1cm5 h LYS 744 N -0.90 0.53 -0.60 3.99 3.64 -1.99 0.30 116.57 121.53 1cm5 h LYS 744 Ca -0.45 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1cm5 h LYS 744 Cb 1.31 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1cm5 h LYS 744 CO 0.60 0.35 0.32 1.49 -2.27 0.00 0.00 179.45 179.95 1cm5 h GLU 745 N 0.54 0.84 -0.58 1.90 4.81 -1.99 -0.35 114.58 119.76 1cm5 h GLU 745 Ca 0.15 -0.10 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1cm5 h GLU 745 Cb -0.06 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 1cm5 h GLU 745 CO -0.03 0.64 0.08 1.96 -0.73 0.00 0.00 179.01 180.93 1cm5 h GLN 746 N 0.81 0.94 -0.42 1.92 4.20 -1.85 -2.29 115.11 118.42 1cm5 h GLN 746 Ca 0.21 -0.24 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 1cm5 h GLN 746 Cb 0.05 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1cm5 h GLN 746 CO -0.03 0.88 -0.11 1.96 -0.67 0.00 0.00 178.83 180.86 1cm5 h GLN 747 N 0.88 0.75 -1.00 1.46 4.20 -0.51 -2.74 115.11 118.15 1cm5 h GLN 747 Ca 0.18 -0.25 0.06 0.00 0.06 0.00 0.00 58.65 58.70 1cm5 h GLN 747 Cb 0.41 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.07 1cm5 h GLN 747 CO 0.01 0.84 0.65 0.37 -0.67 0.00 0.00 178.83 180.03 1cm5 h GLN 748 N 0.68 1.17 -0.07 1.46 5.75 -0.52 -1.18 115.11 122.40 1cm5 h GLN 748 Ca 0.12 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1cm5 h GLN 748 Cb 0.58 -0.26 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 1cm5 h GLN 748 CO 0.04 0.77 0.03 0.22 -2.65 0.00 0.00 178.83 177.25 1cm5 h ASP 749 N 1.21 0.10 -0.20 -0.69 -0.00 -1.18 -2.83 116.42 112.83 1cm5 h ASP 749 Ca 0.42 -0.14 0.03 0.00 -0.00 0.00 0.00 57.03 57.34 1cm5 h ASP 749 Cb 0.11 -0.03 -0.03 0.00 -0.00 0.00 0.00 39.33 39.38 1cm5 h ASP 749 CO -0.16 0.21 0.01 0.58 -0.00 0.00 0.00 179.24 179.88 1cm5 h VAL 750 N -0.02 0.87 0.00 2.25 2.07 -1.04 -2.79 116.25 117.58 1cm5 h VAL 750 Ca 0.03 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1cm5 h VAL 750 Cb 0.14 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1cm5 h VAL 750 CO -0.00 0.01 0.00 0.16 0.02 0.00 0.00 177.57 177.76 1cm5 h ILE 751 N 0.08 0.00 -0.09 4.57 3.07 -1.27 -2.74 117.51 121.13 1cm5 h ILE 751 Ca 0.10 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 66.00 1cm5 h ILE 751 Cb 0.11 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 38.15 1cm5 h ILE 751 CO -0.15 0.00 0.00 0.35 -1.05 0.00 0.00 178.15 177.30 1cm5 n THR 752 N -3.03 0.10 -1.67 0.16 -2.24 -1.07 -4.93 114.28 101.60 1cm5 n THR 752 Ca 0.01 -0.39 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 1cm5 n THR 752 Cb 0.31 0.77 0.12 0.00 -2.10 0.00 0.00 70.33 69.43 1cm5 n THR 752 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1cm5 s ARG 753 N -1.90 1.41 -0.08 -0.78 0.52 -1.04 -4.33 118.95 112.76 1cm5 s ARG 753 Ca 0.34 0.20 -0.30 0.00 -0.52 0.00 0.00 55.73 55.46 1cm5 s ARG 753 Cb 0.20 -1.88 -0.03 0.00 0.52 0.00 0.00 34.95 33.76 1cm5 s ARG 753 CO 0.31 -2.00 1.32 0.99 0.02 0.00 0.00 175.30 175.94 1cm5 s THR 754 N -3.40 4.05 -0.47 0.02 2.01 -1.26 -4.68 115.64 111.91 1cm5 s THR 754 Ca 0.63 1.35 -0.06 0.00 0.31 0.00 0.00 61.69 63.92 1cm5 s THR 754 Cb -0.13 -3.87 0.12 0.00 0.01 0.00 0.00 72.50 68.63 1cm5 s THR 754 CO 0.52 -0.05 0.31 -0.36 -0.69 0.00 0.00 174.62 174.35 1cm5 s PHE 755 N 2.87 3.50 -0.11 4.92 0.40 -1.26 -4.35 117.98 123.94 1cm5 s PHE 755 Ca 0.59 -2.16 -0.34 0.00 -0.60 0.00 0.00 56.93 54.43 1cm5 s PHE 755 Cb -0.26 -3.38 -0.11 0.00 0.51 0.00 0.00 43.02 39.77 1cm5 s PHE 755 CO 0.21 -0.97 1.93 2.41 0.70 0.00 0.00 175.22 179.50 1cm5 n THR 756 N 4.64 0.55 0.87 0.64 -1.04 0.50 -4.85 114.28 115.60 1cm5 n THR 756 Ca -0.04 -0.14 0.12 0.00 -2.04 0.00 0.00 64.05 61.95 1cm5 n THR 756 Cb 0.41 -1.91 0.15 0.00 -1.82 0.00 0.00 70.33 67.16 1cm5 n THR 756 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cm5 n GLN 757 N 6.91 0.09 -3.80 -2.82 1.13 -1.26 -2.21 117.38 115.41 1cm5 n GLN 757 Ca 0.24 0.01 -0.08 0.00 -1.94 0.00 0.00 57.00 55.24 1cm5 n GLN 757 Cb 0.30 -1.54 -0.02 0.00 0.11 0.00 0.00 30.24 29.09 1cm5 n GLN 757 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1cm5 s SER 758 N -3.31 -0.30 0.00 1.08 1.04 -1.26 -4.60 113.70 106.35 1cm5 s SER 758 Ca 0.09 -0.52 0.29 0.00 0.48 0.00 0.00 55.95 56.28 1cm5 s SER 758 Cb 0.16 0.71 1.17 0.00 0.10 0.00 0.00 66.02 68.15 1cm5 s SER 758 CO 0.74 -1.29 1.81 0.23 0.98 0.00 0.00 173.24 175.72