#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyo n ARG 14 N 0.00 -2.85 0.29 5.56 1.74 -1.26 -4.76 116.66 115.38 3dyo n ARG 14 Ca 0.00 0.34 0.17 0.00 -0.77 0.00 0.00 57.85 57.60 3dyo n ARG 14 Cb 0.00 -4.37 0.85 0.00 -1.02 0.00 0.00 32.46 27.92 3dyo n ARG 14 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3dyo h ASP 15 N -1.82 0.00 -0.03 0.55 3.32 -1.95 -0.71 116.42 115.79 3dyo h ASP 15 Ca -0.64 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.41 3dyo h ASP 15 Cb 1.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.93 3dyo h ASP 15 CO 0.64 0.05 0.00 -2.67 -1.72 0.00 0.00 179.24 175.54 3dyo n TRP 16 N -3.29 0.04 -2.04 4.55 2.14 -1.26 -3.04 117.44 114.55 3dyo n TRP 16 Ca -0.01 -0.02 -0.11 0.00 2.07 0.00 0.00 57.50 59.43 3dyo n TRP 16 Cb 0.22 0.00 0.08 0.00 -0.81 0.00 0.00 31.31 30.80 3dyo n TRP 16 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 3dyo n GLU 17 N -0.52 2.56 -3.35 -2.67 1.02 -0.27 -0.75 120.64 116.66 3dyo n GLU 17 Ca 0.07 -3.70 -0.10 0.00 -0.02 0.00 0.00 57.16 53.41 3dyo n GLU 17 Cb 0.06 -1.85 -0.08 0.00 -0.02 0.00 0.00 31.44 29.55 3dyo n GLU 17 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3dyo s ASN 18 N -3.42 0.49 0.00 1.62 3.84 -1.17 -4.72 114.94 111.58 3dyo s ASN 18 Ca 0.43 -0.06 0.16 0.00 0.21 0.00 0.00 52.86 53.59 3dyo s ASN 18 Cb 0.39 1.01 0.93 0.00 -0.55 0.00 0.00 41.25 43.03 3dyo s ASN 18 CO -0.02 -0.33 1.35 -0.81 -2.79 0.00 0.00 177.10 174.51 3dyo n PRO 19 N 5.35 0.56 0.10 0.43 -0.04 -1.26 -0.76 135.00 139.38 3dyo n PRO 19 Ca -0.02 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.56 3dyo n PRO 19 Cb 0.49 -1.44 0.17 0.00 -0.04 0.00 0.00 33.50 32.69 3dyo n PRO 19 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3dyo h GLY 20 N 2.86 0.00 -7.80 0.55 0.00 -1.93 -3.39 103.07 93.36 3dyo h GLY 20 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 3dyo h GLY 20 CO 0.00 0.00 -0.76 0.14 0.00 0.00 0.00 176.54 175.92 3dyo s VAL 21 N -3.20 2.30 -1.22 4.60 1.01 0.06 -4.94 120.40 119.01 3dyo s VAL 21 Ca 0.06 -1.83 0.11 0.00 0.00 0.00 0.00 61.98 60.31 3dyo s VAL 21 Cb 0.11 -2.46 0.14 0.00 0.00 0.00 0.00 36.38 34.18 3dyo s VAL 21 CO 0.71 -0.21 0.95 0.35 0.00 0.00 0.00 175.10 176.89 3dyo n THR 22 N 4.40 0.27 -3.62 3.92 -2.24 -1.26 -4.80 114.28 110.95 3dyo n THR 22 Ca -0.09 -0.63 -0.03 0.00 -2.27 0.00 0.00 64.05 61.03 3dyo n THR 22 Cb 0.42 1.03 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 3dyo n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyo s GLN 23 N -0.92 0.17 -0.06 -0.78 1.03 -1.26 -1.12 119.66 116.72 3dyo s GLN 23 Ca 0.15 -0.06 -0.02 0.00 0.04 0.00 0.00 55.36 55.47 3dyo s GLN 23 Cb 0.10 0.08 0.04 0.00 0.03 0.00 0.00 33.01 33.25 3dyo s GLN 23 CO 0.14 -0.07 0.11 -0.51 -2.54 0.00 0.00 175.29 172.42 3dyo s LEU 24 N -2.12 0.29 -0.93 2.60 1.43 -0.45 -4.86 118.68 114.63 3dyo s LEU 24 Ca 0.11 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.42 3dyo s LEU 24 Cb -0.01 0.12 0.00 0.00 0.03 0.00 0.00 46.19 46.33 3dyo s LEU 24 CO -0.03 -0.21 0.00 0.59 0.23 0.00 0.00 176.35 176.92 3dyo n ASN 25 N 4.96 -4.72 -4.75 2.29 3.02 -1.26 -1.37 115.26 113.43 3dyo n ASN 25 Ca -0.11 0.22 -0.40 0.00 -0.03 0.00 0.00 54.58 54.25 3dyo n ASN 25 Cb 0.50 -3.00 -0.05 0.00 -0.61 0.00 0.00 39.78 36.62 3dyo n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3dyo s ARG 26 N -2.50 4.77 0.72 3.52 3.52 -1.26 -4.66 118.95 123.07 3dyo s ARG 26 Ca 0.00 1.54 -0.11 0.00 -0.13 0.00 0.00 55.73 57.03 3dyo s ARG 26 Cb 0.00 -3.29 0.02 0.00 -1.56 0.00 0.00 34.95 30.12 3dyo s ARG 26 CO 0.00 0.38 1.07 -0.51 -0.81 0.00 0.00 175.30 175.43 3dyo s LEU 27 N -0.88 3.11 0.60 -0.88 1.43 0.15 -4.99 118.68 117.22 3dyo s LEU 27 Ca 0.43 1.71 -0.20 0.00 -1.03 0.00 0.00 54.13 55.05 3dyo s LEU 27 Cb -0.26 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.42 3dyo s LEU 27 CO 0.33 -1.66 1.30 0.00 0.23 0.00 0.00 176.35 176.55 3dyo s ALA 28 N -2.95 2.57 0.64 4.21 0.00 -1.26 -4.66 121.76 120.31 3dyo s ALA 28 Ca 0.60 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.65 3dyo s ALA 28 Cb -0.15 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.41 3dyo s ALA 28 CO 0.54 -1.43 1.04 0.00 0.00 0.00 0.00 175.76 175.92 3dyo s ALA 29 N -1.39 2.83 0.23 0.00 0.00 -1.26 -4.98 121.76 117.18 3dyo s ALA 29 Ca 0.78 0.11 -0.21 0.00 0.00 0.00 0.00 51.96 52.64 3dyo s ALA 29 Cb -0.37 -3.16 0.07 0.00 0.00 0.00 0.00 23.12 19.66 3dyo s ALA 29 CO 0.41 -0.92 0.95 -3.38 0.00 0.00 0.00 175.76 172.83 3dyo s HIS 30 N -2.92 0.03 0.79 0.00 -3.43 -1.26 -4.88 115.29 103.62 3dyo s HIS 30 Ca 0.58 -0.48 -0.12 0.00 -0.80 0.00 0.00 55.06 54.24 3dyo s HIS 30 Cb -0.13 0.72 0.06 0.00 -1.43 0.00 0.00 32.58 31.80 3dyo s HIS 30 CO 0.49 -1.07 1.11 -2.14 -2.00 0.00 0.00 174.74 171.13 3dyo s PRO 31 N -2.48 2.16 -0.03 -0.38 0.02 -1.14 -4.27 135.00 128.88 3dyo s PRO 31 Ca 0.18 0.52 -0.36 0.00 0.02 0.00 0.00 61.00 61.36 3dyo s PRO 31 Cb -0.03 -1.94 -0.14 0.00 0.02 0.00 0.00 34.50 32.41 3dyo s PRO 31 CO 0.06 -1.54 1.65 -2.30 -0.33 0.00 0.00 177.00 174.54 3dyo n PRO 32 N -3.36 1.68 -4.36 5.54 -0.02 -1.26 -4.98 135.00 128.23 3dyo n PRO 32 Ca 0.07 0.61 -0.27 0.00 -2.02 0.00 0.00 63.50 61.89 3dyo n PRO 32 Cb 0.57 -2.35 -0.11 0.00 -0.02 0.00 0.00 33.50 31.60 3dyo n PRO 32 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3dyo s PHE 33 N 2.32 2.45 0.00 6.00 2.99 -1.26 -4.80 117.98 125.68 3dyo s PHE 33 Ca 0.89 -0.30 0.00 0.00 0.00 0.00 0.00 56.93 57.52 3dyo s PHE 33 Cb -0.84 -1.20 0.00 0.00 0.00 0.00 0.00 43.02 40.98 3dyo s PHE 33 CO 0.51 0.52 0.04 0.00 -0.00 0.00 0.00 175.22 176.28 3dyo n ALA 34 N 0.11 0.42 -3.80 5.36 0.00 -1.26 -5.02 120.51 116.32 3dyo n ALA 34 Ca -0.11 -0.04 -0.30 0.00 0.00 0.00 0.00 53.44 52.99 3dyo n ALA 34 Cb 0.56 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.03 3dyo n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dyo n SER 35 N -0.12 -3.36 -4.77 0.00 2.88 -1.26 -4.14 113.62 102.85 3dyo n SER 35 Ca 0.00 -1.03 -0.36 0.00 -1.33 0.00 0.00 58.87 56.16 3dyo n SER 35 Cb 0.08 -3.18 -0.01 0.00 -0.75 0.00 0.00 64.21 60.35 3dyo n SER 35 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 3dyo s TRP 36 N -3.65 2.78 -0.22 0.66 0.51 -0.47 -4.57 118.94 113.99 3dyo s TRP 36 Ca 0.30 1.54 0.16 0.00 -2.12 0.00 0.00 56.10 55.98 3dyo s TRP 36 Cb -0.11 -3.32 0.42 0.00 -0.81 0.00 0.00 33.47 29.66 3dyo s TRP 36 CO 0.88 -1.50 1.32 0.54 -0.51 0.00 0.00 176.95 177.67 3dyo n ARG 37 N -0.92 2.46 -3.70 4.98 5.12 -1.26 -0.57 116.66 122.78 3dyo n ARG 37 Ca 0.10 -2.66 -0.17 0.00 -1.93 0.00 0.00 57.85 53.19 3dyo n ARG 37 Cb 0.50 -1.67 -0.16 0.00 -1.16 0.00 0.00 32.46 29.97 3dyo n ARG 37 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 3dyo s ASN 38 N -2.09 0.60 0.26 0.55 3.84 -1.26 -4.98 114.94 111.86 3dyo s ASN 38 Ca 0.36 0.23 -0.05 0.00 0.21 0.00 0.00 52.86 53.62 3dyo s ASN 38 Cb 0.29 0.12 0.30 0.00 -0.55 0.00 0.00 41.25 41.42 3dyo s ASN 38 CO 0.07 -0.21 1.92 0.28 -2.79 0.00 0.00 177.10 176.37 3dyo h SER 39 N 8.04 1.08 -0.69 -4.21 0.02 -1.98 -2.69 113.55 113.12 3dyo h SER 39 Ca -0.23 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.60 3dyo h SER 39 Cb 1.12 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 63.36 3dyo h SER 39 CO 0.24 0.81 0.16 -0.33 -1.14 0.00 0.00 176.83 176.57 3dyo h GLU 40 N 1.26 1.12 -0.66 3.45 4.39 -1.98 0.31 114.58 122.47 3dyo h GLU 40 Ca 0.33 -0.27 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 3dyo h GLU 40 Cb -0.09 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.38 3dyo h GLU 40 CO -0.07 0.99 0.26 0.93 -1.16 0.00 0.00 179.01 179.97 3dyo h GLU 41 N 1.06 0.99 -0.55 2.33 4.39 -1.89 -1.16 114.58 119.75 3dyo h GLU 41 Ca 0.22 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.70 3dyo h GLU 41 Cb 0.38 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 3dyo h GLU 41 CO 0.00 0.83 0.18 0.00 -1.16 0.00 0.00 179.01 178.87 3dyo h ALA 42 N 1.11 0.72 -0.87 3.43 0.00 -1.13 -0.61 119.26 121.91 3dyo h ALA 42 Ca 0.22 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.99 3dyo h ALA 42 Cb 0.21 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3dyo h ALA 42 CO -0.02 0.37 0.56 -0.09 0.00 0.00 0.00 179.25 180.07 3dyo h ARG 43 N 0.76 1.04 -0.03 0.00 2.43 -0.08 -2.62 114.38 115.88 3dyo h ARG 43 Ca 0.18 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3dyo h ARG 43 Cb 0.26 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3dyo h ARG 43 CO -0.01 0.69 0.00 0.25 -1.51 0.00 0.00 179.97 179.39 3dyo n THR 44 N -4.55 0.02 -2.98 0.20 -2.24 -0.47 -4.93 114.28 99.33 3dyo n THR 44 Ca 0.11 -0.27 -0.19 0.00 -2.27 0.00 0.00 64.05 61.43 3dyo n THR 44 Cb 0.11 0.55 0.04 0.00 -2.10 0.00 0.00 70.33 68.92 3dyo n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dyo n ASP 45 N 0.26 -5.48 -4.92 3.42 2.03 -0.33 -4.97 116.55 106.55 3dyo n ASP 45 Ca 0.19 -0.28 -0.26 0.00 0.52 0.00 0.00 54.79 54.96 3dyo n ASP 45 Cb 0.37 -4.28 0.03 0.00 -0.72 0.00 0.00 41.12 36.52 3dyo n ASP 45 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3dyo s ARG 46 N -5.61 2.90 0.49 -0.67 0.52 -0.61 -4.98 118.95 110.99 3dyo s ARG 46 Ca 0.29 -0.10 -0.22 0.00 -0.52 0.00 0.00 55.73 55.19 3dyo s ARG 46 Cb -0.13 -2.31 -0.08 0.00 0.52 0.00 0.00 34.95 32.95 3dyo s ARG 46 CO 0.36 -0.66 0.98 -2.30 0.02 0.00 0.00 175.30 173.70 3dyo n PRO 47 N -2.52 1.18 -4.30 3.54 -0.02 -1.26 -4.83 135.00 126.78 3dyo n PRO 47 Ca 0.04 0.43 -0.34 0.00 -2.02 0.00 0.00 63.50 61.62 3dyo n PRO 47 Cb 0.58 -2.08 -0.11 0.00 -0.02 0.00 0.00 33.50 31.86 3dyo n PRO 47 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3dyo s SER 48 N -0.93 5.04 0.06 2.55 0.15 -1.26 -4.97 113.70 114.34 3dyo s SER 48 Ca 0.68 -0.06 0.12 0.00 0.70 0.00 0.00 55.95 57.39 3dyo s SER 48 Cb -0.50 -1.81 0.52 0.00 -1.71 0.00 0.00 66.02 62.52 3dyo s SER 48 CO 0.53 0.19 1.36 0.00 1.20 0.00 0.00 173.24 176.52 3dyo n GLN 49 N 3.43 0.04 -0.11 5.44 6.02 -1.26 -1.82 117.38 129.11 3dyo n GLN 49 Ca -0.17 0.39 0.12 0.00 -0.01 0.00 0.00 57.00 57.32 3dyo n GLN 49 Cb 0.52 -1.59 0.28 0.00 1.02 0.00 0.00 30.24 30.48 3dyo n GLN 49 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3dyo n GLN 50 N -1.66 2.14 -3.94 -1.09 3.00 -1.26 -4.71 117.38 109.85 3dyo n GLN 50 Ca 0.02 -1.70 -0.30 0.00 -0.01 0.00 0.00 57.00 55.00 3dyo n GLN 50 Cb 0.11 -1.46 -0.15 0.00 0.00 0.00 0.00 30.24 28.74 3dyo n GLN 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 3dyo s LEU 51 N -1.62 2.82 0.01 1.08 2.96 -0.76 -1.22 118.68 121.95 3dyo s LEU 51 Ca 0.35 -1.34 0.03 0.00 -0.22 0.00 0.00 54.13 52.95 3dyo s LEU 51 Cb 0.20 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 45.64 3dyo s LEU 51 CO 0.30 -0.27 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.88 3dyo s ARG 52 N 1.35 2.60 0.02 1.98 0.52 -0.01 -4.71 118.95 120.71 3dyo s ARG 52 Ca -0.03 -0.70 -0.18 0.00 -0.52 0.00 0.00 55.73 54.30 3dyo s ARG 52 Cb -0.19 -2.54 -0.06 0.00 0.52 0.00 0.00 34.95 32.68 3dyo s ARG 52 CO -0.08 0.60 0.50 0.45 0.02 0.00 0.00 175.30 176.80 3dyo s SER 53 N -1.51 6.93 -0.12 0.23 0.15 -1.26 -0.77 113.70 117.34 3dyo s SER 53 Ca 0.18 1.11 0.15 0.00 0.70 0.00 0.00 55.95 58.09 3dyo s SER 53 Cb -0.11 -2.31 0.50 0.00 -1.71 0.00 0.00 66.02 62.39 3dyo s SER 53 CO 0.09 0.26 1.42 0.18 1.20 0.00 0.00 173.24 176.38 3dyo n LEU 54 N 1.99 3.82 -4.76 3.45 4.77 0.52 -4.92 117.00 121.87 3dyo n LEU 54 Ca -0.11 -2.67 -0.33 0.00 -0.03 0.00 0.00 56.01 52.87 3dyo n LEU 54 Cb 0.51 -0.47 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3dyo n LEU 54 CO 0.40 0.70 0.75 0.20 -1.33 0.00 0.00 177.39 178.11 3dyo s ASN 55 N -1.50 4.85 0.00 -1.43 0.01 -1.24 -4.86 114.94 110.78 3dyo s ASN 55 Ca 0.38 2.07 0.00 0.00 -0.71 0.00 0.00 52.86 54.61 3dyo s ASN 55 Cb 0.28 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.38 3dyo s ASN 55 CO 0.13 -1.81 0.00 0.61 -1.51 0.00 0.00 177.10 174.52 3dyo n GLY 56 N -0.33 0.61 3.69 0.66 0.00 0.31 -5.00 105.19 105.13 3dyo n GLY 56 Ca 0.11 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 3dyo n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyo s GLU 57 N -1.74 4.39 0.46 1.61 2.02 -1.26 -1.17 118.70 123.01 3dyo s GLU 57 Ca 0.00 1.11 0.04 0.00 0.02 0.00 0.00 54.97 56.14 3dyo s GLU 57 Cb 0.00 -3.53 -0.04 0.00 0.10 0.00 0.00 34.13 30.66 3dyo s GLU 57 CO 0.00 -0.20 0.01 -1.58 0.02 0.00 0.00 175.26 173.50 3dyo s TRP 58 N 1.68 2.16 -0.07 1.61 0.52 0.00 -4.94 118.94 119.91 3dyo s TRP 58 Ca 0.42 -0.83 -0.02 0.00 0.02 0.00 0.00 56.10 55.69 3dyo s TRP 58 Cb -0.18 -1.68 -0.03 0.00 -1.15 0.00 0.00 33.47 30.42 3dyo s TRP 58 CO 0.17 0.33 0.03 1.03 0.02 0.00 0.00 176.95 178.52 3dyo s ARG 59 N -3.80 3.02 -0.09 4.98 1.81 -0.23 -0.05 118.95 124.58 3dyo s ARG 59 Ca 0.19 -0.41 -0.09 0.00 -1.72 0.00 0.00 55.73 53.70 3dyo s ARG 59 Cb 0.05 -2.83 0.02 0.00 -0.45 0.00 0.00 34.95 31.75 3dyo s ARG 59 CO 0.10 0.69 0.26 0.12 -0.68 0.00 0.00 175.30 175.79 3dyo s PHE 60 N -0.97 -0.28 0.00 -0.53 5.36 0.32 -1.05 117.98 120.83 3dyo s PHE 60 Ca 0.16 0.68 0.01 0.00 -0.96 0.00 0.00 56.93 56.81 3dyo s PHE 60 Cb -0.12 0.10 -0.01 0.00 -0.34 0.00 0.00 43.02 42.65 3dyo s PHE 60 CO 0.05 -0.14 -0.03 0.00 -1.46 0.00 0.00 175.22 173.65 3dyo s ALA 61 N 0.11 0.20 -0.11 11.12 0.00 -0.38 -0.23 121.76 132.47 3dyo s ALA 61 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 51.96 51.72 3dyo s ALA 61 Cb -0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 3dyo s ALA 61 CO 0.00 0.02 0.05 -0.46 0.00 0.00 0.00 175.76 175.37 3dyo s TRP 62 N -0.29 3.31 0.08 0.00 -0.00 -1.26 -0.64 118.94 120.13 3dyo s TRP 62 Ca -0.02 0.28 0.04 0.00 -0.00 0.00 0.00 56.10 56.40 3dyo s TRP 62 Cb -0.02 -1.87 -0.03 0.00 -0.00 0.00 0.00 33.47 31.54 3dyo s TRP 62 CO -0.00 0.51 -0.12 -0.06 -0.00 0.00 0.00 176.95 177.28 3dyo s PHE 63 N -0.76 1.10 -0.21 5.86 0.40 -0.38 -5.01 117.98 118.98 3dyo s PHE 63 Ca 0.12 -0.56 0.24 0.00 -0.60 0.00 0.00 56.93 56.14 3dyo s PHE 63 Cb -0.12 -0.61 0.59 0.00 0.51 0.00 0.00 43.02 43.40 3dyo s PHE 63 CO 0.03 0.02 1.69 -1.00 0.70 0.00 0.00 175.22 176.66 3dyo h PRO 64 N 3.93 0.00 -2.46 0.24 0.13 -1.84 0.30 132.00 132.30 3dyo h PRO 64 Ca -0.39 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.78 3dyo h PRO 64 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.17 3dyo h PRO 64 CO 0.47 0.10 0.35 0.00 -0.23 0.00 0.00 178.00 178.69 3dyo s ALA 65 N -3.33 -1.74 0.48 -0.56 0.00 -1.20 -0.67 121.76 114.75 3dyo s ALA 65 Ca 0.04 0.90 0.14 0.00 0.00 0.00 0.00 51.96 53.05 3dyo s ALA 65 Cb 0.07 0.44 1.11 0.00 0.00 0.00 0.00 23.12 24.74 3dyo s ALA 65 CO 0.65 -0.64 2.06 -1.00 0.00 0.00 0.00 175.76 176.83 3dyo h PRO 66 N 2.18 0.04 0.00 0.00 0.13 -1.86 -1.67 132.00 130.82 3dyo h PRO 66 Ca -0.27 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3dyo h PRO 66 Cb 1.25 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3dyo h PRO 66 CO 0.35 0.12 0.00 0.39 -0.23 0.00 0.00 178.00 178.63 3dyo n GLU 67 N -4.43 0.15 -0.08 0.86 4.71 -1.26 -1.80 120.64 118.79 3dyo n GLU 67 Ca -0.02 0.43 0.11 0.00 -0.01 0.00 0.00 57.16 57.67 3dyo n GLU 67 Cb 0.16 -1.82 0.35 0.00 -1.01 0.00 0.00 31.44 29.12 3dyo n GLU 67 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dyo n ALA 68 N -1.73 2.51 -2.66 0.62 0.00 -0.63 -4.86 120.51 113.76 3dyo n ALA 68 Ca 0.02 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.44 3dyo n ALA 68 Cb 0.18 -1.04 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 3dyo n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dyo s VAL 69 N -1.78 4.90 0.43 0.00 1.01 -0.74 -5.00 120.40 119.21 3dyo s VAL 69 Ca 0.34 1.53 -0.25 0.00 0.00 0.00 0.00 61.98 63.60 3dyo s VAL 69 Cb 0.19 -4.09 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 3dyo s VAL 69 CO 0.29 0.02 1.27 -2.16 0.00 0.00 0.00 175.10 174.52 3dyo s PRO 70 N 2.23 3.85 0.44 2.72 0.04 -1.26 -4.90 135.00 138.12 3dyo s PRO 70 Ca 0.36 2.06 0.21 0.00 0.04 0.00 0.00 61.00 63.67 3dyo s PRO 70 Cb -0.16 -2.63 1.02 0.00 0.04 0.00 0.00 34.50 32.77 3dyo s PRO 70 CO 0.11 -0.56 1.90 0.93 0.04 0.00 0.00 177.00 179.42 3dyo h GLU 71 N 2.42 0.00 -0.21 4.56 3.07 -1.99 -2.25 114.58 120.18 3dyo h GLU 71 Ca -0.50 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.43 3dyo h GLU 71 Cb 1.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.15 3dyo h GLU 71 CO 0.62 0.25 0.19 0.66 -1.40 0.00 0.00 179.01 179.33 3dyo h SER 72 N 0.00 0.00 -0.35 1.42 4.64 -1.93 -0.48 113.55 116.84 3dyo h SER 72 Ca -0.00 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.41 3dyo h SER 72 Cb 0.60 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 3dyo h SER 72 CO 0.03 0.00 0.25 -0.25 -0.87 0.00 0.00 176.83 175.99 3dyo h TRP 73 N 0.00 0.07 -0.10 4.77 7.01 -1.57 0.20 115.95 126.33 3dyo h TRP 73 Ca 0.10 0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 3dyo h TRP 73 Cb 0.49 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.51 3dyo h TRP 73 CO 0.00 0.04 -0.15 -0.07 -2.79 0.00 0.00 178.44 175.47 3dyo h LEU 74 N 0.07 0.15 0.00 0.65 3.38 -1.26 -3.25 115.31 115.04 3dyo h LEU 74 Ca 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dyo h LEU 74 Cb 0.57 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3dyo h LEU 74 CO -0.01 0.32 -0.62 -0.62 0.09 0.00 0.00 178.44 177.59 3dyo n GLU 75 N -4.29 3.38 -3.81 1.13 -0.58 -0.78 -3.35 120.64 112.35 3dyo n GLU 75 Ca -0.01 -0.02 -0.13 0.00 -0.42 0.00 0.00 57.16 56.58 3dyo n GLU 75 Cb 0.26 -0.92 -0.14 0.00 -0.57 0.00 0.00 31.44 30.07 3dyo n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dyo n ASP 77 N 3.45 1.76 -4.70 0.00 2.03 -1.26 -4.20 116.55 113.63 3dyo n ASP 77 Ca -0.18 1.13 -0.42 0.00 0.52 0.00 0.00 54.79 55.84 3dyo n ASP 77 Cb 0.56 -1.25 -0.03 0.00 -0.72 0.00 0.00 41.12 39.69 3dyo n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dyo s LEU 78 N 0.56 4.32 0.34 -2.67 1.43 -1.26 -4.93 118.68 116.47 3dyo s LEU 78 Ca 0.77 1.76 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 3dyo s LEU 78 Cb -0.85 -3.57 0.66 0.00 0.03 0.00 0.00 46.19 42.47 3dyo s LEU 78 CO 0.49 -0.44 1.95 -0.65 0.23 0.00 0.00 176.35 177.93 3dyo h PRO 79 N 7.04 0.83 0.00 1.29 0.11 -2.03 -0.10 132.00 139.14 3dyo h PRO 79 Ca -0.37 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3dyo h PRO 79 Cb 1.19 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3dyo h PRO 79 CO 0.82 0.55 0.00 0.39 -0.21 0.00 0.00 178.00 179.55 3dyo n GLU 80 N -4.47 0.44 -1.27 1.05 4.71 -1.26 -4.85 120.64 114.98 3dyo n GLU 80 Ca 0.11 0.06 -0.30 0.00 -0.01 0.00 0.00 57.16 57.02 3dyo n GLU 80 Cb 0.19 -1.50 0.14 0.00 -1.01 0.00 0.00 31.44 29.26 3dyo n GLU 80 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dyo s ALA 81 N -2.34 1.57 0.33 0.62 0.00 -0.05 -4.93 121.76 116.96 3dyo s ALA 81 Ca 0.24 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.13 3dyo s ALA 81 Cb 0.14 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 3dyo s ALA 81 CO 0.28 -2.34 0.13 -0.51 0.00 0.00 0.00 175.76 173.32 3dyo s ASP 82 N -3.53 4.67 -0.22 0.00 1.01 0.68 -4.85 116.67 114.42 3dyo s ASP 82 Ca 0.63 -0.76 -0.11 0.00 0.71 0.00 0.00 52.55 53.02 3dyo s ASP 82 Cb -0.17 -0.74 -0.05 0.00 1.01 0.00 0.00 42.92 42.97 3dyo s ASP 82 CO 0.56 -0.27 0.17 -0.89 0.21 0.00 0.00 175.17 174.95 3dyo s THR 83 N -2.42 5.37 0.16 -1.27 2.01 -1.26 -0.52 115.64 117.70 3dyo s THR 83 Ca 0.37 0.22 0.01 0.00 0.31 0.00 0.00 61.69 62.59 3dyo s THR 83 Cb -0.03 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 3dyo s THR 83 CO 0.22 0.37 0.03 0.68 -0.69 0.00 0.00 174.62 175.23 3dyo s VAL 84 N 0.85 0.43 0.20 3.82 -7.23 0.93 -4.95 120.40 114.44 3dyo s VAL 84 Ca 0.08 -1.95 -0.25 0.00 -1.81 0.00 0.00 61.98 58.05 3dyo s VAL 84 Cb -0.13 -2.11 -0.08 0.00 0.56 0.00 0.00 36.38 34.62 3dyo s VAL 84 CO 0.03 -0.46 0.81 -0.69 -0.31 0.00 0.00 175.10 174.48 3dyo s VAL 85 N -3.83 4.33 -0.02 1.32 1.01 -1.26 -0.82 120.40 121.13 3dyo s VAL 85 Ca 0.24 1.71 0.01 0.00 0.00 0.00 0.00 61.98 63.95 3dyo s VAL 85 Cb 0.07 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.35 3dyo s VAL 85 CO 0.03 0.44 -0.01 -0.69 0.00 0.00 0.00 175.10 174.87 3dyo s VAL 86 N -1.26 0.24 0.49 2.92 1.01 -0.32 -4.11 120.40 119.38 3dyo s VAL 86 Ca 0.39 -0.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.17 3dyo s VAL 86 Cb -0.22 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.78 3dyo s VAL 86 CO 0.26 0.13 1.02 -2.16 0.00 0.00 0.00 175.10 174.36 3dyo s PRO 87 N 0.70 3.83 0.14 2.72 0.04 -1.26 -0.53 135.00 140.64 3dyo s PRO 87 Ca -0.07 1.30 -0.25 0.00 0.04 0.00 0.00 61.00 62.01 3dyo s PRO 87 Cb -0.10 -2.10 0.07 0.00 0.04 0.00 0.00 34.50 32.40 3dyo s PRO 87 CO -0.01 -0.39 0.88 -1.54 0.04 0.00 0.00 177.00 175.98 3dyo s SER 88 N -2.12 -0.26 -0.20 6.66 1.04 -0.26 -4.94 113.70 113.63 3dyo s SER 88 Ca 0.66 -0.32 -0.07 0.00 0.48 0.00 0.00 55.95 56.70 3dyo s SER 88 Cb -0.15 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 3dyo s SER 88 CO 0.21 -0.91 0.06 0.20 0.98 0.00 0.00 173.24 173.77 3dyo s ASN 89 N -2.83 5.43 0.49 7.02 -0.87 -1.26 -3.16 114.94 119.76 3dyo s ASN 89 Ca 0.10 -0.01 0.27 0.00 -1.57 0.00 0.00 52.86 51.65 3dyo s ASN 89 Cb -0.02 -1.94 1.23 0.00 -0.02 0.00 0.00 41.25 40.50 3dyo s ASN 89 CO -0.00 0.12 1.96 4.11 -2.57 0.00 0.00 177.10 180.71 3dyo h TRP 90 N 7.07 0.00 -0.01 2.20 0.09 -1.79 0.13 115.95 123.64 3dyo h TRP 90 Ca -0.36 0.00 -0.01 0.00 0.09 0.00 0.00 58.89 58.60 3dyo h TRP 90 Cb 1.17 0.00 -0.00 0.00 0.08 0.00 0.00 29.16 30.41 3dyo h TRP 90 CO 0.59 0.15 -0.06 1.96 0.09 0.00 0.00 178.44 181.17 3dyo h GLN 91 N 0.00 0.01 0.00 0.12 7.50 -1.79 0.04 115.11 120.99 3dyo h GLN 91 Ca -0.00 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 3dyo h GLN 91 Cb 0.54 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.07 3dyo h GLN 91 CO 0.02 0.07 0.00 -1.33 -1.50 0.00 0.00 178.83 176.09 3dyo n MET 92 N -4.46 0.01 -0.18 1.46 2.81 0.43 -1.99 117.12 115.21 3dyo n MET 92 Ca -0.03 0.13 0.10 0.00 -1.81 0.00 0.00 57.70 56.09 3dyo n MET 92 Cb 0.14 -1.51 0.19 0.00 -0.71 0.00 0.00 33.22 31.33 3dyo n MET 92 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3dyo n HIS 93 N -1.53 0.47 -0.98 2.03 8.25 -0.03 -4.98 115.22 118.44 3dyo n HIS 93 Ca 0.05 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 3dyo n HIS 93 Cb 0.26 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.37 3dyo n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyo n GLY 94 N 1.26 0.49 0.23 -1.41 0.00 -0.84 -4.94 105.19 99.98 3dyo n GLY 94 Ca 0.17 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 3dyo n GLY 94 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3dyo h TYR 95 N 0.00 0.64 -2.91 1.61 -1.99 -1.69 -3.47 116.97 109.16 3dyo h TYR 95 Ca 0.00 -0.17 0.02 0.00 2.00 0.00 0.00 58.73 60.58 3dyo h TYR 95 Cb 0.00 -0.14 -0.00 0.00 2.00 0.00 0.00 36.73 38.58 3dyo h TYR 95 CO 0.00 0.83 0.33 0.16 -0.00 0.00 0.00 178.16 179.48 3dyo s ASP 96 N -6.83 0.00 0.04 3.88 1.47 -1.26 -5.04 116.67 108.93 3dyo s ASP 96 Ca -0.07 -1.05 -0.19 0.00 1.18 0.00 0.00 52.55 52.42 3dyo s ASP 96 Cb 0.13 0.78 -0.06 0.00 -0.34 0.00 0.00 42.92 43.43 3dyo s ASP 96 CO 0.81 -1.56 0.55 0.00 0.68 0.00 0.00 175.17 175.65 3dyo s ALA 97 N -2.29 3.59 0.48 2.11 0.00 -1.26 -4.35 121.76 120.03 3dyo s ALA 97 Ca 0.17 -0.01 -0.20 0.00 0.00 0.00 0.00 51.96 51.91 3dyo s ALA 97 Cb -0.05 -2.61 -0.09 0.00 0.00 0.00 0.00 23.12 20.37 3dyo s ALA 97 CO 0.10 0.36 1.03 -1.25 0.00 0.00 0.00 175.76 176.00 3dyo s PRO 98 N -0.90 3.86 -0.10 0.00 0.04 -1.26 -4.99 135.00 131.65 3dyo s PRO 98 Ca 0.28 1.35 0.03 0.00 0.04 0.00 0.00 61.00 62.70 3dyo s PRO 98 Cb -0.19 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.24 3dyo s PRO 98 CO 0.18 -0.38 -0.19 0.42 0.04 0.00 0.00 177.00 177.06 3dyo s ILE 99 N -1.98 1.74 -0.46 0.56 1.01 -1.10 -4.64 121.20 116.32 3dyo s ILE 99 Ca 0.66 -0.81 -0.10 0.00 0.00 0.00 0.00 60.65 60.40 3dyo s ILE 99 Cb -0.16 -1.54 0.10 0.00 0.01 0.00 0.00 42.46 40.88 3dyo s ILE 99 CO 0.19 0.49 0.33 -0.47 0.00 0.00 0.00 174.94 175.48 3dyo s TYR 100 N 0.64 3.37 0.02 3.97 5.04 -1.26 0.06 117.35 129.19 3dyo s TYR 100 Ca -0.13 -1.63 0.04 0.00 -2.44 0.00 0.00 57.07 52.92 3dyo s TYR 100 Cb -0.16 -3.29 -0.02 0.00 0.35 0.00 0.00 41.96 38.84 3dyo s TYR 100 CO 0.04 -0.93 -0.13 -0.08 -1.34 0.00 0.00 175.55 173.11 3dyo s THR 101 N 1.42 1.06 0.00 4.34 -1.32 -1.26 0.42 115.64 120.30 3dyo s THR 101 Ca 0.04 -0.85 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 3dyo s THR 101 Cb -0.25 -0.94 0.00 0.00 -1.51 0.00 0.00 72.50 69.80 3dyo s THR 101 CO 0.01 0.09 0.00 -3.20 -2.21 0.00 0.00 174.62 169.31 3dyo n ASN 102 N 2.18 0.00 -0.10 8.08 2.85 -1.26 -3.93 115.26 123.08 3dyo n ASN 102 Ca -0.17 0.00 -0.18 0.00 -0.11 0.00 0.00 54.58 54.13 3dyo n ASN 102 Cb 0.55 0.00 -0.09 0.00 1.24 0.00 0.00 39.78 41.48 3dyo n ASN 102 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 3dyo n VAL 103 N -0.84 1.50 -1.81 3.44 0.31 -1.26 -4.02 118.33 115.65 3dyo n VAL 103 Ca 0.00 0.02 -0.42 0.00 -0.01 0.00 0.00 64.34 63.94 3dyo n VAL 103 Cb 0.00 -2.13 -0.02 0.00 -0.91 0.00 0.00 33.84 30.78 3dyo n VAL 103 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3dyo s THR 104 N -2.34 2.17 0.64 2.52 2.01 -1.26 -3.04 115.64 116.34 3dyo s THR 104 Ca -0.26 0.14 -0.18 0.00 0.31 0.00 0.00 61.69 61.70 3dyo s THR 104 Cb 0.05 -3.09 -0.01 0.00 0.01 0.00 0.00 72.50 69.46 3dyo s THR 104 CO 0.49 0.02 1.31 -0.31 -0.69 0.00 0.00 174.62 175.44 3dyo s TYR 105 N 0.14 2.09 -1.29 4.92 1.51 -1.26 -4.86 117.35 118.59 3dyo s TYR 105 Ca 0.64 1.47 0.25 0.00 -1.01 0.00 0.00 57.07 58.41 3dyo s TYR 105 Cb -0.47 -3.72 1.18 0.00 -0.11 0.00 0.00 41.96 38.84 3dyo s TYR 105 CO 0.45 -2.96 1.81 -0.35 -1.11 0.00 0.00 175.55 173.39 3dyo n PRO 106 N -1.81 0.24 -4.34 -1.71 -0.04 -1.26 -4.78 135.00 121.30 3dyo n PRO 106 Ca 0.15 0.06 -0.19 0.00 -0.04 0.00 0.00 63.50 63.49 3dyo n PRO 106 Cb 0.48 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 3dyo n PRO 106 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3dyo s ILE 107 N -2.71 1.72 0.27 0.52 -4.36 -1.26 -5.06 121.20 110.33 3dyo s ILE 107 Ca 0.20 -2.17 -0.30 0.00 -0.26 0.00 0.00 60.65 58.11 3dyo s ILE 107 Cb 0.16 -2.01 -0.12 0.00 1.25 0.00 0.00 42.46 41.74 3dyo s ILE 107 CO 0.40 -0.57 1.53 0.41 0.24 0.00 0.00 174.94 176.95 3dyo n THR 108 N -0.30 0.97 -2.27 8.37 -1.04 -1.26 -4.88 114.28 113.86 3dyo n THR 108 Ca -0.09 -0.24 -0.41 0.00 -2.04 0.00 0.00 64.05 61.27 3dyo n THR 108 Cb 0.60 -1.79 -0.03 0.00 -1.82 0.00 0.00 70.33 67.29 3dyo n THR 108 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dyo s VAL 109 N 0.01 3.63 -0.46 12.58 1.01 -1.26 -4.77 120.40 131.12 3dyo s VAL 109 Ca 0.66 0.49 0.06 0.00 0.00 0.00 0.00 61.98 63.19 3dyo s VAL 109 Cb -0.55 -4.28 0.29 0.00 0.00 0.00 0.00 36.38 31.84 3dyo s VAL 109 CO 0.48 -1.11 1.01 -3.20 0.00 0.00 0.00 175.10 172.28 3dyo n ASN 110 N 10.52 -2.25 -4.69 3.32 5.15 -1.26 -5.10 115.26 120.94 3dyo n ASN 110 Ca 0.14 -3.51 -0.41 0.00 -0.60 0.00 0.00 54.58 50.21 3dyo n ASN 110 Cb 0.50 1.67 0.02 0.00 -0.53 0.00 0.00 39.78 41.44 3dyo n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3dyo n PRO 111 N 0.79 1.80 -1.01 1.20 -0.04 -1.26 -0.20 135.00 136.29 3dyo n PRO 111 Ca 0.09 0.64 -0.07 0.00 -0.04 0.00 0.00 63.50 64.12 3dyo n PRO 111 Cb 0.67 -2.34 0.29 0.00 -0.04 0.00 0.00 33.50 32.08 3dyo n PRO 111 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3dyo n PRO 112 N -0.05 3.49 -2.70 0.54 -0.04 -1.26 -5.10 135.00 129.88 3dyo n PRO 112 Ca 0.07 -3.09 -0.31 0.00 -0.04 0.00 0.00 63.50 60.14 3dyo n PRO 112 Cb 0.40 -2.18 -0.03 0.00 -0.04 0.00 0.00 33.50 31.65 3dyo n PRO 112 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyo s PHE 113 N -3.03 3.47 0.34 0.54 0.40 0.73 -4.36 117.98 116.07 3dyo s PHE 113 Ca 0.54 1.15 0.07 0.00 -0.60 0.00 0.00 56.93 58.09 3dyo s PHE 113 Cb 0.44 -2.54 -0.07 0.00 0.51 0.00 0.00 43.02 41.37 3dyo s PHE 113 CO 0.12 -0.20 -0.02 0.14 0.70 0.00 0.00 175.22 175.97 3dyo s VAL 114 N -2.48 1.75 0.73 -0.44 -7.23 -1.26 -4.51 120.40 106.96 3dyo s VAL 114 Ca 0.53 -2.07 -0.15 0.00 -1.81 0.00 0.00 61.98 58.48 3dyo s VAL 114 Cb -0.10 -2.73 0.04 0.00 0.56 0.00 0.00 36.38 34.14 3dyo s VAL 114 CO 0.33 -0.12 1.20 -2.84 -0.31 0.00 0.00 175.10 173.36 3dyo s PRO 115 N -3.74 2.17 0.19 4.82 0.02 -1.26 -4.90 135.00 132.30 3dyo s PRO 115 Ca 0.33 1.75 0.02 0.00 0.02 0.00 0.00 61.00 63.12 3dyo s PRO 115 Cb 0.07 -1.84 0.09 0.00 0.02 0.00 0.00 34.50 32.84 3dyo s PRO 115 CO 0.15 -1.81 1.45 1.79 -0.33 0.00 0.00 177.00 178.25 3dyo h THR 116 N -0.27 1.42 -2.79 0.99 1.35 -2.00 -3.33 112.91 108.28 3dyo h THR 116 Ca -0.48 -2.28 -0.61 0.00 -0.55 0.00 0.00 66.41 62.50 3dyo h THR 116 Cb 1.29 2.22 -0.13 0.00 -1.73 0.00 0.00 68.15 69.81 3dyo h THR 116 CO 0.50 0.67 0.64 -1.61 -0.25 0.00 0.00 175.52 175.47 3dyo s GLU 117 N -3.49 3.20 -0.31 4.72 2.02 -1.26 -4.69 118.70 118.88 3dyo s GLU 117 Ca -0.04 -0.54 0.01 0.00 0.02 0.00 0.00 54.97 54.42 3dyo s GLU 117 Cb 0.11 -4.16 0.09 0.00 0.10 0.00 0.00 34.13 30.27 3dyo s GLU 117 CO 0.82 -1.76 0.07 1.21 0.02 0.00 0.00 175.26 175.62 3dyo s ASN 118 N 3.41 4.21 -0.02 -0.19 2.47 0.16 -4.98 114.94 120.00 3dyo s ASN 118 Ca 0.27 -1.73 -0.39 0.00 0.42 0.00 0.00 52.86 51.43 3dyo s ASN 118 Cb -0.14 -1.13 -0.18 0.00 -1.45 0.00 0.00 41.25 38.36 3dyo s ASN 118 CO 0.14 -0.38 1.34 -2.65 -3.72 0.00 0.00 177.10 171.83 3dyo n PRO 119 N 4.65 0.79 -4.47 0.43 -0.02 -1.15 -3.22 135.00 132.01 3dyo n PRO 119 Ca -0.01 0.28 -0.29 0.00 -2.02 0.00 0.00 63.50 61.46 3dyo n PRO 119 Cb 0.42 -1.89 -0.17 0.00 -0.02 0.00 0.00 33.50 31.85 3dyo n PRO 119 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dyo s THR 120 N 0.94 1.61 -0.26 3.45 2.01 0.11 -1.22 115.64 122.28 3dyo s THR 120 Ca 0.89 -0.71 -0.10 0.00 0.31 0.00 0.00 61.69 62.09 3dyo s THR 120 Cb -1.08 -1.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.92 3dyo s THR 120 CO 0.54 0.46 0.15 -0.83 -0.69 0.00 0.00 174.62 174.26 3dyo s GLY 121 N 0.98 1.92 -0.44 4.40 0.00 0.68 -1.25 107.32 113.61 3dyo s GLY 121 Ca -0.06 -1.02 -0.10 0.00 0.00 0.00 0.00 44.72 43.54 3dyo s GLY 121 CO -0.02 0.52 0.30 0.00 0.00 0.00 0.00 173.10 173.90 3dyo s TYR 123 N 1.45 3.23 0.11 0.00 1.51 -0.24 -1.25 117.35 122.16 3dyo s TYR 123 Ca 0.04 0.11 -0.14 0.00 -1.01 0.00 0.00 57.07 56.06 3dyo s TYR 123 Cb -0.24 -1.65 0.03 0.00 -0.11 0.00 0.00 41.96 39.99 3dyo s TYR 123 CO 0.02 0.53 0.35 -1.54 -1.11 0.00 0.00 175.55 173.80 3dyo s SER 124 N -2.35 -0.15 -0.16 2.29 1.04 -0.22 -0.01 113.70 114.15 3dyo s SER 124 Ca 0.29 -0.36 -0.13 0.00 0.48 0.00 0.00 55.95 56.24 3dyo s SER 124 Cb -0.12 0.43 0.04 0.00 0.10 0.00 0.00 66.02 66.47 3dyo s SER 124 CO 0.22 -0.80 0.41 -0.22 0.98 0.00 0.00 173.24 173.83 3dyo s LEU 125 N -2.71 0.30 -0.20 2.42 2.96 -0.67 -1.07 118.68 119.71 3dyo s LEU 125 Ca 0.02 0.84 -0.05 0.00 -0.22 0.00 0.00 54.13 54.72 3dyo s LEU 125 Cb 0.02 1.39 -0.02 0.00 0.50 0.00 0.00 46.19 48.07 3dyo s LEU 125 CO -0.11 -0.16 0.00 -0.89 -1.32 0.00 0.00 176.35 173.88 3dyo s THR 126 N 0.52 3.99 0.22 3.68 2.01 -1.26 -0.41 115.64 124.40 3dyo s THR 126 Ca -0.02 -0.30 -0.08 0.00 0.31 0.00 0.00 61.69 61.59 3dyo s THR 126 Cb -0.04 -2.81 -0.02 0.00 0.01 0.00 0.00 72.50 69.64 3dyo s THR 126 CO -0.03 0.43 0.33 0.72 -0.69 0.00 0.00 174.62 175.38 3dyo s PHE 127 N 1.00 0.64 0.06 4.92 -0.12 0.60 -4.95 117.98 120.13 3dyo s PHE 127 Ca 0.02 -0.95 0.01 0.00 -0.05 0.00 0.00 56.93 55.96 3dyo s PHE 127 Cb -0.14 -0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.11 3dyo s PHE 127 CO 0.02 -0.84 0.13 -0.80 -0.05 0.00 0.00 175.22 173.69 3dyo s ASN 128 N -3.06 5.90 -0.05 1.98 -0.87 -1.26 -0.03 114.94 117.55 3dyo s ASN 128 Ca 0.27 0.13 0.02 0.00 -1.57 0.00 0.00 52.86 51.72 3dyo s ASN 128 Cb 0.02 -1.71 0.01 0.00 -0.02 0.00 0.00 41.25 39.56 3dyo s ASN 128 CO 0.09 0.19 -0.11 -0.69 -2.57 0.00 0.00 177.10 174.00 3dyo s VAL 129 N -1.41 1.04 0.42 1.60 1.01 -0.25 -4.96 120.40 117.86 3dyo s VAL 129 Ca 0.31 -0.45 -0.24 0.00 0.00 0.00 0.00 61.98 61.59 3dyo s VAL 129 Cb -0.12 -0.95 -0.08 0.00 0.00 0.00 0.00 36.38 35.23 3dyo s VAL 129 CO 0.23 0.33 1.17 -1.81 0.00 0.00 0.00 175.10 175.02 3dyo s ASP 130 N 0.52 6.38 0.21 3.32 1.11 -1.26 -1.44 116.67 125.52 3dyo s ASP 130 Ca -0.11 2.33 -0.09 0.00 0.18 0.00 0.00 52.55 54.87 3dyo s ASP 130 Cb -0.14 -2.61 0.29 0.00 1.07 0.00 0.00 42.92 41.54 3dyo s ASP 130 CO 0.03 -0.77 1.75 -0.08 1.18 0.00 0.00 175.17 177.27 3dyo h GLU 131 N 2.41 0.43 -0.48 8.23 4.22 -1.95 -1.27 114.58 126.18 3dyo h GLU 131 Ca -0.49 -0.03 0.14 0.00 0.08 0.00 0.00 59.36 59.06 3dyo h GLU 131 Cb 1.24 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 3dyo h GLU 131 CO 0.62 0.28 0.54 0.66 -2.18 0.00 0.00 179.01 178.93 3dyo h SER 132 N 0.44 0.00 1.14 1.04 4.64 -1.98 0.88 113.55 119.71 3dyo h SER 132 Ca 0.32 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.54 3dyo h SER 132 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3dyo h SER 132 CO -0.30 0.00 -0.49 -0.50 -0.87 0.00 0.00 176.83 174.67 3dyo h TRP 133 N 0.00 0.00 0.00 4.77 4.06 -1.52 -3.27 115.95 119.99 3dyo h TRP 133 Ca 0.23 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.18 3dyo h TRP 133 Cb 1.31 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.47 3dyo h TRP 133 CO 0.00 0.49 -1.33 1.28 -3.56 0.00 0.00 178.44 175.32 3dyo n LEU 134 N -3.38 0.46 0.21 -4.49 4.77 0.19 -4.26 117.00 110.50 3dyo n LEU 134 Ca 0.01 -0.27 0.08 0.00 -0.03 0.00 0.00 56.01 55.80 3dyo n LEU 134 Cb 0.64 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.19 3dyo n LEU 134 CO 0.39 0.11 0.78 1.56 -1.33 0.00 0.00 177.39 178.91 3dyo h GLN 135 N 0.00 0.00 -3.33 3.23 4.20 -1.31 -3.45 115.11 114.45 3dyo h GLN 135 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3dyo h GLN 135 Cb 0.63 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.31 3dyo h GLN 135 CO 0.00 0.27 0.02 -1.21 -0.67 0.00 0.00 178.83 177.24 3dyo s GLU 136 N -3.79 1.39 1.34 1.46 0.41 -1.25 -5.12 118.70 113.14 3dyo s GLU 136 Ca -0.01 -0.90 0.00 0.00 -0.41 0.00 0.00 54.97 53.66 3dyo s GLU 136 Cb 0.11 0.52 0.00 0.00 -1.78 0.00 0.00 34.13 32.98 3dyo s GLU 136 CO 0.65 -0.59 0.00 0.41 -0.49 0.00 0.00 175.26 175.24 3dyo n GLY 137 N -0.34 -1.70 3.20 -1.39 0.00 -1.26 -4.75 105.19 98.94 3dyo n GLY 137 Ca -0.09 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.34 3dyo n GLY 137 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyo s GLN 138 N 0.00 2.64 -0.26 1.61 0.74 0.11 -4.81 119.66 119.70 3dyo s GLN 138 Ca 0.00 -0.80 -0.05 0.00 0.05 0.00 0.00 55.36 54.56 3dyo s GLN 138 Cb 0.00 -2.08 0.01 0.00 1.10 0.00 0.00 33.01 32.03 3dyo s GLN 138 CO 0.00 0.21 0.01 0.99 -0.55 0.00 0.00 175.29 175.95 3dyo s THR 139 N 0.23 3.53 0.30 -0.34 2.01 -1.26 -0.82 115.64 119.28 3dyo s THR 139 Ca -0.13 -0.69 0.11 0.00 0.31 0.00 0.00 61.69 61.28 3dyo s THR 139 Cb -0.16 -2.74 -0.05 0.00 0.01 0.00 0.00 72.50 69.55 3dyo s THR 139 CO 0.06 0.22 -0.14 0.00 -0.69 0.00 0.00 174.62 174.08 3dyo s ARG 140 N 1.45 1.81 0.08 4.92 1.70 -0.35 0.76 118.95 129.33 3dyo s ARG 140 Ca 0.03 -1.77 0.08 0.00 -0.47 0.00 0.00 55.73 53.60 3dyo s ARG 140 Cb -0.16 -1.81 -0.04 0.00 -0.57 0.00 0.00 34.95 32.37 3dyo s ARG 140 CO -0.01 0.27 -0.16 -1.50 -1.08 0.00 0.00 175.30 172.82 3dyo s ILE 141 N -2.51 2.97 -0.12 4.99 2.07 -0.03 -1.01 121.20 127.56 3dyo s ILE 141 Ca 0.31 -1.32 -0.00 0.00 -1.41 0.00 0.00 60.65 58.23 3dyo s ILE 141 Cb -0.03 -2.33 0.02 0.00 0.13 0.00 0.00 42.46 40.25 3dyo s ILE 141 CO 0.16 0.19 -0.09 -0.63 -1.91 0.00 0.00 174.94 172.67 3dyo s ILE 142 N -1.08 1.15 -0.44 2.00 1.01 0.26 -1.49 121.20 122.62 3dyo s ILE 142 Ca 0.17 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.36 3dyo s ILE 142 Cb -0.11 -1.14 0.08 0.00 0.01 0.00 0.00 42.46 41.31 3dyo s ILE 142 CO 0.09 0.39 0.30 -0.36 0.00 0.00 0.00 174.94 175.36 3dyo s PHE 143 N 1.65 3.34 0.39 3.97 0.40 -0.53 -1.25 117.98 125.94 3dyo s PHE 143 Ca 0.05 -1.50 0.37 0.00 -0.60 0.00 0.00 56.93 55.25 3dyo s PHE 143 Cb -0.13 -3.09 1.82 0.00 0.51 0.00 0.00 43.02 42.14 3dyo s PHE 143 CO -0.09 -0.87 2.16 -0.44 0.70 0.00 0.00 175.22 176.69 3dyo h ASP 144 N 8.47 0.00 -0.66 1.36 3.32 -0.87 0.11 116.42 128.15 3dyo h ASP 144 Ca -0.23 0.00 0.20 0.00 0.02 0.00 0.00 57.03 57.02 3dyo h ASP 144 Cb 1.09 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.40 3dyo h ASP 144 CO 0.80 0.02 0.23 -0.83 -1.72 0.00 0.00 179.24 177.74 3dyo s GLY 145 N -4.17 -0.19 -0.09 2.75 0.00 -1.26 -3.50 107.32 100.85 3dyo s GLY 145 Ca -0.02 3.02 -0.00 0.00 0.00 0.00 0.00 44.72 47.72 3dyo s GLY 145 CO 0.50 3.45 -0.07 0.14 0.00 0.00 0.00 173.10 177.11 3dyo s VAL 146 N 2.56 0.90 -0.24 1.40 1.01 -1.25 -1.81 120.40 122.98 3dyo s VAL 146 Ca -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 3dyo s VAL 146 Cb -0.07 -0.92 0.01 0.00 0.00 0.00 0.00 36.38 35.40 3dyo s VAL 146 CO -0.15 0.34 -0.05 0.21 0.00 0.00 0.00 175.10 175.44 3dyo s ASN 147 N 1.51 4.30 -0.00 3.32 3.84 -0.33 -4.09 114.94 123.48 3dyo s ASN 147 Ca 0.00 -0.67 0.05 0.00 0.21 0.00 0.00 52.86 52.46 3dyo s ASN 147 Cb -0.13 -1.70 -0.07 0.00 -0.55 0.00 0.00 41.25 38.81 3dyo s ASN 147 CO -0.05 -0.09 0.20 -1.54 -2.79 0.00 0.00 177.10 172.83 3dyo n SER 148 N 4.73 1.17 -3.47 -4.21 3.41 -0.75 -0.88 113.62 113.62 3dyo n SER 148 Ca -0.17 -0.46 -0.13 0.00 -0.26 0.00 0.00 58.87 57.85 3dyo n SER 148 Cb 0.49 1.07 -0.03 0.00 -0.26 0.00 0.00 64.21 65.47 3dyo n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo s ALA 149 N -1.74 -1.71 0.05 7.33 0.00 -1.19 -3.87 121.76 120.62 3dyo s ALA 149 Ca 0.01 0.89 -0.27 0.00 0.00 0.00 0.00 51.96 52.60 3dyo s ALA 149 Cb 0.04 0.44 0.08 0.00 0.00 0.00 0.00 23.12 23.68 3dyo s ALA 149 CO 0.22 -0.61 0.73 -0.59 0.00 0.00 0.00 175.76 175.51 3dyo s PHE 150 N -2.76 -0.49 0.02 0.00 -0.12 -0.71 -0.24 117.98 113.68 3dyo s PHE 150 Ca -0.01 0.48 0.03 0.00 -0.05 0.00 0.00 56.93 57.37 3dyo s PHE 150 Cb -0.01 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 3dyo s PHE 150 CO -0.05 -0.67 -0.05 -1.01 -0.05 0.00 0.00 175.22 173.39 3dyo s HIS 151 N -2.85 2.93 -0.07 3.49 3.76 -0.79 -0.89 115.29 120.86 3dyo s HIS 151 Ca -0.00 -0.02 0.04 0.00 -0.15 0.00 0.00 55.06 54.92 3dyo s HIS 151 Cb -0.01 -1.59 -0.00 0.00 1.11 0.00 0.00 32.58 32.09 3dyo s HIS 151 CO -0.06 0.41 -0.21 -1.17 -0.85 0.00 0.00 174.74 172.86 3dyo s LEU 152 N -1.65 1.97 0.11 0.89 2.96 0.08 -1.13 118.68 121.90 3dyo s LEU 152 Ca 0.19 -0.46 0.10 0.00 -0.22 0.00 0.00 54.13 53.74 3dyo s LEU 152 Cb -0.11 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.33 3dyo s LEU 152 CO 0.10 0.15 -0.25 0.26 -1.32 0.00 0.00 176.35 175.29 3dyo s TRP 153 N 0.24 2.17 -0.07 5.38 0.51 0.11 0.20 118.94 127.48 3dyo s TRP 153 Ca -0.12 -0.39 -0.00 0.00 -2.12 0.00 0.00 56.10 53.47 3dyo s TRP 153 Cb -0.15 -1.19 0.02 0.00 -0.81 0.00 0.00 33.47 31.34 3dyo s TRP 153 CO 0.06 0.28 -0.03 0.00 -0.51 0.00 0.00 176.95 176.74 3dyo n ASN 155 N 4.71 -5.58 0.00 0.00 3.02 0.97 -1.32 115.26 117.06 3dyo n ASN 155 Ca -0.14 -0.58 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 3dyo n ASN 155 Cb 0.50 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.23 3dyo n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyo n GLY 156 N -1.75 1.74 3.61 7.41 0.00 -1.21 -5.01 105.19 109.97 3dyo n GLY 156 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3dyo n GLY 156 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyo s ARG 157 N -0.02 3.09 0.20 1.61 0.52 -0.43 -4.92 118.95 119.00 3dyo s ARG 157 Ca 0.00 -0.47 -0.31 0.00 -0.52 0.00 0.00 55.73 54.43 3dyo s ARG 157 Cb 0.00 -2.77 -0.10 0.00 0.52 0.00 0.00 34.95 32.60 3dyo s ARG 157 CO 0.00 0.58 1.57 -0.46 0.02 0.00 0.00 175.30 177.01 3dyo s TRP 158 N -0.56 3.01 -0.18 -0.53 -0.00 -1.26 -0.84 118.94 118.58 3dyo s TRP 158 Ca 0.09 0.68 -0.07 0.00 -0.00 0.00 0.00 56.10 56.79 3dyo s TRP 158 Cb -0.12 -3.95 -0.08 0.00 -0.00 0.00 0.00 33.47 29.32 3dyo s TRP 158 CO 0.02 -3.41 -0.22 0.28 -0.00 0.00 0.00 176.95 173.62 3dyo n VAL 159 N 3.53 0.99 -3.18 5.86 0.31 0.13 -4.91 118.33 121.07 3dyo n VAL 159 Ca 0.12 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3dyo n VAL 159 Cb 0.38 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 3dyo n VAL 159 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dyo n GLY 160 N 2.01 -1.26 3.19 2.92 0.00 -1.16 -4.73 105.19 106.15 3dyo n GLY 160 Ca -0.35 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 3dyo n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dyo s TYR 161 N -3.00 0.08 0.04 1.61 5.04 -0.47 -0.75 117.35 119.90 3dyo s TYR 161 Ca 0.00 -0.36 -0.21 0.00 -2.44 0.00 0.00 57.07 54.06 3dyo s TYR 161 Cb 0.00 -0.04 0.05 0.00 0.35 0.00 0.00 41.96 42.32 3dyo s TYR 161 CO 0.00 -0.47 0.47 0.20 -1.34 0.00 0.00 175.55 174.42 3dyo s GLY 162 N -2.32 -0.36 0.35 8.97 0.00 -0.06 -1.34 107.32 112.55 3dyo s GLY 162 Ca -0.02 0.51 0.03 0.00 0.00 0.00 0.00 44.72 45.24 3dyo s GLY 162 CO -0.06 0.23 0.09 1.20 0.00 0.00 0.00 173.10 174.56 3dyo s GLN 163 N -2.33 1.72 0.00 2.90 -0.21 -0.27 -1.74 119.66 119.73 3dyo s GLN 163 Ca -0.06 -1.99 0.00 0.00 0.02 0.00 0.00 55.36 53.33 3dyo s GLN 163 Cb -0.01 -0.65 0.00 0.00 1.00 0.00 0.00 33.01 33.35 3dyo s GLN 163 CO -0.01 -0.32 0.00 -3.47 -2.12 0.00 0.00 175.29 169.37 3dyo n ASP 164 N -0.89 -1.50 0.00 5.90 -0.08 -1.25 -4.94 116.55 113.79 3dyo n ASP 164 Ca -0.03 0.00 0.03 0.00 -1.51 0.00 0.00 54.79 53.28 3dyo n ASP 164 Cb 0.66 -0.75 0.15 0.00 2.34 0.00 0.00 41.12 43.51 3dyo n ASP 164 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3dyo n SER 165 N 0.00 0.01 -0.11 1.67 7.64 -1.26 -3.45 113.62 118.11 3dyo n SER 165 Ca 0.00 0.50 0.06 0.00 1.01 0.00 0.00 58.87 60.44 3dyo n SER 165 Cb 0.00 -0.50 0.09 0.00 -1.01 0.00 0.00 64.21 62.78 3dyo n SER 165 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dyo n ARG 166 N -1.51 2.16 -4.16 1.43 5.12 -1.26 -3.84 116.66 114.59 3dyo n ARG 166 Ca 0.02 -2.12 -0.16 0.00 -1.93 0.00 0.00 57.85 53.65 3dyo n ARG 166 Cb 0.08 -1.30 -0.11 0.00 -1.16 0.00 0.00 32.46 29.96 3dyo n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3dyo s LEU 167 N -2.00 2.32 0.34 0.55 1.43 -1.22 -4.45 118.68 115.64 3dyo s LEU 167 Ca 0.19 -0.68 -0.27 0.00 -1.03 0.00 0.00 54.13 52.33 3dyo s LEU 167 Cb 0.16 -0.41 -0.09 0.00 0.03 0.00 0.00 46.19 45.88 3dyo s LEU 167 CO 0.03 -0.15 1.18 -2.16 0.23 0.00 0.00 176.35 175.48 3dyo s PRO 168 N -2.10 4.32 -0.20 1.29 0.04 -1.23 -4.47 135.00 132.65 3dyo s PRO 168 Ca -0.00 1.93 -0.04 0.00 0.04 0.00 0.00 61.00 62.93 3dyo s PRO 168 Cb -0.08 -2.94 -0.01 0.00 0.04 0.00 0.00 34.50 31.51 3dyo s PRO 168 CO 0.01 -0.12 -0.05 -1.12 0.04 0.00 0.00 177.00 175.77 3dyo s SER 169 N -0.88 4.37 0.05 6.66 0.01 0.37 -4.96 113.70 119.32 3dyo s SER 169 Ca 0.51 -0.34 0.08 0.00 1.31 0.00 0.00 55.95 57.51 3dyo s SER 169 Cb -0.33 -1.74 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 3dyo s SER 169 CO 0.43 0.02 -0.22 -1.61 0.41 0.00 0.00 173.24 172.28 3dyo s GLU 170 N 1.22 1.92 -0.00 12.44 2.02 -1.26 -1.46 118.70 133.58 3dyo s GLU 170 Ca 0.03 -1.06 -0.00 0.00 0.02 0.00 0.00 54.97 53.95 3dyo s GLU 170 Cb -0.14 -2.09 -0.00 0.00 0.10 0.00 0.00 34.13 31.99 3dyo s GLU 170 CO -0.01 0.52 0.01 -0.06 0.02 0.00 0.00 175.26 175.74 3dyo s PHE 171 N -0.90 0.02 -0.32 1.61 0.40 -0.55 -0.67 117.98 117.57 3dyo s PHE 171 Ca 0.14 -0.04 -0.26 0.00 -0.60 0.00 0.00 56.93 56.17 3dyo s PHE 171 Cb -0.10 -0.02 0.01 0.00 0.51 0.00 0.00 43.02 43.42 3dyo s PHE 171 CO 0.04 -0.03 0.90 0.34 0.70 0.00 0.00 175.22 177.17 3dyo s ASP 172 N -0.18 6.76 0.00 1.36 -1.08 -1.26 -0.85 116.67 121.42 3dyo s ASP 172 Ca -0.02 0.78 0.21 0.00 -0.52 0.00 0.00 52.55 53.00 3dyo s ASP 172 Cb -0.01 -2.46 0.54 0.00 -1.46 0.00 0.00 42.92 39.53 3dyo s ASP 172 CO -0.00 -0.73 1.46 0.18 0.52 0.00 0.00 175.17 176.59 3dyo n LEU 173 N 6.49 3.68 -0.31 -1.34 4.77 0.23 -4.64 117.00 125.87 3dyo n LEU 173 Ca 0.07 -1.86 0.17 0.00 -0.03 0.00 0.00 56.01 54.35 3dyo n LEU 173 Cb 0.48 -0.39 0.35 0.00 -2.33 0.00 0.00 43.42 41.53 3dyo n LEU 173 CO 0.54 0.89 1.00 0.28 -1.33 0.00 0.00 177.39 178.77 3dyo h SER 174 N 4.01 0.17 0.21 -1.43 0.02 -1.75 0.31 113.55 115.09 3dyo h SER 174 Ca 0.00 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3dyo h SER 174 Cb 0.95 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3dyo h SER 174 CO 0.00 -0.15 -0.09 0.00 -1.14 0.00 0.00 176.83 175.45 3dyo n ALA 175 N -2.58 2.76 0.14 3.77 0.00 -1.26 -4.00 120.51 119.33 3dyo n ALA 175 Ca 0.25 -0.31 0.06 0.00 0.00 0.00 0.00 53.44 53.43 3dyo n ALA 175 Cb 0.78 -1.30 -0.08 0.00 0.00 0.00 0.00 19.45 18.85 3dyo n ALA 175 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3dyo n PHE 176 N -0.68 0.00 -3.10 0.00 3.01 0.06 -5.05 117.46 111.70 3dyo n PHE 176 Ca 0.16 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.39 3dyo n PHE 176 Cb 0.28 -0.19 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 3dyo n PHE 176 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dyo s LEU 177 N -3.45 3.77 0.14 4.37 1.43 -0.96 -4.73 118.68 119.25 3dyo s LEU 177 Ca -0.02 0.36 0.05 0.00 -1.03 0.00 0.00 54.13 53.49 3dyo s LEU 177 Cb 0.08 -3.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.02 3dyo s LEU 177 CO 0.47 -0.56 -0.11 0.00 0.23 0.00 0.00 176.35 176.39 3dyo s ARG 178 N -4.48 1.02 0.35 1.70 1.70 -1.26 -5.04 118.95 112.94 3dyo s ARG 178 Ca 0.45 -1.38 -0.28 0.00 -0.47 0.00 0.00 55.73 54.06 3dyo s ARG 178 Cb -0.10 -0.65 -0.10 0.00 -0.57 0.00 0.00 34.95 33.54 3dyo s ARG 178 CO 0.37 0.09 1.30 0.00 -1.08 0.00 0.00 175.30 175.98 3dyo s ALA 179 N -3.02 3.43 0.00 7.88 0.00 -1.26 -4.57 121.76 124.22 3dyo s ALA 179 Ca 0.14 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.33 3dyo s ALA 179 Cb 0.01 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 3dyo s ALA 179 CO 0.01 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.51 3dyo n GLY 180 N 0.76 0.83 3.75 0.00 0.00 -0.52 -4.92 105.19 105.10 3dyo n GLY 180 Ca 0.01 -1.68 -0.40 0.00 0.00 0.00 0.00 46.02 43.95 3dyo n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyo s GLU 181 N 0.00 4.54 0.10 1.61 2.02 -1.26 -1.09 118.70 124.62 3dyo s GLU 181 Ca 0.00 1.13 0.03 0.00 0.02 0.00 0.00 54.97 56.15 3dyo s GLU 181 Cb 0.00 -3.34 -0.04 0.00 0.10 0.00 0.00 34.13 30.85 3dyo s GLU 181 CO 0.00 0.35 -0.08 -0.80 0.02 0.00 0.00 175.26 174.75 3dyo s ASN 182 N -0.34 1.29 -0.11 -0.19 0.01 0.95 -4.83 114.94 111.72 3dyo s ASN 182 Ca 0.39 -0.90 0.00 0.00 -0.71 0.00 0.00 52.86 51.64 3dyo s ASN 182 Cb -0.21 0.05 0.02 0.00 0.41 0.00 0.00 41.25 41.52 3dyo s ASN 182 CO 0.25 -0.36 -0.09 -0.60 -1.51 0.00 0.00 177.10 174.79 3dyo s ARG 183 N -3.25 1.66 0.08 -0.60 3.52 -1.26 -0.29 118.95 118.80 3dyo s ARG 183 Ca 0.08 -0.32 -0.11 0.00 -0.13 0.00 0.00 55.73 55.25 3dyo s ARG 183 Cb 0.01 -1.63 -0.06 0.00 -1.56 0.00 0.00 34.95 31.70 3dyo s ARG 183 CO -0.02 -0.22 0.42 -0.51 -0.81 0.00 0.00 175.30 174.16 3dyo s LEU 184 N 1.53 4.37 -0.06 -0.88 1.43 0.45 -0.02 118.68 125.49 3dyo s LEU 184 Ca 0.02 0.87 0.01 0.00 -1.03 0.00 0.00 54.13 54.00 3dyo s LEU 184 Cb -0.13 -2.96 0.02 0.00 0.03 0.00 0.00 46.19 43.15 3dyo s LEU 184 CO -0.07 0.19 -0.06 0.00 0.23 0.00 0.00 176.35 176.64 3dyo s ALA 185 N -1.35 0.85 -0.10 4.21 0.00 -0.32 -1.67 121.76 123.38 3dyo s ALA 185 Ca 0.32 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.10 3dyo s ALA 185 Cb -0.15 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.46 3dyo s ALA 185 CO 0.17 -0.08 -0.09 0.08 0.00 0.00 0.00 175.76 175.85 3dyo s VAL 186 N 1.05 1.06 -0.40 0.00 1.01 0.99 0.05 120.40 124.17 3dyo s VAL 186 Ca -0.09 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.46 3dyo s VAL 186 Cb -0.14 -1.05 0.06 0.00 0.00 0.00 0.00 36.38 35.24 3dyo s VAL 186 CO -0.01 0.37 0.23 -0.32 0.00 0.00 0.00 175.10 175.37 3dyo s MET 187 N 1.47 2.70 -0.24 2.72 1.75 -0.29 -1.08 119.30 126.34 3dyo s MET 187 Ca 0.01 -1.29 -0.11 0.00 -1.25 0.00 0.00 55.69 53.05 3dyo s MET 187 Cb -0.13 -3.75 -0.05 0.00 2.84 0.00 0.00 34.83 33.74 3dyo s MET 187 CO -0.06 -0.84 0.17 0.08 -0.65 0.00 0.00 175.02 173.72 3dyo s VAL 188 N 1.48 5.35 -0.12 10.11 1.01 0.76 -1.89 120.40 137.10 3dyo s VAL 188 Ca 0.02 0.20 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 3dyo s VAL 188 Cb -0.21 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 3dyo s VAL 188 CO 0.04 0.34 0.25 -0.76 0.00 0.00 0.00 175.10 174.97 3dyo s LEU 189 N 1.11 4.34 0.05 3.92 1.43 0.67 -0.23 118.68 129.96 3dyo s LEU 189 Ca 0.08 0.57 -0.23 0.00 -1.03 0.00 0.00 54.13 53.52 3dyo s LEU 189 Cb -0.14 -2.30 -0.15 0.00 0.03 0.00 0.00 46.19 43.63 3dyo s LEU 189 CO 0.05 0.25 1.51 -0.09 0.23 0.00 0.00 176.35 178.30 3dyo h ARG 190 N 5.73 0.12 -6.31 1.70 2.43 -1.42 -1.99 114.38 114.64 3dyo h ARG 190 Ca -0.48 -0.03 -0.66 0.00 -0.81 0.00 0.00 59.98 58.00 3dyo h ARG 190 Cb 1.19 -0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 30.58 3dyo h ARG 190 CO 0.67 0.34 -0.68 -1.58 -1.51 0.00 0.00 179.97 177.21 3dyo s TRP 191 N -5.15 2.94 0.33 2.20 0.52 -1.26 -3.92 118.94 114.61 3dyo s TRP 191 Ca -0.14 -0.02 -0.16 0.00 0.02 0.00 0.00 56.10 55.79 3dyo s TRP 191 Cb 0.05 -1.58 0.03 0.00 -1.15 0.00 0.00 33.47 30.82 3dyo s TRP 191 CO 0.69 0.43 0.71 -1.54 0.02 0.00 0.00 176.95 177.26 3dyo s SER 192 N -1.80 -0.02 0.63 2.95 1.04 -1.26 -4.92 113.70 110.32 3dyo s SER 192 Ca 0.21 -0.97 0.41 0.00 0.48 0.00 0.00 55.95 56.07 3dyo s SER 192 Cb -0.11 0.77 2.08 0.00 0.10 0.00 0.00 66.02 68.86 3dyo s SER 192 CO 0.12 -1.49 2.25 -2.24 0.98 0.00 0.00 173.24 172.86 3dyo h ASP 193 N 2.03 0.00 0.63 7.02 3.04 -1.14 0.11 116.42 128.11 3dyo h ASP 193 Ca -0.27 0.00 -0.03 0.00 -3.24 0.00 0.00 57.03 53.49 3dyo h ASP 193 Cb 1.25 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.53 3dyo h ASP 193 CO 0.34 0.00 -0.14 1.23 -2.04 0.00 0.00 179.24 178.63 3dyo h GLY 194 N 0.65 0.00 2.00 7.15 0.00 -1.90 -2.62 103.07 108.34 3dyo h GLY 194 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3dyo h GLY 194 CO 0.00 0.00 -0.11 1.76 0.00 0.00 0.00 176.54 178.19 3dyo h SER 195 N 0.00 0.00 0.01 0.19 0.02 -1.13 -0.83 113.55 111.81 3dyo h SER 195 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3dyo h SER 195 Cb 0.49 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.03 3dyo h SER 195 CO 0.02 0.11 -0.00 1.88 -1.14 0.00 0.00 176.83 177.70 3dyo h TYR 196 N 0.00 0.00 -0.43 3.45 -1.99 -1.59 -1.77 116.97 114.63 3dyo h TYR 196 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3dyo h TYR 196 Cb 0.23 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 3dyo h TYR 196 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 3dyo n LEU 197 N -3.47 3.18 -2.42 3.88 4.77 -0.34 -4.42 117.00 118.18 3dyo n LEU 197 Ca -0.03 -2.01 -0.24 0.00 -0.03 0.00 0.00 56.01 53.70 3dyo n LEU 197 Cb 0.08 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 40.88 3dyo n LEU 197 CO 0.24 0.79 0.15 -0.62 -1.33 0.00 0.00 177.39 176.62 3dyo n GLU 198 N 0.75 3.19 -1.13 3.23 1.02 -0.67 -0.83 120.64 126.20 3dyo n GLU 198 Ca 0.15 -4.28 -0.25 0.00 -0.02 0.00 0.00 57.16 52.75 3dyo n GLU 198 Cb 0.48 -2.14 0.11 0.00 -0.02 0.00 0.00 31.44 29.87 3dyo n GLU 198 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dyo n ASP 199 N -0.49 5.60 -4.76 1.62 2.03 0.22 -4.96 116.55 115.81 3dyo n ASP 199 Ca 0.36 -3.49 -0.36 0.00 0.52 0.00 0.00 54.79 51.82 3dyo n ASP 199 Cb 0.74 -0.90 0.02 0.00 -0.72 0.00 0.00 41.12 40.26 3dyo n ASP 199 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3dyo s GLN 200 N -3.06 3.14 -1.00 -0.67 1.11 -1.26 -4.58 119.66 113.35 3dyo s GLN 200 Ca 0.52 1.77 -0.23 0.00 0.01 0.00 0.00 55.36 57.43 3dyo s GLN 200 Cb 0.42 -1.99 0.02 0.00 -1.01 0.00 0.00 33.01 30.45 3dyo s GLN 200 CO 0.04 -1.06 1.62 0.34 0.01 0.00 0.00 175.29 176.24 3dyo s ASP 201 N -1.61 6.09 0.07 5.90 2.15 -1.26 -4.81 116.67 123.20 3dyo s ASP 201 Ca 0.75 -1.27 -0.28 0.00 0.43 0.00 0.00 52.55 52.19 3dyo s ASP 201 Cb -0.29 -2.57 0.09 0.00 -0.30 0.00 0.00 42.92 39.86 3dyo s ASP 201 CO 0.32 -1.89 1.12 0.00 -0.17 0.00 0.00 175.17 174.55 3dyo s MET 202 N 5.57 0.81 0.47 4.34 0.23 -1.25 -5.02 119.30 124.44 3dyo s MET 202 Ca 0.54 -0.45 -0.25 0.00 -1.03 0.00 0.00 55.69 54.50 3dyo s MET 202 Cb -0.02 0.27 -0.08 0.00 -1.53 0.00 0.00 34.83 33.48 3dyo s MET 202 CO -0.06 -0.37 1.42 -1.58 -2.03 0.00 0.00 175.02 172.40 3dyo s TRP 203 N -2.84 2.42 -0.45 3.16 0.52 -1.26 -4.32 118.94 116.16 3dyo s TRP 203 Ca 0.13 1.28 -0.15 0.00 0.02 0.00 0.00 56.10 57.38 3dyo s TRP 203 Cb 0.02 -3.90 0.06 0.00 -1.15 0.00 0.00 33.47 28.49 3dyo s TRP 203 CO -0.01 -2.94 0.37 1.03 0.02 0.00 0.00 176.95 175.42 3dyo s ARG 204 N -2.53 2.98 0.09 4.98 1.81 0.11 -4.93 118.95 121.45 3dyo s ARG 204 Ca 0.63 -1.25 0.00 0.00 -1.72 0.00 0.00 55.73 53.39 3dyo s ARG 204 Cb -0.43 -4.09 -0.00 0.00 -0.45 0.00 0.00 34.95 29.98 3dyo s ARG 204 CO 0.55 -0.94 0.00 -1.33 -0.68 0.00 0.00 175.30 172.90 3dyo n MET 205 N 5.19 1.73 -3.71 3.54 2.81 -1.26 -2.71 117.12 122.71 3dyo n MET 205 Ca -0.12 -0.65 -0.07 0.00 -1.81 0.00 0.00 57.70 55.05 3dyo n MET 205 Cb 0.45 0.18 -0.02 0.00 -0.71 0.00 0.00 33.22 33.12 3dyo n MET 205 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3dyo s SER 206 N -1.49 -0.32 0.00 7.83 1.04 -1.26 -4.80 113.70 114.70 3dyo s SER 206 Ca 0.00 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.06 3dyo s SER 206 Cb 0.00 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.74 3dyo s SER 206 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 3dyo n GLY 207 N -0.42 1.36 3.46 7.32 0.00 -0.05 -2.00 105.19 114.85 3dyo n GLY 207 Ca -0.08 -2.15 -0.44 0.00 0.00 0.00 0.00 46.02 43.36 3dyo n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dyo s ILE 208 N -1.23 4.76 -2.75 -0.61 1.01 -1.19 -1.19 121.20 120.00 3dyo s ILE 208 Ca 0.00 -1.84 0.24 0.00 0.00 0.00 0.00 60.65 59.05 3dyo s ILE 208 Cb 0.00 -4.84 0.18 0.00 0.01 0.00 0.00 42.46 37.81 3dyo s ILE 208 CO 0.00 -1.57 1.27 2.22 0.00 0.00 0.00 174.94 176.86 3dyo n PHE 209 N 6.45 0.00 -4.55 3.97 1.16 -0.75 -1.10 117.46 122.63 3dyo n PHE 209 Ca 0.28 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.61 3dyo n PHE 209 Cb 0.47 -0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.24 3dyo n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3dyo s ARG 210 N -2.10 1.85 0.75 3.97 0.52 -1.05 -4.31 118.95 118.57 3dyo s ARG 210 Ca 0.27 -2.05 -0.15 0.00 -0.52 0.00 0.00 55.73 53.27 3dyo s ARG 210 Cb 0.20 -1.26 0.05 0.00 0.52 0.00 0.00 34.95 34.45 3dyo s ARG 210 CO 0.36 -0.15 1.24 -0.51 0.02 0.00 0.00 175.30 176.26 3dyo s ASP 211 N -3.62 3.98 -0.08 0.23 1.01 -1.26 -4.47 116.67 112.46 3dyo s ASP 211 Ca 0.33 2.46 0.04 0.00 0.71 0.00 0.00 52.55 56.09 3dyo s ASP 211 Cb 0.09 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.40 3dyo s ASP 211 CO 0.16 -2.41 -0.20 -0.69 0.21 0.00 0.00 175.17 172.23 3dyo s VAL 212 N -1.87 2.45 0.17 -1.27 1.01 -1.26 -0.26 120.40 119.37 3dyo s VAL 212 Ca 0.77 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.71 3dyo s VAL 212 Cb -0.32 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.13 3dyo s VAL 212 CO 0.46 0.56 0.39 -0.94 0.00 0.00 0.00 175.10 175.57 3dyo s SER 213 N -0.05 -0.10 -0.08 3.32 1.04 -0.38 -0.35 113.70 117.10 3dyo s SER 213 Ca -0.06 -0.64 0.05 0.00 0.48 0.00 0.00 55.95 55.78 3dyo s SER 213 Cb -0.14 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.46 3dyo s SER 213 CO 0.05 -0.95 -0.24 -0.76 0.98 0.00 0.00 173.24 172.32 3dyo s LEU 214 N -2.91 2.07 -0.10 2.42 1.02 0.05 -0.57 118.68 120.67 3dyo s LEU 214 Ca 0.12 -0.53 0.03 0.00 0.02 0.00 0.00 54.13 53.76 3dyo s LEU 214 Cb 0.01 -1.37 0.01 0.00 0.02 0.00 0.00 46.19 44.86 3dyo s LEU 214 CO -0.03 0.19 -0.19 -0.22 0.02 0.00 0.00 176.35 176.12 3dyo s LEU 215 N 0.14 1.89 -0.21 1.79 2.96 -0.18 -0.83 118.68 124.25 3dyo s LEU 215 Ca -0.12 -0.46 -0.07 0.00 -0.22 0.00 0.00 54.13 53.25 3dyo s LEU 215 Cb -0.16 -1.18 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 3dyo s LEU 215 CO 0.07 0.09 0.07 -2.28 -1.32 0.00 0.00 176.35 172.97 3dyo s HIS 216 N 0.61 3.19 0.15 5.38 5.65 -0.36 -1.21 115.29 128.71 3dyo s HIS 216 Ca -0.14 -0.07 0.09 0.00 0.25 0.00 0.00 55.06 55.19 3dyo s HIS 216 Cb -0.16 -2.13 -0.04 0.00 -1.18 0.00 0.00 32.58 29.06 3dyo s HIS 216 CO 0.04 -0.01 -0.20 0.15 -0.65 0.00 0.00 174.74 174.07 3dyo s LYS 217 N 0.79 1.28 0.80 2.88 -0.14 -0.00 -4.71 119.74 120.64 3dyo s LYS 217 Ca 0.04 -1.36 -0.11 0.00 -1.36 0.00 0.00 55.97 53.18 3dyo s LYS 217 Cb -0.13 -1.46 0.07 0.00 -1.68 0.00 0.00 37.83 34.63 3dyo s LYS 217 CO 0.02 0.31 1.09 -1.25 -0.76 0.00 0.00 175.35 174.77 3dyo s PRO 218 N -2.50 2.06 0.20 -1.68 0.04 -1.26 0.09 135.00 131.95 3dyo s PRO 218 Ca 0.14 1.04 -0.10 0.00 0.04 0.00 0.00 61.00 62.12 3dyo s PRO 218 Cb -0.07 -1.88 0.14 0.00 0.04 0.00 0.00 34.50 32.72 3dyo s PRO 218 CO 0.06 -1.74 1.82 1.15 0.04 0.00 0.00 177.00 178.33 3dyo h THR 219 N -1.20 1.22 -3.59 1.26 2.02 -1.93 -3.35 112.91 107.35 3dyo h THR 219 Ca -0.45 -0.53 -0.65 0.00 0.77 0.00 0.00 66.41 65.55 3dyo h THR 219 Cb 1.24 0.26 -0.15 0.00 -1.74 0.00 0.00 68.15 67.76 3dyo h THR 219 CO 0.53 0.24 0.03 -0.89 0.37 0.00 0.00 175.52 175.80 3dyo s THR 220 N -5.87 4.95 0.18 3.16 2.01 -1.26 -4.00 115.64 114.80 3dyo s THR 220 Ca -0.13 0.32 -0.08 0.00 0.31 0.00 0.00 61.69 62.11 3dyo s THR 220 Cb 0.15 -4.05 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 3dyo s THR 220 CO 0.79 -0.34 0.27 0.00 -0.69 0.00 0.00 174.62 174.66 3dyo s GLN 221 N 2.55 1.21 -0.25 4.92 -2.07 -0.64 -4.90 119.66 120.47 3dyo s GLN 221 Ca 0.21 -1.28 -0.29 0.00 -1.82 0.00 0.00 55.36 52.18 3dyo s GLN 221 Cb -0.15 0.36 -0.00 0.00 -1.09 0.00 0.00 33.01 32.13 3dyo s GLN 221 CO 0.15 -0.44 1.24 0.42 -1.32 0.00 0.00 175.29 175.34 3dyo s ILE 222 N -4.01 4.28 -0.46 3.63 1.01 -1.26 -2.05 121.20 122.34 3dyo s ILE 222 Ca 0.22 1.50 0.18 0.00 0.00 0.00 0.00 60.65 62.55 3dyo s ILE 222 Cb 0.04 -4.16 -0.24 0.00 0.01 0.00 0.00 42.46 38.11 3dyo s ILE 222 CO 0.03 -0.34 0.60 -1.54 0.00 0.00 0.00 174.94 173.69 3dyo n SER 223 N 7.09 0.79 -3.58 3.58 3.41 -0.14 -4.93 113.62 119.84 3dyo n SER 223 Ca 0.14 -0.48 -0.07 0.00 -0.26 0.00 0.00 58.87 58.20 3dyo n SER 223 Cb 0.46 1.41 -0.03 0.00 -0.26 0.00 0.00 64.21 65.79 3dyo n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dyo s ASP 224 N -3.41 -0.24 -0.18 4.04 -1.08 -1.17 -4.87 116.67 109.75 3dyo s ASP 224 Ca 0.00 0.13 -0.21 0.00 -0.52 0.00 0.00 52.55 51.96 3dyo s ASP 224 Cb 0.13 0.23 0.05 0.00 -1.46 0.00 0.00 42.92 41.87 3dyo s ASP 224 CO 0.76 -0.32 0.56 0.72 0.52 0.00 0.00 175.17 177.41 3dyo s PHE 225 N -1.96 -0.59 -0.05 -5.34 -0.12 -1.26 -0.83 117.98 107.82 3dyo s PHE 225 Ca 0.05 1.38 0.03 0.00 -0.05 0.00 0.00 56.93 58.34 3dyo s PHE 225 Cb -0.01 0.23 0.00 0.00 -0.63 0.00 0.00 43.02 42.61 3dyo s PHE 225 CO -0.04 -0.34 -0.14 -1.01 -0.05 0.00 0.00 175.22 173.64 3dyo s HIS 226 N 0.01 1.49 -0.11 3.49 3.76 -0.34 -4.82 115.29 118.78 3dyo s HIS 226 Ca -0.02 -0.48 0.02 0.00 -0.15 0.00 0.00 55.06 54.42 3dyo s HIS 226 Cb -0.04 -1.05 -0.01 0.00 1.11 0.00 0.00 32.58 32.59 3dyo s HIS 226 CO 0.02 -0.21 -0.16 0.08 -0.85 0.00 0.00 174.74 173.62 3dyo s VAL 227 N 0.34 2.78 0.08 -0.90 1.01 -1.26 -0.75 120.40 121.70 3dyo s VAL 227 Ca -0.09 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.16 3dyo s VAL 227 Cb -0.13 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 3dyo s VAL 227 CO 0.03 0.54 -0.11 0.00 0.00 0.00 0.00 175.10 175.56 3dyo s ALA 228 N 0.17 1.06 -0.07 5.51 0.00 -0.17 -4.83 121.76 123.43 3dyo s ALA 228 Ca -0.09 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.80 3dyo s ALA 228 Cb -0.15 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 22.98 3dyo s ALA 228 CO 0.06 0.03 -0.05 0.95 0.00 0.00 0.00 175.76 176.75 3dyo s THR 229 N -1.91 0.70 0.26 0.00 -4.23 -1.26 -0.50 115.64 108.70 3dyo s THR 229 Ca 0.01 -0.15 0.11 0.00 -1.18 0.00 0.00 61.69 60.48 3dyo s THR 229 Cb -0.06 -0.75 -0.05 0.00 1.34 0.00 0.00 72.50 72.98 3dyo s THR 229 CO 0.01 0.29 -0.19 0.00 -0.54 0.00 0.00 174.62 174.18 3dyo s ARG 230 N 1.37 1.60 0.22 3.99 1.70 -0.19 -4.87 118.95 122.77 3dyo s ARG 230 Ca -0.03 -1.71 0.00 0.00 -0.47 0.00 0.00 55.73 53.52 3dyo s ARG 230 Cb -0.13 -1.66 -0.05 0.00 -0.57 0.00 0.00 34.95 32.54 3dyo s ARG 230 CO -0.03 0.31 0.10 -0.06 -1.08 0.00 0.00 175.30 174.54 3dyo s PHE 231 N -2.49 1.33 0.87 5.89 0.40 -1.26 -0.92 117.98 121.79 3dyo s PHE 231 Ca 0.28 -1.25 -0.11 0.00 -0.60 0.00 0.00 56.93 55.24 3dyo s PHE 231 Cb -0.05 -0.73 0.16 0.00 0.51 0.00 0.00 43.02 42.92 3dyo s PHE 231 CO 0.13 -0.46 1.20 0.54 0.70 0.00 0.00 175.22 177.33 3dyo s ASN 232 N -3.23 3.67 0.30 1.36 4.22 -0.89 -4.94 114.94 115.43 3dyo s ASN 232 Ca 0.37 0.15 0.03 0.00 -2.14 0.00 0.00 52.86 51.27 3dyo s ASN 232 Cb 0.07 -0.36 0.62 0.00 1.28 0.00 0.00 41.25 42.87 3dyo s ASN 232 CO 0.12 -2.35 1.85 -2.24 -2.04 0.00 0.00 177.10 172.43 3dyo h ASP 233 N -1.22 0.86 -0.46 3.54 3.04 -2.02 -2.41 116.42 117.75 3dyo h ASP 233 Ca -0.42 0.05 0.00 0.00 -3.24 0.00 0.00 57.03 53.41 3dyo h ASP 233 Cb 1.26 -0.13 0.00 0.00 -1.04 0.00 0.00 39.33 39.42 3dyo h ASP 233 CO 0.42 0.45 0.00 -0.90 -2.04 0.00 0.00 179.24 177.17 3dyo n ASP 234 N -4.60 3.48 -0.85 4.15 5.68 -1.26 -4.97 116.55 118.17 3dyo n ASP 234 Ca 0.18 -2.16 -0.10 0.00 -0.50 0.00 0.00 54.79 52.21 3dyo n ASP 234 Cb 0.38 -0.36 -0.04 0.00 -1.14 0.00 0.00 41.12 39.96 3dyo n ASP 234 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3dyo n PHE 235 N 0.73 -0.08 1.18 2.11 3.01 -0.91 -4.89 117.46 118.61 3dyo n PHE 235 Ca 0.17 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.76 3dyo n PHE 235 Cb 0.57 -2.05 0.30 0.00 -0.01 0.00 0.00 39.48 38.29 3dyo n PHE 235 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3dyo n SER 236 N 0.29 1.08 -3.94 4.37 3.41 -1.26 -4.62 113.62 112.94 3dyo n SER 236 Ca -0.11 -0.89 -0.10 0.00 -0.26 0.00 0.00 58.87 57.52 3dyo n SER 236 Cb 0.38 0.22 -0.12 0.00 -0.26 0.00 0.00 64.21 64.43 3dyo n SER 236 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyo s ARG 237 N -2.58 0.27 0.11 4.33 0.52 -1.26 0.75 118.95 121.08 3dyo s ARG 237 Ca 0.21 -0.43 -0.09 0.00 -0.52 0.00 0.00 55.73 54.91 3dyo s ARG 237 Cb 0.19 0.10 -0.00 0.00 0.52 0.00 0.00 34.95 35.76 3dyo s ARG 237 CO 0.56 -0.05 0.22 0.00 0.02 0.00 0.00 175.30 176.05 3dyo s ALA 238 N -1.10 -0.22 -0.11 2.13 0.00 0.16 -2.10 121.76 120.53 3dyo s ALA 238 Ca -0.12 -0.64 -0.00 0.00 0.00 0.00 0.00 51.96 51.20 3dyo s ALA 238 Cb -0.07 0.57 0.02 0.00 0.00 0.00 0.00 23.12 23.64 3dyo s ALA 238 CO -0.00 -0.54 -0.08 0.08 0.00 0.00 0.00 175.76 175.21 3dyo s VAL 239 N -3.88 1.05 -0.23 0.00 1.01 -0.10 0.60 120.40 118.85 3dyo s VAL 239 Ca 0.07 -0.32 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 3dyo s VAL 239 Cb 0.04 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3dyo s VAL 239 CO -0.09 0.37 0.31 -0.22 0.00 0.00 0.00 175.10 175.47 3dyo s LEU 240 N 1.56 4.12 -0.13 3.92 0.20 0.21 -1.03 118.68 127.53 3dyo s LEU 240 Ca 0.02 0.33 0.03 0.00 0.69 0.00 0.00 54.13 55.19 3dyo s LEU 240 Cb -0.13 -2.35 0.00 0.00 -0.43 0.00 0.00 46.19 43.28 3dyo s LEU 240 CO -0.07 -0.05 -0.22 -0.70 -0.29 0.00 0.00 176.35 175.03 3dyo s GLU 241 N 1.39 3.07 -0.20 1.98 2.12 0.35 0.06 118.70 127.47 3dyo s GLU 241 Ca 0.14 -0.84 0.01 0.00 0.36 0.00 0.00 54.97 54.64 3dyo s GLU 241 Cb -0.15 -2.41 0.03 0.00 0.26 0.00 0.00 34.13 31.86 3dyo s GLU 241 CO 0.07 0.08 -0.15 0.00 -0.54 0.00 0.00 175.26 174.72 3dyo s ALA 242 N 0.61 2.24 -0.07 6.30 0.00 0.37 -1.00 121.76 130.21 3dyo s ALA 242 Ca -0.12 -1.29 -0.18 0.00 0.00 0.00 0.00 51.96 50.38 3dyo s ALA 242 Cb -0.16 -1.28 -0.05 0.00 0.00 0.00 0.00 23.12 21.63 3dyo s ALA 242 CO 0.03 -0.65 0.48 -2.00 0.00 0.00 0.00 175.76 173.62 3dyo s GLU 243 N 1.30 4.24 -0.03 0.00 2.12 0.07 -1.02 118.70 125.38 3dyo s GLU 243 Ca 0.00 0.48 0.04 0.00 0.36 0.00 0.00 54.97 55.86 3dyo s GLU 243 Cb -0.15 -3.37 -0.01 0.00 0.26 0.00 0.00 34.13 30.87 3dyo s GLU 243 CO -0.10 0.33 -0.15 0.08 -0.54 0.00 0.00 175.26 174.88 3dyo s VAL 244 N 0.05 1.25 0.16 3.70 1.01 0.11 -1.20 120.40 125.47 3dyo s VAL 244 Ca 0.26 -0.64 0.10 0.00 0.00 0.00 0.00 61.98 61.70 3dyo s VAL 244 Cb -0.16 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 3dyo s VAL 244 CO 0.12 0.36 -0.21 -1.10 0.00 0.00 0.00 175.10 174.27 3dyo s GLN 245 N -0.13 1.62 0.22 2.72 -0.21 -0.01 -1.76 119.66 122.11 3dyo s GLN 245 Ca 0.01 -1.39 0.08 0.00 0.02 0.00 0.00 55.36 54.09 3dyo s GLN 245 Cb -0.08 -1.95 -0.05 0.00 1.00 0.00 0.00 33.01 31.92 3dyo s GLN 245 CO 0.01 0.43 -0.15 0.00 -2.12 0.00 0.00 175.29 173.46 3dyo s MET 246 N -2.47 1.40 0.10 2.91 0.23 -0.17 -0.97 119.30 120.33 3dyo s MET 246 Ca 0.19 -1.63 0.08 0.00 -1.03 0.00 0.00 55.69 53.30 3dyo s MET 246 Cb -0.09 -1.23 -0.03 0.00 -1.53 0.00 0.00 34.83 31.95 3dyo s MET 246 CO 0.10 0.20 -0.20 0.00 -2.03 0.00 0.00 175.02 173.09 3dyo n GLY 248 N 1.08 -1.24 3.65 0.00 0.00 -1.26 -1.63 105.19 105.80 3dyo n GLY 248 Ca -0.20 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.21 3dyo n GLY 248 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyo s GLU 249 N -0.31 4.12 0.22 1.61 2.12 -1.26 -4.99 118.70 120.21 3dyo s GLU 249 Ca 0.00 1.54 -0.30 0.00 0.36 0.00 0.00 54.97 56.57 3dyo s GLU 249 Cb 0.00 -3.81 -0.09 0.00 0.26 0.00 0.00 34.13 30.49 3dyo s GLU 249 CO 0.00 -0.86 1.19 -0.51 -0.54 0.00 0.00 175.26 174.54 3dyo s LEU 250 N 3.83 4.47 -0.00 2.70 1.43 -1.26 -5.01 118.68 124.85 3dyo s LEU 250 Ca 0.56 2.30 0.03 0.00 -1.03 0.00 0.00 54.13 55.98 3dyo s LEU 250 Cb -0.20 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.39 3dyo s LEU 250 CO 0.18 -0.34 -0.08 -0.13 0.23 0.00 0.00 176.35 176.21 3dyo s ARG 251 N -0.69 0.66 0.58 1.70 1.81 -1.26 -5.02 118.95 116.73 3dyo s ARG 251 Ca 0.51 -0.32 0.39 0.00 -1.72 0.00 0.00 55.73 54.58 3dyo s ARG 251 Cb -0.33 -0.63 1.99 0.00 -0.45 0.00 0.00 34.95 35.53 3dyo s ARG 251 CO 0.39 0.17 2.17 -0.44 -0.68 0.00 0.00 175.30 176.92 3dyo h ASP 252 N 5.86 0.00 1.36 0.23 3.32 -2.00 -1.32 116.42 123.87 3dyo h ASP 252 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 3dyo h ASP 252 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3dyo h ASP 252 CO 0.49 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.01 3dyo n TYR 253 N -2.93 0.82 -2.08 4.55 0.18 -1.26 -4.87 117.16 111.58 3dyo n TYR 253 Ca -0.02 0.24 -0.35 0.00 1.88 0.00 0.00 57.90 59.66 3dyo n TYR 253 Cb 0.12 -0.90 0.02 0.00 -0.38 0.00 0.00 39.34 38.20 3dyo n TYR 253 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3dyo s LEU 254 N -4.35 3.65 0.08 -3.48 1.43 -0.50 -1.27 118.68 114.25 3dyo s LEU 254 Ca 0.11 2.22 -0.07 0.00 -1.03 0.00 0.00 54.13 55.35 3dyo s LEU 254 Cb 0.13 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.76 3dyo s LEU 254 CO 0.57 -1.44 0.16 -0.13 0.23 0.00 0.00 176.35 175.74 3dyo s ARG 255 N -3.44 0.81 -0.02 1.70 1.81 0.04 -4.17 118.95 115.68 3dyo s ARG 255 Ca 0.73 -1.00 0.06 0.00 -1.72 0.00 0.00 55.73 53.80 3dyo s ARG 255 Cb -0.26 0.32 -0.01 0.00 -0.45 0.00 0.00 34.95 34.55 3dyo s ARG 255 CO 0.32 -0.25 -0.19 0.08 -0.68 0.00 0.00 175.30 174.58 3dyo s VAL 256 N -3.87 1.51 -0.08 3.52 1.01 -0.19 -1.21 120.40 121.09 3dyo s VAL 256 Ca 0.06 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3dyo s VAL 256 Cb 0.05 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.17 3dyo s VAL 256 CO -0.11 0.43 -0.20 -0.89 0.00 0.00 0.00 175.10 174.33 3dyo s THR 257 N -0.36 1.76 -0.13 3.92 2.01 -0.05 -1.57 115.64 121.22 3dyo s THR 257 Ca 0.05 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.21 3dyo s THR 257 Cb -0.08 -1.53 -0.00 0.00 0.01 0.00 0.00 72.50 70.89 3dyo s THR 257 CO -0.00 0.49 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.56 3dyo s VAL 258 N 0.31 2.53 0.05 3.82 1.01 0.03 -0.89 120.40 127.27 3dyo s VAL 258 Ca -0.14 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.08 3dyo s VAL 258 Cb -0.16 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 3dyo s VAL 258 CO 0.06 0.53 -0.21 -0.94 0.00 0.00 0.00 175.10 174.55 3dyo s SER 259 N 0.57 2.46 -0.05 3.32 1.04 -0.55 -1.08 113.70 119.42 3dyo s SER 259 Ca -0.11 -0.54 0.06 0.00 0.48 0.00 0.00 55.95 55.84 3dyo s SER 259 Cb -0.16 -0.19 -0.02 0.00 0.10 0.00 0.00 66.02 65.75 3dyo s SER 259 CO 0.04 0.14 -0.23 -0.22 0.98 0.00 0.00 173.24 173.95 3dyo s LEU 260 N -1.27 2.22 0.07 2.42 2.96 0.31 -0.85 118.68 124.54 3dyo s LEU 260 Ca 0.07 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.61 3dyo s LEU 260 Cb -0.09 -1.41 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 3dyo s LEU 260 CO 0.02 0.29 -0.17 0.26 -1.32 0.00 0.00 176.35 175.43 3dyo s TRP 261 N -0.40 1.43 -0.29 5.38 0.52 -0.58 -0.30 118.94 124.68 3dyo s TRP 261 Ca 0.04 -0.42 0.03 0.00 0.02 0.00 0.00 56.10 55.76 3dyo s TRP 261 Cb -0.12 -0.81 0.08 0.00 -1.15 0.00 0.00 33.47 31.47 3dyo s TRP 261 CO 0.02 0.10 -0.03 -1.14 0.02 0.00 0.00 176.95 175.91 3dyo s GLN 262 N -1.65 1.84 5.50 4.98 -0.44 0.18 -0.53 119.66 129.53 3dyo s GLN 262 Ca 0.02 -1.55 0.00 0.00 -2.50 0.00 0.00 55.36 51.33 3dyo s GLN 262 Cb -0.10 -2.99 0.00 0.00 -1.64 0.00 0.00 33.01 28.29 3dyo s GLN 262 CO 0.03 -0.74 0.00 0.41 0.50 0.00 0.00 175.29 175.48 3dyo n GLY 263 N 4.38 2.35 0.48 2.59 0.00 -1.26 -1.07 105.19 112.66 3dyo n GLY 263 Ca -0.06 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.53 3dyo n GLY 263 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dyo n GLU 264 N 13.31 1.61 -4.19 1.61 4.71 -1.26 -4.82 120.64 131.62 3dyo n GLU 264 Ca 0.00 -0.94 -0.34 0.00 -0.01 0.00 0.00 57.16 55.87 3dyo n GLU 264 Cb 0.00 -1.27 -0.12 0.00 -1.01 0.00 0.00 31.44 29.04 3dyo n GLU 264 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 3dyo s THR 265 N -1.71 4.09 -0.27 2.62 2.01 -0.23 -5.06 115.64 117.10 3dyo s THR 265 Ca 0.23 -0.28 -0.26 0.00 0.31 0.00 0.00 61.69 61.69 3dyo s THR 265 Cb 0.12 -2.83 0.00 0.00 0.01 0.00 0.00 72.50 69.81 3dyo s THR 265 CO 0.17 0.46 0.93 -1.58 -0.69 0.00 0.00 174.62 173.91 3dyo s GLN 266 N 0.64 4.13 -0.02 4.92 0.74 -1.26 0.51 119.66 129.33 3dyo s GLN 266 Ca -0.00 1.01 0.21 0.00 0.05 0.00 0.00 55.36 56.63 3dyo s GLN 266 Cb -0.14 -3.68 -0.29 0.00 1.10 0.00 0.00 33.01 30.00 3dyo s GLN 266 CO 0.02 -0.66 0.68 1.33 -0.55 0.00 0.00 175.29 176.11 3dyo n VAL 267 N 5.45 0.00 -3.52 1.34 0.24 0.58 -4.95 118.33 117.48 3dyo n VAL 267 Ca 0.08 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.34 62.02 3dyo n VAL 267 Cb 0.47 0.48 -0.03 0.00 -1.47 0.00 0.00 33.84 33.29 3dyo n VAL 267 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dyo s ALA 268 N -3.26 -1.84 -0.02 2.33 0.00 -1.09 -4.98 121.76 112.89 3dyo s ALA 268 Ca -0.00 1.19 -0.30 0.00 0.00 0.00 0.00 51.96 52.85 3dyo s ALA 268 Cb 0.15 0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.40 3dyo s ALA 268 CO 0.89 -0.55 0.69 0.45 0.00 0.00 0.00 175.76 177.24 3dyo s SER 269 N -1.96 -0.62 -0.04 0.00 0.15 -1.26 -0.53 113.70 109.44 3dyo s SER 269 Ca 0.01 0.57 -0.16 0.00 0.70 0.00 0.00 55.95 57.08 3dyo s SER 269 Cb -0.01 0.53 0.03 0.00 -1.71 0.00 0.00 66.02 64.86 3dyo s SER 269 CO -0.04 -0.65 0.35 -0.83 1.20 0.00 0.00 173.24 173.27 3dyo s GLY 270 N -1.45 -0.21 0.02 9.45 0.00 -0.24 -4.98 107.32 109.92 3dyo s GLY 270 Ca -0.08 0.53 0.02 0.00 0.00 0.00 0.00 44.72 45.19 3dyo s GLY 270 CO 0.05 0.32 -0.08 -1.59 0.00 0.00 0.00 173.10 171.80 3dyo s THR 271 N -1.04 0.60 0.07 0.90 2.01 -1.26 -0.79 115.64 116.13 3dyo s THR 271 Ca -0.11 -0.75 -0.25 0.00 0.31 0.00 0.00 61.69 60.89 3dyo s THR 271 Cb -0.04 -0.59 0.07 0.00 0.01 0.00 0.00 72.50 71.95 3dyo s THR 271 CO 0.04 -0.13 0.60 0.00 -0.69 0.00 0.00 174.62 174.44 3dyo s ALA 272 N -0.82 -1.57 0.70 7.40 0.00 -0.61 -4.98 121.76 121.89 3dyo s ALA 272 Ca -0.03 0.74 -0.08 0.00 0.00 0.00 0.00 51.96 52.58 3dyo s ALA 272 Cb -0.07 0.52 0.05 0.00 0.00 0.00 0.00 23.12 23.62 3dyo s ALA 272 CO 0.00 -0.59 1.04 -1.25 0.00 0.00 0.00 175.76 174.96 3dyo s PRO 273 N -2.73 2.42 0.71 0.00 0.04 -1.26 -1.03 135.00 133.15 3dyo s PRO 273 Ca -0.04 0.00 -0.12 0.00 0.04 0.00 0.00 61.00 60.88 3dyo s PRO 273 Cb -0.01 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.44 3dyo s PRO 273 CO -0.04 -1.17 1.09 -0.06 0.04 0.00 0.00 177.00 176.87 3dyo s PHE 274 N -3.28 2.70 0.00 0.56 0.40 -1.26 -4.86 117.98 112.24 3dyo s PHE 274 Ca 0.59 1.53 0.00 0.00 -0.60 0.00 0.00 56.93 58.45 3dyo s PHE 274 Cb -0.11 -3.06 0.00 0.00 0.51 0.00 0.00 43.02 40.36 3dyo s PHE 274 CO 0.47 -1.63 0.00 0.41 0.70 0.00 0.00 175.22 175.17 3dyo n GLY 275 N -1.08 2.05 3.92 4.36 0.00 0.34 -4.95 105.19 109.83 3dyo n GLY 275 Ca 0.09 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 3dyo n GLY 275 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dyo s GLY 276 N 0.00 1.66 0.95 -0.02 0.00 0.14 -4.80 107.32 105.25 3dyo s GLY 276 Ca 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 44.72 43.74 3dyo s GLY 276 CO 0.00 -0.31 1.10 -1.83 0.00 0.00 0.00 173.10 172.06 3dyo s GLU 277 N -5.60 0.79 0.24 2.90 -1.05 -1.26 -4.44 118.70 110.28 3dyo s GLU 277 Ca 0.65 1.15 -0.30 0.00 -0.15 0.00 0.00 54.97 56.32 3dyo s GLU 277 Cb -0.09 -1.73 -0.10 0.00 -0.44 0.00 0.00 34.13 31.77 3dyo s GLU 277 CO 0.49 -2.66 1.50 0.42 0.95 0.00 0.00 175.26 175.97 3dyo s ILE 278 N -2.71 2.50 -0.16 1.83 -1.09 -1.26 -4.33 121.20 115.97 3dyo s ILE 278 Ca 0.66 0.41 -0.03 0.00 -2.23 0.00 0.00 60.65 59.45 3dyo s ILE 278 Cb -0.21 -3.26 -0.09 0.00 -1.58 0.00 0.00 42.46 37.32 3dyo s ILE 278 CO 0.59 0.06 -0.17 -0.38 -1.23 0.00 0.00 174.94 173.81 3dyo n ILE 279 N 2.61 0.90 -3.43 2.92 2.08 0.99 -4.90 119.36 120.53 3dyo n ILE 279 Ca 0.08 -0.30 0.00 0.00 0.56 0.00 0.00 62.75 63.10 3dyo n ILE 279 Cb 0.39 -1.33 0.00 0.00 -0.75 0.00 0.00 39.64 37.95 3dyo n ILE 279 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 3dyo n ASP 280 N -3.29 0.00 0.32 4.38 5.68 -0.61 -5.00 116.55 118.04 3dyo n ASP 280 Ca -0.30 -0.98 0.20 0.00 -0.50 0.00 0.00 54.79 53.22 3dyo n ASP 280 Cb 0.77 0.00 1.11 0.00 -1.14 0.00 0.00 41.12 41.86 3dyo n ASP 280 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3dyo h GLU 281 N 0.00 0.00 -0.01 0.11 3.07 -2.05 -0.31 114.58 115.39 3dyo h GLU 281 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3dyo h GLU 281 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3dyo h GLU 281 CO 0.00 0.00 -0.15 0.54 -1.40 0.00 0.00 179.01 178.00 3dyo n ARG 282 N -3.24 1.37 0.00 2.33 5.12 -1.26 -5.06 116.66 115.92 3dyo n ARG 282 Ca -0.03 -0.89 0.00 0.00 -1.93 0.00 0.00 57.85 55.00 3dyo n ARG 282 Cb 0.12 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 29.94 3dyo n ARG 282 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3dyo n GLY 283 N 1.28 0.10 0.00 -0.13 0.00 -0.13 -5.06 105.19 101.25 3dyo n GLY 283 Ca 0.15 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.26 3dyo n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 284 N 0.00 4.26 3.54 -0.02 0.00 -1.26 -0.01 105.19 111.70 3dyo n GLY 284 Ca 0.00 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 3dyo n GLY 284 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dyo s TYR 285 N -1.71 3.03 0.03 1.61 1.51 -1.26 -4.90 117.35 115.66 3dyo s TYR 285 Ca 0.00 0.11 0.29 0.00 -1.01 0.00 0.00 57.07 56.45 3dyo s TYR 285 Cb 0.00 -3.53 1.06 0.00 -0.11 0.00 0.00 41.96 39.38 3dyo s TYR 285 CO 0.00 -0.93 1.87 0.00 -1.11 0.00 0.00 175.55 175.39 3dyo h ALA 286 N 8.91 1.00 -0.57 3.71 0.00 -1.94 0.41 119.26 130.78 3dyo h ALA 286 Ca -0.25 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3dyo h ALA 286 Cb 1.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3dyo h ALA 286 CO 0.93 0.10 0.00 -0.40 0.00 0.00 0.00 179.25 179.89 3dyo n ASP 287 N -3.19 5.05 -4.15 0.00 5.75 -1.26 -3.26 116.55 115.49 3dyo n ASP 287 Ca 0.01 -2.68 -0.10 0.00 -0.01 0.00 0.00 54.79 52.01 3dyo n ASP 287 Cb 0.39 -0.63 -0.10 0.00 -1.03 0.00 0.00 41.12 39.74 3dyo n ASP 287 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3dyo s ARG 288 N -2.31 0.90 -0.12 0.11 0.52 -1.17 -0.99 118.95 115.88 3dyo s ARG 288 Ca 0.50 -1.42 -0.29 0.00 -0.52 0.00 0.00 55.73 53.99 3dyo s ARG 288 Cb 0.36 0.21 0.08 0.00 0.52 0.00 0.00 34.95 36.12 3dyo s ARG 288 CO 0.18 -0.24 0.76 0.54 0.02 0.00 0.00 175.30 176.57 3dyo s VAL 289 N -4.01 0.00 -0.07 3.52 0.11 -0.72 0.13 120.40 119.35 3dyo s VAL 289 Ca 0.22 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.30 3dyo s VAL 289 Cb 0.07 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.93 3dyo s VAL 289 CO 0.01 0.00 -0.16 -0.89 -3.33 0.00 0.00 175.10 170.73 3dyo s THR 290 N -0.82 1.39 -0.04 5.04 2.01 -1.26 0.07 115.64 122.04 3dyo s THR 290 Ca -0.07 -0.64 -0.00 0.00 0.31 0.00 0.00 61.69 61.30 3dyo s THR 290 Cb -0.01 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 3dyo s THR 290 CO 0.06 0.41 0.00 -0.76 -0.69 0.00 0.00 174.62 173.64 3dyo s LEU 291 N 0.52 3.55 -0.12 4.42 2.01 -0.19 -4.92 118.68 123.94 3dyo s LEU 291 Ca -0.15 0.07 0.01 0.00 0.01 0.00 0.00 54.13 54.08 3dyo s LEU 291 Cb -0.16 -1.92 0.02 0.00 0.01 0.00 0.00 46.19 44.13 3dyo s LEU 291 CO 0.05 0.33 -0.16 -0.13 1.01 0.00 0.00 176.35 177.45 3dyo s ARG 292 N -1.22 2.32 -0.08 1.70 0.52 -1.26 -0.47 118.95 120.46 3dyo s ARG 292 Ca 0.16 -0.59 0.04 0.00 -0.52 0.00 0.00 55.73 54.83 3dyo s ARG 292 Cb -0.11 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.33 3dyo s ARG 292 CO 0.06 -0.11 -0.21 -0.51 0.02 0.00 0.00 175.30 174.55 3dyo s LEU 293 N 1.13 2.27 0.12 2.53 1.43 0.11 -4.92 118.68 121.35 3dyo s LEU 293 Ca -0.03 -0.45 -0.24 0.00 -1.03 0.00 0.00 54.13 52.38 3dyo s LEU 293 Cb -0.14 -1.45 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 3dyo s LEU 293 CO -0.05 0.23 0.73 0.20 0.23 0.00 0.00 176.35 177.70 3dyo s ASN 294 N -0.06 7.29 -0.18 2.29 0.02 -1.26 -0.62 114.94 122.41 3dyo s ASN 294 Ca -0.06 1.53 -0.01 0.00 -1.02 0.00 0.00 52.86 53.30 3dyo s ASN 294 Cb -0.14 -2.46 0.05 0.00 0.02 0.00 0.00 41.25 38.71 3dyo s ASN 294 CO 0.05 0.18 -0.01 -0.69 0.02 0.00 0.00 177.10 176.64 3dyo s VAL 295 N -0.90 0.89 0.04 1.60 1.01 0.20 -4.89 120.40 118.35 3dyo s VAL 295 Ca 0.35 -0.64 -0.23 0.00 0.00 0.00 0.00 61.98 61.46 3dyo s VAL 295 Cb -0.22 -1.21 -0.06 0.00 0.00 0.00 0.00 36.38 34.90 3dyo s VAL 295 CO 0.24 -0.03 0.69 -1.61 0.00 0.00 0.00 175.10 174.39 3dyo s GLU 296 N 1.71 4.42 -1.32 2.72 0.41 -1.26 -0.66 118.70 124.71 3dyo s GLU 296 Ca -0.01 0.93 -0.18 0.00 -0.41 0.00 0.00 54.97 55.31 3dyo s GLU 296 Cb -0.16 -3.34 0.02 0.00 -1.78 0.00 0.00 34.13 28.87 3dyo s GLU 296 CO -0.07 0.37 0.48 0.09 -0.49 0.00 0.00 175.26 175.63 3dyo n ASN 297 N 2.59 -2.35 -4.74 -0.19 4.13 0.23 -4.89 115.26 110.04 3dyo n ASN 297 Ca -0.05 -1.20 -0.35 0.00 1.68 0.00 0.00 54.58 54.66 3dyo n ASN 297 Cb 0.50 -2.18 0.06 0.00 -1.54 0.00 0.00 39.78 36.62 3dyo n ASN 297 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 3dyo s PRO 298 N -7.03 2.63 -0.29 3.52 0.04 -1.26 -4.93 135.00 127.67 3dyo s PRO 298 Ca 0.28 1.82 -0.25 0.00 0.04 0.00 0.00 61.00 62.88 3dyo s PRO 298 Cb -0.14 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.52 3dyo s PRO 298 CO 0.95 -1.47 0.87 0.15 0.04 0.00 0.00 177.00 177.54 3dyo s LYS 299 N -3.57 4.04 0.40 4.56 1.02 -1.26 -4.99 119.74 119.94 3dyo s LYS 299 Ca 0.77 0.80 -0.22 0.00 0.02 0.00 0.00 55.97 57.33 3dyo s LYS 299 Cb -0.30 -3.71 -0.11 0.00 -0.52 0.00 0.00 37.83 33.19 3dyo s LYS 299 CO 0.39 -0.70 0.94 -0.51 -0.92 0.00 0.00 175.35 174.54 3dyo s LEU 300 N 3.11 4.03 -0.02 3.17 1.43 -1.26 -4.47 118.68 124.67 3dyo s LEU 300 Ca 0.36 1.70 -0.12 0.00 -1.03 0.00 0.00 54.13 55.04 3dyo s LEU 300 Cb -0.14 -4.41 -0.05 0.00 0.03 0.00 0.00 46.19 41.62 3dyo s LEU 300 CO 0.12 -0.29 0.35 0.86 0.23 0.00 0.00 176.35 177.61 3dyo s TRP 301 N -2.05 3.68 0.28 0.29 -0.00 0.08 -3.98 118.94 117.23 3dyo s TRP 301 Ca 0.59 0.86 -0.17 0.00 -0.00 0.00 0.00 56.10 57.38 3dyo s TRP 301 Cb -0.11 -2.19 0.01 0.00 -0.00 0.00 0.00 33.47 31.18 3dyo s TRP 301 CO 0.15 0.65 0.64 -1.54 -0.00 0.00 0.00 176.95 176.85 3dyo s SER 302 N -1.17 -0.16 0.46 5.86 1.04 -0.59 -4.62 113.70 114.51 3dyo s SER 302 Ca 0.23 -0.77 0.24 0.00 0.48 0.00 0.00 55.95 56.13 3dyo s SER 302 Cb -0.15 0.69 1.08 0.00 0.10 0.00 0.00 66.02 67.74 3dyo s SER 302 CO 0.12 -1.30 1.91 0.00 0.98 0.00 0.00 173.24 174.95 3dyo h ALA 303 N 2.09 1.13 -0.13 5.32 0.00 -1.92 -2.02 119.26 123.72 3dyo h ALA 303 Ca -0.22 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.30 3dyo h ALA 303 Cb 1.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.01 3dyo h ALA 303 CO 0.29 0.26 -0.66 0.93 0.00 0.00 0.00 179.25 180.07 3dyo h GLU 304 N 0.00 0.68 -2.43 0.00 5.08 -1.94 -3.41 114.58 112.56 3dyo h GLU 304 Ca -0.00 -0.56 -0.48 0.00 -1.00 0.00 0.00 59.36 57.32 3dyo h GLU 304 Cb 0.61 0.12 -0.37 0.00 0.50 0.00 0.00 28.75 29.61 3dyo h GLU 304 CO 0.03 1.17 -0.76 0.42 -1.00 0.00 0.00 179.01 178.87 3dyo s ILE 305 N -3.72 -0.11 -1.48 3.13 1.01 -1.12 -4.99 121.20 113.93 3dyo s ILE 305 Ca -0.11 -1.11 -0.09 0.00 0.00 0.00 0.00 60.65 59.34 3dyo s ILE 305 Cb 0.07 -0.97 -0.09 0.00 0.01 0.00 0.00 42.46 41.48 3dyo s ILE 305 CO 0.87 -0.75 2.91 -0.81 0.00 0.00 0.00 174.94 177.16 3dyo n PRO 306 N 4.61 3.46 -1.74 2.79 -0.04 -0.78 -1.55 135.00 141.75 3dyo n PRO 306 Ca 0.05 -2.06 -0.42 0.00 -0.04 0.00 0.00 63.50 61.03 3dyo n PRO 306 Cb 0.42 -2.72 -0.02 0.00 -0.04 0.00 0.00 33.50 31.13 3dyo n PRO 306 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3dyo s ASN 307 N 2.29 6.35 0.05 3.54 0.01 -1.26 -4.87 114.94 121.05 3dyo s ASN 307 Ca 0.67 2.95 0.05 0.00 -0.71 0.00 0.00 52.86 55.81 3dyo s ASN 307 Cb 0.18 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.19 3dyo s ASN 307 CO -0.05 -0.95 -0.14 -0.76 -1.51 0.00 0.00 177.10 173.69 3dyo s LEU 308 N -0.00 2.21 0.47 0.60 1.43 -1.26 -4.16 118.68 117.97 3dyo s LEU 308 Ca 0.67 -0.50 0.06 0.00 -1.03 0.00 0.00 54.13 53.32 3dyo s LEU 308 Cb -0.49 -0.55 -0.01 0.00 0.03 0.00 0.00 46.19 45.17 3dyo s LEU 308 CO 0.43 -0.01 0.23 -0.31 0.23 0.00 0.00 176.35 176.92 3dyo s TYR 309 N -0.99 2.15 -0.13 0.29 1.51 -0.15 -4.68 117.35 115.35 3dyo s TYR 309 Ca -0.00 -0.74 0.02 0.00 -1.01 0.00 0.00 57.07 55.34 3dyo s TYR 309 Cb -0.08 -1.89 0.01 0.00 -0.11 0.00 0.00 41.96 39.89 3dyo s TYR 309 CO 0.01 -0.03 -0.20 0.50 -1.11 0.00 0.00 175.55 174.73 3dyo s ARG 310 N -4.03 2.73 -0.13 -0.62 6.06 0.31 -0.57 118.95 122.70 3dyo s ARG 310 Ca 0.32 -0.75 -0.05 0.00 -2.50 0.00 0.00 55.73 52.75 3dyo s ARG 310 Cb 0.01 -2.23 -0.04 0.00 0.06 0.00 0.00 34.95 32.76 3dyo s ARG 310 CO 0.19 -0.02 0.05 0.00 -2.50 0.00 0.00 175.30 173.02 3dyo s ALA 311 N 0.84 3.43 -0.12 6.12 0.00 0.03 -1.53 121.76 130.52 3dyo s ALA 311 Ca -0.08 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.16 3dyo s ALA 311 Cb -0.15 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.22 3dyo s ALA 311 CO -0.01 0.42 -0.22 0.08 0.00 0.00 0.00 175.76 176.03 3dyo s VAL 312 N -0.37 2.15 -0.33 0.00 1.01 -0.03 -1.36 120.40 121.48 3dyo s VAL 312 Ca 0.09 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 3dyo s VAL 312 Cb -0.12 -1.84 0.05 0.00 0.00 0.00 0.00 36.38 34.46 3dyo s VAL 312 CO 0.02 0.55 0.07 -0.69 0.00 0.00 0.00 175.10 175.05 3dyo s VAL 313 N 0.58 3.46 -0.19 2.92 1.01 0.16 -1.48 120.40 126.86 3dyo s VAL 313 Ca -0.13 -1.28 -0.09 0.00 0.00 0.00 0.00 61.98 60.48 3dyo s VAL 313 Cb -0.17 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 3dyo s VAL 313 CO 0.04 -0.19 0.10 -1.61 0.00 0.00 0.00 175.10 173.43 3dyo s GLU 314 N 1.33 4.07 -0.24 2.72 2.02 -0.07 -1.15 118.70 127.39 3dyo s GLU 314 Ca -0.02 -0.29 -0.10 0.00 0.02 0.00 0.00 54.97 54.58 3dyo s GLU 314 Cb -0.20 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.67 3dyo s GLU 314 CO 0.01 0.27 0.14 -1.17 0.02 0.00 0.00 175.26 174.54 3dyo s LEU 315 N 0.40 3.96 0.00 1.80 2.96 -0.10 -0.87 118.68 126.83 3dyo s LEU 315 Ca 0.05 0.04 -0.03 0.00 -0.22 0.00 0.00 54.13 53.97 3dyo s LEU 315 Cb -0.12 -2.07 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3dyo s LEU 315 CO -0.01 0.04 0.27 0.00 -1.32 0.00 0.00 176.35 175.34 3dyo n HIS 316 N 4.46 -1.22 -4.01 5.38 1.44 -0.35 -0.50 115.22 120.42 3dyo n HIS 316 Ca -0.15 -0.91 -0.21 0.00 -2.01 0.00 0.00 57.72 54.44 3dyo n HIS 316 Cb 0.52 0.32 -0.03 0.00 0.12 0.00 0.00 29.99 30.92 3dyo n HIS 316 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 3dyo s THR 317 N -2.61 4.87 0.35 0.61 -4.23 -0.69 -0.78 115.64 113.17 3dyo s THR 317 Ca 0.10 -1.16 0.06 0.00 -1.18 0.00 0.00 61.69 59.51 3dyo s THR 317 Cb -0.01 -3.66 0.30 0.00 1.34 0.00 0.00 72.50 70.47 3dyo s THR 317 CO 0.07 -0.33 1.92 0.00 -0.54 0.00 0.00 174.62 175.74 3dyo h ALA 318 N 1.29 1.73 0.00 3.99 0.00 -1.50 0.66 119.26 125.42 3dyo h ALA 318 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3dyo h ALA 318 Cb 1.23 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3dyo h ALA 318 CO 0.61 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.56 3dyo n ASP 319 N -4.51 0.00 0.00 0.00 5.68 -1.26 -4.84 116.55 111.62 3dyo n ASP 319 Ca 0.13 -0.08 0.00 0.00 -0.50 0.00 0.00 54.79 54.35 3dyo n ASP 319 Cb 0.31 -0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 3dyo n ASP 319 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dyo n GLY 320 N 0.31 0.86 3.71 6.12 0.00 0.23 -5.07 105.19 111.36 3dyo n GLY 320 Ca 0.10 -0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.42 3dyo n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyo s THR 321 N -2.00 5.18 0.26 2.61 2.01 -1.24 -4.83 115.64 117.63 3dyo s THR 321 Ca 0.00 0.94 -0.29 0.00 0.31 0.00 0.00 61.69 62.64 3dyo s THR 321 Cb 0.00 -3.82 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 3dyo s THR 321 CO 0.00 0.30 1.17 -0.22 -0.69 0.00 0.00 174.62 175.18 3dyo s LEU 322 N 0.84 4.50 -0.25 4.42 2.96 -1.26 -1.71 118.68 128.18 3dyo s LEU 322 Ca 0.25 2.35 -0.15 0.00 -0.22 0.00 0.00 54.13 56.35 3dyo s LEU 322 Cb -0.15 -3.63 -0.11 0.00 0.50 0.00 0.00 46.19 42.80 3dyo s LEU 322 CO 0.10 -0.29 -0.30 -0.38 -1.32 0.00 0.00 176.35 174.16 3dyo n ILE 323 N 1.50 1.52 -3.63 6.68 5.41 0.35 -4.94 119.36 126.26 3dyo n ILE 323 Ca 0.01 -0.24 -0.05 0.00 1.00 0.00 0.00 62.75 63.47 3dyo n ILE 323 Cb 0.44 -2.00 -0.02 0.00 -0.71 0.00 0.00 39.64 37.35 3dyo n ILE 323 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3dyo s GLU 324 N -2.57 0.94 0.02 0.38 -1.05 -0.99 -4.86 118.70 110.56 3dyo s GLU 324 Ca -0.35 -0.45 0.01 0.00 -0.15 0.00 0.00 54.97 54.03 3dyo s GLU 324 Cb 0.12 0.37 -0.01 0.00 -0.44 0.00 0.00 34.13 34.16 3dyo s GLU 324 CO 0.48 -0.42 -0.05 0.00 0.95 0.00 0.00 175.26 176.22 3dyo s ALA 325 N -3.12 0.38 0.36 -0.84 0.00 0.26 -0.93 121.76 117.88 3dyo s ALA 325 Ca 0.09 -0.43 0.07 0.00 0.00 0.00 0.00 51.96 51.69 3dyo s ALA 325 Cb -0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 23.03 3dyo s ALA 325 CO -0.04 0.01 -0.02 -1.21 0.00 0.00 0.00 175.76 174.51 3dyo s GLU 326 N -0.79 1.83 0.07 0.00 0.41 -0.30 -1.37 118.70 118.56 3dyo s GLU 326 Ca -0.05 -2.00 -0.27 0.00 -0.41 0.00 0.00 54.97 52.24 3dyo s GLU 326 Cb -0.06 -1.48 0.08 0.00 -1.78 0.00 0.00 34.13 30.90 3dyo s GLU 326 CO -0.00 -0.01 0.93 0.00 -0.49 0.00 0.00 175.26 175.69 3dyo s ALA 327 N -2.81 -1.75 0.21 5.21 0.00 -1.26 -0.66 121.76 120.69 3dyo s ALA 327 Ca 0.34 0.57 -0.20 0.00 0.00 0.00 0.00 51.96 52.67 3dyo s ALA 327 Cb 0.07 0.53 0.04 0.00 0.00 0.00 0.00 23.12 23.75 3dyo s ALA 327 CO 0.17 -0.87 0.60 0.00 0.00 0.00 0.00 175.76 175.65 3dyo s ASP 329 N -2.86 7.55 -0.06 0.00 1.01 -1.26 -0.79 116.67 120.26 3dyo s ASP 329 Ca 0.08 1.85 0.06 0.00 0.71 0.00 0.00 52.55 55.24 3dyo s ASP 329 Cb -0.02 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.30 3dyo s ASP 329 CO -0.02 0.02 -0.25 -0.69 0.21 0.00 0.00 175.17 174.44 3dyo s VAL 330 N -0.45 2.03 -0.17 -1.27 1.01 0.27 -4.69 120.40 117.12 3dyo s VAL 330 Ca 0.45 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.39 3dyo s VAL 330 Cb -0.24 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.44 3dyo s VAL 330 CO 0.31 0.56 -0.17 -0.83 0.00 0.00 0.00 175.10 174.97 3dyo s GLY 331 N -0.10 1.31 -0.68 4.51 0.00 -1.26 -0.98 107.32 110.12 3dyo s GLY 331 Ca -0.05 -1.14 -0.27 0.00 0.00 0.00 0.00 44.72 43.25 3dyo s GLY 331 CO 0.04 0.40 1.30 -1.36 0.00 0.00 0.00 173.10 173.48 3dyo s PHE 332 N 1.35 2.33 -0.02 1.90 0.40 -1.26 -4.81 117.98 117.87 3dyo s PHE 332 Ca 0.04 0.14 -0.21 0.00 -0.60 0.00 0.00 56.93 56.29 3dyo s PHE 332 Cb -0.13 -4.56 0.04 0.00 0.51 0.00 0.00 43.02 38.88 3dyo s PHE 332 CO -0.12 -1.97 0.46 -0.98 0.70 0.00 0.00 175.22 173.32 3dyo s ARG 333 N 5.61 0.84 -0.07 0.44 3.03 -1.26 -0.74 118.95 126.79 3dyo s ARG 333 Ca 0.40 -0.03 0.02 0.00 2.03 0.00 0.00 55.73 58.15 3dyo s ARG 333 Cb -0.08 0.39 -0.02 0.00 -1.03 0.00 0.00 34.95 34.20 3dyo s ARG 333 CO 0.18 -0.25 -0.14 -2.00 -1.13 0.00 0.00 175.30 171.96 3dyo s GLU 334 N -1.37 2.76 -0.15 3.89 2.12 -1.26 -4.90 118.70 119.80 3dyo s GLU 334 Ca -0.12 -0.69 0.02 0.00 0.36 0.00 0.00 54.97 54.54 3dyo s GLU 334 Cb -0.03 -2.46 0.01 0.00 0.26 0.00 0.00 34.13 31.92 3dyo s GLU 334 CO 0.06 0.51 -0.21 0.08 -0.54 0.00 0.00 175.26 175.15 3dyo s VAL 335 N -0.42 2.04 -0.03 3.70 1.01 -1.26 -1.06 120.40 124.39 3dyo s VAL 335 Ca 0.05 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 60.86 3dyo s VAL 335 Cb -0.12 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.49 3dyo s VAL 335 CO 0.02 0.54 0.46 0.00 0.00 0.00 0.00 175.10 176.12 3dyo s ARG 336 N 0.91 0.82 -0.23 2.72 1.70 -0.77 -4.61 118.95 119.49 3dyo s ARG 336 Ca -0.05 -0.01 -0.09 0.00 -0.47 0.00 0.00 55.73 55.11 3dyo s ARG 336 Cb -0.15 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 3dyo s ARG 336 CO -0.04 -0.24 0.11 0.42 -1.08 0.00 0.00 175.30 174.47 3dyo s ILE 337 N -1.27 4.95 -0.04 4.99 1.01 -1.26 1.00 121.20 130.57 3dyo s ILE 337 Ca -0.13 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.54 3dyo s ILE 337 Cb -0.03 -3.30 0.02 0.00 0.01 0.00 0.00 42.46 39.17 3dyo s ILE 337 CO 0.07 0.37 0.10 -0.70 0.00 0.00 0.00 174.94 174.77 3dyo s GLU 338 N 1.05 0.08 -1.24 2.79 2.12 0.04 -4.84 118.70 118.70 3dyo s GLU 338 Ca 0.06 0.22 -0.02 0.00 0.36 0.00 0.00 54.97 55.59 3dyo s GLU 338 Cb -0.14 -0.08 0.01 0.00 0.26 0.00 0.00 34.13 34.19 3dyo s GLU 338 CO 0.04 -0.09 0.15 -1.71 -0.54 0.00 0.00 175.26 173.11 3dyo n ASN 339 N 3.62 -4.37 0.00 -1.70 5.15 -1.26 -1.41 115.26 115.30 3dyo n ASN 339 Ca -0.20 0.01 0.00 0.00 -0.60 0.00 0.00 54.58 53.79 3dyo n ASN 339 Cb 0.55 -3.66 0.00 0.00 -0.53 0.00 0.00 39.78 36.15 3dyo n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dyo n GLY 340 N -0.98 0.83 3.32 8.20 0.00 -1.26 -5.04 105.19 110.27 3dyo n GLY 340 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3dyo n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyo s LEU 341 N 0.00 2.12 -0.34 0.99 1.43 -0.50 -2.34 118.68 120.05 3dyo s LEU 341 Ca 0.00 -0.44 -0.28 0.00 -1.03 0.00 0.00 54.13 52.37 3dyo s LEU 341 Cb 0.00 -1.36 0.02 0.00 0.03 0.00 0.00 46.19 44.87 3dyo s LEU 341 CO 0.00 0.32 1.04 -0.22 0.23 0.00 0.00 176.35 177.72 3dyo s LEU 342 N -0.59 3.93 0.01 1.79 2.96 -1.26 -0.78 118.68 124.74 3dyo s LEU 342 Ca 0.09 0.93 0.03 0.00 -0.22 0.00 0.00 54.13 54.96 3dyo s LEU 342 Cb -0.10 -3.48 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 3dyo s LEU 342 CO -0.01 -0.89 -0.05 -0.76 -1.32 0.00 0.00 176.35 173.32 3dyo s LEU 343 N 3.64 3.24 -0.20 -0.68 1.43 0.28 -2.04 118.68 124.35 3dyo s LEU 343 Ca 0.44 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.41 3dyo s LEU 343 Cb -0.12 -1.87 0.04 0.00 0.03 0.00 0.00 46.19 44.26 3dyo s LEU 343 CO 0.17 0.27 -0.14 -0.22 0.23 0.00 0.00 176.35 176.66 3dyo s LEU 344 N -1.55 2.46 -1.46 1.79 2.96 0.15 -1.85 118.68 121.19 3dyo s LEU 344 Ca 0.18 -0.90 -0.09 0.00 -0.22 0.00 0.00 54.13 53.10 3dyo s LEU 344 Cb -0.11 -1.39 0.04 0.00 0.50 0.00 0.00 46.19 45.24 3dyo s LEU 344 CO 0.09 -0.10 0.87 0.59 -1.32 0.00 0.00 176.35 176.48 3dyo n ASN 345 N 4.61 -5.45 0.00 3.68 3.02 -0.22 -1.67 115.26 119.23 3dyo n ASN 345 Ca -0.17 -0.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 3dyo n ASN 345 Cb 0.47 -4.36 0.00 0.00 -0.61 0.00 0.00 39.78 35.28 3dyo n ASN 345 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyo n GLY 346 N -1.66 0.64 3.53 7.41 0.00 -1.26 -5.02 105.19 108.83 3dyo n GLY 346 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 3dyo n GLY 346 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyo s LYS 347 N -0.33 2.08 -0.10 1.61 -0.14 -0.67 -5.00 119.74 117.20 3dyo s LYS 347 Ca 0.00 -1.02 -0.30 0.00 -1.36 0.00 0.00 55.97 53.29 3dyo s LYS 347 Cb 0.00 -2.26 -0.02 0.00 -1.68 0.00 0.00 37.83 33.87 3dyo s LYS 347 CO 0.00 0.52 1.14 -1.25 -0.76 0.00 0.00 175.35 175.00 3dyo s PRO 348 N -1.96 4.35 0.70 -1.68 0.04 -1.26 0.32 135.00 135.51 3dyo s PRO 348 Ca 0.19 1.57 -0.11 0.00 0.04 0.00 0.00 61.00 62.68 3dyo s PRO 348 Cb -0.11 -3.58 0.01 0.00 0.04 0.00 0.00 34.50 30.86 3dyo s PRO 348 CO 0.11 -0.45 1.07 -0.51 0.04 0.00 0.00 177.00 177.25 3dyo s LEU 349 N 2.37 3.16 -0.29 -3.56 1.43 -0.86 -4.93 118.68 115.99 3dyo s LEU 349 Ca 0.53 1.68 -0.00 0.00 -1.03 0.00 0.00 54.13 55.31 3dyo s LEU 349 Cb -0.22 -4.50 0.09 0.00 0.03 0.00 0.00 46.19 41.59 3dyo s LEU 349 CO 0.19 -1.52 0.07 -0.22 0.23 0.00 0.00 176.35 175.09 3dyo s LEU 350 N -5.48 2.43 -0.23 1.79 2.96 -1.26 -4.80 118.68 114.08 3dyo s LEU 350 Ca 0.59 -1.53 -0.29 0.00 -0.22 0.00 0.00 54.13 52.68 3dyo s LEU 350 Cb -0.15 -0.96 -0.00 0.00 0.50 0.00 0.00 46.19 45.58 3dyo s LEU 350 CO 0.53 -0.37 1.22 -0.63 -1.32 0.00 0.00 176.35 175.77 3dyo s ILE 351 N 1.54 4.32 -0.90 6.68 -1.09 0.23 -4.94 121.20 127.04 3dyo s ILE 351 Ca 0.07 1.56 -0.01 0.00 -2.23 0.00 0.00 60.65 60.04 3dyo s ILE 351 Cb -0.18 -4.14 0.23 0.00 -1.58 0.00 0.00 42.46 36.80 3dyo s ILE 351 CO -0.19 -0.28 0.85 0.54 -1.23 0.00 0.00 174.94 174.63 3dyo n ARG 352 N 6.81 2.81 -3.63 2.79 1.74 -1.26 -2.01 116.66 123.91 3dyo n ARG 352 Ca 0.14 -4.51 -0.21 0.00 -0.77 0.00 0.00 57.85 52.50 3dyo n ARG 352 Cb 0.46 -2.41 -0.03 0.00 -1.02 0.00 0.00 32.46 29.46 3dyo n ARG 352 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dyo s GLY 353 N -0.51 2.11 -0.05 -0.13 0.00 0.04 0.47 107.32 109.25 3dyo s GLY 353 Ca 0.29 -1.88 -0.16 0.00 0.00 0.00 0.00 44.72 42.98 3dyo s GLY 353 CO -0.10 -1.70 0.36 0.54 0.00 0.00 0.00 173.10 172.20 3dyo s VAL 354 N -2.46 0.04 0.06 1.40 0.11 -0.88 -0.79 120.40 117.87 3dyo s VAL 354 Ca 0.47 -0.30 -0.23 0.00 -2.93 0.00 0.00 61.98 58.99 3dyo s VAL 354 Cb -0.03 -0.62 -0.06 0.00 -1.53 0.00 0.00 36.38 34.14 3dyo s VAL 354 CO 0.27 -0.17 0.69 0.20 -3.33 0.00 0.00 175.10 172.77 3dyo s ASN 355 N -0.87 7.16 -0.09 3.54 0.01 -0.19 -1.03 114.94 123.46 3dyo s ASN 355 Ca -0.09 1.38 -0.02 0.00 -0.71 0.00 0.00 52.86 53.41 3dyo s ASN 355 Cb -0.04 -2.43 0.04 0.00 0.41 0.00 0.00 41.25 39.23 3dyo s ASN 355 CO 0.04 0.11 0.03 -0.60 -1.51 0.00 0.00 177.10 175.17 3dyo s ARG 356 N -0.44 0.36 0.52 -0.60 3.52 -0.81 -0.27 118.95 121.23 3dyo s ARG 356 Ca 0.35 0.11 -0.10 0.00 -0.13 0.00 0.00 55.73 55.95 3dyo s ARG 356 Cb -0.20 -1.06 -0.05 0.00 -1.56 0.00 0.00 34.95 32.08 3dyo s ARG 356 CO 0.21 -0.39 0.90 -1.01 -0.81 0.00 0.00 175.30 174.21 3dyo s HIS 357 N 2.03 3.55 -0.65 5.12 3.76 -1.26 -3.81 115.29 124.04 3dyo s HIS 357 Ca 0.04 1.14 -0.20 0.00 -0.15 0.00 0.00 55.06 55.88 3dyo s HIS 357 Cb -0.13 -2.56 0.09 0.00 1.11 0.00 0.00 32.58 31.09 3dyo s HIS 357 CO -0.05 -0.40 0.85 -1.21 -0.85 0.00 0.00 174.74 173.08 3dyo s GLU 358 N -4.60 3.12 -0.01 1.40 2.02 -1.26 -4.93 118.70 114.43 3dyo s GLU 358 Ca 0.53 -1.15 0.01 0.00 0.02 0.00 0.00 54.97 54.37 3dyo s GLU 358 Cb -0.10 -4.30 0.01 0.00 0.10 0.00 0.00 34.13 29.84 3dyo s GLU 358 CO 0.43 -1.68 -0.02 -1.58 0.02 0.00 0.00 175.26 172.43 3dyo s HIS 359 N 3.27 0.30 -0.06 1.61 2.46 -1.26 -4.53 115.29 117.07 3dyo s HIS 359 Ca 0.18 -0.03 0.01 0.00 0.47 0.00 0.00 55.06 55.68 3dyo s HIS 359 Cb -0.19 -0.28 0.02 0.00 -0.13 0.00 0.00 32.58 32.00 3dyo s HIS 359 CO 0.07 -0.06 -0.06 -1.58 -2.47 0.00 0.00 174.74 170.64 3dyo s HIS 360 N 0.41 0.99 0.53 3.88 5.04 0.17 -4.99 115.29 121.30 3dyo s HIS 360 Ca -0.04 -0.34 0.27 0.00 -1.54 0.00 0.00 55.06 53.41 3dyo s HIS 360 Cb -0.07 -0.85 1.64 0.00 0.04 0.00 0.00 32.58 33.35 3dyo s HIS 360 CO -0.01 -0.28 2.18 -1.00 -2.34 0.00 0.00 174.74 173.30 3dyo h PRO 361 N 7.46 0.00 0.02 2.88 0.13 -1.80 0.12 132.00 140.81 3dyo h PRO 361 Ca -0.32 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.46 3dyo h PRO 361 Cb 1.15 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.23 3dyo h PRO 361 CO 0.43 0.05 -1.93 -0.11 -0.23 0.00 0.00 178.00 176.20 3dyo n LEU 362 N -3.85 2.11 -0.69 1.56 7.94 -1.26 -1.79 117.00 121.02 3dyo n LEU 362 Ca -0.03 0.31 0.12 0.00 -1.11 0.00 0.00 56.01 55.30 3dyo n LEU 362 Cb 0.14 -0.93 0.35 0.00 0.53 0.00 0.00 43.42 43.51 3dyo n LEU 362 CO 0.29 0.53 0.77 1.41 -1.11 0.00 0.00 177.39 179.28 3dyo n HIS 363 N -4.12 0.16 0.00 1.96 8.25 -1.19 -4.96 115.22 115.31 3dyo n HIS 363 Ca -0.41 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 56.97 3dyo n HIS 363 Cb 0.84 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.95 3dyo n HIS 363 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dyo n GLY 364 N 1.24 1.92 0.93 -1.41 0.00 0.41 -2.73 105.19 105.56 3dyo n GLY 364 Ca 0.17 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.18 3dyo n GLY 364 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dyo n GLN 365 N 3.28 3.02 -2.87 1.61 6.02 -1.26 0.41 117.38 127.59 3dyo n GLN 365 Ca 0.00 -2.42 -0.41 0.00 -0.01 0.00 0.00 57.00 54.16 3dyo n GLN 365 Cb 0.00 -1.52 -0.04 0.00 1.02 0.00 0.00 30.24 29.70 3dyo n GLN 365 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3dyo s VAL 366 N -1.49 4.83 0.09 5.09 1.01 -1.11 -4.86 120.40 123.96 3dyo s VAL 366 Ca 0.35 1.79 0.07 0.00 0.00 0.00 0.00 61.98 64.19 3dyo s VAL 366 Cb 0.21 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3dyo s VAL 366 CO 0.18 0.26 -0.12 -0.04 0.00 0.00 0.00 175.10 175.38 3dyo s MET 367 N 0.55 2.10 0.11 2.72 -1.94 -1.26 -4.66 119.30 116.92 3dyo s MET 367 Ca 0.44 -1.02 0.04 0.00 -1.71 0.00 0.00 55.69 53.44 3dyo s MET 367 Cb -0.20 -2.28 -0.04 0.00 2.01 0.00 0.00 34.83 34.32 3dyo s MET 367 CO 0.24 0.51 -0.10 0.16 -0.01 0.00 0.00 175.02 175.83 3dyo s ASP 368 N -2.05 1.50 0.21 3.03 -4.77 -1.26 -5.05 116.67 108.28 3dyo s ASP 368 Ca 0.20 -0.86 -0.09 0.00 -3.30 0.00 0.00 52.55 48.50 3dyo s ASP 368 Cb -0.11 0.01 0.26 0.00 -1.09 0.00 0.00 42.92 41.99 3dyo s ASP 368 CO 0.12 -0.29 1.79 -0.08 0.70 0.00 0.00 175.17 177.41 3dyo h GLU 369 N 3.38 0.60 -0.62 2.11 4.81 -1.99 -1.50 114.58 121.36 3dyo h GLU 369 Ca -0.37 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 3dyo h GLU 369 Cb 1.19 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 3dyo h GLU 369 CO 0.56 0.40 0.28 0.37 -0.73 0.00 0.00 179.01 179.88 3dyo h GLN 370 N 0.62 0.91 -0.70 1.92 4.15 -1.99 0.36 115.11 120.38 3dyo h GLN 370 Ca 0.31 -0.15 -0.03 0.00 0.77 0.00 0.00 58.65 59.55 3dyo h GLN 370 Cb 0.25 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 3dyo h GLN 370 CO -0.21 0.75 0.32 1.15 -1.93 0.00 0.00 178.83 178.90 3dyo h THR 371 N 0.86 1.24 -0.66 2.39 2.02 -1.87 -0.81 112.91 116.09 3dyo h THR 371 Ca 0.21 -0.69 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 3dyo h THR 371 Cb 0.15 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 3dyo h THR 371 CO -0.02 0.28 0.32 0.24 0.37 0.00 0.00 175.52 176.71 3dyo h MET 372 N 0.98 0.95 -0.41 6.66 2.86 -0.72 -1.00 114.93 124.25 3dyo h MET 372 Ca 0.24 -0.14 -0.06 0.00 -2.06 0.00 0.00 59.70 57.68 3dyo h MET 372 Cb 0.15 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3dyo h MET 372 CO -0.03 0.75 0.04 0.28 1.06 0.00 0.00 176.91 179.01 3dyo h VAL 373 N 0.91 1.25 -0.81 -2.22 2.07 -0.68 -1.15 116.25 115.63 3dyo h VAL 373 Ca 0.23 -0.94 0.07 0.00 0.82 0.00 0.00 66.70 66.88 3dyo h VAL 373 Cb 0.11 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 3dyo h VAL 373 CO -0.03 0.32 0.48 -0.61 0.02 0.00 0.00 177.57 177.75 3dyo h GLN 374 N 0.55 0.82 -0.17 1.57 4.15 -0.88 0.22 115.11 121.37 3dyo h GLN 374 Ca 0.12 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.49 3dyo h GLN 374 Cb 0.42 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 3dyo h GLN 374 CO 0.01 0.54 0.11 -0.44 -1.93 0.00 0.00 178.83 177.13 3dyo h ASP 375 N 0.85 0.20 -0.65 -0.69 3.32 -0.85 -1.17 116.42 117.43 3dyo h ASP 375 Ca 0.37 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.34 3dyo h ASP 375 Cb 0.25 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 3dyo h ASP 375 CO -0.20 0.17 0.23 0.40 -1.72 0.00 0.00 179.24 178.12 3dyo h ILE 376 N 0.21 1.24 -0.43 0.35 2.04 -0.54 0.25 117.51 120.63 3dyo h ILE 376 Ca 0.06 -0.81 -0.05 0.00 1.00 0.00 0.00 64.86 65.06 3dyo h ILE 376 Cb 0.01 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 3dyo h ILE 376 CO -0.01 0.31 0.06 -0.07 0.00 0.00 0.00 178.15 178.45 3dyo h LEU 377 N 0.94 0.69 -0.80 1.44 3.38 -0.85 -0.91 115.31 119.19 3dyo h LEU 377 Ca 0.21 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 3dyo h LEU 377 Cb 0.25 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3dyo h LEU 377 CO -0.01 0.78 0.00 -0.07 0.09 0.00 0.00 178.44 179.23 3dyo h LEU 378 N 0.57 0.88 0.12 1.67 3.38 -0.99 0.99 115.31 121.93 3dyo h LEU 378 Ca 0.13 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.88 3dyo h LEU 378 Cb 0.39 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3dyo h LEU 378 CO 0.01 0.94 -0.17 0.24 0.09 0.00 0.00 178.44 179.54 3dyo h MET 379 N 0.84 -0.34 -0.64 1.13 2.86 -0.69 -1.87 114.93 116.22 3dyo h MET 379 Ca 0.16 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.79 3dyo h MET 379 Cb 0.49 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.20 3dyo h MET 379 CO 0.02 -0.22 0.26 0.87 1.06 0.00 0.00 176.91 178.90 3dyo h LYS 380 N -0.35 0.96 0.00 1.72 1.57 -0.96 -0.72 116.57 118.79 3dyo h LYS 380 Ca 0.02 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3dyo h LYS 380 Cb 0.36 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 3dyo h LYS 380 CO -0.08 0.80 -0.01 1.96 -0.57 0.00 0.00 179.45 181.55 3dyo h GLN 381 N 0.90 0.00 -0.54 3.15 4.20 -0.72 -1.77 115.11 120.33 3dyo h GLN 381 Ca 0.21 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.74 3dyo h GLN 381 Cb 0.20 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.87 3dyo h GLN 381 CO -0.02 0.01 0.15 0.09 -0.67 0.00 0.00 178.83 178.39 3dyo n ASN 382 N -3.22 3.85 -1.20 1.46 3.02 -0.57 -4.96 115.26 113.65 3dyo n ASN 382 Ca -0.02 -3.36 -0.14 0.00 -0.03 0.00 0.00 54.58 51.02 3dyo n ASN 382 Cb 0.13 -0.68 -0.05 0.00 -0.61 0.00 0.00 39.78 38.58 3dyo n ASN 382 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dyo n ASN 383 N -0.61 -4.59 -4.83 6.41 3.02 -0.66 -3.86 115.26 110.13 3dyo n ASN 383 Ca 0.36 0.26 -0.34 0.00 -0.03 0.00 0.00 54.58 54.83 3dyo n ASN 383 Cb 1.20 -3.43 -0.06 0.00 -0.61 0.00 0.00 39.78 36.88 3dyo n ASN 383 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dyo s PHE 384 N -2.56 3.51 0.00 3.10 0.40 -0.39 -4.84 117.98 117.20 3dyo s PHE 384 Ca 0.00 1.29 0.00 0.00 -0.60 0.00 0.00 56.93 57.62 3dyo s PHE 384 Cb 0.00 -2.57 0.00 0.00 0.51 0.00 0.00 43.02 40.96 3dyo s PHE 384 CO 0.00 0.22 0.67 0.27 0.70 0.00 0.00 175.22 177.08 3dyo n ASN 385 N 0.17 1.19 -3.70 1.36 0.23 0.18 -4.24 115.26 110.44 3dyo n ASN 385 Ca 0.01 -1.44 -0.11 0.00 -0.53 0.00 0.00 54.58 52.51 3dyo n ASN 385 Cb 0.52 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.16 3dyo n ASN 385 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3dyo s ALA 386 N -0.44 -0.77 -0.03 -2.53 0.00 -1.03 -0.43 121.76 116.54 3dyo s ALA 386 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.81 3dyo s ALA 386 Cb 0.00 0.52 0.01 0.00 0.00 0.00 0.00 23.12 23.65 3dyo s ALA 386 CO 0.00 -0.54 0.15 0.54 0.00 0.00 0.00 175.76 175.91 3dyo s VAL 387 N -3.35 0.04 -0.16 0.00 0.11 0.13 -2.07 120.40 115.11 3dyo s VAL 387 Ca 0.00 -0.36 -0.04 0.00 -2.93 0.00 0.00 61.98 58.65 3dyo s VAL 387 Cb 0.01 -0.34 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 3dyo s VAL 387 CO -0.09 -0.20 -0.02 -0.60 -3.33 0.00 0.00 175.10 170.87 3dyo s ARG 388 N -0.68 3.73 -1.42 1.54 3.52 -0.20 -1.32 118.95 124.12 3dyo s ARG 388 Ca -0.08 -0.48 -0.14 0.00 -0.13 0.00 0.00 55.73 54.90 3dyo s ARG 388 Cb -0.05 -2.98 0.02 0.00 -1.56 0.00 0.00 34.95 30.39 3dyo s ARG 388 CO 0.01 0.25 2.25 0.00 -0.81 0.00 0.00 175.30 176.99 3dyo s SER 390 N 3.27 6.68 -0.41 0.00 1.04 -1.25 -1.15 113.70 121.89 3dyo s SER 390 Ca 0.49 1.92 0.11 0.00 0.48 0.00 0.00 55.95 58.94 3dyo s SER 390 Cb 0.14 -2.53 0.34 0.00 0.10 0.00 0.00 66.02 64.07 3dyo s SER 390 CO -0.07 -0.95 0.76 1.41 0.98 0.00 0.00 173.24 175.36 3dyo n HIS 391 N 7.28 0.87 -3.55 5.02 -0.00 -1.26 -4.17 115.22 119.40 3dyo n HIS 391 Ca 0.17 -3.85 -0.06 0.00 -0.00 0.00 0.00 57.72 53.98 3dyo n HIS 391 Cb 0.44 -0.43 -0.02 0.00 -0.00 0.00 0.00 29.99 29.98 3dyo n HIS 391 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 3dyo s TYR 392 N -2.57 -0.24 0.40 4.41 -0.85 -0.30 -4.28 117.35 113.92 3dyo s TYR 392 Ca 0.41 0.13 -0.27 0.00 -0.52 0.00 0.00 57.07 56.83 3dyo s TYR 392 Cb 0.33 0.53 -0.10 0.00 0.38 0.00 0.00 41.96 43.11 3dyo s TYR 392 CO -0.09 -0.41 1.40 -2.14 -1.52 0.00 0.00 175.55 172.79 3dyo s PRO 393 N -2.82 4.00 0.64 -3.49 0.02 -0.72 -4.50 135.00 128.13 3dyo s PRO 393 Ca 0.07 2.37 -0.00 0.00 0.02 0.00 0.00 61.00 63.46 3dyo s PRO 393 Cb -0.01 -2.85 0.08 0.00 0.02 0.00 0.00 34.50 31.75 3dyo s PRO 393 CO -0.07 -0.55 0.90 -0.80 -0.33 0.00 0.00 177.00 176.16 3dyo s ASN 394 N -0.44 4.79 0.30 2.53 0.02 -1.26 -4.83 114.94 116.04 3dyo s ASN 394 Ca 0.55 -0.17 -0.29 0.00 -1.02 0.00 0.00 52.86 51.93 3dyo s ASN 394 Cb -0.43 -0.45 -0.13 0.00 0.02 0.00 0.00 41.25 40.27 3dyo s ASN 394 CO 0.56 -1.53 1.31 1.57 0.02 0.00 0.00 177.10 179.03 3dyo n HIS 395 N -2.62 2.16 -0.14 2.20 -0.00 -1.26 -4.85 115.22 110.70 3dyo n HIS 395 Ca 0.12 0.52 0.15 0.00 -0.00 0.00 0.00 57.72 58.51 3dyo n HIS 395 Cb 0.60 -2.42 0.52 0.00 -0.00 0.00 0.00 29.99 28.69 3dyo n HIS 395 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3dyo h PRO 396 N 3.13 0.37 0.00 1.57 0.13 -1.96 -1.45 132.00 133.80 3dyo h PRO 396 Ca -0.45 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 3dyo h PRO 396 Cb 1.28 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 3dyo h PRO 396 CO 0.67 0.25 -0.07 1.25 -0.23 0.00 0.00 178.00 179.87 3dyo h LEU 397 N 0.38 0.00 -0.73 1.56 5.85 -2.01 -2.74 115.31 117.61 3dyo h LEU 397 Ca 0.35 0.00 0.11 0.00 0.84 0.00 0.00 57.88 59.18 3dyo h LEU 397 Cb 0.82 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 3dyo h LEU 397 CO -0.10 0.07 0.34 -0.25 -0.34 0.00 0.00 178.44 178.16 3dyo h TRP 398 N 0.00 0.61 -0.28 1.25 2.91 -1.61 -0.93 115.95 117.90 3dyo h TRP 398 Ca -0.00 0.03 -0.11 0.00 1.13 0.00 0.00 58.89 59.94 3dyo h TRP 398 Cb 0.13 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.61 3dyo h TRP 398 CO 0.00 0.18 -0.28 1.88 -1.03 0.00 0.00 178.44 179.19 3dyo h TYR 399 N 0.56 0.65 -0.67 2.65 -1.99 -1.65 0.52 116.97 117.04 3dyo h TYR 399 Ca 0.38 -0.15 -0.07 0.00 2.00 0.00 0.00 58.73 60.89 3dyo h TYR 399 Cb 0.47 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 39.02 3dyo h TYR 399 CO -0.12 0.79 0.14 1.15 -0.00 0.00 0.00 178.16 180.11 3dyo h THR 400 N 0.49 1.26 -0.46 -2.88 2.02 -1.37 0.30 112.91 112.27 3dyo h THR 400 Ca 0.07 -0.99 -0.13 0.00 0.77 0.00 0.00 66.41 66.13 3dyo h THR 400 Cb 0.73 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 3dyo h THR 400 CO 0.06 0.37 -0.21 -0.07 0.37 0.00 0.00 175.52 176.04 3dyo h LEU 401 N 1.01 0.99 -0.91 2.58 3.38 -0.78 -1.54 115.31 120.04 3dyo h LEU 401 Ca 0.21 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 3dyo h LEU 401 Cb 0.40 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3dyo h LEU 401 CO 0.01 1.17 0.08 0.00 0.09 0.00 0.00 178.44 179.78 3dyo h ASP 403 N 0.84 0.95 0.49 0.00 3.32 -0.21 -0.93 116.42 120.89 3dyo h ASP 403 Ca 0.17 -0.09 -0.30 0.00 0.02 0.00 0.00 57.03 56.83 3dyo h ASP 403 Cb 0.38 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3dyo h ASP 403 CO 0.01 0.77 -1.42 0.03 -1.72 0.00 0.00 179.24 176.91 3dyo h ARG 404 N 1.06 0.29 0.00 3.56 3.08 -0.84 -3.33 114.38 118.21 3dyo h ARG 404 Ca 0.27 -0.50 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 3dyo h ARG 404 Cb 0.02 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3dyo h ARG 404 CO -0.04 1.20 -0.88 1.88 -1.07 0.00 0.00 179.97 181.05 3dyo h TYR 405 N 0.08 0.00 -0.90 3.04 -1.99 -0.07 -3.46 116.97 113.67 3dyo h TYR 405 Ca -0.20 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.53 3dyo h TYR 405 Cb 2.02 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.75 3dyo h TYR 405 CO 0.07 0.23 0.00 0.41 -0.00 0.00 0.00 178.16 178.88 3dyo n GLY 406 N 1.23 -0.15 2.99 3.88 0.00 -0.38 -4.82 105.19 107.94 3dyo n GLY 406 Ca -0.02 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 3dyo n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyo s LEU 407 N -0.20 1.54 0.08 0.99 1.43 -1.03 -4.69 118.68 116.80 3dyo s LEU 407 Ca 0.00 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 53.03 3dyo s LEU 407 Cb 0.00 0.40 -0.05 0.00 0.03 0.00 0.00 46.19 46.56 3dyo s LEU 407 CO 0.00 -0.04 1.06 -0.31 0.23 0.00 0.00 176.35 177.29 3dyo s TYR 408 N 0.09 3.62 0.04 0.29 4.12 0.43 -4.71 117.35 121.22 3dyo s TYR 408 Ca -0.00 1.59 0.09 0.00 0.02 0.00 0.00 57.07 58.76 3dyo s TYR 408 Cb -0.01 -3.22 -0.03 0.00 -1.52 0.00 0.00 41.96 37.18 3dyo s TYR 408 CO 0.00 -0.45 -0.25 0.08 0.02 0.00 0.00 175.55 174.95 3dyo s VAL 409 N 0.51 2.03 -0.38 0.71 1.01 0.15 0.20 120.40 124.63 3dyo s VAL 409 Ca 0.52 -1.32 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 3dyo s VAL 409 Cb -0.26 -1.73 0.03 0.00 0.00 0.00 0.00 36.38 34.42 3dyo s VAL 409 CO 0.30 0.35 0.21 -0.69 0.00 0.00 0.00 175.10 175.28 3dyo s VAL 410 N -0.78 4.61 -0.16 2.92 1.01 -0.44 -0.24 120.40 127.32 3dyo s VAL 410 Ca 0.11 -0.85 -0.16 0.00 0.00 0.00 0.00 61.98 61.08 3dyo s VAL 410 Cb -0.10 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 3dyo s VAL 410 CO 0.02 -0.24 0.40 -0.62 0.00 0.00 0.00 175.10 174.66 3dyo s ASP 411 N 1.56 6.52 -0.07 3.32 2.15 -0.92 -1.68 116.67 127.56 3dyo s ASP 411 Ca 0.02 0.62 0.04 0.00 0.43 0.00 0.00 52.55 53.67 3dyo s ASP 411 Cb -0.19 -2.24 -0.00 0.00 -0.30 0.00 0.00 42.92 40.19 3dyo s ASP 411 CO 0.07 -0.00 -0.21 -0.70 -0.17 0.00 0.00 175.17 174.16 3dyo s GLU 412 N 0.83 2.37 0.55 4.34 2.12 -1.26 -0.90 118.70 126.76 3dyo s GLU 412 Ca 0.21 -0.75 -0.20 0.00 0.36 0.00 0.00 54.97 54.59 3dyo s GLU 412 Cb -0.14 -1.93 -0.05 0.00 0.26 0.00 0.00 34.13 32.27 3dyo s GLU 412 CO 0.07 0.24 1.23 0.00 -0.54 0.00 0.00 175.26 176.26 3dyo s ALA 413 N 0.15 2.69 -1.43 6.30 0.00 -0.47 -1.76 121.76 127.24 3dyo s ALA 413 Ca -0.10 1.06 -0.13 0.00 0.00 0.00 0.00 51.96 52.80 3dyo s ALA 413 Cb -0.15 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 3dyo s ALA 413 CO 0.05 -1.10 2.46 -1.71 0.00 0.00 0.00 175.76 175.46 3dyo n ASN 414 N -1.24 5.56 -3.81 0.00 5.15 -1.26 -4.03 115.26 115.62 3dyo n ASN 414 Ca 0.12 -2.70 -0.27 0.00 -0.60 0.00 0.00 54.58 51.12 3dyo n ASN 414 Cb 0.48 -1.55 -0.17 0.00 -0.53 0.00 0.00 39.78 38.02 3dyo n ASN 414 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3dyo s ILE 415 N 2.99 0.78 -0.14 -1.44 1.01 -1.25 -4.74 121.20 118.42 3dyo s ILE 415 Ca 0.55 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.61 3dyo s ILE 415 Cb 0.15 -1.11 0.07 0.00 0.01 0.00 0.00 42.46 41.58 3dyo s ILE 415 CO -0.06 -0.02 0.27 -0.70 0.00 0.00 0.00 174.94 174.43 3dyo s GLU 416 N 1.76 0.16 -0.34 2.79 2.12 -0.01 -1.03 118.70 124.16 3dyo s GLU 416 Ca -0.00 0.70 0.11 0.00 0.36 0.00 0.00 54.97 56.14 3dyo s GLU 416 Cb -0.16 -0.15 0.45 0.00 0.26 0.00 0.00 34.13 34.54 3dyo s GLU 416 CO -0.07 -0.33 1.11 0.25 -0.54 0.00 0.00 175.26 175.68 3dyo n THR 417 N 5.35 2.03 -0.34 -1.70 -2.24 -1.04 -0.61 114.28 115.74 3dyo n THR 417 Ca -0.06 -4.07 0.10 0.00 -2.27 0.00 0.00 64.05 57.75 3dyo n THR 417 Cb 0.50 -0.51 0.30 0.00 -2.10 0.00 0.00 70.33 68.52 3dyo n THR 417 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 3dyo h ASN 418 N 2.51 0.81 -0.01 3.42 -0.00 -1.45 -2.00 115.58 118.86 3dyo h ASN 418 Ca 0.19 0.06 0.00 0.00 -0.00 0.00 0.00 56.30 56.55 3dyo h ASN 418 Cb 1.23 -0.10 0.00 0.00 -0.00 0.00 0.00 38.32 39.46 3dyo h ASN 418 CO 0.66 0.38 0.00 0.61 -0.00 0.00 0.00 177.43 179.08 3dyo n GLY 419 N -1.37 -0.88 3.83 1.57 0.00 -1.17 -4.84 105.19 102.34 3dyo n GLY 419 Ca 0.20 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 3dyo n GLY 419 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dyo s MET 420 N -1.98 3.20 -0.19 1.61 -1.94 -0.75 -4.76 119.30 114.49 3dyo s MET 420 Ca 0.31 0.92 -0.00 0.00 -1.71 0.00 0.00 55.69 55.21 3dyo s MET 420 Cb 0.14 -2.03 0.05 0.00 2.01 0.00 0.00 34.83 35.00 3dyo s MET 420 CO 0.24 -0.89 -0.05 0.08 -0.01 0.00 0.00 175.02 174.39 3dyo s VAL 421 N -3.00 1.21 1.14 -6.03 1.01 -1.26 -3.39 120.40 110.07 3dyo s VAL 421 Ca 0.58 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 3dyo s VAL 421 Cb -0.13 -1.42 0.26 0.00 0.00 0.00 0.00 36.38 35.08 3dyo s VAL 421 CO 0.52 0.06 1.14 -2.16 0.00 0.00 0.00 175.10 174.66 3dyo s PRO 422 N 1.57 -0.69 0.40 2.72 0.04 -1.26 -4.82 135.00 132.96 3dyo s PRO 422 Ca -0.01 -0.07 0.07 0.00 0.04 0.00 0.00 61.00 61.04 3dyo s PRO 422 Cb -0.16 -1.66 0.85 0.00 0.04 0.00 0.00 34.50 33.57 3dyo s PRO 422 CO -0.07 -3.36 2.04 1.98 0.04 0.00 0.00 177.00 177.63 3dyo h MET 423 N -2.33 0.56 -0.76 4.56 4.05 -1.88 -2.04 114.93 117.10 3dyo h MET 423 Ca -0.46 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 58.92 3dyo h MET 423 Cb 1.29 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 31.96 3dyo h MET 423 CO 0.38 0.37 0.01 0.27 0.23 0.00 0.00 176.91 178.17 3dyo n ASN 424 N -4.47 3.82 -0.21 1.39 6.94 -1.26 -3.85 115.26 117.62 3dyo n ASN 424 Ca 0.05 -2.56 0.02 0.00 -0.02 0.00 0.00 54.58 52.06 3dyo n ASN 424 Cb 0.10 -0.61 0.12 0.00 -2.36 0.00 0.00 39.78 37.03 3dyo n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3dyo h ARG 425 N 2.35 0.17 0.20 -3.83 2.43 -1.68 -0.28 114.38 113.75 3dyo h ARG 425 Ca 0.01 -0.01 -0.33 0.00 -0.81 0.00 0.00 59.98 58.84 3dyo h ARG 425 Cb 1.40 -0.04 0.02 0.00 -0.42 0.00 0.00 29.97 30.93 3dyo h ARG 425 CO 0.30 0.11 -1.54 -0.07 -1.51 0.00 0.00 179.97 177.27 3dyo h LEU 426 N 0.18 0.67 -1.82 3.80 3.38 -1.86 -3.32 115.31 116.33 3dyo h LEU 426 Ca 0.34 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.39 3dyo h LEU 426 Cb 0.56 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3dyo h LEU 426 CO -0.50 1.71 0.00 0.71 0.09 0.00 0.00 178.44 180.45 3dyo h THR 427 N 0.04 0.00 -0.02 0.22 1.35 -1.77 -0.64 112.91 112.08 3dyo h THR 427 Ca -0.29 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 3dyo h THR 427 Cb 2.05 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 69.70 3dyo h THR 427 CO 0.20 0.00 -0.10 -0.67 -0.25 0.00 0.00 175.52 174.70 3dyo n ASP 428 N -2.93 2.47 -4.62 5.36 2.03 -0.14 -1.63 116.55 117.08 3dyo n ASP 428 Ca -0.00 -1.77 -0.38 0.00 0.52 0.00 0.00 54.79 53.16 3dyo n ASP 428 Cb 0.21 0.10 -0.09 0.00 -0.72 0.00 0.00 41.12 40.61 3dyo n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3dyo s ASP 429 N -2.12 6.20 0.54 1.67 -1.08 -0.25 -4.57 116.67 117.06 3dyo s ASP 429 Ca 0.28 0.22 0.23 0.00 -0.52 0.00 0.00 52.55 52.76 3dyo s ASP 429 Cb 0.20 -2.17 1.49 0.00 -1.46 0.00 0.00 42.92 40.97 3dyo s ASP 429 CO 0.37 -0.08 2.16 1.55 0.52 0.00 0.00 175.17 179.69 3dyo h PRO 430 N 7.95 0.00 0.00 4.34 0.13 -1.90 0.28 132.00 142.80 3dyo h PRO 430 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3dyo h PRO 430 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3dyo h PRO 430 CO 0.64 0.04 0.00 0.00 -0.23 0.00 0.00 178.00 178.45 3dyo h ARG 431 N 0.00 0.00 -0.01 0.86 3.08 -1.93 -1.81 114.38 114.56 3dyo h ARG 431 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dyo h ARG 431 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3dyo h ARG 431 CO 0.01 0.00 -0.33 0.91 -1.07 0.00 0.00 179.97 179.49 3dyo n TRP 432 N -2.96 0.00 -0.37 3.04 7.02 0.09 -4.39 117.44 119.86 3dyo n TRP 432 Ca -0.02 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.45 3dyo n TRP 432 Cb 0.13 -0.05 0.12 0.00 -2.42 0.00 0.00 31.31 29.10 3dyo n TRP 432 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3dyo h LEU 433 N 2.13 1.14 -0.21 -0.99 5.85 -1.35 -1.75 115.31 120.13 3dyo h LEU 433 Ca 0.00 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3dyo h LEU 433 Cb 0.66 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3dyo h LEU 433 CO 0.00 0.82 0.06 -0.65 -0.34 0.00 0.00 178.44 178.33 3dyo h PRO 434 N 1.34 0.33 -0.60 5.25 0.11 -1.77 0.20 132.00 136.85 3dyo h PRO 434 Ca 0.37 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.41 3dyo h PRO 434 Cb -0.13 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 30.90 3dyo h PRO 434 CO -0.09 0.43 0.39 0.00 -0.21 0.00 0.00 178.00 178.52 3dyo h ALA 435 N 0.89 0.76 -0.43 -0.75 0.00 -1.72 -2.20 119.26 115.80 3dyo h ALA 435 Ca 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3dyo h ALA 435 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3dyo h ALA 435 CO -0.00 0.21 0.22 0.52 0.00 0.00 0.00 179.25 180.20 3dyo h MET 436 N 0.81 0.61 -0.85 0.00 2.86 -1.10 -2.87 114.93 114.40 3dyo h MET 436 Ca 0.22 -0.08 0.05 0.00 -2.06 0.00 0.00 59.70 57.82 3dyo h MET 436 Cb -0.07 -0.11 -0.06 0.00 0.06 0.00 0.00 31.60 31.42 3dyo h MET 436 CO -0.05 0.51 0.54 0.66 1.06 0.00 0.00 176.91 179.63 3dyo h SER 437 N 0.55 0.87 0.64 1.22 4.64 -0.29 -0.90 113.55 120.29 3dyo h SER 437 Ca 0.15 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.44 3dyo h SER 437 Cb 0.09 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3dyo h SER 437 CO -0.02 0.58 -0.18 -0.33 -0.87 0.00 0.00 176.83 176.01 3dyo h GLU 438 N 1.02 0.00 0.00 4.77 5.08 -1.18 0.34 114.58 124.60 3dyo h GLU 438 Ca 0.35 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.62 3dyo h GLU 438 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3dyo h GLU 438 CO -0.14 0.18 -0.44 0.00 -1.00 0.00 0.00 179.01 177.61 3dyo h ARG 439 N 0.00 0.00 0.00 2.33 3.08 -1.06 -2.24 114.38 116.49 3dyo h ARG 439 Ca -0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.91 3dyo h ARG 439 Cb 0.55 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3dyo h ARG 439 CO 0.02 0.44 -0.84 0.28 -1.07 0.00 0.00 179.97 178.81 3dyo h VAL 440 N 0.00 0.92 -0.66 2.04 2.07 -0.53 -3.33 116.25 116.77 3dyo h VAL 440 Ca -0.00 -1.99 -0.01 0.00 0.82 0.00 0.00 66.70 65.51 3dyo h VAL 440 Cb 0.94 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 32.71 3dyo h VAL 440 CO 0.06 0.31 0.35 0.71 0.02 0.00 0.00 177.57 179.02 3dyo h THR 441 N -1.00 1.21 0.00 2.57 1.35 -0.43 -2.24 112.91 114.38 3dyo h THR 441 Ca -0.21 -0.54 -0.06 0.00 -0.55 0.00 0.00 66.41 65.05 3dyo h THR 441 Cb 1.07 0.37 -0.01 0.00 -1.73 0.00 0.00 68.15 67.84 3dyo h THR 441 CO -0.13 0.23 -0.27 0.03 -0.25 0.00 0.00 175.52 175.13 3dyo h ARG 442 N 0.90 0.00 0.01 4.72 3.08 -1.61 0.28 114.38 121.76 3dyo h ARG 442 Ca 0.23 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.28 3dyo h ARG 442 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 3dyo h ARG 442 CO -0.04 0.27 -0.01 1.98 -1.07 0.00 0.00 179.97 181.11 3dyo h MET 443 N 0.00 -0.01 -0.72 0.04 4.05 -1.53 -2.43 114.93 114.33 3dyo h MET 443 Ca -0.00 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.45 3dyo h MET 443 Cb 0.57 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 31.33 3dyo h MET 443 CO 0.04 0.43 0.45 0.28 0.23 0.00 0.00 176.91 178.33 3dyo h VAL 444 N -0.46 1.10 0.00 -5.77 2.07 -1.21 0.15 116.25 112.13 3dyo h VAL 444 Ca -0.00 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 3dyo h VAL 444 Cb 0.45 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3dyo h VAL 444 CO 0.00 0.16 -0.08 1.56 0.02 0.00 0.00 177.57 179.24 3dyo h GLN 445 N 0.88 0.00 0.18 1.57 4.20 -0.95 -2.19 115.11 118.80 3dyo h GLN 445 Ca 0.29 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.69 3dyo h GLN 445 Cb 0.02 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.82 3dyo h GLN 445 CO -0.11 0.08 -1.48 -0.09 -0.67 0.00 0.00 178.83 176.55 3dyo h ARG 446 N 0.00 0.38 -0.11 1.46 2.43 -0.70 -3.01 114.38 114.83 3dyo h ARG 446 Ca -0.00 -0.65 0.00 0.00 -0.81 0.00 0.00 59.98 58.52 3dyo h ARG 446 Cb 0.14 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3dyo h ARG 446 CO 0.01 1.31 0.00 -0.25 -1.51 0.00 0.00 179.97 179.53 3dyo n ASP 447 N -3.78 2.58 0.08 -3.80 8.00 0.41 -4.25 116.55 115.79 3dyo n ASP 447 Ca -0.22 -1.75 0.08 0.00 0.71 0.00 0.00 54.79 53.61 3dyo n ASP 447 Cb 1.01 -0.06 0.37 0.00 -0.02 0.00 0.00 41.12 42.41 3dyo n ASP 447 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyo n ARG 448 N 0.96 0.09 0.00 -1.24 1.85 -0.84 -1.84 116.66 115.64 3dyo n ARG 448 Ca 0.11 0.46 0.13 0.00 -1.00 0.00 0.00 57.85 57.55 3dyo n ARG 448 Cb 0.44 -1.73 0.30 0.00 -1.05 0.00 0.00 32.46 30.41 3dyo n ARG 448 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3dyo n ASN 449 N -1.91 2.03 -4.65 2.89 3.02 -1.26 -4.85 115.26 110.52 3dyo n ASN 449 Ca 0.01 -1.60 -0.41 0.00 -0.03 0.00 0.00 54.58 52.55 3dyo n ASN 449 Cb 0.11 0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.31 3dyo n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3dyo s HIS 450 N -2.12 3.36 0.45 3.10 3.76 -0.77 -4.86 115.29 118.21 3dyo s HIS 450 Ca 0.30 1.16 0.11 0.00 -0.15 0.00 0.00 55.06 56.48 3dyo s HIS 450 Cb 0.20 -3.01 1.01 0.00 1.11 0.00 0.00 32.58 31.89 3dyo s HIS 450 CO 0.37 -0.31 2.08 -1.00 -0.85 0.00 0.00 174.74 175.03 3dyo h PRO 451 N 7.53 0.31 -0.07 8.40 0.13 -1.87 -2.54 132.00 143.88 3dyo h PRO 451 Ca -0.26 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 3dyo h PRO 451 Cb 1.11 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 3dyo h PRO 451 CO 0.85 0.23 -0.03 0.66 -0.23 0.00 0.00 178.00 179.47 3dyo h SER 452 N 0.31 0.09 -3.09 1.44 4.64 -1.87 -3.40 113.55 111.68 3dyo h SER 452 Ca 0.08 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 60.83 3dyo h SER 452 Cb 0.00 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.02 3dyo h SER 452 CO -0.01 0.14 0.98 -0.69 -0.87 0.00 0.00 176.83 176.38 3dyo s VAL 453 N -4.97 4.10 -0.10 0.95 1.01 -0.96 0.31 120.40 120.74 3dyo s VAL 453 Ca -0.05 1.25 0.09 0.00 0.00 0.00 0.00 61.98 63.27 3dyo s VAL 453 Cb 0.17 -4.10 -0.14 0.00 0.00 0.00 0.00 36.38 32.31 3dyo s VAL 453 CO 0.69 -0.43 0.25 2.30 0.00 0.00 0.00 175.10 177.91 3dyo n ILE 454 N 6.17 0.00 -4.06 2.22 -5.35 0.66 -4.91 119.36 114.09 3dyo n ILE 454 Ca 0.15 -0.23 -0.15 0.00 -0.27 0.00 0.00 62.75 62.25 3dyo n ILE 454 Cb 0.46 0.44 -0.14 0.00 -1.74 0.00 0.00 39.64 38.66 3dyo n ILE 454 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3dyo s ILE 455 N -2.49 0.28 0.05 7.28 1.01 -1.15 -3.85 121.20 122.34 3dyo s ILE 455 Ca -0.02 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.50 3dyo s ILE 455 Cb 0.06 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.24 3dyo s ILE 455 CO 0.39 0.09 0.13 0.26 0.00 0.00 0.00 174.94 175.81 3dyo s TRP 456 N 0.00 3.35 -0.03 3.97 0.52 -0.15 -2.17 118.94 124.43 3dyo s TRP 456 Ca 0.00 0.18 0.06 0.00 0.02 0.00 0.00 56.10 56.36 3dyo s TRP 456 Cb -0.02 -1.70 -0.01 0.00 -1.15 0.00 0.00 33.47 30.58 3dyo s TRP 456 CO -0.00 0.56 -0.20 0.45 0.02 0.00 0.00 176.95 177.77 3dyo s SER 457 N -2.28 2.43 0.00 2.95 0.15 -0.08 -0.24 113.70 116.63 3dyo s SER 457 Ca 0.30 -0.38 0.24 0.00 0.70 0.00 0.00 55.95 56.81 3dyo s SER 457 Cb -0.12 -0.39 1.43 0.00 -1.71 0.00 0.00 66.02 65.23 3dyo s SER 457 CO 0.22 0.23 1.85 0.18 1.20 0.00 0.00 173.24 176.93 3dyo n LEU 458 N 2.72 0.00 0.00 3.45 4.77 -0.98 -1.36 117.00 125.60 3dyo n LEU 458 Ca -0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 3dyo n LEU 458 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 3dyo n LEU 458 CO 0.24 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3dyo n GLY 459 N 0.70 0.51 3.39 -0.72 0.00 -1.26 -4.64 105.19 103.16 3dyo n GLY 459 Ca 0.18 -1.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.10 3dyo n GLY 459 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyo s ASN 460 N -4.00 -0.47 -1.19 1.61 2.47 -0.20 -4.74 114.94 108.43 3dyo s ASN 460 Ca 0.00 0.75 -0.32 0.00 0.42 0.00 0.00 52.86 53.71 3dyo s ASN 460 Cb 0.00 0.78 0.04 0.00 -1.45 0.00 0.00 41.25 40.62 3dyo s ASN 460 CO 0.00 -0.31 0.69 -0.62 -3.72 0.00 0.00 177.10 173.14 3dyo n GLU 461 N 2.14 -0.39 -1.83 0.43 1.02 -1.26 -3.99 120.64 116.75 3dyo n GLU 461 Ca -0.16 0.15 0.01 0.00 -0.02 0.00 0.00 57.16 57.13 3dyo n GLU 461 Cb 0.56 -2.64 0.05 0.00 -0.02 0.00 0.00 31.44 29.40 3dyo n GLU 461 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3dyo n SER 462 N -2.22 1.61 0.00 1.62 7.64 -1.26 -1.33 113.62 119.68 3dyo n SER 462 Ca -0.12 -2.41 0.00 0.00 1.01 0.00 0.00 58.87 57.35 3dyo n SER 462 Cb 0.57 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 3dyo n SER 462 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dyo n GLY 463 N -0.16 0.87 2.92 0.23 0.00 -1.25 -4.08 105.19 103.72 3dyo n GLY 463 Ca 0.11 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 3dyo n GLY 463 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dyo s HIS 464 N 0.00 2.07 0.38 1.61 2.46 -1.26 -3.79 115.29 116.76 3dyo s HIS 464 Ca 0.00 -1.42 0.08 0.00 0.47 0.00 0.00 55.06 54.19 3dyo s HIS 464 Cb 0.00 -1.46 -0.07 0.00 -0.13 0.00 0.00 32.58 30.92 3dyo s HIS 464 CO 0.00 -0.70 0.00 0.20 -2.47 0.00 0.00 174.74 171.77 3dyo s GLY 465 N 1.51 2.33 0.53 1.59 0.00 -1.26 -4.85 107.32 107.18 3dyo s GLY 465 Ca -0.02 -2.17 0.25 0.00 0.00 0.00 0.00 44.72 42.77 3dyo s GLY 465 CO -0.07 -2.03 2.14 0.00 0.00 0.00 0.00 173.10 173.14 3dyo h ALA 466 N 1.80 1.54 -0.57 3.20 0.00 -1.79 -1.75 119.26 121.69 3dyo h ALA 466 Ca -0.43 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 3dyo h ALA 466 Cb 1.25 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 3dyo h ALA 466 CO 0.74 0.09 0.23 -0.91 0.00 0.00 0.00 179.25 179.40 3dyo h ASN 467 N 0.00 0.74 -0.18 0.00 2.35 -1.62 -1.71 115.58 115.17 3dyo h ASN 467 Ca -0.00 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 3dyo h ASN 467 Cb 0.16 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 3dyo h ASN 467 CO 0.01 0.67 0.07 0.45 -1.65 0.00 0.00 177.43 176.98 3dyo h HIS 468 N 0.81 0.27 -0.81 1.19 3.86 -1.49 -1.05 115.15 117.93 3dyo h HIS 468 Ca 0.19 -0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.42 3dyo h HIS 468 Cb 0.16 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.50 3dyo h HIS 468 CO 0.01 0.33 0.51 -0.44 0.86 0.00 0.00 177.93 179.20 3dyo h ASP 469 N 0.14 0.85 -0.37 2.45 3.32 -1.37 0.48 116.42 121.92 3dyo h ASP 469 Ca 0.06 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3dyo h ASP 469 Cb 0.17 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3dyo h ASP 469 CO -0.01 0.59 0.25 0.00 -1.72 0.00 0.00 179.24 178.35 3dyo h ALA 470 N 1.34 0.47 -0.03 3.45 0.00 -1.11 -1.98 119.26 121.40 3dyo h ALA 470 Ca 0.32 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 3dyo h ALA 470 Cb 0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3dyo h ALA 470 CO -0.11 -0.06 -0.70 -0.07 0.00 0.00 0.00 179.25 178.31 3dyo h LEU 471 N 0.51 0.16 -0.08 0.00 3.38 -0.63 -0.74 115.31 117.91 3dyo h LEU 471 Ca 0.14 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3dyo h LEU 471 Cb -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3dyo h LEU 471 CO -0.03 0.81 -0.06 0.22 0.09 0.00 0.00 178.44 179.47 3dyo h TYR 472 N 0.09 -0.15 -0.52 1.13 3.20 0.11 -1.83 116.97 119.01 3dyo h TYR 472 Ca -0.02 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 3dyo h TYR 472 Cb 1.23 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.56 3dyo h TYR 472 CO 0.02 -0.10 0.05 -0.09 -1.64 0.00 0.00 178.16 176.40 3dyo h ARG 473 N -0.07 0.83 -0.38 1.82 9.65 -1.08 -1.72 114.38 123.43 3dyo h ARG 473 Ca 0.05 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 58.76 3dyo h ARG 473 Cb 0.15 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 3dyo h ARG 473 CO -0.12 0.80 0.16 2.35 2.80 0.00 0.00 179.97 185.96 3dyo h TRP 474 N 0.79 0.29 -0.56 2.20 7.01 -0.66 -1.54 115.95 123.47 3dyo h TRP 474 Ca 0.16 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.09 3dyo h TRP 474 Cb 0.40 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.37 3dyo h TRP 474 CO 0.02 0.13 0.01 0.82 -2.79 0.00 0.00 178.44 176.64 3dyo h ILE 475 N 0.33 1.26 -0.19 2.65 2.04 -1.02 -0.18 117.51 122.40 3dyo h ILE 475 Ca 0.17 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 3dyo h ILE 475 Cb 0.12 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3dyo h ILE 475 CO -0.15 0.39 -0.03 0.11 0.00 0.00 0.00 178.15 178.47 3dyo h LYS 476 N 0.89 0.28 0.07 2.37 1.79 -0.87 0.12 116.57 121.23 3dyo h LYS 476 Ca 0.17 -0.05 -0.16 0.00 -2.18 0.00 0.00 60.65 58.43 3dyo h LYS 476 Cb 0.50 -0.05 0.02 0.00 -1.58 0.00 0.00 32.23 31.12 3dyo h LYS 476 CO 0.02 0.33 -0.69 1.03 -1.08 0.00 0.00 179.45 179.07 3dyo h SER 477 N 0.27 0.47 0.67 0.86 0.87 -0.71 -3.32 113.55 112.66 3dyo h SER 477 Ca 0.06 -0.87 -0.19 0.00 -1.23 0.00 0.00 61.79 59.57 3dyo h SER 477 Cb 0.24 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3dyo h SER 477 CO 0.01 1.30 -0.85 -0.37 -0.53 0.00 0.00 176.83 176.38 3dyo h VAL 478 N -0.28 1.53 -2.22 2.23 -1.51 -0.66 -3.41 116.25 111.93 3dyo h VAL 478 Ca -0.11 -2.67 -0.51 0.00 -1.23 0.00 0.00 66.70 62.18 3dyo h VAL 478 Cb 1.47 2.48 -0.35 0.00 -2.13 0.00 0.00 31.29 32.75 3dyo h VAL 478 CO 0.13 0.77 -0.86 -0.62 -1.23 0.00 0.00 177.57 175.77 3dyo s ASP 479 N -6.87 1.45 0.00 4.19 2.15 0.40 -4.94 116.67 113.05 3dyo s ASP 479 Ca -0.02 -2.51 0.17 0.00 0.43 0.00 0.00 52.55 50.63 3dyo s ASP 479 Cb 0.11 -0.04 0.98 0.00 -0.30 0.00 0.00 42.92 43.66 3dyo s ASP 479 CO 0.81 -0.20 1.47 -2.65 -0.17 0.00 0.00 175.17 174.43 3dyo n PRO 480 N 3.34 0.43 0.00 4.34 -0.02 -1.25 -3.16 135.00 138.68 3dyo n PRO 480 Ca 0.22 0.05 0.14 0.00 -2.02 0.00 0.00 63.50 61.88 3dyo n PRO 480 Cb 0.46 -1.50 0.55 0.00 -0.02 0.00 0.00 33.50 32.99 3dyo n PRO 480 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyo n SER 481 N -1.11 0.24 -3.98 2.55 3.41 -1.26 -4.81 113.62 108.65 3dyo n SER 481 Ca 0.11 -0.02 -0.19 0.00 -0.26 0.00 0.00 58.87 58.51 3dyo n SER 481 Cb 0.09 -0.20 -0.15 0.00 -0.26 0.00 0.00 64.21 63.69 3dyo n SER 481 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dyo s ARG 482 N -2.81 0.81 0.87 4.33 0.52 -1.19 -4.19 118.95 117.28 3dyo s ARG 482 Ca 0.19 -0.26 -0.10 0.00 -0.52 0.00 0.00 55.73 55.03 3dyo s ARG 482 Cb 0.19 -0.78 0.12 0.00 0.52 0.00 0.00 34.95 35.00 3dyo s ARG 482 CO 0.55 0.10 1.12 -2.14 0.02 0.00 0.00 175.30 174.94 3dyo s PRO 483 N 0.17 1.44 -0.09 3.54 0.02 -1.25 -4.72 135.00 134.11 3dyo s PRO 483 Ca -0.02 1.32 0.03 0.00 0.02 0.00 0.00 61.00 62.34 3dyo s PRO 483 Cb -0.07 -1.79 -0.02 0.00 0.02 0.00 0.00 34.50 32.64 3dyo s PRO 483 CO 0.00 -2.26 -0.17 0.08 -0.33 0.00 0.00 177.00 174.32 3dyo s VAL 484 N -2.76 2.76 0.15 3.83 1.01 -1.26 -0.98 120.40 123.15 3dyo s VAL 484 Ca 0.64 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.86 3dyo s VAL 484 Cb -0.20 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 3dyo s VAL 484 CO 0.57 0.56 -0.06 0.00 0.00 0.00 0.00 175.10 176.17 3dyo s GLN 485 N -0.10 1.05 -0.29 2.72 -2.07 0.67 -0.69 119.66 120.96 3dyo s GLN 485 Ca -0.03 -1.47 -0.17 0.00 -1.82 0.00 0.00 55.36 51.87 3dyo s GLN 485 Cb -0.14 -0.47 0.14 0.00 -1.09 0.00 0.00 33.01 31.44 3dyo s GLN 485 CO 0.04 0.00 0.95 -0.47 -1.32 0.00 0.00 175.29 174.49 3dyo s TYR 486 N -3.46 -0.61 -0.14 9.60 5.04 -1.26 -2.32 117.35 124.21 3dyo s TYR 486 Ca 0.18 1.24 0.18 0.00 -2.44 0.00 0.00 57.07 56.23 3dyo s TYR 486 Cb 0.04 0.37 -0.13 0.00 0.35 0.00 0.00 41.96 42.60 3dyo s TYR 486 CO 0.01 -0.30 0.81 -1.91 -1.34 0.00 0.00 175.55 172.81 3dyo n GLU 487 N 3.65 0.62 -1.52 4.97 0.00 -1.26 -4.62 120.64 122.49 3dyo n GLU 487 Ca -0.18 0.17 -0.40 0.00 0.00 0.00 0.00 57.16 56.74 3dyo n GLU 487 Cb 0.58 -1.78 0.02 0.00 0.00 0.00 0.00 31.44 30.26 3dyo n GLU 487 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3dyo n GLY 488 N 1.36 -1.02 2.03 8.31 0.00 -1.26 0.08 105.19 114.69 3dyo n GLY 488 Ca -0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.92 3dyo n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 489 N 1.57 0.44 0.00 -0.02 0.00 -1.25 -3.88 105.19 102.05 3dyo n GLY 489 Ca 0.11 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.09 3dyo n GLY 489 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 490 N -2.80 0.89 3.90 -0.02 0.00 -1.19 -4.69 105.19 101.28 3dyo n GLY 490 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dyo n GLY 490 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyo n ALA 491 N -1.16 0.00 -2.02 4.61 0.00 0.11 -4.66 120.51 117.40 3dyo n ALA 491 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 3dyo n ALA 491 Cb 0.00 -0.66 0.05 0.00 0.00 0.00 0.00 19.45 18.83 3dyo n ALA 491 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dyo n ASP 492 N 0.00 0.80 -3.07 0.00 5.75 -1.26 -1.85 116.55 116.92 3dyo n ASP 492 Ca 0.00 -2.32 -0.16 0.00 -0.01 0.00 0.00 54.79 52.29 3dyo n ASP 492 Cb 0.00 -0.30 0.13 0.00 -1.03 0.00 0.00 41.12 39.93 3dyo n ASP 492 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3dyo n THR 493 N -0.12 0.00 1.98 2.12 -2.24 -1.26 -4.88 114.28 109.88 3dyo n THR 493 Ca 0.06 -0.28 0.12 0.00 -2.27 0.00 0.00 64.05 61.68 3dyo n THR 493 Cb 0.85 -1.16 0.69 0.00 -2.10 0.00 0.00 70.33 68.61 3dyo n THR 493 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dyo n THR 494 N -3.74 0.00 -0.91 4.28 -2.24 -1.26 -2.75 114.28 107.66 3dyo n THR 494 Ca 0.08 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.94 3dyo n THR 494 Cb 0.32 -0.37 0.33 0.00 -2.10 0.00 0.00 70.33 68.51 3dyo n THR 494 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyo n ALA 495 N -0.87 3.40 -3.20 6.98 0.00 -1.26 -4.94 120.51 120.62 3dyo n ALA 495 Ca 0.17 -2.07 -0.16 0.00 0.00 0.00 0.00 53.44 51.39 3dyo n ALA 495 Cb 0.08 -0.92 -0.15 0.00 0.00 0.00 0.00 19.45 18.46 3dyo n ALA 495 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3dyo s THR 496 N -2.70 0.29 -0.90 0.00 -1.32 -1.11 -4.15 115.64 105.74 3dyo s THR 496 Ca 0.48 -0.08 0.25 0.00 -1.21 0.00 0.00 61.69 61.14 3dyo s THR 496 Cb 0.37 -0.30 0.05 0.00 -1.51 0.00 0.00 72.50 71.11 3dyo s THR 496 CO 0.13 0.12 1.47 0.47 -2.21 0.00 0.00 174.62 174.60 3dyo n ASP 497 N 3.50 0.48 -4.10 8.08 8.00 0.14 -4.85 116.55 127.79 3dyo n ASP 497 Ca -0.19 -0.04 -0.23 0.00 0.71 0.00 0.00 54.79 55.04 3dyo n ASP 497 Cb 0.55 0.11 -0.15 0.00 -0.02 0.00 0.00 41.12 41.60 3dyo n ASP 497 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dyo s ILE 498 N -3.04 1.17 -0.36 0.53 1.01 -1.26 -4.52 121.20 114.72 3dyo s ILE 498 Ca 0.10 -0.61 -0.29 0.00 0.00 0.00 0.00 60.65 59.86 3dyo s ILE 498 Cb 0.17 -0.99 0.01 0.00 0.01 0.00 0.00 42.46 41.66 3dyo s ILE 498 CO 0.68 0.34 1.26 -0.63 0.00 0.00 0.00 174.94 176.58 3dyo s ILE 499 N -0.16 4.16 -0.53 2.92 1.01 0.29 -4.71 121.20 124.19 3dyo s ILE 499 Ca 0.02 1.28 0.07 0.00 0.00 0.00 0.00 60.65 62.02 3dyo s ILE 499 Cb -0.08 -4.29 0.30 0.00 0.01 0.00 0.00 42.46 38.41 3dyo s ILE 499 CO 0.00 -0.62 0.78 0.00 0.00 0.00 0.00 174.94 175.10 3dyo s PRO 501 N -2.63 1.62 -0.16 0.00 0.04 -1.26 -3.46 135.00 129.15 3dyo s PRO 501 Ca 0.42 0.81 -0.01 0.00 0.04 0.00 0.00 61.00 62.26 3dyo s PRO 501 Cb 0.24 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.92 3dyo s PRO 501 CO -0.09 -1.98 -0.12 0.00 0.04 0.00 0.00 177.00 174.84 3dyo s MET 502 N -5.00 3.29 -1.95 4.56 0.23 -1.26 -0.95 119.30 118.23 3dyo s MET 502 Ca 0.62 -0.71 0.00 0.00 -1.03 0.00 0.00 55.69 54.58 3dyo s MET 502 Cb -0.17 -2.71 0.00 0.00 -1.53 0.00 0.00 34.83 30.42 3dyo s MET 502 CO 0.56 0.01 0.00 0.66 -2.03 0.00 0.00 175.02 174.22 3dyo n TYR 503 N 4.10 -0.22 -2.29 3.16 4.02 0.14 -4.96 117.16 121.10 3dyo n TYR 503 Ca -0.19 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.31 3dyo n TYR 503 Cb 0.52 -3.37 -0.02 0.00 -0.02 0.00 0.00 39.34 36.44 3dyo n TYR 503 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dyo s ALA 504 N -2.77 3.26 0.64 -0.72 0.00 -1.26 -4.89 121.76 116.01 3dyo s ALA 504 Ca 0.00 1.02 -0.09 0.00 0.00 0.00 0.00 51.96 52.89 3dyo s ALA 504 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3dyo s ALA 504 CO 0.00 -0.49 0.99 1.03 0.00 0.00 0.00 175.76 177.29 3dyo s ARG 505 N -2.06 3.00 -0.05 0.00 0.52 -1.26 -4.79 118.95 114.32 3dyo s ARG 505 Ca 0.53 0.29 -0.26 0.00 -0.52 0.00 0.00 55.73 55.77 3dyo s ARG 505 Cb -0.33 -2.15 -0.22 0.00 0.52 0.00 0.00 34.95 32.78 3dyo s ARG 505 CO 0.42 -0.80 1.15 0.28 0.02 0.00 0.00 175.30 176.37 3dyo h VAL 506 N -0.37 1.49 0.00 3.52 2.07 -1.95 -0.94 116.25 120.07 3dyo h VAL 506 Ca -0.45 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 65.55 3dyo h VAL 506 Cb 1.24 2.46 -0.01 0.00 -1.52 0.00 0.00 31.29 33.47 3dyo h VAL 506 CO 0.62 0.38 -1.42 0.47 0.02 0.00 0.00 177.57 177.64 3dyo n ASP 507 N -4.77 3.17 -4.69 0.57 8.00 -1.26 -3.31 116.55 114.25 3dyo n ASP 507 Ca -0.09 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.04 3dyo n ASP 507 Cb 0.32 1.08 -0.07 0.00 -0.02 0.00 0.00 41.12 42.43 3dyo n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3dyo s GLU 508 N -2.40 4.22 0.45 -1.24 2.12 -1.26 -4.73 118.70 115.86 3dyo s GLU 508 Ca -0.03 0.20 -0.17 0.00 0.36 0.00 0.00 54.97 55.32 3dyo s GLU 508 Cb 0.04 -3.49 -0.09 0.00 0.26 0.00 0.00 34.13 30.85 3dyo s GLU 508 CO 0.32 0.07 0.92 -0.51 -0.54 0.00 0.00 175.26 175.52 3dyo s ASP 509 N 0.81 6.76 -0.43 -1.70 1.01 -1.26 -3.76 116.67 118.10 3dyo s ASP 509 Ca 0.19 1.54 0.03 0.00 0.71 0.00 0.00 52.55 55.01 3dyo s ASP 509 Cb -0.14 -2.49 0.15 0.00 1.01 0.00 0.00 42.92 41.46 3dyo s ASP 509 CO 0.07 -0.43 0.30 -1.10 0.21 0.00 0.00 175.17 174.21 3dyo s GLN 510 N -3.57 1.02 -0.35 8.23 -0.21 -0.15 -4.90 119.66 119.73 3dyo s GLN 510 Ca 0.59 -1.97 -0.06 0.00 0.02 0.00 0.00 55.36 53.94 3dyo s GLN 510 Cb -0.10 -1.74 -0.18 0.00 1.00 0.00 0.00 33.01 32.00 3dyo s GLN 510 CO 0.22 -1.28 2.88 -0.35 -2.12 0.00 0.00 175.29 174.64 3dyo n PRO 511 N 3.25 1.96 -1.74 2.91 -0.04 -1.26 0.19 135.00 140.27 3dyo n PRO 511 Ca 0.20 -1.08 -0.42 0.00 -0.04 0.00 0.00 63.50 62.15 3dyo n PRO 511 Cb 0.41 -2.10 -0.01 0.00 -0.04 0.00 0.00 33.50 31.76 3dyo n PRO 511 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3dyo n PHE 512 N 2.95 2.66 -1.83 0.54 3.01 -1.26 -4.85 117.46 118.67 3dyo n PHE 512 Ca 0.42 0.45 -0.39 0.00 1.01 0.00 0.00 57.45 58.95 3dyo n PHE 512 Cb 0.58 -2.50 0.03 0.00 -0.01 0.00 0.00 39.48 37.59 3dyo n PHE 512 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3dyo s PRO 513 N -1.63 3.31 0.00 -1.08 0.04 -1.26 -2.02 135.00 132.36 3dyo s PRO 513 Ca 0.57 2.23 0.00 0.00 0.04 0.00 0.00 61.00 63.84 3dyo s PRO 513 Cb -0.53 -2.36 0.00 0.00 0.04 0.00 0.00 34.50 31.66 3dyo s PRO 513 CO 0.60 -1.05 0.00 0.00 0.04 0.00 0.00 177.00 176.59 3dyo n ALA 514 N -0.80 0.00 -3.20 8.56 0.00 -1.26 -4.57 120.51 119.24 3dyo n ALA 514 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.29 3dyo n ALA 514 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 3dyo n ALA 514 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3dyo n VAL 515 N 0.00 0.74 -1.50 0.00 0.24 -1.18 -4.82 118.33 111.81 3dyo n VAL 515 Ca 0.00 -4.69 -0.34 0.00 -2.04 0.00 0.00 64.34 57.27 3dyo n VAL 515 Cb 0.00 -1.44 0.08 0.00 -1.47 0.00 0.00 33.84 31.01 3dyo n VAL 515 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3dyo s PRO 516 N -2.18 2.29 -0.56 7.34 0.04 -0.86 -4.54 135.00 136.53 3dyo s PRO 516 Ca 0.40 1.66 0.02 0.00 0.04 0.00 0.00 61.00 63.12 3dyo s PRO 516 Cb 0.23 -1.86 0.14 0.00 0.04 0.00 0.00 34.50 33.05 3dyo s PRO 516 CO -0.09 -1.70 0.32 0.15 0.04 0.00 0.00 177.00 175.73 3dyo s LYS 517 N -3.96 2.18 0.77 4.56 1.02 0.13 -4.87 119.74 119.57 3dyo s LYS 517 Ca 0.72 -2.61 -0.11 0.00 0.02 0.00 0.00 55.97 54.00 3dyo s LYS 517 Cb -0.27 -3.46 0.06 0.00 -0.52 0.00 0.00 37.83 33.64 3dyo s LYS 517 CO 0.44 -1.13 1.09 -1.58 -0.92 0.00 0.00 175.35 173.25 3dyo s TRP 518 N -0.24 2.64 0.26 3.18 0.52 -1.26 -0.98 118.94 123.06 3dyo s TRP 518 Ca 0.17 1.51 -0.30 0.00 0.02 0.00 0.00 56.10 57.50 3dyo s TRP 518 Cb -0.24 -3.03 -0.14 0.00 -1.15 0.00 0.00 33.47 28.91 3dyo s TRP 518 CO -0.01 -1.76 1.15 0.45 0.02 0.00 0.00 176.95 176.80 3dyo n SER 519 N -3.49 1.73 -0.05 2.95 2.88 -1.25 -4.42 113.62 111.97 3dyo n SER 519 Ca 0.09 1.17 -0.00 0.00 -1.33 0.00 0.00 58.87 58.79 3dyo n SER 519 Cb 0.53 -1.32 0.29 0.00 -0.75 0.00 0.00 64.21 62.96 3dyo n SER 519 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3dyo h ILE 520 N 2.39 1.19 -0.43 2.46 3.07 -1.16 0.79 117.51 125.82 3dyo h ILE 520 Ca -0.42 -0.65 -0.10 0.00 1.55 0.00 0.00 64.86 65.24 3dyo h ILE 520 Cb 1.32 0.71 -0.02 0.00 -0.27 0.00 0.00 36.82 38.57 3dyo h ILE 520 CO 0.66 0.24 -0.13 0.11 -1.05 0.00 0.00 178.15 177.98 3dyo h LYS 521 N 0.64 0.79 -0.16 0.16 1.57 -1.84 -2.96 116.57 114.77 3dyo h LYS 521 Ca 0.15 -0.27 -0.22 0.00 -1.87 0.00 0.00 60.65 58.44 3dyo h LYS 521 Cb 0.21 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.47 3dyo h LYS 521 CO -0.01 0.88 -0.76 -0.22 -0.57 0.00 0.00 179.45 178.77 3dyo h LYS 522 N 0.71 0.77 -0.80 3.15 3.64 -1.71 -3.29 116.57 119.04 3dyo h LYS 522 Ca 0.12 -0.62 0.12 0.00 -1.27 0.00 0.00 60.65 59.00 3dyo h LYS 522 Cb 0.62 0.13 -0.08 0.00 -0.41 0.00 0.00 32.23 32.48 3dyo h LYS 522 CO 0.04 1.23 0.41 2.35 -2.27 0.00 0.00 179.45 181.21 3dyo h TRP 523 N 0.53 0.73 -0.41 1.91 2.91 -0.70 -2.27 115.95 118.65 3dyo h TRP 523 Ca -0.05 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.04 3dyo h TRP 523 Cb 1.39 -0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 29.81 3dyo h TRP 523 CO 0.08 0.22 0.27 -0.07 -1.03 0.00 0.00 178.44 177.91 3dyo h LEU 524 N 0.64 0.36 -2.41 0.65 3.38 -1.60 -2.72 115.31 113.61 3dyo h LEU 524 Ca 0.42 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3dyo h LEU 524 Cb 0.52 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3dyo h LEU 524 CO -0.32 0.25 0.00 -1.54 0.09 0.00 0.00 178.44 176.92 3dyo n SER 525 N -4.48 3.54 -4.62 -0.43 3.41 -0.87 -4.52 113.62 105.65 3dyo n SER 525 Ca 0.04 -1.99 -0.38 0.00 -0.26 0.00 0.00 58.87 56.28 3dyo n SER 525 Cb 0.17 -0.38 0.04 0.00 -0.26 0.00 0.00 64.21 63.78 3dyo n SER 525 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dyo n LEU 526 N 1.47 3.59 -4.68 1.04 4.77 -1.03 -4.73 117.00 117.43 3dyo n LEU 526 Ca 0.22 0.86 -0.52 0.00 -0.03 0.00 0.00 56.01 56.54 3dyo n LEU 526 Cb 0.58 -1.39 -0.06 0.00 -2.33 0.00 0.00 43.42 40.22 3dyo n LEU 526 CO 0.16 -1.72 1.36 -2.65 -1.33 0.00 0.00 177.39 173.21 3dyo n PRO 527 N -0.79 1.72 0.00 3.23 -0.02 -1.26 0.18 135.00 138.06 3dyo n PRO 527 Ca 0.13 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3dyo n PRO 527 Cb 0.46 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3dyo n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dyo n GLY 528 N 4.08 2.30 3.75 -1.23 0.00 -1.26 -5.02 105.19 107.81 3dyo n GLY 528 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 3dyo n GLY 528 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dyo s GLU 529 N -0.34 4.49 0.00 1.61 2.56 0.13 -4.92 118.70 122.22 3dyo s GLU 529 Ca 0.00 1.95 0.00 0.00 0.00 0.00 0.00 54.97 56.92 3dyo s GLU 529 Cb 0.00 -3.19 0.00 0.00 2.00 0.00 0.00 34.13 32.94 3dyo s GLU 529 CO 0.00 -0.06 0.02 0.25 -0.56 0.00 0.00 175.26 174.91 3dyo n THR 530 N 1.89 0.00 -1.57 -1.70 -2.24 -1.26 -4.80 114.28 104.60 3dyo n THR 530 Ca 0.02 -0.09 -0.29 0.00 -2.27 0.00 0.00 64.05 61.43 3dyo n THR 530 Cb 0.44 1.19 0.12 0.00 -2.10 0.00 0.00 70.33 69.97 3dyo n THR 530 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3dyo s ARG 531 N -0.13 1.53 0.69 -0.78 0.52 -1.26 -4.06 118.95 115.45 3dyo s ARG 531 Ca 0.00 0.40 -0.11 0.00 -0.52 0.00 0.00 55.73 55.50 3dyo s ARG 531 Cb 0.00 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.60 3dyo s ARG 531 CO 0.00 -1.95 1.06 -1.25 0.02 0.00 0.00 175.30 173.18 3dyo s PRO 532 N -5.25 2.98 -0.10 3.54 0.04 -0.99 -4.79 135.00 130.42 3dyo s PRO 532 Ca 0.63 0.88 0.02 0.00 0.04 0.00 0.00 61.00 62.57 3dyo s PRO 532 Cb -0.14 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.41 3dyo s PRO 532 CO 0.53 -1.05 -0.15 -1.17 0.04 0.00 0.00 177.00 175.20 3dyo s LEU 533 N -5.50 1.72 -0.11 -3.56 0.20 0.78 -0.54 118.68 111.68 3dyo s LEU 533 Ca 0.58 -0.41 -0.03 0.00 0.69 0.00 0.00 54.13 54.96 3dyo s LEU 533 Cb -0.13 -1.06 0.04 0.00 -0.43 0.00 0.00 46.19 44.60 3dyo s LEU 533 CO 0.55 0.03 0.04 -0.63 -0.29 0.00 0.00 176.35 176.04 3dyo s ILE 534 N 0.90 0.19 0.12 6.68 1.01 -0.72 -0.87 121.20 128.51 3dyo s ILE 534 Ca -0.09 0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 3dyo s ILE 534 Cb -0.15 -0.54 -0.09 0.00 0.01 0.00 0.00 42.46 41.68 3dyo s ILE 534 CO -0.00 0.04 1.60 -0.76 0.00 0.00 0.00 174.94 175.82 3dyo s LEU 535 N 2.03 4.37 0.42 2.97 1.43 -0.67 -4.11 118.68 125.12 3dyo s LEU 535 Ca 0.03 2.55 0.22 0.00 -1.03 0.00 0.00 54.13 55.91 3dyo s LEU 535 Cb -0.14 -3.58 0.86 0.00 0.03 0.00 0.00 46.19 43.36 3dyo s LEU 535 CO -0.06 -0.84 1.81 0.00 0.23 0.00 0.00 176.35 177.48 3dyo s GLU 537 N -3.66 0.44 0.16 0.00 2.02 -1.20 -4.39 118.70 112.08 3dyo s GLU 537 Ca 0.00 0.63 -0.24 0.00 0.02 0.00 0.00 54.97 55.38 3dyo s GLU 537 Cb 0.10 0.14 0.06 0.00 0.10 0.00 0.00 34.13 34.54 3dyo s GLU 537 CO 0.65 -0.09 0.82 1.52 0.02 0.00 0.00 175.26 178.18 3dyo s TYR 538 N 0.60 -0.26 -0.80 1.61 -0.85 -1.02 0.23 117.35 116.86 3dyo s TYR 538 Ca -0.03 -0.04 -0.02 0.00 -0.52 0.00 0.00 57.07 56.46 3dyo s TYR 538 Cb -0.05 0.63 -0.00 0.00 0.38 0.00 0.00 41.96 42.92 3dyo s TYR 538 CO -0.04 -0.89 0.69 0.00 -1.52 0.00 0.00 175.55 173.79 3dyo n ALA 539 N -0.41 -2.59 -1.92 9.51 0.00 -1.26 -1.03 120.51 122.82 3dyo n ALA 539 Ca -0.08 -0.09 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 3dyo n ALA 539 Cb 0.61 -1.64 -0.03 0.00 0.00 0.00 0.00 19.45 18.39 3dyo n ALA 539 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3dyo s HIS 540 N -3.04 1.61 -0.19 0.00 2.46 -0.55 -3.81 115.29 111.77 3dyo s HIS 540 Ca 0.05 0.77 -0.04 0.00 0.47 0.00 0.00 55.06 56.31 3dyo s HIS 540 Cb -0.01 -4.03 -0.06 0.00 -0.13 0.00 0.00 32.58 28.35 3dyo s HIS 540 CO 0.80 -2.86 2.89 0.00 -2.47 0.00 0.00 174.74 173.10 3dyo n ALA 541 N 11.73 5.88 -2.59 1.58 0.00 0.11 -4.42 120.51 132.80 3dyo n ALA 541 Ca 0.25 -1.92 -0.43 0.00 0.00 0.00 0.00 53.44 51.33 3dyo n ALA 541 Cb 0.49 -1.94 -0.03 0.00 0.00 0.00 0.00 19.45 17.97 3dyo n ALA 541 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3dyo s MET 542 N -0.40 3.73 5.27 0.00 0.00 -1.26 -3.69 119.30 122.95 3dyo s MET 542 Ca 0.50 0.49 0.00 0.00 0.00 0.00 0.00 55.69 56.67 3dyo s MET 542 Cb 0.28 -3.86 0.00 0.00 0.00 0.00 0.00 34.83 31.25 3dyo s MET 542 CO -0.07 -1.15 0.00 0.41 0.00 0.00 0.00 175.02 174.21 3dyo n GLY 543 N 4.64 2.08 3.56 2.11 0.00 -1.26 -4.23 105.19 112.08 3dyo n GLY 543 Ca 0.09 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 45.15 3dyo n GLY 543 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyo s ASN 544 N -4.00 6.35 0.00 1.61 3.84 -1.26 -4.86 114.94 116.62 3dyo s ASN 544 Ca 0.00 -1.24 0.00 0.00 0.21 0.00 0.00 52.86 51.83 3dyo s ASN 544 Cb 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.13 3dyo s ASN 544 CO 0.00 -1.64 0.00 -0.24 -2.79 0.00 0.00 177.10 172.43 3dyo n SER 545 N 9.32 0.00 -0.20 -4.21 2.88 -1.26 -4.75 113.62 115.40 3dyo n SER 545 Ca 0.29 -0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.80 3dyo n SER 545 Cb 0.50 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.95 3dyo n SER 545 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3dyo n LEU 546 N 0.00 -0.19 -4.73 2.46 4.32 -1.19 -4.77 117.00 112.90 3dyo n LEU 546 Ca 0.00 0.07 -0.42 0.00 -0.02 0.00 0.00 56.01 55.64 3dyo n LEU 546 Cb 0.00 -0.82 -0.03 0.00 -1.62 0.00 0.00 43.42 40.95 3dyo n LEU 546 CO 0.00 -0.15 1.07 -0.83 -1.22 0.00 0.00 177.39 176.26 3dyo s GLY 547 N -2.91 2.23 0.00 -0.72 0.00 0.12 -2.26 107.32 103.77 3dyo s GLY 547 Ca 0.00 1.22 0.00 0.00 0.00 0.00 0.00 44.72 45.94 3dyo s GLY 547 CO 0.00 2.25 0.00 0.61 0.00 0.00 0.00 173.10 175.96 3dyo n GLY 548 N 2.65 0.77 0.20 0.20 0.00 0.16 -4.01 105.19 105.15 3dyo n GLY 548 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.07 3dyo n GLY 548 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3dyo h PHE 549 N 0.00 0.29 -0.17 1.61 3.57 -1.64 -1.99 116.94 118.61 3dyo h PHE 549 Ca 0.00 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.57 3dyo h PHE 549 Cb 0.00 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 3dyo h PHE 549 CO 0.00 0.09 0.13 0.00 -2.23 0.00 0.00 178.31 176.30 3dyo h ALA 550 N 1.33 2.10 -0.72 2.41 0.00 -1.86 -1.94 119.26 120.58 3dyo h ALA 550 Ca 0.23 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.17 3dyo h ALA 550 Cb 0.25 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 3dyo h ALA 550 CO -0.24 -0.21 0.45 -0.22 0.00 0.00 0.00 179.25 179.03 3dyo h LYS 551 N 0.00 0.86 -0.22 0.00 3.64 -1.76 -0.64 116.57 118.44 3dyo h LYS 551 Ca 0.08 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 3dyo h LYS 551 Cb 0.33 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3dyo h LYS 551 CO -0.00 0.57 0.06 1.88 -2.27 0.00 0.00 179.45 179.69 3dyo h TYR 552 N 0.88 0.37 -0.84 1.91 -1.99 -1.38 -2.93 116.97 112.99 3dyo h TYR 552 Ca 0.29 -0.04 -0.03 0.00 2.00 0.00 0.00 58.73 60.96 3dyo h TYR 552 Cb 0.03 -0.10 -0.04 0.00 2.00 0.00 0.00 36.73 38.62 3dyo h TYR 552 CO -0.04 0.44 0.42 -1.49 -0.00 0.00 0.00 178.16 177.49 3dyo h TRP 553 N 0.19 1.18 -0.95 4.88 4.06 -1.29 0.15 115.95 124.17 3dyo h TRP 553 Ca 0.07 -0.05 0.03 0.00 2.06 0.00 0.00 58.89 61.00 3dyo h TRP 553 Cb 0.25 -0.37 -0.05 0.00 -1.00 0.00 0.00 29.16 27.98 3dyo h TRP 553 CO 0.01 0.84 0.62 0.37 -3.56 0.00 0.00 178.44 176.72 3dyo h GLN 554 N 1.18 1.18 -0.15 0.49 -0.00 -1.11 0.12 115.11 116.83 3dyo h GLN 554 Ca 0.29 -0.07 -0.10 0.00 -0.00 0.00 0.00 58.65 58.77 3dyo h GLN 554 Cb 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 27.48 27.30 3dyo h GLN 554 CO -0.04 0.78 -0.30 0.00 0.00 0.00 0.00 178.83 179.28 3dyo h ALA 555 N 1.38 0.24 -0.94 3.38 0.00 -1.20 -1.16 119.26 120.95 3dyo h ALA 555 Ca 0.37 -0.41 0.08 0.00 0.00 0.00 0.00 54.91 54.95 3dyo h ALA 555 Cb -0.03 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 3dyo h ALA 555 CO -0.11 0.26 0.59 0.74 0.00 0.00 0.00 179.25 180.73 3dyo h PHE 556 N 0.09 1.09 -0.08 0.00 0.05 -0.68 -1.30 116.94 116.10 3dyo h PHE 556 Ca 0.01 0.03 -0.14 0.00 3.82 0.00 0.00 57.97 61.69 3dyo h PHE 556 Cb 0.89 -0.35 -0.01 0.00 2.00 0.00 0.00 35.95 38.48 3dyo h PHE 556 CO 0.10 0.52 -0.56 0.00 -0.18 0.00 0.00 178.31 178.20 3dyo h ARG 557 N 1.04 0.25 0.02 1.51 3.08 -0.49 -3.29 114.38 116.50 3dyo h ARG 557 Ca 0.42 -0.16 -0.21 0.00 0.07 0.00 0.00 59.98 60.11 3dyo h ARG 557 Cb 0.25 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 3dyo h ARG 557 CO -0.20 0.74 -0.98 0.37 -1.07 0.00 0.00 179.97 178.83 3dyo h GLN 558 N 0.19 0.10 -4.84 0.04 4.15 -0.63 -3.44 115.11 110.68 3dyo h GLN 558 Ca 0.00 -0.14 -0.67 0.00 0.77 0.00 0.00 58.65 58.62 3dyo h GLN 558 Cb 1.04 0.05 -0.24 0.00 0.21 0.00 0.00 27.48 28.54 3dyo h GLN 558 CO 0.09 0.99 -0.60 0.71 -1.93 0.00 0.00 178.83 178.09 3dyo s TYR 559 N -2.90 3.14 0.23 3.99 1.51 -0.54 -4.99 117.35 117.77 3dyo s TYR 559 Ca -0.01 -0.66 -0.07 0.00 -1.01 0.00 0.00 57.07 55.31 3dyo s TYR 559 Cb 0.10 -2.28 0.37 0.00 -0.11 0.00 0.00 41.96 40.03 3dyo s TYR 559 CO 0.83 -0.47 1.70 -1.35 -1.11 0.00 0.00 175.55 175.16 3dyo h PRO 560 N 8.27 0.29 0.00 -1.71 0.11 -1.86 -1.31 132.00 135.80 3dyo h PRO 560 Ca -0.34 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.75 3dyo h PRO 560 Cb 1.15 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3dyo h PRO 560 CO 0.60 0.19 0.00 0.54 -0.21 0.00 0.00 178.00 179.12 3dyo n ARG 561 N -5.11 0.26 -3.02 1.05 1.74 -1.26 -4.35 116.66 105.97 3dyo n ARG 561 Ca 0.11 0.07 -0.44 0.00 -0.77 0.00 0.00 57.85 56.82 3dyo n ARG 561 Cb 0.37 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.27 3dyo n ARG 561 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3dyo s LEU 562 N -2.67 4.92 -0.30 0.55 1.43 -0.49 -0.15 118.68 121.96 3dyo s LEU 562 Ca 0.20 -1.15 0.11 0.00 -1.03 0.00 0.00 54.13 52.26 3dyo s LEU 562 Cb 0.16 -2.39 0.71 0.00 0.03 0.00 0.00 46.19 44.69 3dyo s LEU 562 CO 0.38 -1.20 1.74 0.00 0.23 0.00 0.00 176.35 177.49 3dyo n GLN 563 N 6.83 3.50 0.00 1.70 6.02 -0.05 -4.64 117.38 130.74 3dyo n GLN 563 Ca -0.07 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 53.85 3dyo n GLN 563 Cb 0.44 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.56 3dyo n GLN 563 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyo n GLY 564 N -0.27 -0.38 0.00 1.08 0.00 -1.26 -0.60 105.19 103.77 3dyo n GLY 564 Ca 0.38 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3dyo n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 565 N 0.00 -1.09 3.08 -0.02 0.00 -0.85 -1.67 105.19 104.64 3dyo n GLY 565 Ca 0.00 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 3dyo n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyo s PHE 566 N -2.03 3.29 0.54 1.61 0.40 -0.48 -0.78 117.98 120.53 3dyo s PHE 566 Ca 0.00 -2.30 -0.22 0.00 -0.60 0.00 0.00 56.93 53.81 3dyo s PHE 566 Cb 0.00 -2.01 -0.06 0.00 0.51 0.00 0.00 43.02 41.46 3dyo s PHE 566 CO 0.00 -0.87 1.28 0.28 0.70 0.00 0.00 175.22 176.60 3dyo n VAL 567 N 4.45 3.64 -3.77 -0.44 0.31 0.03 -2.44 118.33 120.10 3dyo n VAL 567 Ca -0.13 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.33 3dyo n VAL 567 Cb 0.42 -1.55 -0.13 0.00 -0.91 0.00 0.00 33.84 31.67 3dyo n VAL 567 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 3dyo s TRP 568 N -1.31 3.19 0.00 3.52 -0.11 -0.20 -1.03 118.94 123.01 3dyo s TRP 568 Ca 0.71 -1.23 0.00 0.00 1.22 0.00 0.00 56.10 56.80 3dyo s TRP 568 Cb -0.43 -2.25 0.00 0.00 -1.50 0.00 0.00 33.47 29.29 3dyo s TRP 568 CO 0.50 -0.66 0.00 -0.40 -4.62 0.00 0.00 176.95 171.77 3dyo n ASP 569 N 4.83 0.00 0.08 5.86 5.75 -0.37 -0.72 116.55 131.98 3dyo n ASP 569 Ca -0.14 -0.79 -0.10 0.00 -0.01 0.00 0.00 54.79 53.75 3dyo n ASP 569 Cb 0.46 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.49 3dyo n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3dyo h TRP 570 N 0.79 -0.26 -3.97 2.11 2.91 -0.89 -0.65 115.95 115.99 3dyo h TRP 570 Ca 0.00 -0.01 -0.44 0.00 1.13 0.00 0.00 58.89 59.57 3dyo h TRP 570 Cb 0.00 0.09 -0.30 0.00 -0.51 0.00 0.00 29.16 28.44 3dyo h TRP 570 CO 0.00 0.11 -0.79 0.54 -1.03 0.00 0.00 178.44 177.26 3dyo s VAL 571 N -3.32 0.89 0.23 2.65 0.11 -1.26 -1.16 120.40 118.54 3dyo s VAL 571 Ca -0.11 -0.45 -0.31 0.00 -2.93 0.00 0.00 61.98 58.18 3dyo s VAL 571 Cb 0.00 -0.76 -0.13 0.00 -1.53 0.00 0.00 36.38 33.96 3dyo s VAL 571 CO 0.41 0.26 1.43 0.47 -3.33 0.00 0.00 175.10 174.34 3dyo n ASP 572 N 3.03 2.82 -2.95 3.54 8.00 -0.39 -4.35 116.55 126.25 3dyo n ASP 572 Ca -0.16 1.14 -0.32 0.00 0.71 0.00 0.00 54.79 56.15 3dyo n ASP 572 Cb 0.55 -1.43 -0.04 0.00 -0.02 0.00 0.00 41.12 40.18 3dyo n ASP 572 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dyo n GLN 573 N 2.15 3.45 -3.02 -1.24 6.02 0.15 -4.05 117.38 120.85 3dyo n GLN 573 Ca 0.12 -2.70 -0.29 0.00 -0.01 0.00 0.00 57.00 54.12 3dyo n GLN 573 Cb 0.31 -2.40 -0.03 0.00 1.02 0.00 0.00 30.24 29.14 3dyo n GLN 573 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3dyo s SER 574 N 0.69 6.47 0.11 1.08 1.04 -1.26 -4.74 113.70 117.09 3dyo s SER 574 Ca 0.59 0.95 0.09 0.00 0.48 0.00 0.00 55.95 58.06 3dyo s SER 574 Cb 0.27 -2.25 -0.04 0.00 0.10 0.00 0.00 66.02 64.11 3dyo s SER 574 CO -0.13 -0.34 -0.19 -0.76 0.98 0.00 0.00 173.24 172.80 3dyo s LEU 575 N -3.83 2.67 0.13 2.42 1.43 -0.41 -4.32 118.68 116.77 3dyo s LEU 575 Ca 0.48 -0.57 -0.29 0.00 -1.03 0.00 0.00 54.13 52.73 3dyo s LEU 575 Cb -0.10 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.53 3dyo s LEU 575 CO 0.32 0.18 0.91 -0.63 0.23 0.00 0.00 176.35 177.36 3dyo s ILE 576 N -1.13 4.43 0.19 -0.59 -1.09 -0.74 0.10 121.20 122.38 3dyo s ILE 576 Ca 0.18 1.98 0.03 0.00 -2.23 0.00 0.00 60.65 60.60 3dyo s ILE 576 Cb -0.11 -4.28 -0.05 0.00 -1.58 0.00 0.00 42.46 36.45 3dyo s ILE 576 CO 0.10 0.38 -0.01 -0.54 -1.23 0.00 0.00 174.94 173.64 3dyo s LYS 577 N -0.36 1.19 -0.06 2.79 1.02 -0.56 -4.94 119.74 118.82 3dyo s LYS 577 Ca 0.43 -1.58 0.06 0.00 0.02 0.00 0.00 55.97 54.90 3dyo s LYS 577 Cb -0.23 -0.42 -0.01 0.00 -0.52 0.00 0.00 37.83 36.64 3dyo s LYS 577 CO 0.29 -0.10 -0.23 0.71 -0.92 0.00 0.00 175.35 175.09 3dyo s TYR 578 N -3.54 2.29 0.47 3.18 1.51 -1.26 -0.31 117.35 119.68 3dyo s TYR 578 Ca 0.25 -0.70 -0.07 0.00 -1.01 0.00 0.00 57.07 55.54 3dyo s TYR 578 Cb 0.06 -1.51 0.11 0.00 -0.11 0.00 0.00 41.96 40.50 3dyo s TYR 578 CO 0.05 -0.23 0.64 -0.40 -1.11 0.00 0.00 175.55 174.51 3dyo n ASP 579 N 3.05 0.14 0.02 2.29 5.68 0.24 -4.77 116.55 123.20 3dyo n ASP 579 Ca -0.18 -1.29 0.16 0.00 -0.50 0.00 0.00 54.79 52.98 3dyo n ASP 579 Cb 0.52 -0.48 0.63 0.00 -1.14 0.00 0.00 41.12 40.65 3dyo n ASP 579 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3dyo h GLU 580 N 0.00 0.12 -0.07 0.11 9.09 -2.01 0.70 114.58 122.51 3dyo h GLU 580 Ca -0.21 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.20 3dyo h GLU 580 Cb 0.60 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 3dyo h GLU 580 CO 0.16 0.08 0.00 0.09 0.05 0.00 0.00 179.01 179.38 3dyo n ASN 581 N -4.43 0.65 -1.07 3.06 3.02 -1.26 -4.86 115.26 110.37 3dyo n ASN 581 Ca 0.08 -1.61 -0.14 0.00 -0.03 0.00 0.00 54.58 52.88 3dyo n ASN 581 Cb 0.45 -0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.52 3dyo n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyo n GLY 582 N 0.89 1.44 3.71 7.41 0.00 0.24 -4.96 105.19 113.92 3dyo n GLY 582 Ca 0.13 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 3dyo n GLY 582 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dyo s ASN 583 N -2.75 7.34 0.50 1.61 2.47 -1.25 -4.61 114.94 118.25 3dyo s ASN 583 Ca 0.00 1.62 -0.19 0.00 0.42 0.00 0.00 52.86 54.71 3dyo s ASN 583 Cb 0.00 -2.55 -0.08 0.00 -1.45 0.00 0.00 41.25 37.17 3dyo s ASN 583 CO 0.00 -0.20 1.02 -2.16 -3.72 0.00 0.00 177.10 172.04 3dyo s PRO 584 N 0.79 3.77 0.08 0.43 0.04 -1.26 0.79 135.00 139.65 3dyo s PRO 584 Ca 0.49 1.25 -0.07 0.00 0.04 0.00 0.00 61.00 62.71 3dyo s PRO 584 Cb -0.21 -2.10 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 3dyo s PRO 584 CO 0.27 -0.44 0.15 1.67 0.04 0.00 0.00 177.00 178.69 3dyo s TRP 585 N -2.17 0.21 -0.23 0.56 1.48 0.57 -4.88 118.94 114.47 3dyo s TRP 585 Ca 0.65 -0.65 -0.22 0.00 -1.06 0.00 0.00 56.10 54.82 3dyo s TRP 585 Cb -0.15 -0.11 -0.02 0.00 -1.16 0.00 0.00 33.47 32.04 3dyo s TRP 585 CO 0.24 -0.51 0.71 -1.12 -4.06 0.00 0.00 176.95 172.20 3dyo s SER 586 N -2.84 6.72 0.12 -2.66 0.01 -1.26 -1.50 113.70 112.29 3dyo s SER 586 Ca 0.05 0.88 0.07 0.00 1.31 0.00 0.00 55.95 58.26 3dyo s SER 586 Cb 0.05 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.86 3dyo s SER 586 CO -0.11 -0.39 -0.05 0.00 0.41 0.00 0.00 173.24 173.10 3dyo s ALA 587 N 2.43 3.10 0.00 1.44 0.00 0.12 -4.92 121.76 123.94 3dyo s ALA 587 Ca 0.31 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.01 3dyo s ALA 587 Cb -0.16 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 21.98 3dyo s ALA 587 CO 0.09 0.61 0.00 2.48 0.00 0.00 0.00 175.76 178.94 3dyo n TYR 588 N 0.43 0.00 -1.58 0.00 0.18 -1.26 -1.29 117.16 113.64 3dyo n TYR 588 Ca -0.12 0.00 -0.48 0.00 1.88 0.00 0.00 57.90 59.19 3dyo n TYR 588 Cb 0.53 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.46 3dyo n TYR 588 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3dyo n GLY 589 N 1.65 -0.05 1.78 -7.48 0.00 -0.57 -1.78 105.19 98.75 3dyo n GLY 589 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 3dyo n GLY 589 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 590 N 1.83 3.14 0.00 -0.02 0.00 -1.25 -3.90 105.19 104.99 3dyo n GLY 590 Ca 0.14 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 3dyo n GLY 590 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dyo n ASP 591 N 0.12 0.00 -0.74 1.61 8.00 -0.73 -2.27 116.55 122.54 3dyo n ASP 591 Ca 0.00 0.14 0.09 0.00 0.71 0.00 0.00 54.79 55.72 3dyo n ASP 591 Cb 0.00 -0.34 0.23 0.00 -0.02 0.00 0.00 41.12 40.99 3dyo n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dyo n PHE 592 N -1.34 0.76 -0.94 1.24 3.01 -1.26 -4.91 117.46 114.01 3dyo n PHE 592 Ca 0.08 -0.87 0.00 0.00 1.01 0.00 0.00 57.45 57.67 3dyo n PHE 592 Cb 0.18 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.38 3dyo n PHE 592 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dyo n GLY 593 N -0.61 0.88 3.71 1.37 0.00 -0.96 -4.86 105.19 104.72 3dyo n GLY 593 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3dyo n GLY 593 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dyo s ASP 594 N -2.87 6.69 -0.23 1.61 -4.77 -1.26 -4.98 116.67 110.85 3dyo s ASP 594 Ca 0.00 2.47 -0.20 0.00 -3.30 0.00 0.00 52.55 51.52 3dyo s ASP 594 Cb 0.00 -2.58 0.06 0.00 -1.09 0.00 0.00 42.92 39.31 3dyo s ASP 594 CO 0.00 -0.77 0.62 0.28 0.70 0.00 0.00 175.17 176.00 3dyo s THR 595 N 1.41 -0.00 0.82 2.11 -1.32 -1.26 -3.94 115.64 113.45 3dyo s THR 595 Ca 0.68 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 61.06 3dyo s THR 595 Cb -0.40 -0.86 0.08 0.00 -1.51 0.00 0.00 72.50 69.81 3dyo s THR 595 CO 0.31 0.00 1.11 -2.84 -2.21 0.00 0.00 174.62 170.98 3dyo s PRO 596 N 0.52 1.88 0.17 7.08 0.02 -1.26 -5.16 135.00 138.24 3dyo s PRO 596 Ca -0.02 1.26 -0.05 0.00 0.02 0.00 0.00 61.00 62.21 3dyo s PRO 596 Cb -0.05 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.60 3dyo s PRO 596 CO -0.02 -1.94 0.20 0.54 -0.33 0.00 0.00 177.00 175.45 3dyo s ASN 597 N -3.20 0.13 -0.33 2.53 2.20 -1.26 -4.74 114.94 110.28 3dyo s ASN 597 Ca 0.63 -1.07 0.09 0.00 -0.94 0.00 0.00 52.86 51.56 3dyo s ASN 597 Cb -0.19 0.40 0.62 0.00 -2.00 0.00 0.00 41.25 40.08 3dyo s ASN 597 CO 0.57 -0.85 1.67 0.47 -2.94 0.00 0.00 177.10 176.02 3dyo n ASP 598 N -0.20 3.66 0.00 3.54 8.00 0.17 -4.93 116.55 126.79 3dyo n ASP 598 Ca -0.05 -3.48 0.00 0.00 0.71 0.00 0.00 54.79 51.98 3dyo n ASP 598 Cb 0.64 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 41.03 3dyo n ASP 598 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 3dyo n ARG 599 N -0.78 0.00 0.00 -1.24 1.85 -1.25 -1.29 116.66 113.95 3dyo n ARG 599 Ca 0.41 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 57.34 3dyo n ARG 599 Cb 1.28 0.00 0.48 0.00 -1.05 0.00 0.00 32.46 33.17 3dyo n ARG 599 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3dyo n GLN 600 N 14.00 0.74 0.01 2.89 0.00 -1.26 -1.51 117.38 132.25 3dyo n GLN 600 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 57.00 57.04 3dyo n GLN 600 Cb 0.00 -1.34 0.20 0.00 0.00 0.00 0.00 30.24 29.10 3dyo n GLN 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3dyo n PHE 601 N -0.84 0.03 1.84 2.61 3.01 -0.41 -1.08 117.46 122.63 3dyo n PHE 601 Ca 0.12 0.02 0.15 0.00 1.01 0.00 0.00 57.45 58.75 3dyo n PHE 601 Cb 0.06 -0.52 0.82 0.00 -0.01 0.00 0.00 39.48 39.82 3dyo n PHE 601 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dyo s MET 603 N -2.00 1.81 -0.02 0.00 -1.94 -0.24 -0.67 119.30 116.23 3dyo s MET 603 Ca 0.45 -1.80 0.10 0.00 -1.71 0.00 0.00 55.69 52.73 3dyo s MET 603 Cb 0.22 -3.38 0.17 0.00 2.01 0.00 0.00 34.83 33.85 3dyo s MET 603 CO 0.36 -0.97 1.08 0.09 -0.01 0.00 0.00 175.02 175.56 3dyo n ASN 604 N 4.44 0.62 -4.95 3.03 5.03 -1.26 -4.15 115.26 118.01 3dyo n ASN 604 Ca -0.01 -2.22 -0.23 0.00 0.87 0.00 0.00 54.58 53.00 3dyo n ASN 604 Cb 0.42 -0.27 0.02 0.00 -1.02 0.00 0.00 39.78 38.93 3dyo n ASN 604 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3dyo s GLY 605 N -1.60 1.63 0.48 7.41 0.00 -1.24 -1.24 107.32 112.77 3dyo s GLY 605 Ca 0.15 -1.07 0.27 0.00 0.00 0.00 0.00 44.72 44.07 3dyo s GLY 605 CO -0.05 -0.86 1.80 1.41 0.00 0.00 0.00 173.10 175.40 3dyo h LEU 606 N 0.23 0.00 -8.66 0.66 3.38 0.43 -3.44 115.31 107.92 3dyo h LEU 606 Ca -0.45 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.00 3dyo h LEU 606 Cb 1.26 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.81 3dyo h LEU 606 CO 0.57 0.07 -0.80 0.68 0.09 0.00 0.00 178.44 179.05 3dyo s VAL 607 N -3.47 1.61 0.91 1.22 -7.23 -0.48 -0.56 120.40 112.39 3dyo s VAL 607 Ca 0.03 -1.60 -0.11 0.00 -1.81 0.00 0.00 61.98 58.49 3dyo s VAL 607 Cb 0.08 -1.54 0.13 0.00 0.56 0.00 0.00 36.38 35.61 3dyo s VAL 607 CO 0.61 -0.17 1.09 -0.36 -0.31 0.00 0.00 175.10 175.96 3dyo s PHE 608 N -1.45 2.21 0.47 2.82 0.40 0.06 -1.26 117.98 121.22 3dyo s PHE 608 Ca 0.07 1.33 0.23 0.00 -0.60 0.00 0.00 56.93 57.96 3dyo s PHE 608 Cb -0.09 -3.16 1.25 0.00 0.51 0.00 0.00 43.02 41.53 3dyo s PHE 608 CO 0.04 -2.48 1.88 0.00 0.70 0.00 0.00 175.22 175.36 3dyo h ALA 609 N -1.62 2.46 -0.26 5.36 0.00 -1.89 1.02 119.26 124.32 3dyo h ALA 609 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3dyo h ALA 609 Cb 1.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3dyo h ALA 609 CO 0.53 -0.73 0.00 -0.40 0.00 0.00 0.00 179.25 178.65 3dyo n ASP 610 N -4.42 1.69 0.00 0.00 5.68 -1.26 -4.55 116.55 113.69 3dyo n ASP 610 Ca 0.18 -2.06 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 3dyo n ASP 610 Cb 0.79 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 3dyo n ASP 610 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3dyo n ARG 611 N 0.29 -0.02 -2.31 0.11 3.00 0.35 -5.00 116.66 113.07 3dyo n ARG 611 Ca 0.09 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.53 3dyo n ARG 611 Cb 0.29 -2.72 -0.03 0.00 0.00 0.00 0.00 32.46 30.00 3dyo n ARG 611 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3dyo s THR 612 N -3.27 3.23 0.47 0.55 2.01 -1.25 -4.75 115.64 112.62 3dyo s THR 612 Ca 0.00 1.16 -0.23 0.00 0.31 0.00 0.00 61.69 62.93 3dyo s THR 612 Cb 0.00 -3.74 -0.07 0.00 0.01 0.00 0.00 72.50 68.70 3dyo s THR 612 CO 0.00 0.25 1.20 -2.84 -0.69 0.00 0.00 174.62 172.53 3dyo s PRO 613 N -1.14 3.68 0.51 4.92 0.02 -1.26 -0.76 135.00 140.96 3dyo s PRO 613 Ca 0.49 1.85 -0.05 0.00 0.02 0.00 0.00 61.00 63.31 3dyo s PRO 613 Cb -0.35 -2.40 -0.02 0.00 0.02 0.00 0.00 34.50 31.75 3dyo s PRO 613 CO 0.43 -0.63 0.80 -1.01 -0.33 0.00 0.00 177.00 176.26 3dyo s HIS 614 N -1.50 3.45 0.42 6.54 3.76 0.28 -4.79 115.29 123.45 3dyo s HIS 614 Ca 0.64 0.71 0.14 0.00 -0.15 0.00 0.00 55.06 56.40 3dyo s HIS 614 Cb -0.30 -2.41 1.00 0.00 1.11 0.00 0.00 32.58 31.98 3dyo s HIS 614 CO 0.37 -0.42 1.93 -1.35 -0.85 0.00 0.00 174.74 174.42 3dyo h PRO 615 N 0.14 0.45 -0.26 8.40 0.11 -1.93 -1.99 132.00 136.91 3dyo h PRO 615 Ca -0.47 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.69 3dyo h PRO 615 Cb 1.22 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3dyo h PRO 615 CO 0.61 0.30 0.22 0.00 -0.21 0.00 0.00 178.00 178.92 3dyo h ALA 616 N 1.65 2.06 -0.72 -0.75 0.00 -1.86 -2.20 119.26 117.45 3dyo h ALA 616 Ca 0.35 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.38 3dyo h ALA 616 Cb 0.72 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 3dyo h ALA 616 CO -0.11 -0.35 0.28 1.25 0.00 0.00 0.00 179.25 180.31 3dyo h LEU 617 N 0.00 0.26 -1.34 0.00 5.85 -1.55 -0.48 115.31 118.04 3dyo h LEU 617 Ca 0.12 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 3dyo h LEU 617 Cb 0.56 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 3dyo h LEU 617 CO -0.00 0.11 -0.33 0.00 -0.34 0.00 0.00 178.44 177.88 3dyo h THR 618 N 0.43 1.20 -0.59 1.05 1.03 -1.60 -0.36 112.91 114.07 3dyo h THR 618 Ca 0.38 -1.14 -0.08 0.00 -0.01 0.00 0.00 66.41 65.56 3dyo h THR 618 Cb 0.56 1.62 -0.02 0.00 -1.07 0.00 0.00 68.15 69.23 3dyo h THR 618 CO -0.38 0.32 0.04 -0.08 -0.01 0.00 0.00 175.52 175.41 3dyo h GLU 619 N 0.00 1.00 -0.26 0.00 4.57 -1.22 -0.93 114.58 117.74 3dyo h GLU 619 Ca -0.00 -0.28 -0.06 0.00 -1.18 0.00 0.00 59.36 57.83 3dyo h GLU 619 Cb 0.59 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 3dyo h GLU 619 CO 0.04 0.96 -0.06 0.00 -1.18 0.00 0.00 179.01 178.77 3dyo h ALA 620 N 1.10 0.36 -0.66 2.92 0.00 -0.48 -1.66 119.26 120.84 3dyo h ALA 620 Ca 0.18 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.90 3dyo h ALA 620 Cb 0.48 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 3dyo h ALA 620 CO 0.02 0.17 0.32 -0.22 0.00 0.00 0.00 179.25 179.54 3dyo h LYS 621 N 0.26 0.55 -0.28 0.00 3.64 -0.84 0.45 116.57 120.34 3dyo h LYS 621 Ca 0.07 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 3dyo h LYS 621 Cb 0.53 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 3dyo h LYS 621 CO 0.03 0.37 -0.08 1.25 -2.27 0.00 0.00 179.45 178.74 3dyo h HIS 622 N 0.57 0.63 -0.16 1.91 2.76 -1.04 -2.91 115.15 116.91 3dyo h HIS 622 Ca 0.32 -0.14 -0.08 0.00 -2.20 0.00 0.00 60.37 58.27 3dyo h HIS 622 Cb 0.31 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 3dyo h HIS 622 CO -0.11 0.76 -0.27 1.96 -1.30 0.00 0.00 177.93 178.97 3dyo h GLN 623 N 0.31 0.29 -0.18 5.26 1.08 -1.05 -2.77 115.11 118.04 3dyo h GLN 623 Ca 0.07 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3dyo h GLN 623 Cb 0.57 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 3dyo h GLN 623 CO 0.03 0.55 0.00 1.04 -0.95 0.00 0.00 178.83 179.50 3dyo n GLN 624 N -4.14 1.39 -1.23 1.46 6.02 0.13 -4.97 117.38 116.04 3dyo n GLN 624 Ca -0.01 -0.59 -0.36 0.00 -0.01 0.00 0.00 57.00 56.03 3dyo n GLN 624 Cb 0.39 -1.14 0.07 0.00 1.02 0.00 0.00 30.24 30.58 3dyo n GLN 624 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3dyo n GLN 625 N -0.02 0.27 -0.20 -1.09 6.02 -1.05 -4.89 117.38 116.41 3dyo n GLN 625 Ca 0.05 0.13 0.10 0.00 -0.01 0.00 0.00 57.00 57.27 3dyo n GLN 625 Cb 0.15 -1.83 0.20 0.00 1.02 0.00 0.00 30.24 29.78 3dyo n GLN 625 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3dyo n PHE 626 N -2.45 0.53 -4.56 1.08 3.01 -1.26 -4.84 117.46 108.97 3dyo n PHE 626 Ca 0.10 -0.33 -0.23 0.00 1.01 0.00 0.00 57.45 58.00 3dyo n PHE 626 Cb 0.50 -0.01 -0.16 0.00 -0.01 0.00 0.00 39.48 39.81 3dyo n PHE 626 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3dyo s PHE 627 N -1.21 1.27 0.11 1.38 0.40 -1.26 -0.53 117.98 118.14 3dyo s PHE 627 Ca 0.34 -0.36 0.07 0.00 -0.60 0.00 0.00 56.93 56.38 3dyo s PHE 627 Cb 0.19 -0.89 -0.04 0.00 0.51 0.00 0.00 43.02 42.79 3dyo s PHE 627 CO 0.26 -0.15 -0.06 -0.65 0.70 0.00 0.00 175.22 175.32 3dyo s GLN 628 N 0.25 2.27 0.05 0.44 -1.52 -0.09 -4.93 119.66 116.12 3dyo s GLN 628 Ca -0.05 -1.00 0.03 0.00 -1.95 0.00 0.00 55.36 52.39 3dyo s GLN 628 Cb -0.11 -2.36 -0.02 0.00 -0.22 0.00 0.00 33.01 30.29 3dyo s GLN 628 CO 0.02 0.50 -0.10 -0.06 -0.25 0.00 0.00 175.29 175.40 3dyo s PHE 629 N -1.34 0.85 0.02 0.91 0.40 -1.26 0.41 117.98 117.98 3dyo s PHE 629 Ca 0.24 -0.44 0.01 0.00 -0.60 0.00 0.00 56.93 56.14 3dyo s PHE 629 Cb -0.11 -0.50 -0.02 0.00 0.51 0.00 0.00 43.02 42.90 3dyo s PHE 629 CO 0.16 -0.03 -0.05 1.03 0.70 0.00 0.00 175.22 177.03 3dyo s ARG 630 N -1.45 0.38 -0.12 0.44 0.52 -0.29 -4.98 118.95 113.45 3dyo s ARG 630 Ca -0.06 -0.56 0.03 0.00 -0.52 0.00 0.00 55.73 54.62 3dyo s ARG 630 Cb -0.09 -0.12 0.00 0.00 0.52 0.00 0.00 34.95 35.26 3dyo s ARG 630 CO 0.01 0.01 -0.21 -1.17 0.02 0.00 0.00 175.30 173.96 3dyo s LEU 631 N -1.22 2.20 -0.27 2.53 2.96 -1.26 -0.52 118.68 123.10 3dyo s LEU 631 Ca -0.10 -0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 53.25 3dyo s LEU 631 Cb -0.08 -1.46 0.09 0.00 0.50 0.00 0.00 46.19 45.24 3dyo s LEU 631 CO -0.00 0.12 0.09 -0.55 -1.32 0.00 0.00 176.35 174.69 3dyo s SER 632 N 0.56 3.62 1.69 3.68 0.15 0.67 -5.00 113.70 119.06 3dyo s SER 632 Ca -0.13 -1.34 0.00 0.00 0.70 0.00 0.00 55.95 55.19 3dyo s SER 632 Cb -0.17 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 3dyo s SER 632 CO 0.04 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.70 3dyo n GLY 633 N 4.99 1.07 0.94 9.45 0.00 -1.26 0.75 105.19 121.14 3dyo n GLY 633 Ca -0.05 0.48 0.08 0.00 0.00 0.00 0.00 46.02 46.52 3dyo n GLY 633 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dyo n GLN 634 N 0.00 3.06 -4.30 1.61 3.00 -1.26 -4.94 117.38 114.54 3dyo n GLN 634 Ca 0.00 -2.46 -0.34 0.00 -0.01 0.00 0.00 57.00 54.18 3dyo n GLN 634 Cb 0.00 -1.56 -0.11 0.00 0.00 0.00 0.00 30.24 28.57 3dyo n GLN 634 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3dyo s THR 635 N -1.64 4.26 -0.19 5.09 2.01 0.23 0.01 115.64 125.41 3dyo s THR 635 Ca 0.35 -0.24 -0.05 0.00 0.31 0.00 0.00 61.69 62.06 3dyo s THR 635 Cb 0.23 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.86 3dyo s THR 635 CO 0.17 0.53 0.01 -0.63 -0.69 0.00 0.00 174.62 174.01 3dyo s ILE 636 N -0.12 4.12 -0.24 1.82 1.01 0.14 -0.24 121.20 127.69 3dyo s ILE 636 Ca 0.04 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.35 3dyo s ILE 636 Cb -0.13 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 3dyo s ILE 636 CO 0.02 0.44 0.08 -0.70 0.00 0.00 0.00 174.94 174.78 3dyo s GLU 637 N 0.77 3.74 -0.14 2.79 2.12 0.32 0.11 118.70 128.41 3dyo s GLU 637 Ca 0.01 -0.44 -0.03 0.00 0.36 0.00 0.00 54.97 54.87 3dyo s GLU 637 Cb -0.14 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 3dyo s GLU 637 CO 0.02 -0.10 -0.05 0.08 -0.54 0.00 0.00 175.26 174.67 3dyo s VAL 638 N 1.38 3.78 -0.06 3.70 1.01 0.90 -1.14 120.40 129.97 3dyo s VAL 638 Ca 0.05 -0.41 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3dyo s VAL 638 Cb -0.15 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.58 3dyo s VAL 638 CO 0.04 0.51 -0.19 -0.89 0.00 0.00 0.00 175.10 174.57 3dyo s THR 639 N 0.18 2.57 -0.00 3.92 2.01 0.16 -0.87 115.64 123.62 3dyo s THR 639 Ca -0.03 -0.88 -0.17 0.00 0.31 0.00 0.00 61.69 60.92 3dyo s THR 639 Cb -0.14 -1.99 -0.06 0.00 0.01 0.00 0.00 72.50 70.33 3dyo s THR 639 CO 0.03 0.57 0.49 -0.55 -0.69 0.00 0.00 174.62 174.47 3dyo s SER 640 N -0.30 6.88 0.00 3.53 0.15 -0.04 -0.91 113.70 123.01 3dyo s SER 640 Ca 0.01 1.04 0.19 0.00 0.70 0.00 0.00 55.95 57.89 3dyo s SER 640 Cb -0.13 -2.30 0.53 0.00 -1.71 0.00 0.00 66.02 62.42 3dyo s SER 640 CO 0.03 0.22 1.45 -0.62 1.20 0.00 0.00 173.24 175.51 3dyo n GLU 641 N 2.26 2.76 -2.77 5.44 1.02 0.31 -2.43 120.64 127.24 3dyo n GLU 641 Ca -0.11 -2.46 -0.34 0.00 -0.02 0.00 0.00 57.16 54.23 3dyo n GLU 641 Cb 0.52 -1.47 -0.06 0.00 -0.02 0.00 0.00 31.44 30.40 3dyo n GLU 641 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3dyo s TYR 642 N -1.01 3.39 -0.16 -0.32 1.51 -1.26 -4.82 117.35 114.68 3dyo s TYR 642 Ca 0.41 1.66 0.18 0.00 -1.01 0.00 0.00 57.07 58.31 3dyo s TYR 642 Cb 0.21 -2.91 -0.26 0.00 -0.11 0.00 0.00 41.96 38.90 3dyo s TYR 642 CO 0.28 -0.11 0.20 1.28 -1.11 0.00 0.00 175.55 176.09 3dyo n LEU 643 N -0.28 0.09 -0.00 -1.29 4.77 -1.26 -1.44 117.00 117.58 3dyo n LEU 643 Ca 0.06 0.04 -0.00 0.00 -0.03 0.00 0.00 56.01 56.07 3dyo n LEU 643 Cb 0.52 0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 42.00 3dyo n LEU 643 CO 0.40 0.40 -0.51 0.49 -1.33 0.00 0.00 177.39 176.84 3dyo n PHE 644 N -2.70 0.00 -4.15 -1.77 3.01 -1.26 -4.83 117.46 105.77 3dyo n PHE 644 Ca -0.27 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 57.97 3dyo n PHE 644 Cb 1.05 -0.02 -0.05 0.00 -0.01 0.00 0.00 39.48 40.45 3dyo n PHE 644 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 3dyo s ARG 645 N -2.01 2.78 0.51 -1.08 1.70 -1.26 -4.85 118.95 114.75 3dyo s ARG 645 Ca -0.00 -1.10 -0.04 0.00 -0.47 0.00 0.00 55.73 54.12 3dyo s ARG 645 Cb 0.00 -2.49 -0.01 0.00 -0.57 0.00 0.00 34.95 31.88 3dyo s ARG 645 CO 0.02 0.41 0.79 -1.01 -1.08 0.00 0.00 175.30 174.43 3dyo s HIS 646 N -2.11 3.34 -1.39 5.89 3.76 -1.26 -3.50 115.29 120.02 3dyo s HIS 646 Ca 0.32 0.57 -0.13 0.00 -0.15 0.00 0.00 55.06 55.66 3dyo s HIS 646 Cb -0.08 -2.47 0.08 0.00 1.11 0.00 0.00 32.58 31.22 3dyo s HIS 646 CO 0.24 -0.52 2.06 -1.13 -0.85 0.00 0.00 174.74 174.54 3dyo n SER 647 N -2.33 4.33 -1.28 1.40 3.41 -0.75 -4.68 113.62 113.73 3dyo n SER 647 Ca 0.02 -2.92 0.06 0.00 -0.26 0.00 0.00 58.87 55.77 3dyo n SER 647 Cb 0.57 -1.62 0.26 0.00 -0.26 0.00 0.00 64.21 63.16 3dyo n SER 647 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3dyo n ASP 648 N 5.77 3.72 -2.76 4.04 5.68 -1.26 -3.86 116.55 127.88 3dyo n ASP 648 Ca 0.48 -2.39 -0.10 0.00 -0.50 0.00 0.00 54.79 52.28 3dyo n ASP 648 Cb 0.39 -0.52 0.06 0.00 -1.14 0.00 0.00 41.12 39.91 3dyo n ASP 648 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3dyo n ASN 649 N 0.68 -0.21 -3.73 -1.12 5.15 -1.26 -5.06 115.26 109.71 3dyo n ASN 649 Ca 0.19 -2.79 -0.13 0.00 -0.60 0.00 0.00 54.58 51.25 3dyo n ASN 649 Cb 0.73 0.26 -0.10 0.00 -0.53 0.00 0.00 39.78 40.14 3dyo n ASN 649 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dyo s GLU 650 N -1.52 0.47 0.03 1.20 8.01 -1.25 -4.16 118.70 121.47 3dyo s GLU 650 Ca 0.27 0.61 0.02 0.00 0.01 0.00 0.00 54.97 55.87 3dyo s GLU 650 Cb 0.40 0.19 -0.02 0.00 -4.31 0.00 0.00 34.13 30.40 3dyo s GLU 650 CO -0.03 -0.08 -0.06 -0.48 0.01 0.00 0.00 175.26 174.62 3dyo s LEU 651 N 0.43 2.18 -0.23 1.80 0.05 -0.02 -2.54 118.68 120.34 3dyo s LEU 651 Ca -0.02 -0.40 -0.14 0.00 0.05 0.00 0.00 54.13 53.63 3dyo s LEU 651 Cb -0.04 -0.14 -0.04 0.00 -2.05 0.00 0.00 46.19 43.92 3dyo s LEU 651 CO -0.02 -0.14 0.31 -0.22 -0.55 0.00 0.00 176.35 175.73 3dyo s LEU 652 N -1.11 4.11 -0.10 1.48 2.96 0.22 -0.96 118.68 125.27 3dyo s LEU 652 Ca -0.07 0.31 -0.03 0.00 -0.22 0.00 0.00 54.13 54.12 3dyo s LEU 652 Cb -0.07 -2.35 -0.03 0.00 0.50 0.00 0.00 46.19 44.24 3dyo s LEU 652 CO 0.00 -0.05 0.02 -1.00 -1.32 0.00 0.00 176.35 174.01 3dyo s HIS 653 N 1.40 3.23 0.05 5.38 3.76 0.37 0.69 115.29 130.16 3dyo s HIS 653 Ca 0.14 0.22 0.05 0.00 -0.15 0.00 0.00 55.06 55.31 3dyo s HIS 653 Cb -0.15 -1.84 -0.02 0.00 1.11 0.00 0.00 32.58 31.69 3dyo s HIS 653 CO 0.07 0.47 -0.13 1.67 -0.85 0.00 0.00 174.74 175.97 3dyo s TRP 654 N -0.78 1.15 -0.07 1.40 1.48 0.48 -0.76 118.94 121.84 3dyo s TRP 654 Ca 0.12 -0.38 -0.05 0.00 -1.06 0.00 0.00 56.10 54.73 3dyo s TRP 654 Cb -0.12 -0.68 0.02 0.00 -1.16 0.00 0.00 33.47 31.54 3dyo s TRP 654 CO 0.02 0.03 0.17 -1.64 -4.06 0.00 0.00 176.95 171.48 3dyo s MET 655 N -1.28 0.18 -0.12 3.25 1.00 0.04 -0.84 119.30 121.52 3dyo s MET 655 Ca -0.00 0.29 0.01 0.00 0.00 0.00 0.00 55.69 55.99 3dyo s MET 655 Cb -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 34.83 34.76 3dyo s MET 655 CO 0.01 -0.07 -0.17 0.08 0.00 0.00 0.00 175.02 174.88 3dyo s VAL 656 N 0.42 2.71 0.01 -6.03 1.01 0.18 -0.43 120.40 118.27 3dyo s VAL 656 Ca -0.03 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 3dyo s VAL 656 Cb -0.04 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 3dyo s VAL 656 CO -0.02 0.53 -0.01 0.00 0.00 0.00 0.00 175.10 175.61 3dyo s ALA 657 N 0.40 0.04 -0.37 5.51 0.00 -0.65 -0.81 121.76 125.88 3dyo s ALA 657 Ca -0.13 -0.23 -0.13 0.00 0.00 0.00 0.00 51.96 51.48 3dyo s ALA 657 Cb -0.16 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.02 3dyo s ALA 657 CO 0.06 -0.07 0.24 -1.17 0.00 0.00 0.00 175.76 174.82 3dyo s LEU 658 N -0.58 4.72 -1.51 0.00 2.96 0.09 -1.04 118.68 123.32 3dyo s LEU 658 Ca -0.06 -0.77 -0.02 0.00 -0.22 0.00 0.00 54.13 53.06 3dyo s LEU 658 Cb -0.04 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.56 3dyo s LEU 658 CO -0.00 -0.35 0.11 0.47 -1.32 0.00 0.00 176.35 175.26 3dyo n ASP 659 N 5.07 0.48 0.00 3.68 8.00 -0.78 0.20 116.55 133.21 3dyo n ASP 659 Ca -0.12 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.15 3dyo n ASP 659 Cb 0.48 -1.88 0.00 0.00 -0.02 0.00 0.00 41.12 39.70 3dyo n ASP 659 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dyo n GLY 660 N -2.45 2.76 3.63 0.44 0.00 -1.26 -4.85 105.19 103.46 3dyo n GLY 660 Ca -0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 3dyo n GLY 660 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyo s LYS 661 N -0.13 4.11 0.39 1.61 1.02 0.55 -4.67 119.74 122.63 3dyo s LYS 661 Ca 0.00 0.86 -0.26 0.00 0.02 0.00 0.00 55.97 56.59 3dyo s LYS 661 Cb 0.00 -3.67 -0.11 0.00 -0.52 0.00 0.00 37.83 33.53 3dyo s LYS 661 CO 0.00 -0.59 1.21 -2.30 -0.92 0.00 0.00 175.35 172.75 3dyo n PRO 662 N 6.12 1.84 0.00 -1.68 -0.02 -1.26 -0.73 135.00 139.27 3dyo n PRO 662 Ca 0.06 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3dyo n PRO 662 Cb 0.48 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3dyo n PRO 662 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dyo n LEU 663 N 0.49 1.42 -3.53 2.45 4.77 0.01 -4.81 117.00 117.80 3dyo n LEU 663 Ca 0.07 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.90 3dyo n LEU 663 Cb 0.38 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3dyo n LEU 663 CO 0.60 0.19 0.36 0.00 -1.33 0.00 0.00 177.39 177.21 3dyo s ALA 664 N -1.83 -1.54 -0.03 -1.18 0.00 -0.90 -5.00 121.76 111.28 3dyo s ALA 664 Ca 0.00 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 52.52 3dyo s ALA 664 Cb 0.00 0.33 0.07 0.00 0.00 0.00 0.00 23.12 23.52 3dyo s ALA 664 CO 0.00 -0.50 0.65 -1.54 0.00 0.00 0.00 175.76 174.36 3dyo s SER 665 N -1.82 -0.62 0.35 0.00 1.04 -1.26 0.47 113.70 111.86 3dyo s SER 665 Ca -0.06 0.62 -0.15 0.00 0.48 0.00 0.00 55.95 56.83 3dyo s SER 665 Cb -0.01 0.53 0.04 0.00 0.10 0.00 0.00 66.02 66.68 3dyo s SER 665 CO 0.01 -0.62 0.71 -0.83 0.98 0.00 0.00 173.24 173.48 3dyo s GLY 666 N -1.32 0.42 0.05 7.32 0.00 -0.02 -4.98 107.32 108.78 3dyo s GLY 666 Ca -0.10 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 43.88 3dyo s GLY 666 CO 0.08 -0.37 -0.08 -0.54 0.00 0.00 0.00 173.10 172.19 3dyo s GLU 667 N -2.91 0.55 -0.09 2.90 2.02 -1.26 -0.39 118.70 119.53 3dyo s GLU 667 Ca 0.17 -0.80 -0.05 0.00 0.02 0.00 0.00 54.97 54.31 3dyo s GLU 667 Cb -0.04 -0.27 0.04 0.00 0.10 0.00 0.00 34.13 33.95 3dyo s GLU 667 CO 0.11 0.04 0.21 0.08 0.02 0.00 0.00 175.26 175.72 3dyo s VAL 668 N -1.57 -0.03 0.40 2.63 1.01 0.22 -4.97 120.40 118.08 3dyo s VAL 668 Ca -0.08 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.75 3dyo s VAL 668 Cb -0.09 -0.32 -0.09 0.00 0.00 0.00 0.00 36.38 35.88 3dyo s VAL 668 CO -0.00 0.05 1.38 -2.16 0.00 0.00 0.00 175.10 174.37 3dyo s PRO 669 N 0.95 3.97 -0.21 2.72 0.04 -1.26 0.69 135.00 141.89 3dyo s PRO 669 Ca -0.07 2.34 -0.07 0.00 0.04 0.00 0.00 61.00 63.24 3dyo s PRO 669 Cb -0.08 -2.82 -0.04 0.00 0.04 0.00 0.00 34.50 31.60 3dyo s PRO 669 CO -0.06 -0.56 0.06 -0.51 0.04 0.00 0.00 177.00 175.98 3dyo s LEU 670 N -2.36 3.64 -0.42 -3.56 1.43 -1.05 -4.72 118.68 111.64 3dyo s LEU 670 Ca 0.56 -0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 3dyo s LEU 670 Cb -0.42 -1.94 0.15 0.00 0.03 0.00 0.00 46.19 44.01 3dyo s LEU 670 CO 0.55 0.09 0.29 -0.62 0.23 0.00 0.00 176.35 176.89 3dyo s ASP 671 N 0.90 2.66 -0.07 2.29 2.15 -1.26 -4.73 116.67 118.61 3dyo s ASP 671 Ca 0.04 -2.77 0.04 0.00 0.43 0.00 0.00 52.55 50.29 3dyo s ASP 671 Cb -0.14 -0.65 -0.02 0.00 -0.30 0.00 0.00 42.92 41.82 3dyo s ASP 671 CO 0.03 -0.23 -0.20 -0.69 -0.17 0.00 0.00 175.17 173.91 3dyo s VAL 672 N 0.30 2.48 0.57 1.11 1.01 -1.26 -4.89 120.40 119.72 3dyo s VAL 672 Ca 0.24 -0.91 -0.14 0.00 0.00 0.00 0.00 61.98 61.17 3dyo s VAL 672 Cb -0.11 -1.95 -0.06 0.00 0.00 0.00 0.00 36.38 34.27 3dyo s VAL 672 CO -0.09 0.57 1.01 0.00 0.00 0.00 0.00 175.10 176.59 3dyo s ALA 673 N -0.24 3.05 0.23 5.51 0.00 -1.26 -1.81 121.76 127.24 3dyo s ALA 673 Ca -0.00 0.08 -0.32 0.00 0.00 0.00 0.00 51.96 51.72 3dyo s ALA 673 Cb -0.13 -3.11 -0.13 0.00 0.00 0.00 0.00 23.12 19.74 3dyo s ALA 673 CO 0.03 -0.48 1.43 -0.35 0.00 0.00 0.00 175.76 176.39 3dyo n PRO 674 N -2.11 2.05 -0.86 0.00 -0.04 -1.23 0.11 135.00 132.92 3dyo n PRO 674 Ca 0.06 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.25 3dyo n PRO 674 Cb 0.54 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.60 3dyo n PRO 674 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3dyo n GLN 675 N 2.21 -1.12 -1.31 0.54 1.13 -0.52 -4.93 117.38 113.37 3dyo n GLN 675 Ca 0.12 0.28 -0.11 0.00 -1.94 0.00 0.00 57.00 55.36 3dyo n GLN 675 Cb 0.31 -4.52 0.06 0.00 0.11 0.00 0.00 30.24 26.20 3dyo n GLN 675 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dyo n GLY 676 N -0.43 0.26 3.27 1.08 0.00 0.31 -4.71 105.19 104.96 3dyo n GLY 676 Ca 0.00 -1.92 -0.15 0.00 0.00 0.00 0.00 46.02 43.95 3dyo n GLY 676 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyo s LYS 677 N -3.72 1.14 -0.07 1.61 1.02 -1.26 -0.86 119.74 117.60 3dyo s LYS 677 Ca 0.30 -1.51 -0.06 0.00 0.02 0.00 0.00 55.97 54.72 3dyo s LYS 677 Cb -0.01 -0.64 0.02 0.00 -0.52 0.00 0.00 37.83 36.68 3dyo s LYS 677 CO 0.20 0.04 0.18 -1.14 -0.92 0.00 0.00 175.35 173.70 3dyo s GLN 678 N -3.77 0.19 -0.13 1.68 0.74 -0.05 -4.80 119.66 113.52 3dyo s GLN 678 Ca 0.20 0.28 -0.02 0.00 0.05 0.00 0.00 55.36 55.87 3dyo s GLN 678 Cb 0.03 0.04 -0.03 0.00 1.10 0.00 0.00 33.01 34.16 3dyo s GLN 678 CO 0.03 -0.05 -0.05 -0.51 -0.55 0.00 0.00 175.29 174.15 3dyo s LEU 679 N 0.34 3.22 -0.14 3.68 1.43 -1.26 -0.07 118.68 125.88 3dyo s LEU 679 Ca -0.02 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.01 3dyo s LEU 679 Cb -0.03 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.45 3dyo s LEU 679 CO -0.01 0.23 -0.22 -0.63 0.23 0.00 0.00 176.35 175.95 3dyo s ILE 680 N -0.02 2.02 -0.25 -0.59 1.01 0.12 -4.97 121.20 118.52 3dyo s ILE 680 Ca 0.01 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.55 3dyo s ILE 680 Cb -0.13 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 3dyo s ILE 680 CO 0.03 0.54 0.35 -0.70 0.00 0.00 0.00 174.94 175.16 3dyo s GLU 681 N 0.83 4.06 0.21 2.79 -6.30 -1.26 -0.69 118.70 118.33 3dyo s GLU 681 Ca -0.07 0.04 -0.19 0.00 -2.50 0.00 0.00 54.97 52.25 3dyo s GLU 681 Cb -0.15 -3.62 -0.08 0.00 0.00 0.00 0.00 34.13 30.28 3dyo s GLU 681 CO -0.02 -0.19 0.70 -0.51 0.02 0.00 0.00 175.26 175.26 3dyo s LEU 682 N 1.79 4.36 0.42 2.70 1.43 0.10 -5.02 118.68 124.47 3dyo s LEU 682 Ca 0.15 1.38 -0.24 0.00 -1.03 0.00 0.00 54.13 54.39 3dyo s LEU 682 Cb -0.15 -3.52 -0.10 0.00 0.03 0.00 0.00 46.19 42.45 3dyo s LEU 682 CO 0.09 0.05 1.07 -2.65 0.23 0.00 0.00 176.35 175.14 3dyo n PRO 683 N 0.79 1.47 -1.71 1.29 -0.02 -1.26 -4.89 135.00 130.67 3dyo n PRO 683 Ca -0.03 0.53 -0.40 0.00 -2.02 0.00 0.00 63.50 61.58 3dyo n PRO 683 Cb 0.51 -2.12 0.02 0.00 -0.02 0.00 0.00 33.50 31.89 3dyo n PRO 683 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dyo n GLU 684 N 0.08 1.82 -4.10 -0.52 2.13 -1.26 -4.94 120.64 113.85 3dyo n GLU 684 Ca 0.09 0.65 -0.32 0.00 0.66 0.00 0.00 57.16 58.24 3dyo n GLU 684 Cb 0.39 -2.43 -0.07 0.00 0.27 0.00 0.00 31.44 29.61 3dyo n GLU 684 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3dyo s LEU 685 N -2.16 3.87 0.93 4.31 1.43 -1.26 -5.09 118.68 120.70 3dyo s LEU 685 Ca 0.64 0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 53.74 3dyo s LEU 685 Cb -0.48 -2.31 0.15 0.00 0.03 0.00 0.00 46.19 43.58 3dyo s LEU 685 CO 0.55 0.25 1.10 -2.16 0.23 0.00 0.00 176.35 176.33 3dyo s PRO 686 N -1.85 1.03 0.14 1.29 0.04 -1.26 -4.99 135.00 129.40 3dyo s PRO 686 Ca 0.24 0.61 -0.04 0.00 0.04 0.00 0.00 61.00 61.84 3dyo s PRO 686 Cb -0.12 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 3dyo s PRO 686 CO 0.15 -2.34 0.36 -0.65 0.04 0.00 0.00 177.00 174.56 3dyo s GLN 687 N -5.02 3.60 0.21 4.56 1.11 -1.26 -5.03 119.66 117.83 3dyo s GLN 687 Ca 0.64 -0.13 -0.30 0.00 0.01 0.00 0.00 55.36 55.58 3dyo s GLN 687 Cb -0.17 -2.86 -0.09 0.00 -1.01 0.00 0.00 33.01 28.88 3dyo s GLN 687 CO 0.56 0.48 1.23 -1.25 0.01 0.00 0.00 175.29 176.32 3dyo s PRO 688 N -2.67 4.46 0.00 2.91 0.04 -1.26 -4.87 135.00 133.61 3dyo s PRO 688 Ca 0.40 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.42 3dyo s PRO 688 Cb -0.12 -3.20 0.08 0.00 0.04 0.00 0.00 34.50 31.29 3dyo s PRO 688 CO 0.25 -0.12 0.88 -1.91 0.04 0.00 0.00 177.00 176.14 3dyo n GLU 689 N 2.25 0.83 -3.85 4.56 2.13 -1.26 -4.89 120.64 120.40 3dyo n GLU 689 Ca 0.04 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.87 3dyo n GLU 689 Cb 0.44 -1.03 0.01 0.00 0.27 0.00 0.00 31.44 31.14 3dyo n GLU 689 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3dyo n SER 690 N -0.53 -1.26 -4.74 4.31 3.41 -1.26 -5.15 113.62 108.40 3dyo n SER 690 Ca 0.01 -1.39 -0.36 0.00 -0.26 0.00 0.00 58.87 56.87 3dyo n SER 690 Cb 0.00 1.99 0.06 0.00 -0.26 0.00 0.00 64.21 66.00 3dyo n SER 690 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo s ALA 691 N -1.96 2.41 0.00 7.33 0.00 -1.26 -4.81 121.76 123.46 3dyo s ALA 691 Ca 0.27 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.30 3dyo s ALA 691 Cb -0.01 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3dyo s ALA 691 CO 0.01 -1.45 0.00 0.41 0.00 0.00 0.00 175.76 174.73 3dyo n GLY 692 N 0.64 0.98 3.53 0.00 0.00 -0.14 -4.93 105.19 105.26 3dyo n GLY 692 Ca 0.14 -2.01 -0.37 0.00 0.00 0.00 0.00 46.02 43.79 3dyo n GLY 692 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dyo s GLN 693 N -1.12 3.81 0.01 1.61 2.00 -1.26 0.77 119.66 125.48 3dyo s GLN 693 Ca 0.00 -0.40 -0.23 0.00 -2.00 0.00 0.00 55.36 52.73 3dyo s GLN 693 Cb 0.00 -3.41 -0.05 0.00 0.80 0.00 0.00 33.01 30.34 3dyo s GLN 693 CO 0.00 -0.10 0.69 -0.51 -0.50 0.00 0.00 175.29 174.87 3dyo s LEU 694 N 1.44 4.41 0.00 3.68 1.43 -0.30 -1.86 118.68 127.48 3dyo s LEU 694 Ca 0.06 1.30 0.05 0.00 -1.03 0.00 0.00 54.13 54.51 3dyo s LEU 694 Cb -0.15 -3.09 -0.01 0.00 0.03 0.00 0.00 46.19 42.97 3dyo s LEU 694 CO 0.05 0.03 -0.16 0.26 0.23 0.00 0.00 176.35 176.76 3dyo s TRP 695 N 0.04 1.40 -0.19 0.29 0.52 -0.21 -0.10 118.94 120.68 3dyo s TRP 695 Ca 0.35 -0.29 -0.06 0.00 0.02 0.00 0.00 56.10 56.13 3dyo s TRP 695 Cb -0.19 -0.88 -0.03 0.00 -1.15 0.00 0.00 33.47 31.21 3dyo s TRP 695 CO 0.20 -0.00 0.02 -1.17 0.02 0.00 0.00 176.95 176.02 3dyo s LEU 696 N -0.59 3.47 -0.05 2.99 2.96 0.39 -1.64 118.68 126.20 3dyo s LEU 696 Ca 0.05 -0.09 0.05 0.00 -0.22 0.00 0.00 54.13 53.92 3dyo s LEU 696 Cb -0.07 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 3dyo s LEU 696 CO -0.00 0.11 -0.21 -0.89 -1.32 0.00 0.00 176.35 174.04 3dyo s THR 697 N 0.76 1.74 0.09 3.68 2.01 0.43 -0.78 115.64 123.56 3dyo s THR 697 Ca 0.01 -0.88 0.07 0.00 0.31 0.00 0.00 61.69 61.20 3dyo s THR 697 Cb -0.14 -1.48 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 3dyo s THR 697 CO 0.02 0.49 -0.19 0.68 -0.69 0.00 0.00 174.62 174.93 3dyo s VAL 698 N -0.01 1.58 -0.00 3.82 -7.23 -0.21 -0.78 120.40 117.58 3dyo s VAL 698 Ca -0.05 -1.45 -0.01 0.00 -1.81 0.00 0.00 61.98 58.66 3dyo s VAL 698 Cb -0.13 -1.44 -0.00 0.00 0.56 0.00 0.00 36.38 35.36 3dyo s VAL 698 CO 0.03 -0.06 0.02 -0.13 -0.31 0.00 0.00 175.10 174.66 3dyo s ARG 699 N -1.78 0.18 -0.20 4.82 0.52 0.06 -1.76 118.95 120.80 3dyo s ARG 699 Ca 0.05 -0.22 -0.12 0.00 -0.52 0.00 0.00 55.73 54.92 3dyo s ARG 699 Cb -0.10 0.07 -0.05 0.00 0.52 0.00 0.00 34.95 35.39 3dyo s ARG 699 CO 0.04 -0.03 0.21 0.08 0.02 0.00 0.00 175.30 175.61 3dyo s VAL 700 N -0.64 5.35 -0.02 3.52 1.01 0.42 -0.48 120.40 129.57 3dyo s VAL 700 Ca -0.07 0.34 0.08 0.00 0.00 0.00 0.00 61.98 62.33 3dyo s VAL 700 Cb -0.04 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.77 3dyo s VAL 700 CO -0.00 0.39 -0.25 -0.69 0.00 0.00 0.00 175.10 174.55 3dyo s VAL 701 N 0.60 1.96 -0.41 2.92 1.01 -0.14 -1.30 120.40 125.05 3dyo s VAL 701 Ca 0.11 -1.08 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 3dyo s VAL 701 Cb -0.12 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.66 3dyo s VAL 701 CO 0.02 0.54 0.29 -1.10 0.00 0.00 0.00 175.10 174.85 3dyo s GLN 702 N -0.62 2.92 0.29 2.72 -0.21 0.48 -0.84 119.66 124.40 3dyo s GLN 702 Ca 0.10 -1.10 0.09 0.00 0.02 0.00 0.00 55.36 54.47 3dyo s GLN 702 Cb -0.10 -3.93 0.43 0.00 1.00 0.00 0.00 33.01 30.41 3dyo s GLN 702 CO -0.01 -0.78 1.66 -1.00 -2.12 0.00 0.00 175.29 173.04 3dyo h PRO 703 N 8.59 0.07 -5.83 2.91 0.13 -1.87 1.39 132.00 137.39 3dyo h PRO 703 Ca -0.27 -0.04 -0.64 0.00 -0.87 0.00 0.00 66.00 64.18 3dyo h PRO 703 Cb 1.11 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 3dyo h PRO 703 CO 0.74 0.59 -0.46 -0.80 -0.23 0.00 0.00 178.00 177.83 3dyo s ASN 704 N -6.88 6.41 0.60 1.44 0.02 -1.26 -3.43 114.94 111.84 3dyo s ASN 704 Ca -0.03 0.41 -0.17 0.00 -1.02 0.00 0.00 52.86 52.05 3dyo s ASN 704 Cb 0.13 -2.03 -0.03 0.00 0.02 0.00 0.00 41.25 39.34 3dyo s ASN 704 CO 0.76 0.26 1.12 0.00 0.02 0.00 0.00 177.10 179.26 3dyo s ALA 705 N -1.31 2.59 0.38 0.60 0.00 -1.26 -4.43 121.76 118.33 3dyo s ALA 705 Ca 0.27 0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.93 3dyo s ALA 705 Cb -0.13 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 3dyo s ALA 705 CO 0.18 -1.02 0.09 0.25 0.00 0.00 0.00 175.76 175.26 3dyo n THR 706 N -1.86 0.00 0.28 0.00 -2.24 0.16 -4.90 114.28 105.71 3dyo n THR 706 Ca 0.11 -2.08 0.15 0.00 -2.27 0.00 0.00 64.05 59.95 3dyo n THR 706 Cb 0.51 0.65 0.81 0.00 -2.10 0.00 0.00 70.33 70.21 3dyo n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyo h ALA 707 N 1.48 1.23 0.00 6.98 0.00 -2.00 -3.25 119.26 123.71 3dyo h ALA 707 Ca -0.31 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3dyo h ALA 707 Cb 1.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3dyo h ALA 707 CO 0.49 0.10 0.00 -2.67 0.00 0.00 0.00 179.25 177.17 3dyo n TRP 708 N -3.52 0.00 -3.86 0.00 4.27 -1.26 -5.06 117.44 108.01 3dyo n TRP 708 Ca -0.02 -0.10 -0.11 0.00 -3.89 0.00 0.00 57.50 53.38 3dyo n TRP 708 Cb 0.21 -0.01 -0.09 0.00 -1.36 0.00 0.00 31.31 30.05 3dyo n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 3dyo s SER 709 N -0.21 0.01 0.56 -0.67 1.04 -1.23 -4.65 113.70 108.56 3dyo s SER 709 Ca 0.00 -0.22 -0.07 0.00 0.48 0.00 0.00 55.95 56.14 3dyo s SER 709 Cb 0.00 0.24 -0.02 0.00 0.10 0.00 0.00 66.02 66.34 3dyo s SER 709 CO 0.00 -0.43 0.89 -1.61 0.98 0.00 0.00 173.24 173.08 3dyo s GLU 710 N -1.68 3.32 0.41 4.02 2.02 -1.26 -0.67 118.70 124.86 3dyo s GLU 710 Ca -0.12 0.27 -0.27 0.00 0.02 0.00 0.00 54.97 54.87 3dyo s GLU 710 Cb -0.06 -2.26 -0.10 0.00 0.10 0.00 0.00 34.13 31.82 3dyo s GLU 710 CO 0.01 -0.49 1.44 0.00 0.02 0.00 0.00 175.26 176.23 3dyo n ALA 711 N -2.51 2.09 -0.75 5.21 0.00 -1.26 -1.49 120.51 121.80 3dyo n ALA 711 Ca 0.03 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.77 3dyo n ALA 711 Cb 0.56 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3dyo n ALA 711 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyo n GLY 712 N 0.55 0.83 3.70 0.00 0.00 0.48 -4.90 105.19 105.85 3dyo n GLY 712 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 3dyo n GLY 712 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dyo n HIS 713 N -2.14 2.51 -3.30 1.61 -0.00 -0.55 -4.57 115.22 108.77 3dyo n HIS 713 Ca 0.00 0.29 -0.40 0.00 0.46 0.00 0.00 57.72 58.06 3dyo n HIS 713 Cb 0.00 -2.55 -0.08 0.00 -0.12 0.00 0.00 29.99 27.23 3dyo n HIS 713 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 3dyo s ILE 714 N 0.31 5.09 -0.05 3.57 1.01 -1.26 -0.39 121.20 129.48 3dyo s ILE 714 Ca 0.70 0.44 0.22 0.00 0.00 0.00 0.00 60.65 62.00 3dyo s ILE 714 Cb -0.58 -3.86 -0.31 0.00 0.01 0.00 0.00 42.46 37.72 3dyo s ILE 714 CO 0.45 -0.06 0.53 -1.54 0.00 0.00 0.00 174.94 174.31 3dyo n SER 715 N 5.56 0.07 -3.48 3.58 3.41 -0.42 -5.02 113.62 117.32 3dyo n SER 715 Ca -0.06 0.03 -0.10 0.00 -0.26 0.00 0.00 58.87 58.47 3dyo n SER 715 Cb 0.50 1.87 -0.02 0.00 -0.26 0.00 0.00 64.21 66.29 3dyo n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo s ALA 716 N -3.50 -1.74 0.26 7.33 0.00 -1.24 -4.68 121.76 118.18 3dyo s ALA 716 Ca -0.07 0.87 -0.20 0.00 0.00 0.00 0.00 51.96 52.56 3dyo s ALA 716 Cb 0.14 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.78 3dyo s ALA 716 CO 0.90 -0.68 0.67 1.67 0.00 0.00 0.00 175.76 178.33 3dyo s TRP 717 N -3.12 -0.18 -0.13 0.00 -2.14 -1.26 -0.43 118.94 111.68 3dyo s TRP 717 Ca 0.02 -0.24 -0.30 0.00 2.66 0.00 0.00 56.10 58.24 3dyo s TRP 717 Cb -0.01 0.63 0.13 0.00 -3.10 0.00 0.00 33.47 31.12 3dyo s TRP 717 CO -0.09 -1.16 1.02 -1.14 -2.66 0.00 0.00 176.95 172.93 3dyo s GLN 718 N -3.91 0.58 0.09 3.25 2.00 -0.72 -4.99 119.66 115.96 3dyo s GLN 718 Ca 0.11 -0.04 0.01 0.00 -2.00 0.00 0.00 55.36 53.45 3dyo s GLN 718 Cb -0.05 0.27 -0.04 0.00 0.80 0.00 0.00 33.01 33.99 3dyo s GLN 718 CO 0.04 -0.22 -0.06 -0.65 -0.50 0.00 0.00 175.29 173.90 3dyo s GLN 719 N -1.90 0.79 0.06 1.67 -0.21 -1.26 -1.04 119.66 117.77 3dyo s GLN 719 Ca 0.03 -1.29 -0.06 0.00 0.02 0.00 0.00 55.36 54.06 3dyo s GLN 719 Cb -0.01 -0.16 -0.01 0.00 1.00 0.00 0.00 33.01 33.83 3dyo s GLN 719 CO -0.03 -0.02 0.11 -1.58 -2.12 0.00 0.00 175.29 171.64 3dyo s TRP 720 N -3.53 0.25 -0.07 0.91 0.51 0.04 -4.97 118.94 112.07 3dyo s TRP 720 Ca 0.10 -0.65 -0.21 0.00 -2.12 0.00 0.00 56.10 53.22 3dyo s TRP 720 Cb 0.05 -0.16 -0.04 0.00 -0.81 0.00 0.00 33.47 32.50 3dyo s TRP 720 CO -0.05 -0.43 0.61 1.03 -0.51 0.00 0.00 176.95 177.59 3dyo s ARG 721 N -3.34 4.38 0.00 4.98 0.52 -1.26 -0.46 118.95 123.76 3dyo s ARG 721 Ca 0.01 0.72 0.00 0.00 -0.52 0.00 0.00 55.73 55.94 3dyo s ARG 721 Cb 0.03 -3.42 0.00 0.00 0.52 0.00 0.00 34.95 32.08 3dyo s ARG 721 CO -0.08 0.17 0.00 1.28 0.02 0.00 0.00 175.30 176.69 3dyo n LEU 722 N 3.48 0.00 -4.77 2.53 4.77 0.85 -4.92 117.00 118.94 3dyo n LEU 722 Ca -0.04 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.58 3dyo n LEU 722 Cb 0.51 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3dyo n LEU 722 CO 0.45 0.00 0.81 0.00 -1.33 0.00 0.00 177.39 177.32 3dyo s ALA 723 N -2.97 2.85 -0.03 -1.18 0.00 -1.26 -4.68 121.76 114.49 3dyo s ALA 723 Ca 0.00 0.88 0.07 0.00 0.00 0.00 0.00 51.96 52.91 3dyo s ALA 723 Cb 0.00 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 3dyo s ALA 723 CO 0.00 -0.71 -0.23 -2.00 0.00 0.00 0.00 175.76 172.82 3dyo s GLU 724 N -2.96 2.01 -0.28 0.00 2.12 -1.26 -1.15 118.70 117.18 3dyo s GLU 724 Ca 0.68 -0.84 0.01 0.00 0.36 0.00 0.00 54.97 55.18 3dyo s GLU 724 Cb -0.26 -1.88 0.06 0.00 0.26 0.00 0.00 34.13 32.30 3dyo s GLU 724 CO 0.31 0.47 -0.06 -0.80 -0.54 0.00 0.00 175.26 174.64 3dyo s ASN 725 N -0.45 4.63 0.37 -1.70 0.01 0.23 -4.95 114.94 113.08 3dyo s ASN 725 Ca 0.06 -1.39 -0.27 0.00 -0.71 0.00 0.00 52.86 50.55 3dyo s ASN 725 Cb -0.10 -1.61 -0.10 0.00 0.41 0.00 0.00 41.25 39.85 3dyo s ASN 725 CO 0.00 -0.23 1.34 -0.76 -1.51 0.00 0.00 177.10 175.95 3dyo s LEU 726 N 1.15 4.32 -0.20 0.60 1.43 -1.26 -0.97 118.68 123.75 3dyo s LEU 726 Ca -0.07 2.75 -0.27 0.00 -1.03 0.00 0.00 54.13 55.51 3dyo s LEU 726 Cb -0.20 -3.75 -0.00 0.00 0.03 0.00 0.00 46.19 42.26 3dyo s LEU 726 CO -0.04 -0.73 0.94 -0.55 0.23 0.00 0.00 176.35 176.20 3dyo s SER 727 N -0.52 7.03 0.00 2.29 0.15 -1.26 -4.86 113.70 116.54 3dyo s SER 727 Ca 0.53 1.29 0.04 0.00 0.70 0.00 0.00 55.95 58.51 3dyo s SER 727 Cb -0.40 -2.50 -0.04 0.00 -1.71 0.00 0.00 66.02 61.37 3dyo s SER 727 CO 0.53 -0.54 0.23 1.33 1.20 0.00 0.00 173.24 176.00 3dyo n VAL 728 N 5.05 0.00 -2.50 4.45 0.24 -1.26 -4.99 118.33 119.31 3dyo n VAL 728 Ca 0.08 -0.41 -0.43 0.00 -2.04 0.00 0.00 64.34 61.55 3dyo n VAL 728 Cb 0.47 1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 33.83 3dyo n VAL 728 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3dyo s THR 729 N -1.30 4.39 0.30 3.34 -4.23 -1.26 -4.94 115.64 111.93 3dyo s THR 729 Ca 0.02 1.69 -0.30 0.00 -1.18 0.00 0.00 61.69 61.92 3dyo s THR 729 Cb 0.03 -4.09 -0.12 0.00 1.34 0.00 0.00 72.50 69.66 3dyo s THR 729 CO 0.16 -0.10 1.47 0.00 -0.54 0.00 0.00 174.62 175.62 3dyo n LEU 730 N 6.03 3.87 0.00 4.79 -0.00 -1.26 -4.99 117.00 125.44 3dyo n LEU 730 Ca 0.12 1.17 0.00 0.00 -0.00 0.00 0.00 56.01 57.30 3dyo n LEU 730 Cb 0.46 -1.53 0.00 0.00 -0.00 0.00 0.00 43.42 42.35 3dyo n LEU 730 CO 0.55 -0.16 0.00 -0.81 -0.00 0.00 0.00 177.39 176.96 3dyo n PRO 731 N 1.61 2.82 -4.92 1.47 -0.04 -1.26 -5.01 135.00 129.67 3dyo n PRO 731 Ca 0.08 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.25 3dyo n PRO 731 Cb 0.35 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.66 3dyo n PRO 731 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dyo s ALA 732 N -2.18 2.11 -0.11 0.55 0.00 -1.26 -5.09 121.76 115.78 3dyo s ALA 732 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 51.96 50.48 3dyo s ALA 732 Cb 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 23.12 22.58 3dyo s ALA 732 CO 0.00 0.50 2.08 0.00 0.00 0.00 0.00 175.76 178.33 3dyo n ALA 733 N 1.94 1.53 -1.77 0.00 0.00 -1.26 -4.93 120.51 116.01 3dyo n ALA 733 Ca -0.17 0.02 -0.38 0.00 0.00 0.00 0.00 53.44 52.92 3dyo n ALA 733 Cb 0.52 -2.74 -0.05 0.00 0.00 0.00 0.00 19.45 17.18 3dyo n ALA 733 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3dyo s SER 734 N 6.12 7.01 0.00 0.00 0.15 -1.26 -4.93 113.70 120.79 3dyo s SER 734 Ca 0.96 2.07 0.24 0.00 0.70 0.00 0.00 55.95 59.91 3dyo s SER 734 Cb -0.46 -2.60 0.80 0.00 -1.71 0.00 0.00 66.02 62.05 3dyo s SER 734 CO 0.41 -0.31 1.59 1.41 1.20 0.00 0.00 173.24 177.54 3dyo n HIS 735 N 0.42 0.13 -4.31 3.44 8.25 -1.26 -4.88 115.22 117.01 3dyo n HIS 735 Ca 0.03 -0.07 -0.30 0.00 -0.26 0.00 0.00 57.72 57.12 3dyo n HIS 735 Cb 0.48 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.49 3dyo n HIS 735 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dyo s ALA 736 N -1.87 2.87 -0.04 -1.41 0.00 -1.26 -5.12 121.76 114.93 3dyo s ALA 736 Ca 0.35 -1.23 0.06 0.00 0.00 0.00 0.00 51.96 51.13 3dyo s ALA 736 Cb 0.19 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 3dyo s ALA 736 CO 0.30 0.62 -0.22 -1.50 0.00 0.00 0.00 175.76 174.96 3dyo s ILE 737 N -1.15 1.77 0.72 0.00 1.10 -1.26 -3.93 121.20 118.45 3dyo s ILE 737 Ca 0.20 -0.92 -0.13 0.00 -0.51 0.00 0.00 60.65 59.29 3dyo s ILE 737 Cb -0.11 -1.49 0.03 0.00 0.15 0.00 0.00 42.46 41.04 3dyo s ILE 737 CO 0.11 0.50 1.11 -2.16 -2.11 0.00 0.00 174.94 172.39 3dyo s PRO 738 N -0.19 2.47 -0.00 3.50 0.04 -1.26 -4.94 135.00 134.61 3dyo s PRO 738 Ca -0.01 1.32 0.08 0.00 0.04 0.00 0.00 61.00 62.43 3dyo s PRO 738 Cb -0.12 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 3dyo s PRO 738 CO 0.02 -1.50 -0.24 -1.58 0.04 0.00 0.00 177.00 173.74 3dyo s HIS 739 N -2.57 2.15 -0.18 0.56 2.46 -0.23 -4.84 115.29 112.64 3dyo s HIS 739 Ca 0.65 -0.40 -0.07 0.00 0.47 0.00 0.00 55.06 55.70 3dyo s HIS 739 Cb -0.20 -1.36 -0.04 0.00 -0.13 0.00 0.00 32.58 30.85 3dyo s HIS 739 CO 0.48 -0.00 0.06 -1.17 -2.47 0.00 0.00 174.74 171.64 3dyo s LEU 740 N -0.70 3.75 -0.21 8.88 2.96 -1.26 -1.33 118.68 130.77 3dyo s LEU 740 Ca 0.09 0.05 -0.02 0.00 -0.22 0.00 0.00 54.13 54.03 3dyo s LEU 740 Cb -0.09 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.65 3dyo s LEU 740 CO -0.00 0.16 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.20 3dyo s THR 741 N 0.45 2.89 -0.16 3.68 2.01 0.42 -4.97 115.64 119.95 3dyo s THR 741 Ca 0.03 -0.66 -0.07 0.00 0.31 0.00 0.00 61.69 61.30 3dyo s THR 741 Cb -0.13 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 3dyo s THR 741 CO 0.01 0.47 0.08 -0.89 -0.69 0.00 0.00 174.62 173.59 3dyo s THR 742 N 1.41 4.97 0.33 -0.82 2.01 -1.26 -0.65 115.64 121.62 3dyo s THR 742 Ca 0.05 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.11 3dyo s THR 742 Cb -0.14 -3.22 -0.05 0.00 0.01 0.00 0.00 72.50 69.11 3dyo s THR 742 CO -0.07 0.50 0.09 -0.94 -0.69 0.00 0.00 174.62 173.51 3dyo s SER 743 N 0.00 2.14 0.07 3.53 1.04 -0.15 -5.01 113.70 115.33 3dyo s SER 743 Ca 0.07 -1.47 -0.26 0.00 0.48 0.00 0.00 55.95 54.77 3dyo s SER 743 Cb -0.12 0.16 -0.17 0.00 0.10 0.00 0.00 66.02 65.99 3dyo s SER 743 CO 0.01 -0.74 1.63 -0.08 0.98 0.00 0.00 173.24 175.03 3dyo h GLU 744 N 2.10 -0.27 -0.00 4.02 4.57 -2.03 -3.19 114.58 119.78 3dyo h GLU 744 Ca -0.38 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.82 3dyo h GLU 744 Cb 1.25 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 3dyo h GLU 744 CO 0.63 -0.13 -0.25 -1.33 -1.18 0.00 0.00 179.01 176.76 3dyo n MET 745 N -5.18 0.03 -3.90 1.92 2.81 -1.26 -4.80 117.12 106.74 3dyo n MET 745 Ca -0.09 -0.01 -0.09 0.00 -1.81 0.00 0.00 57.70 55.70 3dyo n MET 745 Cb 0.16 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.13 3dyo n MET 745 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3dyo s ASP 746 N -2.97 -0.17 -0.17 7.83 1.11 -1.21 -0.75 116.67 120.34 3dyo s ASP 746 Ca 0.13 -0.74 0.01 0.00 0.18 0.00 0.00 52.55 52.14 3dyo s ASP 746 Cb 0.18 0.62 0.02 0.00 1.07 0.00 0.00 42.92 44.81 3dyo s ASP 746 CO 0.61 -1.17 -0.20 -0.36 1.18 0.00 0.00 175.17 175.23 3dyo s PHE 747 N -3.96 2.69 -0.04 4.23 2.99 -0.01 -0.97 117.98 122.91 3dyo s PHE 747 Ca 0.16 -1.54 0.06 0.00 0.00 0.00 0.00 56.93 55.61 3dyo s PHE 747 Cb -0.02 -1.86 -0.02 0.00 0.00 0.00 0.00 43.02 41.12 3dyo s PHE 747 CO 0.06 -0.75 -0.21 0.00 -0.00 0.00 0.00 175.22 174.31 3dyo s ILE 749 N -0.51 2.98 -0.05 0.00 1.09 0.30 -0.43 121.20 124.57 3dyo s ILE 749 Ca 0.07 -0.70 0.07 0.00 -1.10 0.00 0.00 60.65 58.99 3dyo s ILE 749 Cb -0.11 -2.23 -0.01 0.00 -1.06 0.00 0.00 42.46 39.04 3dyo s ILE 749 CO 0.01 0.53 -0.25 -1.61 -0.10 0.00 0.00 174.94 173.52 3dyo s GLU 750 N 0.25 2.42 -0.39 2.79 2.02 -0.45 -1.03 118.70 124.31 3dyo s GLU 750 Ca -0.10 -0.91 0.03 0.00 0.02 0.00 0.00 54.97 54.02 3dyo s GLU 750 Cb -0.16 -2.12 0.16 0.00 0.10 0.00 0.00 34.13 32.12 3dyo s GLU 750 CO 0.05 0.42 0.31 -1.17 0.02 0.00 0.00 175.26 174.90 3dyo s LEU 751 N -0.27 1.20 0.00 1.80 2.96 0.96 -1.07 118.68 124.25 3dyo s LEU 751 Ca -0.00 -2.76 0.00 0.00 -0.22 0.00 0.00 54.13 51.15 3dyo s LEU 751 Cb -0.13 -0.37 0.00 0.00 0.50 0.00 0.00 46.19 46.19 3dyo s LEU 751 CO 0.02 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.45 3dyo n GLY 752 N 3.23 1.43 0.17 7.98 0.00 -1.26 -1.85 105.19 114.89 3dyo n GLY 752 Ca 0.24 0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.53 3dyo n GLY 752 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dyo n ASN 753 N 10.88 0.81 -4.84 1.61 6.94 -1.26 -4.88 115.26 124.52 3dyo n ASN 753 Ca 0.00 -0.67 -0.33 0.00 -0.02 0.00 0.00 54.58 53.56 3dyo n ASN 753 Cb 0.00 0.12 -0.06 0.00 -2.36 0.00 0.00 39.78 37.48 3dyo n ASN 753 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3dyo s LYS 754 N -2.62 3.24 0.05 -3.83 1.02 -0.77 0.13 119.74 116.96 3dyo s LYS 754 Ca 0.22 -0.40 0.02 0.00 0.02 0.00 0.00 55.97 55.83 3dyo s LYS 754 Cb 0.19 -2.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.50 3dyo s LYS 754 CO 0.55 0.66 -0.08 1.03 -0.92 0.00 0.00 175.35 176.60 3dyo s ARG 755 N -1.79 0.55 -0.04 1.68 0.52 -0.77 -0.03 118.95 119.08 3dyo s ARG 755 Ca 0.24 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.68 3dyo s ARG 755 Cb -0.12 -0.30 0.01 0.00 0.52 0.00 0.00 34.95 35.06 3dyo s ARG 755 CO 0.16 0.05 -0.09 -1.58 0.02 0.00 0.00 175.30 173.85 3dyo s TRP 756 N -1.50 1.02 -0.14 -0.53 0.51 -0.20 -0.95 118.94 117.15 3dyo s TRP 756 Ca -0.09 -0.29 0.02 0.00 -2.12 0.00 0.00 56.10 53.62 3dyo s TRP 756 Cb -0.09 -0.75 0.02 0.00 -0.81 0.00 0.00 33.47 31.83 3dyo s TRP 756 CO 0.00 -0.14 -0.19 -1.14 -0.51 0.00 0.00 176.95 174.97 3dyo s GLN 757 N 0.37 2.70 -0.25 4.98 0.74 -0.34 -0.54 119.66 127.33 3dyo s GLN 757 Ca -0.06 -0.73 -0.05 0.00 0.05 0.00 0.00 55.36 54.56 3dyo s GLN 757 Cb -0.11 -2.28 -0.01 0.00 1.10 0.00 0.00 33.01 31.72 3dyo s GLN 757 CO 0.01 -0.11 0.02 -0.06 -0.55 0.00 0.00 175.29 174.60 3dyo s PHE 758 N 1.07 3.05 0.04 1.67 0.40 -0.10 -0.86 117.98 123.25 3dyo s PHE 758 Ca -0.02 -0.87 -0.30 0.00 -0.60 0.00 0.00 56.93 55.13 3dyo s PHE 758 Cb -0.14 -2.17 -0.06 0.00 0.51 0.00 0.00 43.02 41.16 3dyo s PHE 758 CO -0.06 -0.52 1.27 1.21 0.70 0.00 0.00 175.22 177.82 3dyo s ASN 759 N 1.51 6.99 0.38 1.36 3.84 -0.41 -0.83 114.94 127.77 3dyo s ASN 759 Ca 0.05 2.05 0.21 0.00 0.21 0.00 0.00 52.86 55.37 3dyo s ASN 759 Cb -0.15 -2.57 0.24 0.00 -0.55 0.00 0.00 41.25 38.22 3dyo s ASN 759 CO -0.00 -0.57 1.53 0.03 -2.79 0.00 0.00 177.10 175.30 3dyo h ARG 760 N 7.12 0.00 0.16 0.43 3.08 -1.25 0.14 114.38 124.07 3dyo h ARG 760 Ca -0.40 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.41 3dyo h ARG 760 Cb 1.20 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.27 3dyo h ARG 760 CO 0.85 0.15 -1.10 1.96 -1.07 0.00 0.00 179.97 180.75 3dyo h GLN 761 N 0.00 0.34 0.00 0.04 7.50 -1.90 -3.37 115.11 117.72 3dyo h GLN 761 Ca -0.00 -0.58 -0.20 0.00 0.50 0.00 0.00 58.65 58.36 3dyo h GLN 761 Cb 1.12 0.22 -0.03 0.00 0.05 0.00 0.00 27.48 28.83 3dyo h GLN 761 CO 0.02 1.28 -1.32 0.66 -1.50 0.00 0.00 178.83 177.97 3dyo h SER 762 N -0.24 0.00 0.00 1.46 4.64 -1.93 -3.45 113.55 114.03 3dyo h SER 762 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 3dyo h SER 762 Cb 1.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.88 3dyo h SER 762 CO 0.16 0.76 0.00 0.61 -0.87 0.00 0.00 176.83 177.49 3dyo n GLY 763 N 1.42 0.66 3.63 -0.77 0.00 0.50 -4.74 105.19 105.89 3dyo n GLY 763 Ca -0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 3dyo n GLY 763 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyo s PHE 764 N -2.46 2.68 -0.37 1.61 0.40 -1.23 -4.90 117.98 113.70 3dyo s PHE 764 Ca 0.00 -0.22 -0.29 0.00 -0.60 0.00 0.00 56.93 55.82 3dyo s PHE 764 Cb 0.00 -1.19 -0.00 0.00 0.51 0.00 0.00 43.02 42.34 3dyo s PHE 764 CO 0.00 0.62 1.61 -1.17 0.70 0.00 0.00 175.22 176.98 3dyo s LEU 765 N -3.62 3.54 -0.02 -0.37 2.96 -1.26 -1.29 118.68 118.61 3dyo s LEU 765 Ca 0.31 1.05 0.20 0.00 -0.22 0.00 0.00 54.13 55.48 3dyo s LEU 765 Cb -0.06 -3.52 -0.24 0.00 0.50 0.00 0.00 46.19 42.86 3dyo s LEU 765 CO 0.19 -1.58 0.52 -1.54 -1.32 0.00 0.00 176.35 172.62 3dyo n SER 766 N 9.56 0.25 -3.57 3.68 3.41 -0.04 -1.13 113.62 125.78 3dyo n SER 766 Ca 0.20 0.10 -0.13 0.00 -0.26 0.00 0.00 58.87 58.78 3dyo n SER 766 Cb 0.47 1.27 -0.05 0.00 -0.26 0.00 0.00 64.21 65.65 3dyo n SER 766 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3dyo s GLN 767 N -3.17 1.07 -0.04 4.33 2.00 -1.20 -4.46 119.66 118.19 3dyo s GLN 767 Ca -0.07 -0.36 -0.07 0.00 -2.00 0.00 0.00 55.36 52.87 3dyo s GLN 767 Cb 0.11 0.49 0.01 0.00 0.80 0.00 0.00 33.01 34.42 3dyo s GLN 767 CO 0.86 -0.40 0.17 -1.64 -0.50 0.00 0.00 175.29 173.78 3dyo s MET 768 N -2.87 0.32 0.05 1.67 -1.94 -1.26 -1.20 119.30 114.07 3dyo s MET 768 Ca -0.03 0.02 0.05 0.00 -1.71 0.00 0.00 55.69 54.02 3dyo s MET 768 Cb -0.00 0.14 -0.02 0.00 2.01 0.00 0.00 34.83 36.96 3dyo s MET 768 CO -0.05 -0.06 -0.14 -1.58 -0.01 0.00 0.00 175.02 173.18 3dyo s TRP 769 N -0.44 1.24 -0.29 -0.03 0.51 -0.12 0.90 118.94 120.70 3dyo s TRP 769 Ca -0.05 -0.38 0.02 0.00 -2.12 0.00 0.00 56.10 53.57 3dyo s TRP 769 Cb -0.04 -0.73 0.08 0.00 -0.81 0.00 0.00 33.47 31.98 3dyo s TRP 769 CO 0.01 0.04 0.01 0.42 -0.51 0.00 0.00 176.95 176.92 3dyo s ILE 770 N -0.95 1.74 0.00 2.03 1.01 -0.98 -1.84 121.20 122.21 3dyo s ILE 770 Ca 0.01 -1.74 0.00 0.00 0.00 0.00 0.00 60.65 58.92 3dyo s ILE 770 Cb -0.08 -2.16 0.00 0.00 0.01 0.00 0.00 42.46 40.23 3dyo s ILE 770 CO 0.01 -0.41 0.00 0.61 0.00 0.00 0.00 174.94 175.15 3dyo n GLY 771 N 4.52 3.26 0.63 6.18 0.00 0.35 -0.93 105.19 119.20 3dyo n GLY 771 Ca -0.04 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 45.92 3dyo n GLY 771 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dyo n ASP 772 N 7.50 2.30 -4.56 1.61 5.68 -1.26 -4.86 116.55 122.96 3dyo n ASP 772 Ca 0.00 -1.65 -0.43 0.00 -0.50 0.00 0.00 54.79 52.21 3dyo n ASP 772 Cb 0.00 0.03 -0.03 0.00 -1.14 0.00 0.00 41.12 39.98 3dyo n ASP 772 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3dyo s LYS 773 N -1.40 3.51 0.33 0.11 2.47 -0.11 -5.04 119.74 119.61 3dyo s LYS 773 Ca 0.19 0.13 -0.29 0.00 -1.56 0.00 0.00 55.97 54.44 3dyo s LYS 773 Cb 0.14 -3.98 -0.10 0.00 -1.46 0.00 0.00 37.83 32.43 3dyo s LYS 773 CO 0.22 -1.42 1.35 0.15 0.16 0.00 0.00 175.35 175.81 3dyo s LYS 774 N 4.17 4.31 0.01 4.03 1.02 -1.26 -2.32 119.74 129.71 3dyo s LYS 774 Ca 0.38 2.28 0.22 0.00 0.02 0.00 0.00 55.97 58.87 3dyo s LYS 774 Cb -0.10 -3.06 -0.24 0.00 -0.52 0.00 0.00 37.83 33.92 3dyo s LYS 774 CO 0.25 -0.27 0.67 1.04 -0.92 0.00 0.00 175.35 176.12 3dyo n GLN 775 N 0.93 0.53 -4.59 1.68 1.13 0.26 -4.78 117.38 112.54 3dyo n GLN 775 Ca 0.01 -0.11 -0.31 0.00 -1.94 0.00 0.00 57.00 54.65 3dyo n GLN 775 Cb 0.41 -1.57 -0.12 0.00 0.11 0.00 0.00 30.24 29.07 3dyo n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dyo s LEU 776 N -4.37 2.64 -0.16 1.08 1.43 -1.26 -0.73 118.68 117.32 3dyo s LEU 776 Ca -0.04 -0.44 0.17 0.00 -1.03 0.00 0.00 54.13 52.79 3dyo s LEU 776 Cb 0.14 -1.53 -0.24 0.00 0.03 0.00 0.00 46.19 44.58 3dyo s LEU 776 CO 0.88 0.24 0.12 0.18 0.23 0.00 0.00 176.35 178.00 3dyo n LEU 777 N 1.41 0.00 -3.98 1.79 4.77 0.28 -4.65 117.00 116.62 3dyo n LEU 777 Ca -0.16 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.73 3dyo n LEU 777 Cb 0.52 0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 41.88 3dyo n LEU 777 CO 0.27 0.38 -0.36 0.42 -1.33 0.00 0.00 177.39 176.77 3dyo s THR 778 N -2.59 0.14 0.89 -5.08 -4.23 -1.10 -4.94 115.64 98.72 3dyo s THR 778 Ca -0.09 -0.88 -0.10 0.00 -1.18 0.00 0.00 61.69 59.43 3dyo s THR 778 Cb 0.07 -0.28 0.13 0.00 1.34 0.00 0.00 72.50 73.76 3dyo s THR 778 CO 0.77 -0.47 1.15 -2.84 -0.54 0.00 0.00 174.62 172.69 3dyo s PRO 779 N -1.41 1.18 -0.30 3.99 0.02 -1.26 -3.82 135.00 133.41 3dyo s PRO 779 Ca -0.15 1.53 -0.26 0.00 0.02 0.00 0.00 61.00 62.15 3dyo s PRO 779 Cb -0.10 -1.75 0.01 0.00 0.02 0.00 0.00 34.50 32.68 3dyo s PRO 779 CO -0.01 -2.51 0.91 -1.17 -0.33 0.00 0.00 177.00 173.89 3dyo s LEU 780 N -6.47 4.04 0.12 -5.54 2.96 -0.29 -4.51 118.68 109.00 3dyo s LEU 780 Ca 0.67 0.90 0.03 0.00 -0.22 0.00 0.00 54.13 55.50 3dyo s LEU 780 Cb -0.23 -3.28 -0.04 0.00 0.50 0.00 0.00 46.19 43.14 3dyo s LEU 780 CO 0.57 -0.69 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.69 3dyo s ARG 781 N 3.19 0.92 0.69 1.98 0.52 -0.63 -4.21 118.95 121.41 3dyo s ARG 781 Ca 0.38 -1.34 -0.15 0.00 -0.52 0.00 0.00 55.73 54.10 3dyo s ARG 781 Cb -0.14 -0.43 0.02 0.00 0.52 0.00 0.00 34.95 34.92 3dyo s ARG 781 CO 0.12 0.04 1.15 -0.51 0.02 0.00 0.00 175.30 176.12 3dyo s ASP 782 N -2.97 4.73 -0.04 0.23 1.11 -1.26 0.48 116.67 118.95 3dyo s ASP 782 Ca 0.12 2.14 -0.02 0.00 0.18 0.00 0.00 52.55 54.98 3dyo s ASP 782 Cb 0.03 -2.57 0.03 0.00 1.07 0.00 0.00 42.92 41.48 3dyo s ASP 782 CO -0.02 -1.89 0.09 -1.58 1.18 0.00 0.00 175.17 172.95 3dyo s GLN 783 N -4.02 0.05 0.00 8.23 0.74 0.89 -4.73 119.66 120.83 3dyo s GLN 783 Ca 0.70 0.24 0.00 0.00 0.05 0.00 0.00 55.36 56.35 3dyo s GLN 783 Cb -0.24 -0.14 0.00 0.00 1.10 0.00 0.00 33.01 33.73 3dyo s GLN 783 CO 0.43 -0.13 0.84 1.19 -0.55 0.00 0.00 175.29 177.07 3dyo n PHE 784 N 3.90 0.00 -4.51 1.67 3.01 -1.26 -2.09 117.46 118.19 3dyo n PHE 784 Ca -0.23 -0.35 -0.24 0.00 1.01 0.00 0.00 57.45 57.64 3dyo n PHE 784 Cb 0.53 -0.04 -0.10 0.00 -0.01 0.00 0.00 39.48 39.86 3dyo n PHE 784 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3dyo s THR 785 N -0.70 1.28 0.03 4.37 -4.23 -1.26 -2.96 115.64 112.16 3dyo s THR 785 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 3dyo s THR 785 Cb 0.00 -2.75 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 3dyo s THR 785 CO 0.00 0.00 -0.02 0.00 -0.54 0.00 0.00 174.62 174.06 3dyo s ARG 786 N -3.84 0.42 -0.17 3.99 1.70 -1.26 -4.74 118.95 115.05 3dyo s ARG 786 Ca 0.33 -0.81 -0.29 0.00 -0.47 0.00 0.00 55.73 54.50 3dyo s ARG 786 Cb 0.08 0.15 -0.05 0.00 -0.57 0.00 0.00 34.95 34.56 3dyo s ARG 786 CO 0.15 -0.07 2.05 0.00 -1.08 0.00 0.00 175.30 176.34 3dyo s ALA 787 N -2.29 3.00 0.13 7.88 0.00 -1.26 -4.86 121.76 124.37 3dyo s ALA 787 Ca -0.08 0.81 -0.35 0.00 0.00 0.00 0.00 51.96 52.34 3dyo s ALA 787 Cb -0.04 -3.99 -0.15 0.00 0.00 0.00 0.00 23.12 18.94 3dyo s ALA 787 CO -0.04 -2.40 1.46 -0.35 0.00 0.00 0.00 175.76 174.43 3dyo n PRO 788 N 8.32 1.69 -1.62 0.00 -0.04 -1.26 -1.40 135.00 140.69 3dyo n PRO 788 Ca 0.25 0.61 -0.29 0.00 -0.04 0.00 0.00 63.50 64.04 3dyo n PRO 788 Cb 0.44 -2.31 0.13 0.00 -0.04 0.00 0.00 33.50 31.72 3dyo n PRO 788 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dyo s LEU 789 N 0.68 2.12 0.33 1.53 1.43 -1.26 -4.58 118.68 118.93 3dyo s LEU 789 Ca 0.80 0.91 0.01 0.00 -1.03 0.00 0.00 54.13 54.83 3dyo s LEU 789 Cb -0.80 -3.26 0.56 0.00 0.03 0.00 0.00 46.19 42.72 3dyo s LEU 789 CO 0.43 -2.42 1.96 0.44 0.23 0.00 0.00 176.35 176.98 3dyo h ASP 790 N -1.41 0.75 0.61 2.29 3.32 -1.87 -1.19 116.42 118.92 3dyo h ASP 790 Ca -0.49 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 56.46 3dyo h ASP 790 Cb 1.33 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 3dyo h ASP 790 CO 0.62 0.59 -0.22 0.78 -1.72 0.00 0.00 179.24 179.29 3dyo h ASN 791 N 0.86 0.00 0.80 6.45 2.35 -1.85 0.11 115.58 124.30 3dyo h ASN 791 Ca 0.22 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.79 3dyo h ASN 791 Cb -0.01 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3dyo h ASN 791 CO -0.04 0.22 -0.85 0.44 -1.65 0.00 0.00 177.43 175.55 3dyo h ASP 792 N 0.00 0.05 0.18 5.81 3.32 -1.54 -3.35 116.42 120.89 3dyo h ASP 792 Ca -0.00 -0.04 -0.34 0.00 0.02 0.00 0.00 57.03 56.67 3dyo h ASP 792 Cb 0.59 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.13 3dyo h ASP 792 CO 0.03 0.87 -1.68 0.40 -1.72 0.00 0.00 179.24 177.15 3dyo h ILE 793 N 0.02 0.96 0.00 0.35 2.04 -0.87 -0.59 117.51 119.42 3dyo h ILE 793 Ca -0.02 -2.49 0.00 0.00 1.00 0.00 0.00 64.86 63.35 3dyo h ILE 793 Cb 1.50 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 40.34 3dyo h ILE 793 CO 0.11 0.83 0.00 0.61 0.00 0.00 0.00 178.15 179.70 3dyo n GLY 794 N 1.84 2.68 0.59 5.37 0.00 0.33 -1.99 105.19 114.00 3dyo n GLY 794 Ca -0.25 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.45 3dyo n GLY 794 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3dyo n VAL 795 N 0.00 0.32 -1.76 1.61 0.24 -1.26 -4.90 118.33 112.57 3dyo n VAL 795 Ca 0.00 -0.39 -0.39 0.00 -2.04 0.00 0.00 64.34 61.51 3dyo n VAL 795 Cb 0.00 0.30 0.03 0.00 -1.47 0.00 0.00 33.84 32.70 3dyo n VAL 795 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3dyo s SER 796 N -1.33 5.55 0.08 -1.34 0.15 -0.84 -4.84 113.70 111.14 3dyo s SER 796 Ca 0.28 2.89 -0.11 0.00 0.70 0.00 0.00 55.95 59.71 3dyo s SER 796 Cb 0.15 -2.65 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 3dyo s SER 796 CO 0.22 -1.39 0.26 -0.70 1.20 0.00 0.00 173.24 172.83 3dyo s GLU 797 N -2.67 0.88 0.26 5.44 2.12 -0.83 -4.91 118.70 118.99 3dyo s GLU 797 Ca 0.66 -0.79 -0.04 0.00 0.36 0.00 0.00 54.97 55.16 3dyo s GLU 797 Cb -0.43 0.37 0.35 0.00 0.26 0.00 0.00 34.13 34.68 3dyo s GLU 797 CO 0.53 -0.30 1.90 0.00 -0.54 0.00 0.00 175.26 176.86 3dyo h ALA 798 N 2.80 1.35 0.00 6.30 0.00 -1.99 0.28 119.26 127.99 3dyo h ALA 798 Ca -0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3dyo h ALA 798 Cb 1.21 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3dyo h ALA 798 CO 0.52 0.54 0.00 0.25 0.00 0.00 0.00 179.25 180.55 3dyo n THR 799 N -4.45 0.03 -3.18 0.00 -2.24 -1.26 -4.39 114.28 98.80 3dyo n THR 799 Ca 0.14 0.01 -0.03 0.00 -2.27 0.00 0.00 64.05 61.90 3dyo n THR 799 Cb 0.11 -0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 67.80 3dyo n THR 799 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3dyo s ARG 800 N -2.75 0.83 0.44 -0.78 3.00 0.03 -5.14 118.95 114.57 3dyo s ARG 800 Ca 0.22 -0.52 -0.24 0.00 -1.00 0.00 0.00 55.73 54.19 3dyo s ARG 800 Cb 0.19 -0.09 -0.08 0.00 0.00 0.00 0.00 34.95 34.97 3dyo s ARG 800 CO 0.48 -1.22 1.20 0.42 0.00 0.00 0.00 175.30 176.19 3dyo s ILE 801 N 1.60 2.96 -0.43 4.11 -1.09 -0.83 -1.96 121.20 125.56 3dyo s ILE 801 Ca 0.18 0.78 -0.05 0.00 -2.23 0.00 0.00 60.65 59.33 3dyo s ILE 801 Cb -0.05 -3.42 0.11 0.00 -1.58 0.00 0.00 42.46 37.52 3dyo s ILE 801 CO -0.06 0.04 0.26 -0.62 -1.23 0.00 0.00 174.94 173.33 3dyo s ASP 802 N -1.15 5.43 0.36 3.58 -1.08 -1.26 -4.88 116.67 117.68 3dyo s ASP 802 Ca 0.61 -1.97 0.25 0.00 -0.52 0.00 0.00 52.55 50.91 3dyo s ASP 802 Cb -0.32 -1.90 1.30 0.00 -1.46 0.00 0.00 42.92 40.55 3dyo s ASP 802 CO 0.39 -0.60 1.76 1.55 0.52 0.00 0.00 175.17 178.80 3dyo h PRO 803 N 8.21 0.00 0.00 4.34 0.13 -1.96 -1.87 132.00 140.85 3dyo h PRO 803 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3dyo h PRO 803 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3dyo h PRO 803 CO 0.76 0.00 -0.44 -1.71 -0.23 0.00 0.00 178.00 176.38 3dyo n ASN 804 N -2.38 0.55 -4.76 1.44 5.15 -1.26 -4.15 115.26 109.85 3dyo n ASN 804 Ca -0.01 0.10 -0.39 0.00 -0.60 0.00 0.00 54.58 53.68 3dyo n ASN 804 Cb 0.07 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.33 3dyo n ASN 804 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dyo s ALA 805 N -3.08 3.12 0.22 5.20 0.00 -0.71 -4.70 121.76 121.81 3dyo s ALA 805 Ca 0.09 1.23 -0.08 0.00 0.00 0.00 0.00 51.96 53.20 3dyo s ALA 805 Cb 0.15 -3.50 0.31 0.00 0.00 0.00 0.00 23.12 20.08 3dyo s ALA 805 CO 0.68 -0.95 1.78 -1.49 0.00 0.00 0.00 175.76 175.78 3dyo h TRP 806 N 2.28 0.60 -0.76 0.00 4.06 -1.81 -1.38 115.95 118.95 3dyo h TRP 806 Ca -0.50 0.03 0.04 0.00 2.06 0.00 0.00 58.89 60.52 3dyo h TRP 806 Cb 1.26 -0.17 -0.04 0.00 -1.00 0.00 0.00 29.16 29.21 3dyo h TRP 806 CO 0.51 0.22 0.50 -0.24 -3.56 0.00 0.00 178.44 175.88 3dyo h VAL 807 N 0.58 1.09 -0.03 1.49 3.04 -1.46 -0.34 116.25 120.63 3dyo h VAL 807 Ca 0.33 -0.31 -0.16 0.00 -1.01 0.00 0.00 66.70 65.55 3dyo h VAL 807 Cb 0.34 0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 29.72 3dyo h VAL 807 CO -0.26 0.16 -0.72 -0.33 -1.01 0.00 0.00 177.57 175.42 3dyo h GLU 808 N 0.90 0.17 -0.06 4.17 4.39 -1.56 0.27 114.58 122.86 3dyo h GLU 808 Ca 0.31 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 3dyo h GLU 808 Cb 0.10 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3dyo h GLU 808 CO -0.10 0.82 0.02 0.00 -1.16 0.00 0.00 179.01 178.59 3dyo h ARG 809 N 0.11 0.09 -0.36 2.33 3.08 -0.44 0.20 114.38 119.40 3dyo h ARG 809 Ca -0.02 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3dyo h ARG 809 Cb 1.28 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 3dyo h ARG 809 CO 0.11 0.26 0.18 -1.49 -1.07 0.00 0.00 179.97 177.95 3dyo h TRP 810 N -0.09 0.52 0.13 3.04 6.55 -0.97 -1.77 115.95 123.37 3dyo h TRP 810 Ca 0.02 -0.02 0.01 0.00 0.95 0.00 0.00 58.89 59.84 3dyo h TRP 810 Cb 0.20 -0.16 -0.02 0.00 -0.86 0.00 0.00 29.16 28.32 3dyo h TRP 810 CO -0.01 0.44 -0.16 0.87 -1.05 0.00 0.00 178.44 178.54 3dyo h LYS 811 N 0.45 -0.32 -0.12 0.49 1.57 -0.75 -0.80 116.57 117.10 3dyo h LYS 811 Ca 0.13 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 3dyo h LYS 811 Cb 0.12 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 3dyo h LYS 811 CO -0.02 -0.21 0.02 0.00 -0.57 0.00 0.00 179.45 178.67 3dyo h ALA 812 N 0.49 1.82 -0.00 3.86 0.00 -0.52 0.49 119.26 125.40 3dyo h ALA 812 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dyo h ALA 812 Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3dyo h ALA 812 CO -0.06 0.15 -0.02 0.00 0.00 0.00 0.00 179.25 179.32 3dyo n ALA 813 N -2.51 2.61 -0.82 0.00 0.00 -0.67 -4.89 120.51 114.22 3dyo n ALA 813 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3dyo n ALA 813 Cb 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.12 3dyo n ALA 813 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyo n GLY 814 N 1.18 0.57 0.34 0.00 0.00 0.16 -4.86 105.19 102.59 3dyo n GLY 814 Ca 0.18 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.11 3dyo n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3dyo h HIS 815 N 0.00 0.54 0.00 1.61 3.86 -1.35 0.18 115.15 120.00 3dyo h HIS 815 Ca 0.00 0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3dyo h HIS 815 Cb 0.00 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.28 3dyo h HIS 815 CO 0.00 0.29 -0.30 1.88 0.86 0.00 0.00 177.93 180.67 3dyo h TYR 816 N 0.54 0.00 -0.01 2.45 -1.99 -1.85 -3.25 116.97 112.87 3dyo h TYR 816 Ca 0.25 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.98 3dyo h TYR 816 Cb 0.29 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.02 3dyo h TYR 816 CO -0.00 0.30 -0.64 1.04 -0.00 0.00 0.00 178.16 178.86 3dyo n GLN 817 N -3.21 1.09 -1.71 4.88 6.02 -0.52 -5.00 117.38 118.94 3dyo n GLN 817 Ca 0.02 -0.52 -0.41 0.00 -0.01 0.00 0.00 57.00 56.09 3dyo n GLN 817 Cb 0.62 -1.40 0.01 0.00 1.02 0.00 0.00 30.24 30.49 3dyo n GLN 817 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dyo n ALA 818 N -0.68 1.41 -2.66 -1.58 0.00 0.52 -5.00 120.51 112.52 3dyo n ALA 818 Ca 0.06 0.28 -0.28 0.00 0.00 0.00 0.00 53.44 53.49 3dyo n ALA 818 Cb 0.37 -2.28 -0.16 0.00 0.00 0.00 0.00 19.45 17.37 3dyo n ALA 818 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3dyo s GLU 819 N -2.19 2.00 -0.03 0.00 -1.05 -1.25 -4.93 118.70 111.26 3dyo s GLU 819 Ca 0.60 -0.76 -0.30 0.00 -0.15 0.00 0.00 54.97 54.36 3dyo s GLU 819 Cb -0.51 -1.79 -0.04 0.00 -0.44 0.00 0.00 34.13 31.36 3dyo s GLU 819 CO 0.59 0.37 1.17 0.00 0.95 0.00 0.00 175.26 178.34 3dyo s ALA 820 N -0.23 3.43 -0.21 -0.84 0.00 -1.26 -2.77 121.76 119.89 3dyo s ALA 820 Ca 0.01 0.65 -0.06 0.00 0.00 0.00 0.00 51.96 52.56 3dyo s ALA 820 Cb -0.11 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 3dyo s ALA 820 CO 0.01 -0.63 0.04 0.00 0.00 0.00 0.00 175.76 175.19 3dyo s ALA 821 N 1.82 3.20 0.03 0.00 0.00 0.11 -4.94 121.76 121.97 3dyo s ALA 821 Ca 0.56 -0.93 -0.30 0.00 0.00 0.00 0.00 51.96 51.28 3dyo s ALA 821 Cb -0.25 -1.90 -0.05 0.00 0.00 0.00 0.00 23.12 20.92 3dyo s ALA 821 CO 0.24 -0.11 1.18 -1.17 0.00 0.00 0.00 175.76 175.91 3dyo s LEU 822 N 0.92 4.35 -0.22 0.00 2.96 -1.26 -1.28 118.68 124.14 3dyo s LEU 822 Ca 0.03 1.94 0.08 0.00 -0.22 0.00 0.00 54.13 55.96 3dyo s LEU 822 Cb -0.14 -3.57 -0.21 0.00 0.50 0.00 0.00 46.19 42.77 3dyo s LEU 822 CO 0.02 -0.48 -0.05 0.18 -1.32 0.00 0.00 176.35 174.70 3dyo n LEU 823 N 4.23 1.76 -3.58 -0.68 4.77 0.28 -4.94 117.00 118.83 3dyo n LEU 823 Ca 0.09 -0.05 -0.15 0.00 -0.03 0.00 0.00 56.01 55.88 3dyo n LEU 823 Cb 0.47 -0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 3dyo n LEU 823 CO 0.55 0.75 0.49 -1.58 -1.33 0.00 0.00 177.39 176.27 3dyo s GLN 824 N -2.51 0.87 -0.26 3.23 0.74 -0.68 -4.91 119.66 116.14 3dyo s GLN 824 Ca -0.24 0.61 -0.01 0.00 0.05 0.00 0.00 55.36 55.77 3dyo s GLN 824 Cb 0.08 0.42 0.14 0.00 1.10 0.00 0.00 33.01 34.75 3dyo s GLN 824 CO 0.70 -0.19 0.38 0.00 -0.55 0.00 0.00 175.29 175.63 3dyo s THR 826 N 2.52 1.25 -0.06 0.00 -4.23 0.16 -4.97 115.64 110.30 3dyo s THR 826 Ca 0.11 -2.08 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 3dyo s THR 826 Cb -0.14 -2.12 0.01 0.00 1.34 0.00 0.00 72.50 71.58 3dyo s THR 826 CO -0.22 -0.52 -0.14 0.00 -0.54 0.00 0.00 174.62 173.19 3dyo s ALA 827 N -3.28 1.37 -0.04 3.99 0.00 -1.26 -0.34 121.76 122.20 3dyo s ALA 827 Ca 0.23 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 51.69 3dyo s ALA 827 Cb 0.03 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.62 3dyo s ALA 827 CO 0.06 0.18 -0.12 -0.51 0.00 0.00 0.00 175.76 175.37 3dyo s ASP 828 N 0.39 1.62 -0.22 0.00 1.01 0.15 -5.00 116.67 114.63 3dyo s ASP 828 Ca -0.10 -0.26 -0.14 0.00 0.71 0.00 0.00 52.55 52.75 3dyo s ASP 828 Cb -0.14 -0.50 -0.04 0.00 1.01 0.00 0.00 42.92 43.25 3dyo s ASP 828 CO 0.03 0.09 0.33 0.42 0.21 0.00 0.00 175.17 176.26 3dyo s THR 829 N 0.22 5.24 0.05 -1.27 -4.23 -1.26 -0.66 115.64 113.72 3dyo s THR 829 Ca -0.05 0.56 0.01 0.00 -1.18 0.00 0.00 61.69 61.02 3dyo s THR 829 Cb -0.11 -3.67 0.01 0.00 1.34 0.00 0.00 72.50 70.07 3dyo s THR 829 CO 0.02 0.26 0.07 0.18 -0.54 0.00 0.00 174.62 174.61 3dyo n LEU 830 N 4.53 0.00 -0.08 4.79 4.77 1.09 -4.95 117.00 127.14 3dyo n LEU 830 Ca -0.10 -0.19 -0.10 0.00 -0.03 0.00 0.00 56.01 55.59 3dyo n LEU 830 Cb 0.51 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 3dyo n LEU 830 CO 0.38 -0.52 0.91 0.00 -1.33 0.00 0.00 177.39 176.83 3dyo h ALA 831 N 0.17 0.35 -0.01 -1.18 0.00 -2.02 -3.26 119.26 113.31 3dyo h ALA 831 Ca -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3dyo h ALA 831 Cb 0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dyo h ALA 831 CO 0.03 -0.09 -0.02 -0.40 0.00 0.00 0.00 179.25 178.77 3dyo n ASP 832 N -4.80 2.39 -3.75 0.00 5.75 -1.26 -5.02 116.55 109.85 3dyo n ASP 832 Ca -0.02 -3.12 -0.04 0.00 -0.01 0.00 0.00 54.79 51.60 3dyo n ASP 832 Cb 0.10 -0.44 -0.01 0.00 -1.03 0.00 0.00 41.12 39.74 3dyo n ASP 832 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dyo s ALA 833 N -2.89 -1.62 -0.07 2.12 0.00 -1.23 -3.66 121.76 114.41 3dyo s ALA 833 Ca 0.33 0.08 0.04 0.00 0.00 0.00 0.00 51.96 52.40 3dyo s ALA 833 Cb 0.29 0.66 -0.02 0.00 0.00 0.00 0.00 23.12 24.05 3dyo s ALA 833 CO 0.03 -1.05 -0.18 0.08 0.00 0.00 0.00 175.76 174.64 3dyo s VAL 834 N -3.31 2.66 -0.29 0.00 1.01 -0.27 0.35 120.40 120.56 3dyo s VAL 834 Ca 0.12 -0.85 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 3dyo s VAL 834 Cb -0.02 -2.03 0.05 0.00 0.00 0.00 0.00 36.38 34.38 3dyo s VAL 834 CO 0.03 0.57 -0.04 -0.22 0.00 0.00 0.00 175.10 175.44 3dyo s LEU 835 N -0.33 3.72 -0.21 3.92 2.96 0.16 -0.03 118.68 128.87 3dyo s LEU 835 Ca 0.02 -1.28 -0.08 0.00 -0.22 0.00 0.00 54.13 52.57 3dyo s LEU 835 Cb -0.13 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 3dyo s LEU 835 CO 0.02 -0.23 0.09 -0.63 -1.32 0.00 0.00 176.35 174.29 3dyo s ILE 836 N 1.22 4.92 -0.10 6.68 -1.09 0.43 -0.67 121.20 132.59 3dyo s ILE 836 Ca -0.06 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.41 3dyo s ILE 836 Cb -0.20 -3.25 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 3dyo s ILE 836 CO -0.02 0.41 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.02 3dyo s THR 837 N 0.72 2.55 0.11 2.92 2.01 0.54 -0.29 115.64 124.20 3dyo s THR 837 Ca 0.05 -0.86 -0.00 0.00 0.31 0.00 0.00 61.69 61.19 3dyo s THR 837 Cb -0.13 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.33 3dyo s THR 837 CO 0.02 0.55 0.00 0.42 -0.69 0.00 0.00 174.62 174.92 3dyo s THR 838 N 0.11 0.32 -0.18 -0.82 -4.23 -0.06 -0.67 115.64 110.12 3dyo s THR 838 Ca -0.09 -1.89 -0.12 0.00 -1.18 0.00 0.00 61.69 58.40 3dyo s THR 838 Cb -0.15 -1.83 0.05 0.00 1.34 0.00 0.00 72.50 71.91 3dyo s THR 838 CO 0.06 -0.70 0.45 0.00 -0.54 0.00 0.00 174.62 173.88 3dyo s ALA 839 N -3.88 -1.13 0.04 3.99 0.00 0.31 -0.68 121.76 120.41 3dyo s ALA 839 Ca 0.17 1.50 -0.00 0.00 0.00 0.00 0.00 51.96 53.62 3dyo s ALA 839 Cb 0.07 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 3dyo s ALA 839 CO -0.03 -0.25 -0.03 -1.01 0.00 0.00 0.00 175.76 174.44 3dyo s HIS 840 N 0.97 0.44 0.00 0.00 3.76 -0.19 1.00 115.29 121.28 3dyo s HIS 840 Ca -0.06 -0.83 0.07 0.00 -0.15 0.00 0.00 55.06 54.10 3dyo s HIS 840 Cb -0.06 -0.32 -0.02 0.00 1.11 0.00 0.00 32.58 33.29 3dyo s HIS 840 CO -0.08 -0.28 -0.22 0.00 -0.85 0.00 0.00 174.74 173.30 3dyo s ALA 841 N -2.84 1.88 -0.18 -1.40 0.00 -0.41 -0.77 121.76 118.03 3dyo s ALA 841 Ca -0.02 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 3dyo s ALA 841 Cb 0.00 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 3dyo s ALA 841 CO -0.06 0.45 -0.05 -1.58 0.00 0.00 0.00 175.76 174.53 3dyo s TRP 842 N -0.61 2.97 0.17 0.00 0.51 0.11 0.09 118.94 122.18 3dyo s TRP 842 Ca 0.09 -0.60 0.07 0.00 -2.12 0.00 0.00 56.10 53.54 3dyo s TRP 842 Cb -0.09 -2.02 -0.04 0.00 -0.81 0.00 0.00 33.47 30.51 3dyo s TRP 842 CO 0.00 -0.28 -0.14 -0.65 -0.51 0.00 0.00 176.95 175.37 3dyo s GLN 843 N 0.88 1.21 -0.15 4.98 -0.21 -1.11 -0.07 119.66 125.18 3dyo s GLN 843 Ca -0.01 -1.47 -0.05 0.00 0.02 0.00 0.00 55.36 53.85 3dyo s GLN 843 Cb -0.15 -1.02 0.07 0.00 1.00 0.00 0.00 33.01 32.92 3dyo s GLN 843 CO 0.01 0.18 0.31 -1.58 -2.12 0.00 0.00 175.29 172.09 3dyo s HIS 844 N -2.73 -0.54 -1.42 0.91 2.46 0.85 -3.76 115.29 111.05 3dyo s HIS 844 Ca 0.18 1.14 -0.03 0.00 0.47 0.00 0.00 55.06 56.81 3dyo s HIS 844 Cb -0.02 0.07 0.02 0.00 -0.13 0.00 0.00 32.58 32.52 3dyo s HIS 844 CO 0.05 -0.40 0.58 1.04 -2.47 0.00 0.00 174.74 173.53 3dyo n GLN 845 N 5.36 -3.90 0.00 2.88 6.02 -1.26 0.80 117.38 127.29 3dyo n GLN 845 Ca -0.07 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 3dyo n GLN 845 Cb 0.50 -4.84 0.00 0.00 1.02 0.00 0.00 30.24 26.92 3dyo n GLN 845 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyo n GLY 846 N -1.80 2.55 3.85 1.08 0.00 -1.26 -5.02 105.19 104.59 3dyo n GLY 846 Ca -0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 3dyo n GLY 846 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dyo s LYS 847 N -0.41 3.61 -0.37 1.61 2.47 0.24 -5.05 119.74 121.85 3dyo s LYS 847 Ca 0.00 -0.07 -0.25 0.00 -1.56 0.00 0.00 55.97 54.09 3dyo s LYS 847 Cb 0.00 -3.23 0.01 0.00 -1.46 0.00 0.00 37.83 33.15 3dyo s LYS 847 CO 0.00 0.69 0.87 0.99 0.16 0.00 0.00 175.35 178.07 3dyo s THR 848 N -0.82 4.64 -0.16 3.43 2.01 -1.26 -0.11 115.64 123.38 3dyo s THR 848 Ca 0.15 1.08 -0.26 0.00 0.31 0.00 0.00 61.69 62.97 3dyo s THR 848 Cb -0.12 -4.28 -0.23 0.00 0.01 0.00 0.00 72.50 67.87 3dyo s THR 848 CO 0.04 -0.49 0.60 -0.07 -0.69 0.00 0.00 174.62 174.01 3dyo h LEU 849 N 9.94 0.00 -7.87 4.42 3.38 -0.84 -3.42 115.31 120.92 3dyo h LEU 849 Ca -0.24 -0.84 -0.15 0.00 0.09 0.00 0.00 57.88 56.74 3dyo h LEU 849 Cb 1.08 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.63 3dyo h LEU 849 CO 0.95 1.10 -0.58 -0.36 0.09 0.00 0.00 178.44 179.64 3dyo s PHE 850 N -2.23 0.16 -0.06 1.13 0.40 -1.14 -0.97 117.98 115.27 3dyo s PHE 850 Ca -0.21 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 55.79 3dyo s PHE 850 Cb -0.01 -0.12 0.01 0.00 0.51 0.00 0.00 43.02 43.41 3dyo s PHE 850 CO 0.64 -0.26 -0.12 0.42 0.70 0.00 0.00 175.22 176.60 3dyo s ILE 851 N -1.61 1.13 -0.16 0.64 1.01 -0.21 0.04 121.20 122.05 3dyo s ILE 851 Ca -0.14 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.05 3dyo s ILE 851 Cb -0.08 -1.03 0.02 0.00 0.01 0.00 0.00 42.46 41.38 3dyo s ILE 851 CO -0.00 0.35 -0.20 -0.55 0.00 0.00 0.00 174.94 174.54 3dyo s SER 852 N 0.65 3.07 -0.15 3.58 0.15 0.05 -0.97 113.70 120.08 3dyo s SER 852 Ca -0.14 -0.61 0.01 0.00 0.70 0.00 0.00 55.95 55.90 3dyo s SER 852 Cb -0.16 -1.43 -0.00 0.00 -1.71 0.00 0.00 66.02 62.72 3dyo s SER 852 CO 0.04 0.03 -0.17 -0.13 1.20 0.00 0.00 173.24 174.21 3dyo s ARG 853 N 1.09 3.19 0.14 5.44 0.52 -0.22 -1.02 118.95 128.08 3dyo s ARG 853 Ca -0.00 -0.77 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 3dyo s ARG 853 Cb -0.14 -2.57 -0.04 0.00 0.52 0.00 0.00 34.95 32.72 3dyo s ARG 853 CO -0.08 0.04 0.02 0.15 0.02 0.00 0.00 175.30 175.45 3dyo s LYS 854 N 0.73 0.97 0.01 3.54 1.02 0.14 -0.78 119.74 125.37 3dyo s LYS 854 Ca -0.07 -1.45 0.03 0.00 0.02 0.00 0.00 55.97 54.50 3dyo s LYS 854 Cb -0.16 -0.01 -0.01 0.00 -0.52 0.00 0.00 37.83 37.13 3dyo s LYS 854 CO 0.01 -0.17 -0.09 0.95 -0.92 0.00 0.00 175.35 175.13 3dyo s THR 855 N -3.84 0.70 -0.13 2.17 -4.23 -1.00 -0.88 115.64 108.43 3dyo s THR 855 Ca 0.21 -0.59 -0.00 0.00 -1.18 0.00 0.00 61.69 60.13 3dyo s THR 855 Cb 0.07 -0.63 0.03 0.00 1.34 0.00 0.00 72.50 73.30 3dyo s THR 855 CO 0.01 0.04 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.73 3dyo s TYR 856 N -0.52 1.77 -0.26 3.99 1.51 0.61 -1.28 117.35 123.17 3dyo s TYR 856 Ca 0.00 -0.97 -0.02 0.00 -1.01 0.00 0.00 57.07 55.07 3dyo s TYR 856 Cb -0.05 -1.38 0.02 0.00 -0.11 0.00 0.00 41.96 40.44 3dyo s TYR 856 CO 0.00 -0.59 -0.03 0.50 -1.11 0.00 0.00 175.55 174.32 3dyo s ARG 857 N 1.61 2.85 -0.18 -0.62 3.52 0.13 -0.43 118.95 125.84 3dyo s ARG 857 Ca 0.04 -0.98 -0.03 0.00 -0.13 0.00 0.00 55.73 54.64 3dyo s ARG 857 Cb -0.13 -3.06 -0.01 0.00 -1.56 0.00 0.00 34.95 30.18 3dyo s ARG 857 CO -0.09 -0.42 -0.06 0.42 -0.81 0.00 0.00 175.30 174.34 3dyo s ILE 858 N 1.35 3.42 0.18 4.11 1.01 0.95 -1.00 121.20 131.22 3dyo s ILE 858 Ca 0.00 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.16 3dyo s ILE 858 Cb -0.17 -2.51 0.01 0.00 0.01 0.00 0.00 42.46 39.80 3dyo s ILE 858 CO -0.03 0.47 0.10 -0.90 0.00 0.00 0.00 174.94 174.57 3dyo n ASP 859 N 4.16 1.81 0.30 3.58 5.75 -1.15 -1.11 116.55 129.89 3dyo n ASP 859 Ca -0.18 -1.66 0.18 0.00 -0.01 0.00 0.00 54.79 53.12 3dyo n ASP 859 Cb 0.52 0.02 0.96 0.00 -1.03 0.00 0.00 41.12 41.59 3dyo n ASP 859 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3dyo h GLY 860 N 0.27 0.00 1.39 6.12 0.00 -1.68 -2.19 103.07 106.97 3dyo h GLY 860 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3dyo h GLY 860 CO 0.19 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.59 3dyo n SER 861 N -3.35 0.00 0.00 0.19 3.41 -1.26 -4.71 113.62 107.91 3dyo n SER 861 Ca -0.02 -0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.30 3dyo n SER 861 Cb 0.15 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 3dyo n SER 861 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dyo n GLY 862 N 0.69 0.81 3.82 5.00 0.00 -0.82 -5.00 105.19 109.69 3dyo n GLY 862 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 3dyo n GLY 862 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dyo s GLN 863 N -0.01 4.12 -0.30 1.61 -0.21 -1.26 -4.41 119.66 119.20 3dyo s GLN 863 Ca 0.00 0.64 -0.08 0.00 0.02 0.00 0.00 55.36 55.94 3dyo s GLN 863 Cb 0.00 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.80 3dyo s GLN 863 CO 0.00 0.64 0.10 1.41 -2.12 0.00 0.00 175.29 175.33 3dyo s MET 864 N -1.15 3.20 -0.24 2.91 -2.45 0.03 -2.95 119.30 118.64 3dyo s MET 864 Ca 0.28 -0.80 -0.10 0.00 -1.25 0.00 0.00 55.69 53.83 3dyo s MET 864 Cb -0.19 -3.44 -0.05 0.00 1.25 0.00 0.00 34.83 32.41 3dyo s MET 864 CO 0.18 -0.42 0.14 0.00 1.05 0.00 0.00 175.02 175.96 3dyo s ALA 865 N 1.54 3.49 -0.16 4.11 0.00 -0.17 -0.74 121.76 129.83 3dyo s ALA 865 Ca 0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 3dyo s ALA 865 Cb -0.17 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 3dyo s ALA 865 CO 0.04 -0.24 -0.12 0.42 0.00 0.00 0.00 175.76 175.86 3dyo s ILE 866 N 1.16 2.97 -0.07 0.00 1.01 0.61 0.19 121.20 127.06 3dyo s ILE 866 Ca 0.06 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 60.06 3dyo s ILE 866 Cb -0.14 -2.27 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 3dyo s ILE 866 CO 0.05 0.50 -0.11 -0.89 0.00 0.00 0.00 174.94 174.49 3dyo s THR 867 N 0.78 3.36 -0.05 2.92 2.01 -0.40 -0.21 115.64 124.04 3dyo s THR 867 Ca -0.05 -0.60 0.01 0.00 0.31 0.00 0.00 61.69 61.37 3dyo s THR 867 Cb -0.15 -2.36 0.02 0.00 0.01 0.00 0.00 72.50 70.02 3dyo s THR 867 CO 0.01 0.58 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.77 3dyo s VAL 868 N -0.57 0.70 -0.21 3.82 1.01 0.13 -2.38 120.40 122.90 3dyo s VAL 868 Ca 0.08 -0.21 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 3dyo s VAL 868 Cb -0.12 -0.70 0.06 0.00 0.00 0.00 0.00 36.38 35.62 3dyo s VAL 868 CO 0.02 0.27 -0.04 -1.81 0.00 0.00 0.00 175.10 173.54 3dyo s ASP 869 N 0.94 3.45 -0.07 3.32 1.01 0.04 -1.08 116.67 124.29 3dyo s ASP 869 Ca -0.10 -1.00 0.02 0.00 0.71 0.00 0.00 52.55 52.18 3dyo s ASP 869 Cb -0.14 -1.01 -0.03 0.00 1.01 0.00 0.00 42.92 42.75 3dyo s ASP 869 CO 0.00 -0.24 -0.10 -0.69 0.21 0.00 0.00 175.17 174.35 3dyo s VAL 870 N 1.54 3.38 -0.10 -1.27 1.01 0.03 -1.06 120.40 123.94 3dyo s VAL 870 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3dyo s VAL 870 Cb -0.18 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 3dyo s VAL 870 CO -0.07 0.59 -0.09 -1.61 0.00 0.00 0.00 175.10 173.92 3dyo s GLU 871 N -0.65 3.05 -0.14 2.72 2.02 -0.14 -0.40 118.70 125.16 3dyo s GLU 871 Ca 0.10 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.51 3dyo s GLU 871 Cb -0.11 -2.64 0.02 0.00 0.10 0.00 0.00 34.13 31.50 3dyo s GLU 871 CO 0.01 0.47 -0.18 0.08 0.02 0.00 0.00 175.26 175.67 3dyo s VAL 872 N -0.30 1.79 0.05 2.63 1.01 0.10 -1.04 120.40 124.64 3dyo s VAL 872 Ca 0.04 -0.79 -0.35 0.00 0.00 0.00 0.00 61.98 60.88 3dyo s VAL 872 Cb -0.13 -1.62 -0.14 0.00 0.00 0.00 0.00 36.38 34.49 3dyo s VAL 872 CO 0.03 0.50 1.64 0.00 0.00 0.00 0.00 175.10 177.26 3dyo n ALA 873 N 4.40 0.81 0.26 5.51 0.00 -0.14 -4.65 120.51 126.70 3dyo n ALA 873 Ca -0.19 0.41 0.18 0.00 0.00 0.00 0.00 53.44 53.84 3dyo n ALA 873 Cb 0.51 -2.35 0.91 0.00 0.00 0.00 0.00 19.45 18.52 3dyo n ALA 873 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3dyo h SER 874 N 6.73 0.00 -0.07 0.00 4.64 -1.93 -1.06 113.55 121.85 3dyo h SER 874 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3dyo h SER 874 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3dyo h SER 874 CO 0.89 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.95 3dyo n ASP 875 N -3.47 2.59 -4.92 4.97 5.75 -1.26 -4.89 116.55 115.32 3dyo n ASP 875 Ca 0.00 -1.85 -0.28 0.00 -0.01 0.00 0.00 54.79 52.65 3dyo n ASP 875 Cb 0.29 -0.03 -0.03 0.00 -1.03 0.00 0.00 41.12 40.32 3dyo n ASP 875 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 3dyo s THR 876 N -1.93 5.16 0.33 2.12 -1.32 -0.40 -5.03 115.64 114.56 3dyo s THR 876 Ca 0.32 -0.24 -0.29 0.00 -1.21 0.00 0.00 61.69 60.27 3dyo s THR 876 Cb 0.20 -3.73 -0.12 0.00 -1.51 0.00 0.00 72.50 67.35 3dyo s THR 876 CO 0.31 -0.20 1.38 -0.81 -2.21 0.00 0.00 174.62 173.10 3dyo n PRO 877 N -0.68 2.29 -1.66 7.08 -0.04 -1.26 -4.85 135.00 135.87 3dyo n PRO 877 Ca -0.04 0.81 -0.46 0.00 -0.04 0.00 0.00 63.50 63.77 3dyo n PRO 877 Cb 0.54 -2.45 -0.04 0.00 -0.04 0.00 0.00 33.50 31.50 3dyo n PRO 877 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3dyo n HIS 878 N 0.80 2.19 -2.00 0.54 8.25 -1.26 -4.91 115.22 118.82 3dyo n HIS 878 Ca 0.05 0.34 -0.32 0.00 -0.26 0.00 0.00 57.72 57.53 3dyo n HIS 878 Cb 0.36 -2.51 0.01 0.00 1.12 0.00 0.00 29.99 28.97 3dyo n HIS 878 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3dyo s PRO 879 N 0.53 3.40 0.43 -0.41 0.04 -1.26 -4.86 135.00 132.86 3dyo s PRO 879 Ca 0.76 1.06 0.14 0.00 0.04 0.00 0.00 61.00 63.00 3dyo s PRO 879 Cb -0.69 -2.05 0.93 0.00 0.04 0.00 0.00 34.50 32.73 3dyo s PRO 879 CO 0.42 -0.74 1.95 0.00 0.04 0.00 0.00 177.00 178.67 3dyo h ALA 880 N 0.23 1.61 -2.45 8.56 0.00 -1.89 -3.40 119.26 121.92 3dyo h ALA 880 Ca -0.46 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 54.34 3dyo h ALA 880 Cb 1.21 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.83 3dyo h ALA 880 CO 0.59 0.29 0.43 -0.98 0.00 0.00 0.00 179.25 179.58 3dyo s ARG 881 N -4.51 1.03 -0.33 0.00 1.70 -1.22 -0.99 118.95 114.62 3dyo s ARG 881 Ca -0.04 -0.45 -0.00 0.00 -0.47 0.00 0.00 55.73 54.78 3dyo s ARG 881 Cb 0.15 0.43 0.11 0.00 -0.57 0.00 0.00 34.95 35.07 3dyo s ARG 881 CO 0.70 -0.46 0.13 0.42 -1.08 0.00 0.00 175.30 175.01 3dyo s ILE 882 N -3.30 0.95 0.00 4.99 1.01 -0.31 -4.11 121.20 120.43 3dyo s ILE 882 Ca 0.06 -1.62 0.00 0.00 0.00 0.00 0.00 60.65 59.09 3dyo s ILE 882 Cb -0.01 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.75 3dyo s ILE 882 CO -0.06 -0.73 0.00 0.61 0.00 0.00 0.00 174.94 174.76 3dyo n GLY 883 N 4.59 2.60 3.32 6.18 0.00 -0.89 -0.06 105.19 120.94 3dyo n GLY 883 Ca 0.00 -0.99 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 3dyo n GLY 883 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyo s LEU 884 N 0.00 2.55 0.12 0.99 1.43 0.18 -0.08 118.68 123.87 3dyo s LEU 884 Ca 0.00 -1.02 -0.10 0.00 -1.03 0.00 0.00 54.13 51.98 3dyo s LEU 884 Cb 0.00 -0.60 0.00 0.00 0.03 0.00 0.00 46.19 45.62 3dyo s LEU 884 CO 0.00 -0.21 0.25 0.54 0.23 0.00 0.00 176.35 177.16 3dyo s ASN 885 N -3.28 0.04 0.17 2.29 4.22 0.18 -1.23 114.94 117.34 3dyo s ASN 885 Ca 0.21 -0.67 -0.23 0.00 -2.14 0.00 0.00 52.86 50.03 3dyo s ASN 885 Cb 0.00 0.39 0.07 0.00 1.28 0.00 0.00 41.25 42.99 3dyo s ASN 885 CO 0.05 -0.80 0.62 0.00 -2.04 0.00 0.00 177.10 174.93 3dyo s GLN 887 N -3.76 3.15 0.30 0.00 0.74 -1.25 -0.62 119.66 118.21 3dyo s GLN 887 Ca 0.02 -0.84 -0.27 0.00 0.05 0.00 0.00 55.36 54.32 3dyo s GLN 887 Cb -0.02 -3.55 -0.10 0.00 1.10 0.00 0.00 33.01 30.45 3dyo s GLN 887 CO -0.11 -0.49 0.94 -0.51 -0.55 0.00 0.00 175.29 174.57 3dyo s LEU 888 N 1.57 4.43 0.39 3.68 1.43 0.98 0.99 118.68 132.15 3dyo s LEU 888 Ca 0.03 1.86 0.20 0.00 -1.03 0.00 0.00 54.13 55.20 3dyo s LEU 888 Cb -0.18 -3.89 0.70 0.00 0.03 0.00 0.00 46.19 42.85 3dyo s LEU 888 CO 0.05 0.00 1.73 0.00 0.23 0.00 0.00 176.35 178.37 3dyo h ALA 889 N 3.46 0.97 -2.29 4.21 0.00 -1.19 0.44 119.26 124.86 3dyo h ALA 889 Ca -0.46 -0.30 -0.46 0.00 0.00 0.00 0.00 54.91 53.68 3dyo h ALA 889 Cb 1.19 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3dyo h ALA 889 CO 0.66 0.41 0.30 -1.14 0.00 0.00 0.00 179.25 179.48 3dyo s GLN 890 N -3.55 4.35 -0.27 0.00 2.00 -1.26 -4.26 119.66 116.67 3dyo s GLN 890 Ca 0.01 1.14 0.03 0.00 -2.00 0.00 0.00 55.36 54.53 3dyo s GLN 890 Cb 0.10 -2.52 0.07 0.00 0.80 0.00 0.00 33.01 31.46 3dyo s GLN 890 CO 0.67 0.15 -0.06 0.08 -0.50 0.00 0.00 175.29 175.64 3dyo s VAL 891 N -1.87 1.99 0.32 1.34 1.01 -1.26 -3.06 120.40 118.87 3dyo s VAL 891 Ca 0.55 -1.66 0.08 0.00 0.00 0.00 0.00 61.98 60.95 3dyo s VAL 891 Cb -0.14 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 3dyo s VAL 891 CO 0.18 -0.18 0.16 0.00 0.00 0.00 0.00 175.10 175.26 3dyo s ALA 892 N 1.15 3.52 0.07 5.51 0.00 -1.26 -5.05 121.76 125.70 3dyo s ALA 892 Ca -0.04 -1.73 -0.07 0.00 0.00 0.00 0.00 51.96 50.12 3dyo s ALA 892 Cb -0.19 -0.87 -0.30 0.00 0.00 0.00 0.00 23.12 21.75 3dyo s ALA 892 CO -0.07 0.08 1.11 0.93 0.00 0.00 0.00 175.76 177.82 3dyo h GLU 893 N 1.53 0.33 -5.98 0.00 5.08 -2.00 -3.43 114.58 110.11 3dyo h GLU 893 Ca -0.44 -0.56 -0.57 0.00 -1.00 0.00 0.00 59.36 56.78 3dyo h GLU 893 Cb 1.25 0.21 -0.14 0.00 0.50 0.00 0.00 28.75 30.57 3dyo h GLU 893 CO 0.62 1.27 -0.73 1.03 -1.00 0.00 0.00 179.01 180.19 3dyo s ARG 894 N -2.65 1.64 -0.07 2.33 1.81 -1.26 -1.65 118.95 119.09 3dyo s ARG 894 Ca -0.05 -1.78 0.01 0.00 -1.72 0.00 0.00 55.73 52.19 3dyo s ARG 894 Cb 0.06 -1.59 0.02 0.00 -0.45 0.00 0.00 34.95 32.99 3dyo s ARG 894 CO 0.90 0.24 -0.07 0.08 -0.68 0.00 0.00 175.30 175.77 3dyo s VAL 895 N -2.65 0.77 -0.08 3.52 1.01 0.37 -4.57 120.40 118.76 3dyo s VAL 895 Ca 0.29 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.08 3dyo s VAL 895 Cb -0.02 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.60 3dyo s VAL 895 CO 0.14 0.29 -0.14 0.21 0.00 0.00 0.00 175.10 175.60 3dyo s ASN 896 N 1.13 2.06 0.05 3.32 3.84 -1.00 -0.47 114.94 123.88 3dyo s ASN 896 Ca -0.07 -0.35 -0.07 0.00 0.21 0.00 0.00 52.86 52.58 3dyo s ASN 896 Cb -0.14 -0.94 -0.01 0.00 -0.55 0.00 0.00 41.25 39.61 3dyo s ASN 896 CO -0.01 0.04 0.13 -1.66 -2.79 0.00 0.00 177.10 172.81 3dyo s TRP 897 N 0.72 0.19 -0.43 0.43 -2.14 -0.12 0.40 118.94 117.99 3dyo s TRP 897 Ca -0.13 -0.54 -0.09 0.00 2.66 0.00 0.00 56.10 58.00 3dyo s TRP 897 Cb -0.16 -0.12 0.09 0.00 -3.10 0.00 0.00 33.47 30.18 3dyo s TRP 897 CO 0.03 -0.43 0.28 -1.17 -2.66 0.00 0.00 176.95 173.00 3dyo s LEU 898 N -2.40 5.26 0.00 -4.66 2.96 0.07 0.44 118.68 120.35 3dyo s LEU 898 Ca -0.01 -1.59 0.00 0.00 -0.22 0.00 0.00 54.13 52.31 3dyo s LEU 898 Cb 0.02 -1.99 0.00 0.00 0.50 0.00 0.00 46.19 44.71 3dyo s LEU 898 CO -0.07 -0.57 0.00 0.61 -1.32 0.00 0.00 176.35 175.00 3dyo n GLY 899 N 4.91 -0.76 3.74 7.98 0.00 -0.74 0.14 105.19 120.46 3dyo n GLY 899 Ca -0.09 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 3dyo n GLY 899 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dyo s LEU 900 N 0.00 4.49 0.00 0.99 1.43 -0.72 -2.06 118.68 122.80 3dyo s LEU 900 Ca 0.00 2.09 0.00 0.00 -1.03 0.00 0.00 54.13 55.19 3dyo s LEU 900 Cb 0.00 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.62 3dyo s LEU 900 CO 0.00 -0.22 0.00 0.61 0.23 0.00 0.00 176.35 176.97 3dyo n GLY 901 N 2.06 -1.06 0.09 -3.19 0.00 -0.20 -4.52 105.19 98.37 3dyo n GLY 901 Ca 0.03 -0.75 0.12 0.00 0.00 0.00 0.00 46.02 45.42 3dyo n GLY 901 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dyo h PRO 902 N 0.00 0.00 -7.20 1.61 0.13 -1.93 0.21 132.00 124.82 3dyo h PRO 902 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 3dyo h PRO 902 Cb 0.00 0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.20 3dyo h PRO 902 CO 0.00 0.00 0.19 -0.65 -0.23 0.00 0.00 178.00 177.31 3dyo s GLN 903 N -3.17 2.45 0.18 0.86 -0.21 -1.26 -4.99 119.66 113.52 3dyo s GLN 903 Ca 0.07 -0.23 -0.33 0.00 0.02 0.00 0.00 55.36 54.89 3dyo s GLN 903 Cb 0.12 -2.23 -0.15 0.00 1.00 0.00 0.00 33.01 31.75 3dyo s GLN 903 CO 0.70 -1.02 1.24 -1.91 -2.12 0.00 0.00 175.29 172.17 3dyo n GLU 904 N -2.76 1.37 -3.81 2.91 2.13 -1.26 -4.88 120.64 114.34 3dyo n GLU 904 Ca 0.07 0.49 -0.12 0.00 0.66 0.00 0.00 57.16 58.25 3dyo n GLU 904 Cb 0.59 -2.04 -0.10 0.00 0.27 0.00 0.00 31.44 30.16 3dyo n GLU 904 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3dyo s ASN 905 N 0.13 -0.14 0.32 4.31 2.20 0.74 -4.92 114.94 117.56 3dyo s ASN 905 Ca 0.73 0.16 0.07 0.00 -0.94 0.00 0.00 52.86 52.88 3dyo s ASN 905 Cb -0.81 0.35 -0.06 0.00 -2.00 0.00 0.00 41.25 38.73 3dyo s ASN 905 CO 0.51 -0.27 -0.03 -0.31 -2.94 0.00 0.00 177.10 174.06 3dyo s TYR 906 N -0.73 2.10 0.30 1.54 1.51 -0.98 -3.74 117.35 117.35 3dyo s TYR 906 Ca -0.08 -0.72 0.05 0.00 -1.01 0.00 0.00 57.07 55.31 3dyo s TYR 906 Cb -0.05 -1.28 0.70 0.00 -0.11 0.00 0.00 41.96 41.23 3dyo s TYR 906 CO 0.02 0.29 1.79 -1.35 -1.11 0.00 0.00 175.55 175.19 3dyo h PRO 907 N 2.14 0.80 -0.70 -1.71 0.11 -1.85 0.30 132.00 131.09 3dyo h PRO 907 Ca -0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3dyo h PRO 907 Cb 1.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3dyo h PRO 907 CO 0.70 0.53 0.00 -0.40 -0.21 0.00 0.00 178.00 178.62 3dyo n ASP 908 N -4.72 3.86 -3.09 -2.05 5.75 -1.26 -4.39 116.55 110.65 3dyo n ASP 908 Ca 0.22 -2.00 -0.17 0.00 -0.01 0.00 0.00 54.79 52.83 3dyo n ASP 908 Cb 0.52 -0.47 -0.01 0.00 -1.03 0.00 0.00 41.12 40.13 3dyo n ASP 908 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3dyo n ARG 909 N 1.62 0.91 0.00 0.11 0.63 0.10 -0.66 116.66 119.37 3dyo n ARG 909 Ca 0.24 -3.00 0.00 0.00 -0.92 0.00 0.00 57.85 54.17 3dyo n ARG 909 Cb 0.61 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 32.05 3dyo n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 3dyo n LEU 910 N 0.62 0.66 0.08 6.15 -0.00 -0.89 -2.31 117.00 121.31 3dyo n LEU 910 Ca 0.20 -0.66 0.02 0.00 -0.00 0.00 0.00 56.01 55.57 3dyo n LEU 910 Cb 0.64 0.00 0.36 0.00 -0.00 0.00 0.00 43.42 44.42 3dyo n LEU 910 CO 0.16 0.16 0.91 0.71 -0.00 0.00 0.00 177.39 179.34 3dyo h THR 911 N 1.64 1.18 -0.27 1.47 1.35 -1.91 -2.91 112.91 113.47 3dyo h THR 911 Ca 0.00 -0.77 -0.11 0.00 -0.55 0.00 0.00 66.41 64.98 3dyo h THR 911 Cb 0.72 1.10 -0.01 0.00 -1.73 0.00 0.00 68.15 68.23 3dyo h THR 911 CO 0.00 0.25 -0.29 0.00 -0.25 0.00 0.00 175.52 175.23 3dyo h ALA 912 N 1.60 1.00 -2.83 6.62 0.00 -1.88 -3.45 119.26 120.32 3dyo h ALA 912 Ca 0.07 -0.38 -0.52 0.00 0.00 0.00 0.00 54.91 54.08 3dyo h ALA 912 Cb 0.35 -0.12 0.09 0.00 0.00 0.00 0.00 17.79 18.11 3dyo h ALA 912 CO 0.02 0.59 0.54 0.00 0.00 0.00 0.00 179.25 180.41 3dyo s ALA 913 N -4.44 2.98 0.17 0.00 0.00 -1.10 -4.99 121.76 114.38 3dyo s ALA 913 Ca -0.07 1.11 0.11 0.00 0.00 0.00 0.00 51.96 53.11 3dyo s ALA 913 Cb 0.13 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 3dyo s ALA 913 CO 0.81 -0.90 -0.24 0.00 0.00 0.00 0.00 175.76 175.43 3dyo s PHE 915 N -1.47 3.35 0.05 0.00 5.36 -1.26 -1.04 117.98 122.98 3dyo s PHE 915 Ca 0.19 1.01 -0.10 0.00 -0.96 0.00 0.00 56.93 57.07 3dyo s PHE 915 Cb -0.09 -2.89 0.03 0.00 -0.34 0.00 0.00 43.02 39.73 3dyo s PHE 915 CO 0.09 -0.26 0.46 -3.47 -1.46 0.00 0.00 175.22 170.59 3dyo n ASP 916 N 5.40 -0.68 -4.58 6.13 -0.08 -0.88 -4.95 116.55 116.92 3dyo n ASP 916 Ca 0.01 -1.31 -0.41 0.00 -1.51 0.00 0.00 54.79 51.57 3dyo n ASP 916 Cb 0.49 1.09 -0.08 0.00 2.34 0.00 0.00 41.12 44.96 3dyo n ASP 916 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 3dyo s ARG 917 N -2.02 3.76 0.11 -0.67 6.06 -1.26 -1.79 118.95 123.14 3dyo s ARG 917 Ca 0.11 0.01 0.08 0.00 -2.50 0.00 0.00 55.73 53.43 3dyo s ARG 917 Cb -0.01 -3.76 -0.04 0.00 0.06 0.00 0.00 34.95 31.20 3dyo s ARG 917 CO 0.02 -0.58 -0.14 -1.58 -2.50 0.00 0.00 175.30 170.51 3dyo s TRP 918 N 2.43 2.63 -0.21 5.12 0.52 0.17 -4.98 118.94 124.62 3dyo s TRP 918 Ca 0.20 -0.22 -0.04 0.00 0.02 0.00 0.00 56.10 56.07 3dyo s TRP 918 Cb -0.15 -1.38 0.09 0.00 -1.15 0.00 0.00 33.47 30.88 3dyo s TRP 918 CO 0.12 0.41 0.22 0.34 0.02 0.00 0.00 176.95 178.07 3dyo s ASP 919 N -2.21 1.39 0.24 2.95 -1.08 -1.26 -0.94 116.67 115.76 3dyo s ASP 919 Ca 0.20 -0.24 0.01 0.00 -0.52 0.00 0.00 52.55 51.99 3dyo s ASP 919 Cb -0.11 0.39 -0.05 0.00 -1.46 0.00 0.00 42.92 41.69 3dyo s ASP 919 CO 0.12 -0.33 0.10 -0.76 0.52 0.00 0.00 175.17 174.82 3dyo s LEU 920 N 2.33 1.51 0.46 -1.34 1.43 0.38 -4.93 118.68 118.52 3dyo s LEU 920 Ca 0.07 -1.38 -0.24 0.00 -1.03 0.00 0.00 54.13 51.56 3dyo s LEU 920 Cb -0.16 0.13 -0.07 0.00 0.03 0.00 0.00 46.19 46.12 3dyo s LEU 920 CO -0.13 -0.76 1.22 -2.16 0.23 0.00 0.00 176.35 174.76 3dyo s PRO 921 N -4.07 3.73 0.28 1.29 0.04 -1.26 -0.48 135.00 134.54 3dyo s PRO 921 Ca 0.38 1.93 0.03 0.00 0.04 0.00 0.00 61.00 63.37 3dyo s PRO 921 Cb 0.08 -2.48 0.64 0.00 0.04 0.00 0.00 34.50 32.77 3dyo s PRO 921 CO 0.13 -0.62 1.78 1.25 0.04 0.00 0.00 177.00 179.58 3dyo h LEU 922 N 2.14 0.70 -2.46 -3.56 5.85 -1.59 -0.73 115.31 115.66 3dyo h LEU 922 Ca -0.50 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 3dyo h LEU 922 Cb 1.25 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 3dyo h LEU 922 CO 0.60 0.28 -0.02 0.77 -0.34 0.00 0.00 178.44 179.73 3dyo h SER 923 N 0.73 0.00 0.47 1.25 4.64 -1.90 -0.42 113.55 118.31 3dyo h SER 923 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 3dyo h SER 923 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 3dyo h SER 923 CO -0.36 0.02 0.00 0.47 -0.87 0.00 0.00 176.83 176.08 3dyo n ASP 924 N -3.70 0.00 -0.85 4.97 8.00 -0.28 -2.51 116.55 122.18 3dyo n ASP 924 Ca -0.03 -0.16 0.09 0.00 0.71 0.00 0.00 54.79 55.40 3dyo n ASP 924 Cb 0.10 -0.26 0.26 0.00 -0.02 0.00 0.00 41.12 41.20 3dyo n ASP 924 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3dyo n MET 925 N -1.26 2.09 -4.62 -1.24 2.81 -0.17 -4.74 117.12 109.98 3dyo n MET 925 Ca 0.13 -1.67 -0.33 0.00 -1.81 0.00 0.00 57.70 54.03 3dyo n MET 925 Cb 0.20 -1.40 -0.16 0.00 -0.71 0.00 0.00 33.22 31.15 3dyo n MET 925 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 3dyo s TYR 926 N -1.49 2.72 -0.32 2.03 5.04 -1.04 -4.52 117.35 119.76 3dyo s TYR 926 Ca 0.33 -1.20 -0.12 0.00 -2.44 0.00 0.00 57.07 53.64 3dyo s TYR 926 Cb 0.18 -1.84 -0.03 0.00 0.35 0.00 0.00 41.96 40.62 3dyo s TYR 926 CO 0.25 -0.55 0.23 0.99 -1.34 0.00 0.00 175.55 175.13 3dyo s THR 927 N 0.80 5.28 -1.62 4.34 2.01 -1.26 -4.97 115.64 120.22 3dyo s THR 927 Ca -0.07 -0.12 -0.10 0.00 0.31 0.00 0.00 61.69 61.71 3dyo s THR 927 Cb -0.15 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.61 3dyo s THR 927 CO -0.01 0.06 2.92 -0.81 -0.69 0.00 0.00 174.62 176.09 3dyo n PRO 928 N 5.09 3.66 -1.67 4.92 -0.04 -1.26 -4.86 135.00 140.83 3dyo n PRO 928 Ca -0.13 -2.23 -0.43 0.00 -0.04 0.00 0.00 63.50 60.67 3dyo n PRO 928 Cb 0.50 -2.83 -0.01 0.00 -0.04 0.00 0.00 33.50 31.12 3dyo n PRO 928 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3dyo n TYR 929 N 3.74 2.09 -0.22 0.54 4.02 -1.26 -4.88 117.16 121.19 3dyo n TYR 929 Ca 0.77 0.56 -0.04 0.00 -0.01 0.00 0.00 57.90 59.18 3dyo n TYR 929 Cb 0.24 -2.40 0.07 0.00 -0.02 0.00 0.00 39.34 37.23 3dyo n TYR 929 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 3dyo h VAL 930 N 2.55 1.05 -3.55 -0.72 2.07 -1.97 -3.30 116.25 112.39 3dyo h VAL 930 Ca -0.45 -0.25 -0.69 0.00 0.82 0.00 0.00 66.70 66.14 3dyo h VAL 930 Cb 1.29 0.25 -0.18 0.00 -1.52 0.00 0.00 31.29 31.13 3dyo h VAL 930 CO 0.65 0.13 -0.15 0.12 0.02 0.00 0.00 177.57 178.34 3dyo s PHE 931 N -6.12 3.15 0.58 1.57 5.36 -1.26 -1.35 117.98 119.91 3dyo s PHE 931 Ca -0.13 -0.30 -0.19 0.00 -0.96 0.00 0.00 56.93 55.35 3dyo s PHE 931 Cb 0.15 -2.97 -0.04 0.00 -0.34 0.00 0.00 43.02 39.82 3dyo s PHE 931 CO 0.76 -0.72 1.20 -2.14 -1.46 0.00 0.00 175.22 172.85 3dyo s PRO 932 N 2.26 3.08 0.26 10.12 0.02 -1.24 -4.96 135.00 144.53 3dyo s PRO 932 Ca 0.14 1.80 -0.14 0.00 0.02 0.00 0.00 61.00 62.82 3dyo s PRO 932 Cb -0.16 -1.97 0.05 0.00 0.02 0.00 0.00 34.50 32.43 3dyo s PRO 932 CO 0.14 -1.11 0.69 -1.13 -0.33 0.00 0.00 177.00 175.26 3dyo n SER 933 N -1.47 -1.67 -4.66 2.53 3.41 -1.26 -4.76 113.62 105.75 3dyo n SER 933 Ca 0.13 -2.08 -0.45 0.00 -0.26 0.00 0.00 58.87 56.21 3dyo n SER 933 Cb 0.50 2.76 -0.02 0.00 -0.26 0.00 0.00 64.21 67.19 3dyo n SER 933 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3dyo n GLU 934 N -0.47 1.87 -3.73 4.33 4.07 -0.49 -4.93 120.64 121.29 3dyo n GLU 934 Ca -0.05 0.66 -0.09 0.00 -0.06 0.00 0.00 57.16 57.63 3dyo n GLU 934 Cb 0.47 -2.26 -0.02 0.00 -0.06 0.00 0.00 31.44 29.56 3dyo n GLU 934 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3dyo s ASN 935 N 0.09 -0.35 0.00 4.31 2.20 -1.26 -4.90 114.94 115.03 3dyo s ASN 935 Ca 0.66 -0.43 0.00 0.00 -0.94 0.00 0.00 52.86 52.15 3dyo s ASN 935 Cb -0.67 0.68 0.00 0.00 -2.00 0.00 0.00 41.25 39.27 3dyo s ASN 935 CO 0.53 -1.22 0.00 0.61 -2.94 0.00 0.00 177.10 174.07 3dyo n GLY 936 N -0.43 0.39 3.74 0.45 0.00 -1.26 -4.79 105.19 103.29 3dyo n GLY 936 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 3dyo n GLY 936 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dyo s LEU 937 N 0.00 3.66 -0.07 0.99 2.96 -1.26 -4.63 118.68 120.33 3dyo s LEU 937 Ca 0.00 2.54 0.02 0.00 -0.22 0.00 0.00 54.13 56.47 3dyo s LEU 937 Cb 0.00 -4.56 0.02 0.00 0.50 0.00 0.00 46.19 42.15 3dyo s LEU 937 CO 0.00 -1.76 -0.12 -0.13 -1.32 0.00 0.00 176.35 173.03 3dyo s ARG 938 N -3.28 1.70 0.55 1.98 3.00 -0.42 -0.19 118.95 122.29 3dyo s ARG 938 Ca 0.79 -0.40 0.09 0.00 0.00 0.00 0.00 55.73 56.21 3dyo s ARG 938 Cb -0.35 -1.46 0.07 0.00 0.00 0.00 0.00 34.95 33.21 3dyo s ARG 938 CO 0.38 -0.02 0.68 0.00 0.00 0.00 0.00 175.30 176.34 3dyo n GLY 940 N -2.09 -0.48 3.71 0.00 0.00 -1.16 -1.76 105.19 103.41 3dyo n GLY 940 Ca 0.11 0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.92 3dyo n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyo s THR 941 N -3.24 5.18 -0.17 2.61 2.01 0.16 -3.76 115.64 118.42 3dyo s THR 941 Ca 0.66 0.92 0.18 0.00 0.31 0.00 0.00 61.69 63.77 3dyo s THR 941 Cb -0.34 -3.81 -0.27 0.00 0.01 0.00 0.00 72.50 68.09 3dyo s THR 941 CO 0.82 0.30 0.47 0.54 -0.69 0.00 0.00 174.62 176.06 3dyo n ARG 942 N 3.86 0.66 -3.68 4.92 5.12 0.12 -0.88 116.66 126.78 3dyo n ARG 942 Ca -0.07 -0.14 -0.11 0.00 -1.93 0.00 0.00 57.85 55.60 3dyo n ARG 942 Cb 0.51 -1.42 -0.09 0.00 -1.16 0.00 0.00 32.46 30.30 3dyo n ARG 942 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3dyo s GLU 943 N -3.17 0.57 -0.04 5.56 2.12 -1.12 -1.30 118.70 121.32 3dyo s GLU 943 Ca -0.04 0.85 0.02 0.00 0.36 0.00 0.00 54.97 56.15 3dyo s GLU 943 Cb 0.12 0.17 0.01 0.00 0.26 0.00 0.00 34.13 34.70 3dyo s GLU 943 CO 0.76 -0.11 -0.07 -1.17 -0.54 0.00 0.00 175.26 174.12 3dyo s LEU 944 N 0.88 1.54 -0.06 2.70 2.96 -0.31 -0.75 118.68 125.63 3dyo s LEU 944 Ca -0.05 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.72 3dyo s LEU 944 Cb -0.05 -0.55 0.00 0.00 0.50 0.00 0.00 46.19 46.08 3dyo s LEU 944 CO -0.07 -0.00 -0.19 0.20 -1.32 0.00 0.00 176.35 174.97 3dyo s ASN 945 N 0.65 2.44 -0.26 3.68 0.01 0.16 -0.57 114.94 121.05 3dyo s ASN 945 Ca -0.10 -0.42 -0.05 0.00 -0.71 0.00 0.00 52.86 51.58 3dyo s ASN 945 Cb -0.13 -0.89 0.13 0.00 0.41 0.00 0.00 41.25 40.77 3dyo s ASN 945 CO 0.01 0.14 0.51 -0.47 -1.51 0.00 0.00 177.10 175.78 3dyo s TYR 946 N 0.22 -1.13 0.00 2.20 5.04 -0.57 -2.36 117.35 120.75 3dyo s TYR 946 Ca -0.10 1.63 0.00 0.00 -2.44 0.00 0.00 57.07 56.16 3dyo s TYR 946 Cb -0.14 0.44 0.00 0.00 0.35 0.00 0.00 41.96 42.60 3dyo s TYR 946 CO 0.04 -0.67 0.00 0.41 -1.34 0.00 0.00 175.55 173.99 3dyo n GLY 947 N 5.41 3.19 0.33 8.97 0.00 -1.26 -0.93 105.19 120.90 3dyo n GLY 947 Ca -0.07 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.79 3dyo n GLY 947 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dyo n PRO 948 N 13.93 1.43 -3.77 1.61 -0.04 -1.26 -4.89 135.00 142.02 3dyo n PRO 948 Ca 0.00 -0.65 -0.33 0.00 -0.04 0.00 0.00 63.50 62.49 3dyo n PRO 948 Cb 0.00 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.05 3dyo n PRO 948 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 3dyo s HIS 949 N -1.88 3.53 -0.05 0.54 3.76 -0.10 -2.14 115.29 118.95 3dyo s HIS 949 Ca 0.31 0.49 0.00 0.00 -0.15 0.00 0.00 55.06 55.72 3dyo s HIS 949 Cb 0.16 -1.94 0.02 0.00 1.11 0.00 0.00 32.58 31.93 3dyo s HIS 949 CO 0.25 0.55 -0.03 -1.14 -0.85 0.00 0.00 174.74 173.52 3dyo s GLN 950 N -2.23 0.74 -0.14 1.40 0.74 -0.01 -1.52 119.66 118.65 3dyo s GLN 950 Ca 0.34 -0.05 0.02 0.00 0.05 0.00 0.00 55.36 55.71 3dyo s GLN 950 Cb -0.13 -0.84 0.00 0.00 1.10 0.00 0.00 33.01 33.15 3dyo s GLN 950 CO 0.22 -0.13 -0.19 -1.58 -0.55 0.00 0.00 175.29 173.06 3dyo s TRP 951 N 1.14 2.71 0.18 1.67 0.51 0.26 -0.79 118.94 124.63 3dyo s TRP 951 Ca -0.08 -1.10 0.11 0.00 -2.12 0.00 0.00 56.10 52.91 3dyo s TRP 951 Cb -0.14 -1.83 -0.04 0.00 -0.81 0.00 0.00 33.47 30.65 3dyo s TRP 951 CO -0.01 -0.48 -0.23 1.03 -0.51 0.00 0.00 176.95 176.75 3dyo s ARG 952 N 0.69 1.44 0.00 4.98 0.52 -0.18 -1.17 118.95 125.23 3dyo s ARG 952 Ca -0.09 -1.47 0.00 0.00 -0.52 0.00 0.00 55.73 53.65 3dyo s ARG 952 Cb -0.16 -1.72 0.00 0.00 0.52 0.00 0.00 34.95 33.59 3dyo s ARG 952 CO 0.01 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.12 3dyo n GLY 953 N 0.35 -0.49 2.77 -3.53 0.00 -0.42 -1.30 105.19 102.57 3dyo n GLY 953 Ca -0.13 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 3dyo n GLY 953 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dyo s ASP 954 N -4.00 0.83 0.26 1.61 2.15 -1.24 -4.15 116.67 112.13 3dyo s ASP 954 Ca 0.00 -1.67 0.05 0.00 0.43 0.00 0.00 52.55 51.37 3dyo s ASP 954 Cb 0.00 0.67 -0.02 0.00 -0.30 0.00 0.00 42.92 43.26 3dyo s ASP 954 CO 0.00 -0.23 0.20 2.22 -0.17 0.00 0.00 175.17 177.18 3dyo n PHE 955 N 4.05 -0.49 -4.41 -5.34 1.16 -0.06 -4.87 117.46 107.50 3dyo n PHE 955 Ca 0.13 -2.08 -0.29 0.00 -1.87 0.00 0.00 57.45 53.34 3dyo n PHE 955 Cb 0.47 0.18 -0.12 0.00 -1.61 0.00 0.00 39.48 38.40 3dyo n PHE 955 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3dyo s GLN 956 N -3.04 1.62 0.11 3.97 -1.52 -0.24 -0.66 119.66 119.89 3dyo s GLN 956 Ca 0.28 -1.24 -0.12 0.00 -1.95 0.00 0.00 55.36 52.32 3dyo s GLN 956 Cb 0.01 -2.01 0.02 0.00 -0.22 0.00 0.00 33.01 30.81 3dyo s GLN 956 CO 0.20 0.47 0.30 -0.59 -0.25 0.00 0.00 175.29 175.41 3dyo s PHE 957 N -1.07 -0.03 0.05 0.91 -0.12 -0.25 0.46 117.98 117.94 3dyo s PHE 957 Ca 0.15 -0.34 0.01 0.00 -0.05 0.00 0.00 56.93 56.70 3dyo s PHE 957 Cb -0.10 0.10 -0.03 0.00 -0.63 0.00 0.00 43.02 42.36 3dyo s PHE 957 CO 0.07 -0.62 -0.06 0.54 -0.05 0.00 0.00 175.22 175.11 3dyo s ASN 958 N -2.82 0.69 -0.13 1.98 2.20 -0.04 -1.30 114.94 115.52 3dyo s ASN 958 Ca 0.04 -0.68 -0.06 0.00 -0.94 0.00 0.00 52.86 51.22 3dyo s ASN 958 Cb 0.03 0.08 0.06 0.00 -2.00 0.00 0.00 41.25 39.42 3dyo s ASN 958 CO -0.11 -0.33 0.31 -0.51 -2.94 0.00 0.00 177.10 173.51 3dyo s ILE 959 N -2.13 -0.13 0.18 0.54 2.07 -1.26 -1.49 121.20 118.98 3dyo s ILE 959 Ca -0.06 0.15 -0.19 0.00 -1.41 0.00 0.00 60.65 59.15 3dyo s ILE 959 Cb -0.05 -0.47 0.07 0.00 0.13 0.00 0.00 42.46 42.14 3dyo s ILE 959 CO -0.02 0.06 0.92 -1.54 -1.91 0.00 0.00 174.94 172.45 3dyo n SER 960 N 4.47 -1.60 -0.81 4.50 3.41 -0.72 -4.56 113.62 118.31 3dyo n SER 960 Ca -0.21 -1.86 0.08 0.00 -0.26 0.00 0.00 58.87 56.62 3dyo n SER 960 Cb 0.53 2.61 0.23 0.00 -0.26 0.00 0.00 64.21 67.32 3dyo n SER 960 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3dyo n ARG 961 N -0.64 2.02 -5.08 4.33 5.12 -1.26 0.32 116.66 121.46 3dyo n ARG 961 Ca -0.02 -1.58 -0.30 0.00 -1.93 0.00 0.00 57.85 54.02 3dyo n ARG 961 Cb 0.53 -1.37 -0.17 0.00 -1.16 0.00 0.00 32.46 30.29 3dyo n ARG 961 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3dyo s TYR 962 N -1.47 2.29 0.72 -1.55 1.51 -1.26 -0.06 117.35 117.53 3dyo s TYR 962 Ca 0.31 -0.88 -0.11 0.00 -1.01 0.00 0.00 57.07 55.38 3dyo s TYR 962 Cb 0.16 -1.54 0.03 0.00 -0.11 0.00 0.00 41.96 40.50 3dyo s TYR 962 CO 0.22 -0.36 1.07 -1.54 -1.11 0.00 0.00 175.55 173.84 3dyo s SER 963 N 0.33 5.10 0.29 2.29 1.04 -1.26 -4.82 113.70 116.67 3dyo s SER 963 Ca -0.16 1.57 -0.02 0.00 0.48 0.00 0.00 55.95 57.82 3dyo s SER 963 Cb -0.17 -2.41 0.42 0.00 0.10 0.00 0.00 66.02 63.96 3dyo s SER 963 CO 0.07 -1.62 1.95 1.56 0.98 0.00 0.00 173.24 176.18 3dyo h GLN 964 N -0.84 1.13 -0.24 4.02 1.08 -1.99 -1.77 115.11 116.50 3dyo h GLN 964 Ca -0.44 -0.07 0.03 0.00 -1.45 0.00 0.00 58.65 56.72 3dyo h GLN 964 Cb 1.22 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 28.37 3dyo h GLN 964 CO 0.57 0.75 0.05 0.37 -0.95 0.00 0.00 178.83 179.61 3dyo h GLN 965 N 1.16 0.14 -0.55 1.46 4.15 -1.99 -0.52 115.11 118.96 3dyo h GLN 965 Ca 0.34 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.75 3dyo h GLN 965 Cb -0.07 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 3dyo h GLN 965 CO -0.09 0.09 0.36 0.37 -1.93 0.00 0.00 178.83 177.64 3dyo h GLN 966 N 0.15 0.73 -0.99 1.69 4.15 -1.84 -0.95 115.11 118.05 3dyo h GLN 966 Ca 0.11 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.51 3dyo h GLN 966 Cb 0.10 -0.16 -0.06 0.00 0.21 0.00 0.00 27.48 27.57 3dyo h GLN 966 CO -0.14 0.49 0.65 -0.07 -1.93 0.00 0.00 178.83 177.83 3dyo h LEU 967 N 0.74 1.09 -0.09 -2.39 3.38 -0.85 -0.78 115.31 116.42 3dyo h LEU 967 Ca 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 3dyo h LEU 967 Cb -0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.42 3dyo h LEU 967 CO -0.04 0.76 -0.02 0.00 0.09 0.00 0.00 178.44 179.23 3dyo h MET 968 N 1.27 0.00 -0.02 1.13 -0.00 -0.53 -3.15 114.93 113.63 3dyo h MET 968 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.09 3dyo h MET 968 Cb -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.56 3dyo h MET 968 CO -0.11 0.02 -0.14 0.39 -0.00 0.00 0.00 176.91 177.07 3dyo n GLU 969 N -3.10 1.92 -4.33 -0.10 1.02 -0.41 -4.87 120.64 110.76 3dyo n GLU 969 Ca 0.04 -1.55 -0.34 0.00 -0.02 0.00 0.00 57.16 55.29 3dyo n GLU 969 Cb 0.52 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 30.34 3dyo n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyo s THR 970 N -2.14 3.25 -1.20 2.62 2.01 -0.35 -5.01 115.64 114.82 3dyo s THR 970 Ca 0.26 -0.56 0.24 0.00 0.31 0.00 0.00 61.69 61.94 3dyo s THR 970 Cb 0.20 -2.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 3dyo s THR 970 CO 0.38 0.48 1.27 -1.54 -0.69 0.00 0.00 174.62 174.52 3dyo n SER 971 N 4.11 0.84 -3.83 3.53 3.41 -1.26 -4.18 113.62 116.24 3dyo n SER 971 Ca -0.18 -0.66 -0.16 0.00 -0.26 0.00 0.00 58.87 57.61 3dyo n SER 971 Cb 0.52 0.46 -0.16 0.00 -0.26 0.00 0.00 64.21 64.77 3dyo n SER 971 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3dyo s HIS 972 N -2.88 0.25 0.49 7.33 3.76 -1.26 -4.32 115.29 118.67 3dyo s HIS 972 Ca 0.13 0.01 0.18 0.00 -0.15 0.00 0.00 55.06 55.24 3dyo s HIS 972 Cb 0.17 -0.33 1.22 0.00 1.11 0.00 0.00 32.58 34.75 3dyo s HIS 972 CO 0.71 -0.10 2.04 0.07 -0.85 0.00 0.00 174.74 176.61 3dyo h ARG 973 N 7.06 0.15 0.00 1.40 0.11 -1.43 -1.01 114.38 120.66 3dyo h ARG 973 Ca -0.41 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.66 3dyo h ARG 973 Cb 1.14 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.19 3dyo h ARG 973 CO 0.48 0.10 0.00 -2.39 0.10 0.00 0.00 179.97 178.26 3dyo n HIS 974 N -4.46 0.60 0.80 4.08 1.44 -1.26 -1.48 115.22 114.93 3dyo n HIS 974 Ca 0.06 0.25 0.12 0.00 -2.01 0.00 0.00 57.72 56.13 3dyo n HIS 974 Cb 0.36 -0.90 0.27 0.00 0.12 0.00 0.00 29.99 29.85 3dyo n HIS 974 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3dyo n LEU 975 N -2.06 2.67 -4.79 2.39 4.77 -0.38 -4.92 117.00 114.68 3dyo n LEU 975 Ca 0.02 -1.09 -0.34 0.00 -0.03 0.00 0.00 56.01 54.56 3dyo n LEU 975 Cb 0.18 -0.15 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3dyo n LEU 975 CO 0.16 0.55 0.74 -0.76 -1.33 0.00 0.00 177.39 176.75 3dyo s LEU 976 N -1.62 3.80 -0.04 2.23 1.43 -0.55 -5.05 118.68 118.89 3dyo s LEU 976 Ca 0.35 2.02 0.01 0.00 -1.03 0.00 0.00 54.13 55.49 3dyo s LEU 976 Cb 0.20 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.88 3dyo s LEU 976 CO 0.30 -0.96 -0.05 -1.38 0.23 0.00 0.00 176.35 174.49 3dyo s HIS 977 N -1.91 0.72 0.20 0.29 -3.43 -1.26 -5.11 115.29 104.79 3dyo s HIS 977 Ca 0.69 -0.19 -0.32 0.00 -0.80 0.00 0.00 55.06 54.44 3dyo s HIS 977 Cb -0.19 -0.62 -0.12 0.00 -1.43 0.00 0.00 32.58 30.21 3dyo s HIS 977 CO 0.23 -0.16 1.69 0.00 -2.00 0.00 0.00 174.74 174.50 3dyo n ALA 978 N 3.90 2.54 -1.94 -1.38 0.00 -1.26 -4.85 120.51 117.51 3dyo n ALA 978 Ca -0.24 0.41 -0.26 0.00 0.00 0.00 0.00 53.44 53.34 3dyo n ALA 978 Cb 0.51 -2.49 0.11 0.00 0.00 0.00 0.00 19.45 17.59 3dyo n ALA 978 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3dyo s GLU 979 N 1.12 1.62 0.41 0.00 2.02 0.91 -5.02 118.70 119.75 3dyo s GLU 979 Ca 0.76 -0.49 -0.25 0.00 0.02 0.00 0.00 54.97 55.01 3dyo s GLU 979 Cb -0.54 -2.11 -0.08 0.00 0.10 0.00 0.00 34.13 31.50 3dyo s GLU 979 CO 0.33 -1.64 1.16 -2.00 0.02 0.00 0.00 175.26 173.13 3dyo s GLU 980 N -5.42 4.02 1.75 1.61 2.12 -1.26 -4.78 118.70 116.74 3dyo s GLU 980 Ca 0.66 1.79 0.00 0.00 0.36 0.00 0.00 54.97 57.78 3dyo s GLU 980 Cb -0.07 -2.62 0.00 0.00 0.26 0.00 0.00 34.13 31.69 3dyo s GLU 980 CO 0.47 -0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 3dyo n GLY 981 N 0.57 -1.19 3.01 -1.50 0.00 -1.26 -4.83 105.19 99.99 3dyo n GLY 981 Ca 0.05 -1.14 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 3dyo n GLY 981 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyo s THR 982 N 0.00 1.26 -0.10 2.61 2.01 0.14 -4.73 115.64 116.84 3dyo s THR 982 Ca 0.00 -0.50 -0.23 0.00 0.31 0.00 0.00 61.69 61.27 3dyo s THR 982 Cb 0.00 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.29 3dyo s THR 982 CO 0.00 0.39 0.69 0.26 -0.69 0.00 0.00 174.62 175.28 3dyo s TRP 983 N 1.07 3.53 -0.16 4.92 0.52 0.15 -0.01 118.94 128.96 3dyo s TRP 983 Ca -0.06 1.19 0.00 0.00 0.02 0.00 0.00 56.10 57.25 3dyo s TRP 983 Cb -0.15 -2.81 0.00 0.00 -1.15 0.00 0.00 33.47 29.36 3dyo s TRP 983 CO -0.02 0.03 -0.15 -1.17 0.02 0.00 0.00 176.95 175.66 3dyo s LEU 984 N 1.07 2.46 -0.24 2.99 2.96 0.20 -1.76 118.68 126.36 3dyo s LEU 984 Ca 0.36 -0.48 -0.03 0.00 -0.22 0.00 0.00 54.13 53.76 3dyo s LEU 984 Cb -0.17 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 44.97 3dyo s LEU 984 CO 0.16 0.07 -0.05 0.20 -1.32 0.00 0.00 176.35 175.41 3dyo s ASN 985 N 0.90 4.34 -0.21 3.68 0.01 -0.56 -1.82 114.94 121.28 3dyo s ASN 985 Ca -0.04 -0.70 0.01 0.00 -0.71 0.00 0.00 52.86 51.42 3dyo s ASN 985 Cb -0.15 -1.70 0.03 0.00 0.41 0.00 0.00 41.25 39.84 3dyo s ASN 985 CO -0.02 -0.10 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.69 3dyo s ILE 986 N 1.39 2.24 -0.09 0.60 1.01 -0.36 -0.86 121.20 125.12 3dyo s ILE 986 Ca 0.02 -1.12 -0.01 0.00 0.00 0.00 0.00 60.65 59.55 3dyo s ILE 986 Cb -0.16 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 3dyo s ILE 986 CO -0.04 0.34 -0.05 -1.81 0.00 0.00 0.00 174.94 173.39 3dyo s ASP 987 N 1.25 4.77 0.16 3.58 1.01 0.17 -0.65 116.67 126.96 3dyo s ASP 987 Ca 0.01 -0.02 -0.01 0.00 0.71 0.00 0.00 52.55 53.23 3dyo s ASP 987 Cb -0.15 -1.37 -0.01 0.00 1.01 0.00 0.00 42.92 42.40 3dyo s ASP 987 CO -0.09 0.32 1.38 1.23 0.21 0.00 0.00 175.17 178.21 3dyo h GLY 988 N 5.59 0.38 -4.95 0.21 0.00 -0.76 -0.63 103.07 102.91 3dyo h GLY 988 Ca -0.45 -0.61 -0.17 0.00 0.00 0.00 0.00 47.33 46.10 3dyo h GLY 988 CO 0.55 0.54 -0.64 -1.36 0.00 0.00 0.00 176.54 175.64 3dyo s PHE 989 N -3.39 0.18 -0.04 5.60 0.40 -0.90 -4.66 117.98 115.17 3dyo s PHE 989 Ca -0.05 -0.38 -0.03 0.00 -0.60 0.00 0.00 56.93 55.88 3dyo s PHE 989 Cb 0.10 -0.14 0.02 0.00 0.51 0.00 0.00 43.02 43.51 3dyo s PHE 989 CO 0.84 -0.21 0.09 -1.58 0.70 0.00 0.00 175.22 175.06 3dyo s HIS 990 N -1.35 -0.09 0.63 0.36 2.46 -1.26 -1.16 115.29 114.88 3dyo s HIS 990 Ca -0.15 0.26 -0.16 0.00 0.47 0.00 0.00 55.06 55.48 3dyo s HIS 990 Cb -0.09 -0.02 -0.02 0.00 -0.13 0.00 0.00 32.58 32.33 3dyo s HIS 990 CO -0.00 -0.07 1.11 1.41 -2.47 0.00 0.00 174.74 174.72 3dyo s MET 991 N 0.37 2.96 1.01 2.88 1.75 -0.16 -4.75 119.30 123.36 3dyo s MET 991 Ca -0.03 1.43 -0.12 0.00 -1.25 0.00 0.00 55.69 55.73 3dyo s MET 991 Cb -0.04 -1.97 0.20 0.00 2.84 0.00 0.00 34.83 35.86 3dyo s MET 991 CO -0.01 -1.13 1.08 0.20 -0.65 0.00 0.00 175.02 174.51 3dyo s GLY 992 N -2.41 1.60 -0.01 2.11 0.00 -0.56 -4.73 107.32 103.33 3dyo s GLY 992 Ca 0.68 0.04 0.22 0.00 0.00 0.00 0.00 44.72 45.66 3dyo s GLY 992 CO 0.38 0.61 0.66 0.29 0.00 0.00 0.00 173.10 175.03 3dyo n ILE 993 N -4.38 0.02 -4.60 0.90 -5.35 -1.26 -4.95 119.36 99.74 3dyo n ILE 993 Ca 0.06 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 3dyo n ILE 993 Cb 0.54 0.32 0.00 0.00 -1.74 0.00 0.00 39.64 38.76 3dyo n ILE 993 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dyo n GLY 994 N 1.34 -0.14 0.00 3.28 0.00 -1.26 -4.74 105.19 103.67 3dyo n GLY 994 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.98 3dyo n GLY 994 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 995 N 0.00 -0.48 0.41 -0.02 0.00 -1.26 0.13 105.19 103.98 3dyo n GLY 995 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.23 3dyo n GLY 995 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dyo h ASP 996 N 0.00 0.24 -5.21 1.61 3.32 -1.80 -1.46 116.42 113.12 3dyo h ASP 996 Ca 0.00 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 3dyo h ASP 996 Cb 0.00 -0.02 -0.09 0.00 0.22 0.00 0.00 39.33 39.44 3dyo h ASP 996 CO 0.00 0.10 -0.09 1.51 -1.72 0.00 0.00 179.24 179.04 3dyo s ASP 997 N -5.79 -0.11 -0.21 6.45 1.47 -1.26 -4.17 116.67 113.04 3dyo s ASP 997 Ca -0.07 -0.86 0.11 0.00 1.18 0.00 0.00 52.55 52.91 3dyo s ASP 997 Cb 0.22 0.59 0.43 0.00 -0.34 0.00 0.00 42.92 43.81 3dyo s ASP 997 CO 0.77 -1.14 1.21 -1.20 0.68 0.00 0.00 175.17 175.50 3dyo n SER 998 N -0.37 2.16 0.00 2.11 7.64 -1.26 -4.65 113.62 119.24 3dyo n SER 998 Ca -0.03 -3.80 0.00 0.00 1.01 0.00 0.00 58.87 56.05 3dyo n SER 998 Cb 0.62 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 3dyo n SER 998 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 3dyo n TRP 999 N -0.99 0.00 -3.91 1.43 2.14 -1.26 -4.11 117.44 110.73 3dyo n TRP 999 Ca 0.22 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.69 3dyo n TRP 999 Cb 0.75 0.00 -0.10 0.00 -0.81 0.00 0.00 31.31 31.15 3dyo n TRP 999 CO 0.00 0.00 0.00 -1.54 2.07 0.00 0.00 177.69 178.22 3dyo s SER 1000N -0.22 0.13 -0.05 -0.67 1.04 -1.26 -4.39 113.70 108.27 3dyo s SER 1000Ca 0.00 -0.42 -0.38 0.00 0.48 0.00 0.00 55.95 55.63 3dyo s SER 1000Cb 0.00 0.21 -0.16 0.00 0.10 0.00 0.00 66.02 66.17 3dyo s SER 1000CO 0.00 -0.45 1.50 -2.65 0.98 0.00 0.00 173.24 172.62 3dyo n PRO 1001N 1.04 1.17 0.00 4.02 -0.02 -1.26 -4.79 135.00 135.16 3dyo n PRO 1001Ca -0.21 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 3dyo n PRO 1001Cb 0.57 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 3dyo n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyo n SER 1002N 3.68 1.10 -4.66 2.55 3.41 -1.26 -5.02 113.62 113.43 3dyo n SER 1002Ca 0.22 -1.48 -0.42 0.00 -0.26 0.00 0.00 58.87 56.92 3dyo n SER 1002Cb 0.17 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 3dyo n SER 1002CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3dyo s VAL 1003N -0.48 4.77 0.67 -3.33 1.01 -1.26 -4.38 120.40 117.40 3dyo s VAL 1003Ca 0.00 1.82 -0.16 0.00 0.00 0.00 0.00 61.98 63.63 3dyo s VAL 1003Cb 0.00 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.17 3dyo s VAL 1003CO 0.00 -0.10 1.20 -0.55 0.00 0.00 0.00 175.10 175.65 3dyo s SER 1004N 1.24 4.67 0.29 3.32 0.15 -1.26 -4.84 113.70 117.26 3dyo s SER 1004Ca 0.40 2.33 0.02 0.00 0.70 0.00 0.00 55.95 59.41 3dyo s SER 1004Cb -0.16 -2.59 0.60 0.00 -1.71 0.00 0.00 66.02 62.17 3dyo s SER 1004CO 0.08 -1.94 1.82 0.00 1.20 0.00 0.00 173.24 174.40 3dyo h ALA 1005N 0.18 1.55 0.00 5.45 0.00 -1.96 -0.14 119.26 124.34 3dyo h ALA 1005Ca -0.49 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3dyo h ALA 1005Cb 1.29 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3dyo h ALA 1005CO 0.52 0.15 0.00 -0.85 0.00 0.00 0.00 179.25 179.07 3dyo n GLU 1006N -4.66 0.16 -0.26 0.00 0.00 -1.26 -0.79 120.64 113.83 3dyo n GLU 1006Ca 0.20 0.54 0.07 0.00 0.00 0.00 0.00 57.16 57.97 3dyo n GLU 1006Cb 0.42 -1.91 0.20 0.00 0.00 0.00 0.00 31.44 30.14 3dyo n GLU 1006CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3dyo n PHE 1007N -2.24 0.65 -3.67 -1.84 3.01 -0.08 -4.98 117.46 108.31 3dyo n PHE 1007Ca 0.00 -0.56 -0.32 0.00 1.01 0.00 0.00 57.45 57.57 3dyo n PHE 1007Cb 0.13 -0.08 -0.05 0.00 -0.01 0.00 0.00 39.48 39.47 3dyo n PHE 1007CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3dyo s GLN 1008N -1.33 3.64 -1.23 -1.08 -0.21 0.03 -1.50 119.66 117.99 3dyo s GLN 1008Ca 0.30 -0.04 -0.13 0.00 0.02 0.00 0.00 55.36 55.51 3dyo s GLN 1008Cb 0.18 -2.91 0.17 0.00 1.00 0.00 0.00 33.01 31.45 3dyo s GLN 1008CO 0.17 0.51 1.53 1.28 -2.12 0.00 0.00 175.29 176.66 3dyo n LEU 1009N 0.39 5.49 -0.52 2.90 4.77 -1.26 -4.68 117.00 124.09 3dyo n LEU 1009Ca -0.05 -4.49 0.05 0.00 -0.03 0.00 0.00 56.01 51.49 3dyo n LEU 1009Cb 0.52 -1.60 0.12 0.00 -2.33 0.00 0.00 43.42 40.13 3dyo n LEU 1009CO 0.46 0.84 0.59 -1.54 -1.33 0.00 0.00 177.39 176.41 3dyo n SER 1010N 5.35 2.68 0.30 -1.43 3.41 -1.26 -4.33 113.62 118.33 3dyo n SER 1010Ca 0.38 -1.94 0.18 0.00 -0.26 0.00 0.00 58.87 57.24 3dyo n SER 1010Cb 0.41 -0.18 1.01 0.00 -0.26 0.00 0.00 64.21 65.20 3dyo n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo h ALA 1011N 1.73 1.37 0.00 7.33 0.00 -1.98 -3.47 119.26 124.24 3dyo h ALA 1011Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyo h ALA 1011Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3dyo h ALA 1011CO 0.00 -0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.57 3dyo n GLY 1012N -1.24 1.84 3.20 0.00 0.00 -1.26 -4.89 105.19 102.84 3dyo n GLY 1012Ca -0.02 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 3dyo n GLY 1012CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dyo s ARG 1013N 0.00 2.92 0.04 1.61 0.52 -1.26 0.01 118.95 122.78 3dyo s ARG 1013Ca 0.00 -0.83 0.06 0.00 -0.52 0.00 0.00 55.73 54.44 3dyo s ARG 1013Cb 0.00 -2.21 -0.02 0.00 0.52 0.00 0.00 34.95 33.23 3dyo s ARG 1013CO 0.00 0.16 -0.17 0.71 0.02 0.00 0.00 175.30 176.02 3dyo s TYR 1014N 0.38 1.52 -0.03 -0.53 1.51 0.47 -4.98 117.35 115.68 3dyo s TYR 1014Ca -0.18 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.54 3dyo s TYR 1014Cb -0.18 -0.90 0.01 0.00 -0.11 0.00 0.00 41.96 40.78 3dyo s TYR 1014CO 0.08 0.06 -0.08 -1.58 -1.11 0.00 0.00 175.55 172.92 3dyo s HIS 1015N -0.81 0.93 0.18 2.71 5.65 -1.26 -0.79 115.29 121.91 3dyo s HIS 1015Ca 0.05 -0.25 -0.12 0.00 0.25 0.00 0.00 55.06 54.99 3dyo s HIS 1015Cb -0.08 -0.69 0.01 0.00 -1.18 0.00 0.00 32.58 30.63 3dyo s HIS 1015CO 0.01 -0.12 0.38 1.52 -0.65 0.00 0.00 174.74 175.88 3dyo s TYR 1016N 0.33 0.19 -0.08 3.88 -0.85 -0.24 -5.00 117.35 115.58 3dyo s TYR 1016Ca -0.05 -0.54 -0.15 0.00 -0.52 0.00 0.00 57.07 55.81 3dyo s TYR 1016Cb -0.10 0.13 0.03 0.00 0.38 0.00 0.00 41.96 42.40 3dyo s TYR 1016CO 0.01 -0.80 0.35 -0.65 -1.52 0.00 0.00 175.55 172.94 3dyo s GLN 1017N -3.93 0.57 0.09 -3.49 -0.21 -1.26 0.20 119.66 111.63 3dyo s GLN 1017Ca 0.14 0.17 0.01 0.00 0.02 0.00 0.00 55.36 55.70 3dyo s GLN 1017Cb 0.02 0.26 -0.04 0.00 1.00 0.00 0.00 33.01 34.25 3dyo s GLN 1017CO -0.01 -0.13 -0.06 -0.51 -2.12 0.00 0.00 175.29 172.46 3dyo s LEU 1018N -0.59 2.49 -0.09 2.90 1.43 0.71 -4.31 118.68 121.21 3dyo s LEU 1018Ca -0.07 -0.97 0.03 0.00 -1.03 0.00 0.00 54.13 52.09 3dyo s LEU 1018Cb -0.04 -0.04 0.01 0.00 0.03 0.00 0.00 46.19 46.16 3dyo s LEU 1018CO 0.03 -0.47 -0.18 -0.69 0.23 0.00 0.00 176.35 175.27 3dyo s VAL 1019N -3.50 1.62 -0.20 -1.59 1.01 -0.42 -0.29 120.40 117.04 3dyo s VAL 1019Ca 0.09 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 3dyo s VAL 1019Cb 0.05 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 3dyo s VAL 1019CO -0.05 0.46 -0.04 0.86 0.00 0.00 0.00 175.10 176.33 3dyo s TRP 1020N 0.64 2.96 0.05 5.22 -0.11 0.08 -1.01 118.94 126.76 3dyo s TRP 1020Ca -0.14 -0.77 0.00 0.00 1.22 0.00 0.00 56.10 56.41 3dyo s TRP 1020Cb -0.16 -2.06 -0.03 0.00 -1.50 0.00 0.00 33.47 29.71 3dyo s TRP 1020CO 0.04 -0.42 -0.04 0.00 -4.62 0.00 0.00 176.95 171.90 3dyo n GLN 1022N 0.76 2.12 0.00 0.00 3.00 -1.26 -0.83 117.38 121.16 3dyo n GLN 1022Ca -0.18 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 56.96 3dyo n GLN 1022Cb 0.58 0.00 0.90 0.00 0.00 0.00 0.00 30.24 31.73 3dyo n GLN 1022CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69