#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 -2.55 0.31 5.56 1.74 -1.26 -4.79 116.66 115.67 3dyo n ARG 14 Ca 0.00 0.42 0.18 0.00 -0.77 0.00 0.00 57.85 57.67 3dyo n ARG 14 Cb 0.00 -4.33 1.02 0.00 -1.02 0.00 0.00 32.46 28.13 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 -1.90 0.00 -0.04 0.55 3.32 -1.95 -1.27 116.42 115.14 3dyo h ASP 15 Ca -0.65 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.40 3dyo h ASP 15 Cb 1.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.92 3dyo h ASP 15 CO 0.57 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 175.42 3dyo n TRP 16 N -3.57 0.05 -2.31 4.55 2.14 -1.26 -2.81 117.44 114.23 3dyo n TRP 16 Ca -0.03 -0.02 -0.09 0.00 2.07 0.00 0.00 57.50 59.43 3dyo n TRP 16 Cb 0.08 0.00 0.05 0.00 -0.81 0.00 0.00 31.31 30.64 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 -0.44 2.35 -3.29 -2.67 1.02 -0.48 -0.75 120.64 116.38 3dyo n GLU 17 Ca 0.04 -3.62 -0.06 0.00 -0.02 0.00 0.00 57.16 53.51 3dyo n GLU 17 Cb 0.05 -1.74 -0.06 0.00 -0.02 0.00 0.00 31.44 29.67 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 -3.47 -0.15 0.25 1.62 2.47 -1.12 -4.75 114.94 109.78 3dyo s ASN 18 Ca 0.39 0.21 0.22 0.00 0.42 0.00 0.00 52.86 54.10 3dyo s ASN 18 Cb 0.37 1.37 0.97 0.00 -1.45 0.00 0.00 41.25 42.51 3dyo s ASN 18 CO -0.02 -0.30 1.66 -0.81 -3.72 0.00 0.00 177.10 173.91 3dyo n PRO 19 N 5.38 0.16 0.14 0.43 -0.04 -1.26 -0.60 135.00 139.21 3dyo n PRO 19 Ca -0.02 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 3dyo n PRO 19 Cb 0.50 -1.86 0.39 0.00 -0.04 0.00 0.00 33.50 32.50 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 1.71 0.00 -7.86 0.55 0.00 -1.92 -3.40 103.07 92.15 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 -0.80 0.14 0.00 0.00 0.00 176.54 175.88 3dyo s VAL 21 N -3.17 2.18 -1.02 4.60 1.01 0.23 -4.92 120.40 119.31 3dyo s VAL 21 Ca 0.09 -1.66 0.12 0.00 0.00 0.00 0.00 61.98 60.53 3dyo s VAL 21 Cb 0.11 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 3dyo s VAL 21 CO 0.58 -0.05 0.68 0.35 0.00 0.00 0.00 175.10 176.65 3dyo n THR 22 N 4.43 0.00 -3.62 3.92 -2.24 -1.26 -4.78 114.28 110.72 3dyo n THR 22 Ca -0.13 -0.35 -0.02 0.00 -2.27 0.00 0.00 64.05 61.28 3dyo n THR 22 Cb 0.42 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.75 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 -1.66 0.13 -0.02 -0.78 1.03 -1.26 -1.74 119.66 115.35 3dyo s GLN 23 Ca 0.09 -0.05 0.00 0.00 0.04 0.00 0.00 55.36 55.44 3dyo s GLN 23 Cb 0.10 0.06 0.03 0.00 0.03 0.00 0.00 33.01 33.22 3dyo s GLN 23 CO 0.34 -0.06 0.02 -0.51 -2.54 0.00 0.00 175.29 172.54 3dyo s LEU 24 N -2.15 1.10 -2.14 2.60 1.43 -0.39 -4.86 118.68 114.28 3dyo s LEU 24 Ca 0.11 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 3dyo s LEU 24 Cb -0.00 -0.13 0.00 0.00 0.03 0.00 0.00 46.19 46.09 3dyo s LEU 24 CO -0.03 -0.12 0.00 0.59 0.23 0.00 0.00 176.35 177.02 3dyo n ASN 25 N 4.18 -5.33 -4.77 2.29 3.02 -1.26 -1.76 115.26 111.62 3dyo n ASN 25 Ca -0.27 0.50 -0.38 0.00 -0.03 0.00 0.00 54.58 54.40 3dyo n ASN 25 Cb 0.50 -4.72 -0.06 0.00 -0.61 0.00 0.00 39.78 34.89 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 -3.71 4.65 0.60 3.52 3.52 -1.26 -4.63 118.95 121.65 3dyo s ARG 26 Ca 0.00 1.42 -0.13 0.00 -0.13 0.00 0.00 55.73 56.89 3dyo s ARG 26 Cb 0.00 -2.96 -0.04 0.00 -1.56 0.00 0.00 34.95 30.39 3dyo s ARG 26 CO 0.00 0.33 1.03 -0.51 -0.81 0.00 0.00 175.30 175.34 3dyo s LEU 27 N -1.77 3.34 0.76 -0.88 1.43 0.49 -5.00 118.68 117.06 3dyo s LEU 27 Ca 0.47 1.53 -0.15 0.00 -1.03 0.00 0.00 54.13 54.96 3dyo s LEU 27 Cb -0.22 -4.49 0.06 0.00 0.03 0.00 0.00 46.19 41.57 3dyo s LEU 27 CO 0.28 -0.92 1.23 0.00 0.23 0.00 0.00 176.35 177.17 3dyo n ALA 28 N -2.43 0.34 -1.78 4.21 0.00 -1.26 -4.67 120.51 114.91 3dyo n ALA 28 Ca 0.07 -0.23 -0.32 0.00 0.00 0.00 0.00 53.44 52.96 3dyo n ALA 28 Cb 0.54 -2.27 -0.00 0.00 0.00 0.00 0.00 19.45 17.71 3dyo n ALA 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyo s ALA 29 N -1.90 2.97 0.07 0.00 0.00 -1.26 -4.99 121.76 116.65 3dyo s ALA 29 Ca 0.76 0.12 -0.27 0.00 0.00 0.00 0.00 51.96 52.57 3dyo s ALA 29 Cb -0.32 -3.13 0.09 0.00 0.00 0.00 0.00 23.12 19.76 3dyo s ALA 29 CO 0.47 -0.60 1.13 -3.38 0.00 0.00 0.00 175.76 173.39 3dyo s HIS 30 N -2.82 -0.06 0.81 0.00 -3.43 -1.26 -4.89 115.29 103.64 3dyo s HIS 30 Ca 0.58 -0.15 -0.12 0.00 -0.80 0.00 0.00 55.06 54.58 3dyo s HIS 30 Cb -0.12 0.60 0.07 0.00 -1.43 0.00 0.00 32.58 31.71 3dyo s HIS 30 CO 0.42 -0.56 1.10 -2.14 -2.00 0.00 0.00 174.74 171.56 3dyo s PRO 31 N -2.73 2.01 0.03 -0.38 0.02 -1.15 -4.30 135.00 128.51 3dyo s PRO 31 Ca 0.15 0.61 -0.36 0.00 0.02 0.00 0.00 61.00 61.42 3dyo s PRO 31 Cb 0.01 -1.91 -0.15 0.00 0.02 0.00 0.00 34.50 32.47 3dyo s PRO 31 CO -0.00 -1.66 1.54 -2.30 -0.33 0.00 0.00 177.00 174.25 3dyo n PRO 32 N -3.46 1.59 -4.44 5.54 -0.02 -1.26 -4.97 135.00 127.98 3dyo n PRO 32 Ca 0.07 0.57 -0.25 0.00 -2.02 0.00 0.00 63.50 61.87 3dyo n PRO 32 Cb 0.56 -2.29 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 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 1.52 2.32 0.00 6.00 2.99 -1.26 -4.80 117.98 124.75 3dyo s PHE 33 Ca 0.86 -0.33 0.00 0.00 0.00 0.00 0.00 56.93 57.45 3dyo s PHE 33 Cb -0.85 -1.07 0.00 0.00 0.00 0.00 0.00 43.02 41.10 3dyo s PHE 33 CO 0.47 0.62 0.00 0.00 -0.00 0.00 0.00 175.22 176.31 3dyo n ALA 34 N -0.23 0.00 -3.86 5.36 0.00 -1.26 -5.04 120.51 115.48 3dyo n ALA 34 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.98 3dyo n ALA 34 Cb 0.58 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.06 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 0.00 -4.50 -4.80 0.00 2.88 -1.26 -4.24 113.62 101.70 3dyo n SER 35 Ca 0.00 -1.13 -0.34 0.00 -1.33 0.00 0.00 58.87 56.07 3dyo n SER 35 Cb 0.04 -2.67 -0.04 0.00 -0.75 0.00 0.00 64.21 60.78 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 -3.53 3.09 -0.36 0.66 0.51 -0.40 -4.58 118.94 114.33 3dyo s TRP 36 Ca 0.45 1.59 0.15 0.00 -2.12 0.00 0.00 56.10 56.17 3dyo s TRP 36 Cb -0.20 -3.03 0.42 0.00 -0.81 0.00 0.00 33.47 29.85 3dyo s TRP 36 CO 0.91 -0.66 1.33 0.54 -0.51 0.00 0.00 176.95 178.56 3dyo n ARG 37 N -0.77 2.76 -3.70 4.98 5.12 -1.26 -0.12 116.66 123.67 3dyo n ARG 37 Ca 0.08 -2.55 -0.16 0.00 -1.93 0.00 0.00 57.85 53.30 3dyo n ARG 37 Cb 0.52 -1.62 -0.15 0.00 -1.16 0.00 0.00 32.46 30.05 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 -1.73 0.44 0.36 0.55 3.84 -1.26 -4.97 114.94 112.17 3dyo s ASN 38 Ca 0.34 0.28 0.05 0.00 0.21 0.00 0.00 52.86 53.75 3dyo s ASN 38 Cb 0.26 0.19 0.70 0.00 -0.55 0.00 0.00 41.25 41.85 3dyo s ASN 38 CO 0.10 -0.20 1.95 0.28 -2.79 0.00 0.00 177.10 176.43 3dyo h SER 39 N 7.92 0.50 -0.43 -4.21 0.02 -1.98 -2.41 113.55 112.96 3dyo h SER 39 Ca -0.25 -0.06 -0.13 0.00 -0.84 0.00 0.00 61.79 60.51 3dyo h SER 39 Cb 1.12 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 3dyo h SER 39 CO 0.26 0.48 -0.22 -0.33 -1.14 0.00 0.00 176.83 175.88 3dyo h GLU 40 N 0.55 0.94 -0.73 3.45 4.39 -1.98 0.69 114.58 121.88 3dyo h GLU 40 Ca 0.13 -0.39 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 3dyo h GLU 40 Cb 0.15 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 3dyo h GLU 40 CO -0.01 1.06 0.29 0.93 -1.16 0.00 0.00 179.01 180.11 3dyo h GLU 41 N 0.81 1.09 -0.39 2.33 5.08 -1.87 0.41 114.58 122.05 3dyo h GLU 41 Ca 0.11 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3dyo h GLU 41 Cb 0.78 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3dyo h GLU 41 CO 0.06 0.89 0.21 0.00 -1.00 0.00 0.00 179.01 179.17 3dyo h ALA 42 N 1.25 0.50 -0.59 3.43 0.00 -0.99 0.28 119.26 123.14 3dyo h ALA 42 Ca 0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3dyo h ALA 42 Cb 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3dyo h ALA 42 CO -0.02 0.03 0.34 -0.09 0.00 0.00 0.00 179.25 179.51 3dyo h ARG 43 N 0.49 0.81 -0.13 0.00 2.43 -0.52 -2.87 114.38 114.59 3dyo h ARG 43 Ca 0.14 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3dyo h ARG 43 Cb 0.07 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3dyo h ARG 43 CO -0.02 0.60 0.00 0.25 -1.51 0.00 0.00 179.97 179.29 3dyo n THR 44 N -4.60 0.15 -2.15 0.20 -2.24 0.11 -4.93 114.28 100.82 3dyo n THR 44 Ca 0.04 -0.37 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 3dyo n THR 44 Cb 0.07 0.57 -0.01 0.00 -2.10 0.00 0.00 70.33 68.86 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 0.48 -3.93 -4.81 3.42 2.03 -0.01 -5.00 116.55 108.74 3dyo n ASP 45 Ca 0.17 0.02 -0.29 0.00 0.52 0.00 0.00 54.79 55.21 3dyo n ASP 45 Cb 0.39 -3.08 0.12 0.00 -0.72 0.00 0.00 41.12 37.83 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 -4.45 1.48 0.84 -0.67 0.52 -0.63 -5.00 118.95 111.04 3dyo s ARG 46 Ca 0.00 0.32 -0.12 0.00 -0.52 0.00 0.00 55.73 55.41 3dyo s ARG 46 Cb 0.00 -1.88 0.10 0.00 0.52 0.00 0.00 34.95 33.69 3dyo s ARG 46 CO 0.00 -1.97 1.15 -2.30 0.02 0.00 0.00 175.30 172.20 3dyo n PRO 47 N -3.62 -0.00 -4.83 3.54 -0.02 -1.26 -4.88 135.00 123.94 3dyo n PRO 47 Ca 0.07 0.08 -0.33 0.00 -2.02 0.00 0.00 63.50 61.30 3dyo n PRO 47 Cb 0.59 -2.40 -0.16 0.00 -0.02 0.00 0.00 33.50 31.51 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 -2.24 3.36 0.56 2.55 0.15 -1.26 -4.98 113.70 111.84 3dyo s SER 48 Ca 0.71 -0.52 0.37 0.00 0.70 0.00 0.00 55.95 57.21 3dyo s SER 48 Cb -0.27 -1.48 1.85 0.00 -1.71 0.00 0.00 66.02 64.40 3dyo s SER 48 CO 0.53 0.12 2.12 -0.61 1.20 0.00 0.00 173.24 176.60 3dyo h GLN 49 N 7.04 0.00 -0.02 5.44 5.75 -1.91 -1.81 115.11 129.59 3dyo h GLN 49 Ca -0.27 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.23 3dyo h GLN 49 Cb 1.21 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.76 3dyo h GLN 49 CO 0.53 0.00 0.00 1.04 -2.65 0.00 0.00 178.83 177.75 3dyo n GLN 50 N -2.92 1.40 -3.86 1.69 3.00 -1.26 -4.60 117.38 110.82 3dyo n GLN 50 Ca -0.01 -0.59 -0.30 0.00 -0.01 0.00 0.00 57.00 56.09 3dyo n GLN 50 Cb 0.15 -1.47 -0.15 0.00 0.00 0.00 0.00 30.24 28.77 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 -1.93 2.57 0.03 1.08 2.96 -0.68 -0.25 118.68 122.46 3dyo s LEU 51 Ca 0.40 -1.40 0.02 0.00 -0.22 0.00 0.00 54.13 52.93 3dyo s LEU 51 Cb 0.20 -1.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.79 3dyo s LEU 51 CO 0.33 -0.32 0.04 -0.13 -1.32 0.00 0.00 176.35 174.95 3dyo s ARG 52 N 1.46 2.83 0.03 1.98 0.52 -0.52 -4.68 118.95 120.57 3dyo s ARG 52 Ca 0.02 -0.64 -0.08 0.00 -0.52 0.00 0.00 55.73 54.51 3dyo s ARG 52 Cb -0.18 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.53 3dyo s ARG 52 CO -0.12 0.60 0.32 0.45 0.02 0.00 0.00 175.30 176.57 3dyo s SER 53 N -1.89 6.56 0.00 0.23 0.15 -1.26 -1.31 113.70 116.17 3dyo s SER 53 Ca 0.23 0.65 0.11 0.00 0.70 0.00 0.00 55.95 57.65 3dyo s SER 53 Cb -0.12 -2.13 0.29 0.00 -1.71 0.00 0.00 66.02 62.36 3dyo s SER 53 CO 0.15 0.23 1.22 0.18 1.20 0.00 0.00 173.24 176.21 3dyo n LEU 54 N 1.08 2.84 -4.76 3.45 4.77 0.48 -4.93 117.00 119.93 3dyo n LEU 54 Ca -0.10 -1.89 -0.35 0.00 -0.03 0.00 0.00 56.01 53.64 3dyo n LEU 54 Cb 0.53 -0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.43 3dyo n LEU 54 CO 0.41 0.70 0.81 0.20 -1.33 0.00 0.00 177.39 178.18 3dyo s ASN 55 N -0.99 5.28 0.00 -1.43 0.01 -1.24 -4.81 114.94 111.76 3dyo s ASN 55 Ca 0.23 2.28 0.00 0.00 -0.71 0.00 0.00 52.86 54.66 3dyo s ASN 55 Cb 0.12 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.19 3dyo s ASN 55 CO 0.16 -1.52 0.00 0.61 -1.51 0.00 0.00 177.10 174.84 3dyo n GLY 56 N 0.29 0.38 3.70 0.66 0.00 -0.09 -5.00 105.19 105.14 3dyo n GLY 56 Ca 0.13 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.00 4.34 0.37 1.61 2.02 -1.26 -0.28 118.70 123.50 3dyo s GLU 57 Ca 0.00 0.64 0.04 0.00 0.02 0.00 0.00 54.97 55.67 3dyo s GLU 57 Cb 0.00 -3.48 -0.06 0.00 0.10 0.00 0.00 34.13 30.70 3dyo s GLU 57 CO 0.00 0.02 0.06 -1.58 0.02 0.00 0.00 175.26 173.78 3dyo s TRP 58 N 1.02 2.02 -0.11 1.61 0.52 0.11 -4.93 118.94 119.18 3dyo s TRP 58 Ca 0.30 -0.97 -0.08 0.00 0.02 0.00 0.00 56.10 55.38 3dyo s TRP 58 Cb -0.16 -1.37 -0.04 0.00 -1.15 0.00 0.00 33.47 30.74 3dyo s TRP 58 CO 0.13 0.05 0.17 1.03 0.02 0.00 0.00 176.95 178.35 3dyo s ARG 59 N -3.83 3.51 -0.05 4.98 1.81 -0.39 0.25 118.95 125.22 3dyo s ARG 59 Ca 0.31 -0.07 -0.04 0.00 -1.72 0.00 0.00 55.73 54.22 3dyo s ARG 59 Cb 0.07 -3.20 0.02 0.00 -0.45 0.00 0.00 34.95 31.39 3dyo s ARG 59 CO 0.15 0.76 0.13 0.12 -0.68 0.00 0.00 175.30 175.77 3dyo s PHE 60 N -1.00 -0.14 -0.01 -0.53 5.36 0.15 0.03 117.98 121.83 3dyo s PHE 60 Ca 0.16 0.37 0.01 0.00 -0.96 0.00 0.00 56.93 56.51 3dyo s PHE 60 Cb -0.13 0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.58 3dyo s PHE 60 CO 0.05 -0.09 -0.02 0.00 -1.46 0.00 0.00 175.22 173.70 3dyo s ALA 61 N 0.35 0.31 -0.10 11.12 0.00 -0.57 -0.68 121.76 132.19 3dyo s ALA 61 Ca -0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 51.96 51.83 3dyo s ALA 61 Cb -0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 3dyo s ALA 61 CO -0.01 0.02 0.19 -0.46 0.00 0.00 0.00 175.76 175.49 3dyo s TRP 62 N 0.36 3.62 0.06 0.00 -0.00 -1.26 -0.54 118.94 121.18 3dyo s TRP 62 Ca -0.04 0.61 0.03 0.00 -0.00 0.00 0.00 56.10 56.70 3dyo s TRP 62 Cb -0.06 -2.00 -0.03 0.00 -0.00 0.00 0.00 33.47 31.38 3dyo s TRP 62 CO -0.01 0.72 -0.08 -0.06 -0.00 0.00 0.00 176.95 177.52 3dyo s PHE 63 N -1.05 0.81 -0.53 5.86 0.40 -0.05 -4.98 117.98 118.44 3dyo s PHE 63 Ca 0.17 -0.60 0.26 0.00 -0.60 0.00 0.00 56.93 56.16 3dyo s PHE 63 Cb -0.13 -0.47 0.83 0.00 0.51 0.00 0.00 43.02 43.76 3dyo s PHE 63 CO 0.06 -0.07 1.75 -1.00 0.70 0.00 0.00 175.22 176.66 3dyo h PRO 64 N 4.06 0.00 -2.03 0.24 0.13 -1.86 0.52 132.00 133.07 3dyo h PRO 64 Ca -0.36 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.80 3dyo h PRO 64 Cb 1.19 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.13 3dyo h PRO 64 CO 0.47 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.62 3dyo s ALA 65 N -3.24 -1.82 0.45 -0.56 0.00 -1.23 -0.60 121.76 114.77 3dyo s ALA 65 Ca 0.07 1.25 0.11 0.00 0.00 0.00 0.00 51.96 53.39 3dyo s ALA 65 Cb 0.10 -0.05 1.03 0.00 0.00 0.00 0.00 23.12 24.20 3dyo s ALA 65 CO 0.55 -0.46 2.08 -1.00 0.00 0.00 0.00 175.76 176.93 3dyo h PRO 66 N 2.52 0.33 0.00 0.00 0.13 -1.87 -1.51 132.00 131.60 3dyo h PRO 66 Ca -0.24 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3dyo h PRO 66 Cb 1.19 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3dyo h PRO 66 CO 0.34 0.22 0.00 0.93 -0.23 0.00 0.00 178.00 179.26 3dyo h GLU 67 N 0.34 0.00 -0.01 0.86 3.07 -1.94 -2.50 114.58 114.39 3dyo h GLU 67 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3dyo h GLU 67 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3dyo h GLU 67 CO -0.03 0.00 -0.02 0.00 -1.40 0.00 0.00 179.01 177.56 3dyo n ALA 68 N -2.01 2.63 -2.65 3.43 0.00 -0.57 -4.90 120.51 116.45 3dyo n ALA 68 Ca -0.01 -0.41 -0.42 0.00 0.00 0.00 0.00 53.44 52.60 3dyo n ALA 68 Cb 0.16 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 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 -2.05 4.70 0.22 0.00 1.01 -0.94 -5.00 120.40 118.33 3dyo s VAL 69 Ca 0.38 1.95 -0.30 0.00 0.00 0.00 0.00 61.98 64.01 3dyo s VAL 69 Cb 0.21 -4.25 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 3dyo s VAL 69 CO 0.36 0.10 1.15 -2.84 0.00 0.00 0.00 175.10 173.88 3dyo s PRO 70 N 1.35 4.55 0.48 2.72 0.02 -1.26 -4.92 135.00 137.94 3dyo s PRO 70 Ca 0.52 1.84 0.15 0.00 0.02 0.00 0.00 61.00 63.53 3dyo s PRO 70 Cb -0.22 -3.22 1.15 0.00 0.02 0.00 0.00 34.50 32.23 3dyo s PRO 70 CO 0.25 0.03 2.09 1.05 -0.33 0.00 0.00 177.00 180.09 3dyo h GLU 71 N 4.69 0.19 -0.79 5.54 9.09 -1.99 -1.43 114.58 129.88 3dyo h GLU 71 Ca -0.45 -0.01 0.20 0.00 0.05 0.00 0.00 59.36 59.15 3dyo h GLU 71 Cb 1.21 -0.04 -0.04 0.00 -1.65 0.00 0.00 28.75 28.23 3dyo h GLU 71 CO 0.71 0.13 0.55 0.66 0.05 0.00 0.00 179.01 181.11 3dyo h SER 72 N 0.20 0.17 -0.86 3.06 4.64 -1.93 -0.08 113.55 118.75 3dyo h SER 72 Ca 0.11 0.02 0.19 0.00 -0.47 0.00 0.00 61.79 61.63 3dyo h SER 72 Cb 0.18 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.19 3dyo h SER 72 CO -0.02 0.07 0.57 -0.25 -0.87 0.00 0.00 176.83 176.34 3dyo h TRP 73 N 0.18 0.50 0.00 4.77 7.01 -1.42 0.42 115.95 127.41 3dyo h TRP 73 Ca 0.39 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.35 3dyo h TRP 73 Cb 1.27 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 28.16 3dyo h TRP 73 CO -0.00 0.15 -0.26 -0.07 -2.79 0.00 0.00 178.44 175.47 3dyo h LEU 74 N 0.39 0.00 0.00 0.65 3.38 -1.20 -3.18 115.31 115.35 3dyo h LEU 74 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 3dyo h LEU 74 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3dyo h LEU 74 CO -0.15 0.26 -1.29 -0.62 0.09 0.00 0.00 178.44 176.72 3dyo n GLU 75 N -3.94 1.14 -3.69 1.13 -0.58 -0.14 -3.52 120.64 111.04 3dyo n GLU 75 Ca -0.02 -0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.51 3dyo n GLU 75 Cb 0.33 -1.29 -0.07 0.00 -0.57 0.00 0.00 31.44 29.85 3dyo n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dyo s ASP 77 N -1.95 5.82 -0.11 0.00 2.15 -1.26 -4.17 116.67 117.15 3dyo s ASP 77 Ca -0.06 2.78 -0.26 0.00 0.43 0.00 0.00 52.55 55.43 3dyo s ASP 77 Cb -0.01 -2.64 -0.02 0.00 -0.30 0.00 0.00 42.92 39.95 3dyo s ASP 77 CO -0.02 -1.20 0.85 -0.76 -0.17 0.00 0.00 175.17 173.88 3dyo s LEU 78 N -2.90 4.24 0.51 -1.34 1.43 -1.26 -4.91 118.68 114.45 3dyo s LEU 78 Ca 0.63 1.31 0.21 0.00 -1.03 0.00 0.00 54.13 55.24 3dyo s LEU 78 Cb -0.40 -3.30 1.34 0.00 0.03 0.00 0.00 46.19 43.85 3dyo s LEU 78 CO 0.51 -0.33 2.11 -0.65 0.23 0.00 0.00 176.35 178.22 3dyo h PRO 79 N 7.10 0.00 0.00 1.29 0.11 -2.03 -1.04 132.00 137.43 3dyo h PRO 79 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3dyo h PRO 79 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3dyo h PRO 79 CO 0.81 0.08 0.00 0.39 -0.21 0.00 0.00 178.00 179.07 3dyo n GLU 80 N -4.15 0.12 -1.25 1.05 4.71 -1.26 -4.87 120.64 114.98 3dyo n GLU 80 Ca -0.03 0.06 -0.30 0.00 -0.01 0.00 0.00 57.16 56.88 3dyo n GLU 80 Cb 0.16 -1.50 0.11 0.00 -1.01 0.00 0.00 31.44 29.21 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 -2.86 1.91 0.37 0.62 0.00 -0.40 -4.94 121.76 116.45 3dyo s ALA 81 Ca 0.16 0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.27 3dyo s ALA 81 Cb 0.17 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 20.02 3dyo s ALA 81 CO 0.43 -2.05 0.14 -0.51 0.00 0.00 0.00 175.76 173.77 3dyo s ASP 82 N -3.44 4.50 -0.22 0.00 1.01 0.15 -4.87 116.67 113.79 3dyo s ASP 82 Ca 0.62 -0.92 -0.10 0.00 0.71 0.00 0.00 52.55 52.86 3dyo s ASP 82 Cb -0.17 -0.59 -0.05 0.00 1.01 0.00 0.00 42.92 43.11 3dyo s ASP 82 CO 0.56 -0.39 0.14 -0.89 0.21 0.00 0.00 175.17 174.81 3dyo s THR 83 N -2.51 5.34 0.09 -1.27 2.01 -1.26 0.33 115.64 118.37 3dyo s THR 83 Ca 0.39 0.17 0.01 0.00 0.31 0.00 0.00 61.69 62.57 3dyo s THR 83 Cb 0.00 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 3dyo s THR 83 CO 0.22 0.38 -0.05 0.68 -0.69 0.00 0.00 174.62 175.17 3dyo s VAL 84 N 0.79 0.55 0.31 3.82 -7.23 0.14 -4.93 120.40 113.85 3dyo s VAL 84 Ca 0.07 -1.91 -0.27 0.00 -1.81 0.00 0.00 61.98 58.06 3dyo s VAL 84 Cb -0.13 -1.69 -0.09 0.00 0.56 0.00 0.00 36.38 35.03 3dyo s VAL 84 CO 0.02 -0.85 1.01 -0.69 -0.31 0.00 0.00 175.10 174.28 3dyo s VAL 85 N -3.72 3.87 -0.03 1.32 1.01 -1.26 -0.71 120.40 120.88 3dyo s VAL 85 Ca 0.12 1.68 0.03 0.00 0.00 0.00 0.00 61.98 63.81 3dyo s VAL 85 Cb 0.06 -3.99 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 3dyo s VAL 85 CO -0.05 0.25 -0.13 -0.69 0.00 0.00 0.00 175.10 174.47 3dyo s VAL 86 N -1.41 1.09 0.59 2.92 1.01 0.61 -4.18 120.40 121.02 3dyo s VAL 86 Ca 0.48 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 3dyo s VAL 86 Cb -0.25 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 3dyo s VAL 86 CO 0.31 0.32 1.09 -2.16 0.00 0.00 0.00 175.10 174.66 3dyo s PRO 87 N 0.04 3.22 0.02 2.72 0.04 -1.26 -0.91 135.00 138.88 3dyo s PRO 87 Ca -0.02 1.40 -0.28 0.00 0.04 0.00 0.00 61.00 62.14 3dyo s PRO 87 Cb -0.09 -2.01 0.10 0.00 0.04 0.00 0.00 34.50 32.54 3dyo s PRO 87 CO 0.01 -0.91 0.91 -1.54 0.04 0.00 0.00 177.00 175.50 3dyo s SER 88 N -2.32 -0.33 -0.21 6.66 1.04 0.80 -4.93 113.70 114.42 3dyo s SER 88 Ca 0.68 -0.08 -0.07 0.00 0.48 0.00 0.00 55.95 56.97 3dyo s SER 88 Cb -0.20 0.40 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 3dyo s SER 88 CO 0.33 -0.67 0.05 0.20 0.98 0.00 0.00 173.24 174.13 3dyo s ASN 89 N -2.57 5.25 0.58 7.02 -0.87 -1.26 -2.96 114.94 120.12 3dyo s ASN 89 Ca 0.06 -0.09 0.34 0.00 -1.57 0.00 0.00 52.86 51.60 3dyo s ASN 89 Cb -0.01 -1.91 1.77 0.00 -0.02 0.00 0.00 41.25 41.08 3dyo s ASN 89 CO -0.07 0.08 2.17 4.11 -2.57 0.00 0.00 177.10 180.83 3dyo h TRP 90 N 7.37 0.00 -0.12 2.20 0.09 -1.80 0.69 115.95 124.38 3dyo h TRP 90 Ca -0.36 0.00 -0.03 0.00 0.09 0.00 0.00 58.89 58.59 3dyo h TRP 90 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.41 3dyo h TRP 90 CO 0.60 0.05 -0.06 1.96 0.09 0.00 0.00 178.44 181.08 3dyo h GLN 91 N 0.00 0.17 0.00 0.12 7.50 -1.79 -1.41 115.11 119.70 3dyo h GLN 91 Ca -0.00 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.12 3dyo h GLN 91 Cb 0.22 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.72 3dyo h GLN 91 CO 0.01 0.25 0.00 -1.33 -1.50 0.00 0.00 178.83 176.26 3dyo n MET 92 N -4.37 0.20 -0.04 1.46 2.81 0.23 -1.45 117.12 115.97 3dyo n MET 92 Ca -0.01 0.47 0.10 0.00 -1.81 0.00 0.00 57.70 56.45 3dyo n MET 92 Cb 0.20 -1.91 0.11 0.00 -0.71 0.00 0.00 33.22 30.91 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 -2.29 0.10 -1.01 2.03 8.25 -0.57 -4.96 115.22 116.77 3dyo n HIS 93 Ca 0.01 -0.06 -0.00 0.00 -0.26 0.00 0.00 57.72 57.42 3dyo n HIS 93 Cb 0.20 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.31 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 1.20 0.47 0.19 -1.41 0.00 -0.53 -4.93 105.19 100.18 3dyo n GLY 94 Ca 0.13 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 -2.84 1.61 -1.99 -1.65 -3.46 116.97 108.64 3dyo h TYR 95 Ca -0.01 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.79 3dyo h TYR 95 Cb 0.06 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.75 3dyo h TYR 95 CO 0.03 0.36 0.32 0.16 -0.00 0.00 0.00 178.16 179.03 3dyo s ASP 96 N -6.88 -0.14 0.17 3.88 1.47 -1.26 -5.04 116.67 108.86 3dyo s ASP 96 Ca -0.03 -0.75 -0.15 0.00 1.18 0.00 0.00 52.55 52.80 3dyo s ASP 96 Cb 0.14 0.71 -0.07 0.00 -0.34 0.00 0.00 42.92 43.36 3dyo s ASP 96 CO 0.72 -1.35 0.58 0.00 0.68 0.00 0.00 175.17 175.79 3dyo s ALA 97 N -3.13 3.55 0.50 2.11 0.00 -1.26 -4.36 121.76 119.17 3dyo s ALA 97 Ca 0.14 -0.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.82 3dyo s ALA 97 Cb -0.05 -2.56 -0.08 0.00 0.00 0.00 0.00 23.12 20.43 3dyo s ALA 97 CO 0.07 0.44 1.00 -1.25 0.00 0.00 0.00 175.76 176.02 3dyo s PRO 98 N -2.05 3.87 -0.13 0.00 0.04 -1.26 -4.96 135.00 130.50 3dyo s PRO 98 Ca 0.40 1.12 0.02 0.00 0.04 0.00 0.00 61.00 62.58 3dyo s PRO 98 Cb -0.15 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.29 3dyo s PRO 98 CO 0.19 -0.35 -0.20 0.42 0.04 0.00 0.00 177.00 177.11 3dyo s ILE 99 N -2.36 1.89 -0.46 0.56 1.01 -1.08 -4.63 121.20 116.13 3dyo s ILE 99 Ca 0.62 -0.88 -0.11 0.00 0.00 0.00 0.00 60.65 60.28 3dyo s ILE 99 Cb -0.12 -1.69 0.10 0.00 0.01 0.00 0.00 42.46 40.76 3dyo s ILE 99 CO 0.26 0.52 0.35 -0.47 0.00 0.00 0.00 174.94 175.59 3dyo s TYR 100 N 0.91 3.34 0.02 3.97 5.04 -1.26 0.64 117.35 130.02 3dyo s TYR 100 Ca -0.06 -1.52 0.05 0.00 -2.44 0.00 0.00 57.07 53.09 3dyo s TYR 100 Cb -0.15 -3.30 -0.02 0.00 0.35 0.00 0.00 41.96 38.84 3dyo s TYR 100 CO -0.03 -0.92 -0.14 -0.08 -1.34 0.00 0.00 175.55 173.05 3dyo s THR 101 N 1.46 1.09 0.00 4.34 -1.32 -1.26 -0.57 115.64 119.37 3dyo s THR 101 Ca 0.04 -0.84 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 3dyo s THR 101 Cb -0.25 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.78 3dyo s THR 101 CO 0.02 0.11 0.00 -3.20 -2.21 0.00 0.00 174.62 169.34 3dyo n ASN 102 N 2.21 0.00 -0.09 8.08 2.85 -1.26 -4.01 115.26 123.04 3dyo n ASN 102 Ca -0.17 0.02 -0.22 0.00 -0.11 0.00 0.00 54.58 54.11 3dyo n ASN 102 Cb 0.55 -0.08 -0.12 0.00 1.24 0.00 0.00 39.78 41.37 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 -1.38 1.57 -1.76 3.44 0.31 -1.26 -3.97 118.33 115.28 3dyo n VAL 103 Ca 0.00 -0.12 -0.42 0.00 -0.01 0.00 0.00 64.34 63.79 3dyo n VAL 103 Cb 0.00 -2.00 -0.03 0.00 -0.91 0.00 0.00 33.84 30.91 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 -2.39 2.09 0.70 2.52 2.01 -1.26 -3.40 115.64 115.90 3dyo s THR 104 Ca -0.28 0.07 -0.16 0.00 0.31 0.00 0.00 61.69 61.63 3dyo s THR 104 Cb 0.06 -3.04 0.02 0.00 0.01 0.00 0.00 72.50 69.55 3dyo s THR 104 CO 0.62 0.01 1.24 -0.31 -0.69 0.00 0.00 174.62 175.48 3dyo s TYR 105 N 0.79 2.07 -2.03 4.92 1.51 -1.26 -4.86 117.35 118.48 3dyo s TYR 105 Ca 0.71 1.56 0.30 0.00 -1.01 0.00 0.00 57.07 58.62 3dyo s TYR 105 Cb -0.49 -3.55 1.40 0.00 -0.11 0.00 0.00 41.96 39.21 3dyo s TYR 105 CO 0.37 -2.70 1.95 -0.35 -1.11 0.00 0.00 175.55 173.71 3dyo n PRO 106 N -2.40 1.09 -4.31 -1.71 -0.04 -1.26 -4.81 135.00 121.56 3dyo n PRO 106 Ca 0.14 -0.38 -0.17 0.00 -0.04 0.00 0.00 63.50 63.05 3dyo n PRO 106 Cb 0.49 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 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 -2.17 1.41 0.35 0.52 -4.36 -1.26 -5.07 121.20 110.62 3dyo s ILE 107 Ca 0.38 -2.12 -0.29 0.00 -0.26 0.00 0.00 60.65 58.36 3dyo s ILE 107 Cb 0.21 -2.05 -0.11 0.00 1.25 0.00 0.00 42.46 41.76 3dyo s ILE 107 CO 0.40 -0.59 1.51 -0.89 0.24 0.00 0.00 174.94 175.61 3dyo s THR 108 N -3.18 2.06 -0.67 8.37 2.01 -1.26 -4.88 115.64 118.08 3dyo s THR 108 Ca 0.22 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 62.00 3dyo s THR 108 Cb 0.02 -3.03 0.03 0.00 0.01 0.00 0.00 72.50 69.53 3dyo s THR 108 CO 0.05 0.01 1.23 -0.69 -0.69 0.00 0.00 174.62 174.53 3dyo s VAL 109 N -0.82 3.86 -0.46 3.82 1.01 -1.26 -4.80 120.40 121.75 3dyo s VAL 109 Ca 0.56 0.59 0.07 0.00 0.00 0.00 0.00 61.98 63.19 3dyo s VAL 109 Cb -0.47 -4.83 0.28 0.00 0.00 0.00 0.00 36.38 31.36 3dyo s VAL 109 CO 0.59 -1.63 0.93 -3.20 0.00 0.00 0.00 175.10 171.79 3dyo n ASN 110 N 8.93 -2.07 -4.72 3.32 5.15 -1.26 -5.11 115.26 119.51 3dyo n ASN 110 Ca 0.05 -3.38 -0.40 0.00 -0.60 0.00 0.00 54.58 50.24 3dyo n ASN 110 Cb 0.49 1.43 0.02 0.00 -0.53 0.00 0.00 39.78 41.19 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 1.00 2.00 -0.99 1.20 -0.04 -1.26 0.05 135.00 136.96 3dyo n PRO 111 Ca 0.10 0.71 -0.07 0.00 -0.04 0.00 0.00 63.50 64.20 3dyo n PRO 111 Cb 0.65 -2.46 0.28 0.00 -0.04 0.00 0.00 33.50 31.92 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 -0.10 3.29 -2.48 0.54 -0.04 -1.26 -5.09 135.00 129.86 3dyo n PRO 112 Ca 0.06 -3.08 -0.30 0.00 -0.04 0.00 0.00 63.50 60.15 3dyo n PRO 112 Cb 0.41 -2.15 -0.01 0.00 -0.04 0.00 0.00 33.50 31.70 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 -3.05 3.53 0.30 0.54 0.40 0.11 -4.37 117.98 115.44 3dyo s PHE 113 Ca 0.54 1.10 0.06 0.00 -0.60 0.00 0.00 56.93 58.02 3dyo s PHE 113 Cb 0.44 -2.52 -0.06 0.00 0.51 0.00 0.00 43.02 41.38 3dyo s PHE 113 CO 0.12 -0.34 -0.01 0.14 0.70 0.00 0.00 175.22 175.82 3dyo s VAL 114 N -2.72 1.49 0.36 -0.44 -7.23 -1.26 -4.46 120.40 106.13 3dyo s VAL 114 Ca 0.52 -2.07 -0.27 0.00 -1.81 0.00 0.00 61.98 58.35 3dyo s VAL 114 Cb -0.10 -2.60 -0.12 0.00 0.56 0.00 0.00 36.38 34.12 3dyo s VAL 114 CO 0.41 -0.18 1.20 -2.65 -0.31 0.00 0.00 175.10 173.56 3dyo n PRO 115 N -0.64 1.85 0.11 4.82 -0.02 -1.26 -4.89 135.00 134.97 3dyo n PRO 115 Ca -0.04 0.65 0.01 0.00 -2.02 0.00 0.00 63.50 62.09 3dyo n PRO 115 Cb 0.65 -2.22 0.33 0.00 -0.02 0.00 0.00 33.50 32.23 3dyo n PRO 115 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3dyo h THR 116 N 2.21 1.23 -2.45 3.45 1.35 -2.00 -3.30 112.91 113.40 3dyo h THR 116 Ca -0.45 -1.10 -0.61 0.00 -0.55 0.00 0.00 66.41 63.70 3dyo h THR 116 Cb 1.30 1.42 -0.13 0.00 -1.73 0.00 0.00 68.15 69.02 3dyo h THR 116 CO 0.61 0.33 0.76 -1.61 -0.25 0.00 0.00 175.52 175.36 3dyo s GLU 117 N -4.47 3.21 -0.38 4.72 2.02 -1.26 -4.69 118.70 117.85 3dyo s GLU 117 Ca -0.05 -0.80 0.01 0.00 0.02 0.00 0.00 54.97 54.14 3dyo s GLU 117 Cb 0.15 -4.36 0.12 0.00 0.10 0.00 0.00 34.13 30.14 3dyo s GLU 117 CO 0.75 -1.92 0.19 1.21 0.02 0.00 0.00 175.26 175.50 3dyo s ASN 118 N 3.78 3.60 0.03 -0.19 2.47 0.23 -4.98 114.94 119.88 3dyo s ASN 118 Ca 0.28 -2.18 -0.38 0.00 0.42 0.00 0.00 52.86 50.99 3dyo s ASN 118 Cb -0.12 -0.81 -0.18 0.00 -1.45 0.00 0.00 41.25 38.68 3dyo s ASN 118 CO 0.08 -0.33 1.26 -2.65 -3.72 0.00 0.00 177.10 171.74 3dyo n PRO 119 N 4.11 0.68 -4.91 0.43 -0.02 -1.18 -3.47 135.00 130.64 3dyo n PRO 119 Ca 0.06 0.25 -0.29 0.00 -2.02 0.00 0.00 63.50 61.49 3dyo n PRO 119 Cb 0.37 -1.83 -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 0.48 1.73 -0.22 3.45 2.01 0.18 -1.78 115.64 121.48 3dyo s THR 120 Ca 0.88 -0.82 -0.06 0.00 0.31 0.00 0.00 61.69 62.00 3dyo s THR 120 Cb -1.09 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 3dyo s THR 120 CO 0.52 0.49 0.04 -0.83 -0.69 0.00 0.00 174.62 174.15 3dyo s GLY 121 N 0.54 1.77 -0.48 4.40 0.00 -0.47 -0.87 107.32 112.21 3dyo s GLY 121 Ca -0.15 -1.01 -0.16 0.00 0.00 0.00 0.00 44.72 43.39 3dyo s GLY 121 CO 0.06 0.34 0.42 0.00 0.00 0.00 0.00 173.10 173.91 3dyo s TYR 123 N 1.68 3.37 0.06 0.00 1.51 0.30 -1.52 117.35 122.75 3dyo s TYR 123 Ca 0.04 0.22 -0.08 0.00 -1.01 0.00 0.00 57.07 56.24 3dyo s TYR 123 Cb -0.25 -1.73 -0.00 0.00 -0.11 0.00 0.00 41.96 39.87 3dyo s TYR 123 CO 0.06 0.57 0.17 -1.54 -1.11 0.00 0.00 175.55 173.71 3dyo s SER 124 N -2.12 0.11 -0.07 2.29 1.04 0.10 -0.65 113.70 114.40 3dyo s SER 124 Ca 0.28 -0.53 -0.05 0.00 0.48 0.00 0.00 55.95 56.13 3dyo s SER 124 Cb -0.12 0.30 0.03 0.00 0.10 0.00 0.00 66.02 66.32 3dyo s SER 124 CO 0.20 -0.62 0.18 -0.22 0.98 0.00 0.00 173.24 173.76 3dyo s LEU 125 N -2.44 1.05 -0.22 2.42 2.96 -0.46 -1.27 118.68 120.73 3dyo s LEU 125 Ca -0.00 0.36 -0.07 0.00 -0.22 0.00 0.00 54.13 54.19 3dyo s LEU 125 Cb 0.02 0.56 -0.03 0.00 0.50 0.00 0.00 46.19 47.23 3dyo s LEU 125 CO -0.07 -0.10 0.07 -0.89 -1.32 0.00 0.00 176.35 174.04 3dyo s THR 126 N 0.53 4.52 0.23 3.68 2.01 -1.26 -1.33 115.64 124.03 3dyo s THR 126 Ca -0.04 -0.11 -0.12 0.00 0.31 0.00 0.00 61.69 61.73 3dyo s THR 126 Cb -0.05 -3.08 -0.00 0.00 0.01 0.00 0.00 72.50 69.37 3dyo s THR 126 CO -0.03 0.38 0.45 0.72 -0.69 0.00 0.00 174.62 175.46 3dyo s PHE 127 N 1.10 0.36 0.01 4.92 -0.12 0.13 -4.94 117.98 119.45 3dyo s PHE 127 Ca 0.04 -0.72 -0.11 0.00 -0.05 0.00 0.00 56.93 56.10 3dyo s PHE 127 Cb -0.14 0.15 -0.05 0.00 -0.63 0.00 0.00 43.02 42.35 3dyo s PHE 127 CO 0.03 -0.95 0.34 1.21 -0.05 0.00 0.00 175.22 175.81 3dyo s ASN 128 N -3.01 6.64 -0.09 1.98 2.47 -1.26 0.80 114.94 122.47 3dyo s ASN 128 Ca 0.22 0.77 0.01 0.00 0.42 0.00 0.00 52.86 54.27 3dyo s ASN 128 Cb 0.00 -2.17 0.02 0.00 -1.45 0.00 0.00 41.25 37.65 3dyo s ASN 128 CO 0.07 0.28 -0.10 -0.69 -3.72 0.00 0.00 177.10 172.95 3dyo s VAL 129 N -1.20 1.08 0.21 -5.21 1.01 0.27 -4.97 120.40 111.59 3dyo s VAL 129 Ca 0.26 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 3dyo s VAL 129 Cb -0.15 -1.04 -0.08 0.00 0.00 0.00 0.00 36.38 35.11 3dyo s VAL 129 CO 0.14 0.36 1.11 -0.62 0.00 0.00 0.00 175.10 176.09 3dyo s ASP 130 N 1.18 7.24 0.57 3.32 -1.08 -1.26 -1.02 116.67 125.61 3dyo s ASP 130 Ca -0.05 2.17 0.30 0.00 -0.52 0.00 0.00 52.55 54.45 3dyo s ASP 130 Cb -0.14 -2.61 1.46 0.00 -1.46 0.00 0.00 42.92 40.16 3dyo s ASP 130 CO -0.02 -0.22 1.86 -0.08 0.52 0.00 0.00 175.17 177.23 3dyo h GLU 131 N 4.71 0.00 0.00 4.34 4.57 -1.94 0.23 114.58 126.50 3dyo h GLU 131 Ca -0.45 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.72 3dyo h GLU 131 Cb 1.21 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 3dyo h GLU 131 CO 0.71 0.00 -0.06 0.66 -1.18 0.00 0.00 179.01 179.14 3dyo h SER 132 N 0.00 0.00 1.38 1.04 4.64 -1.98 0.16 113.55 118.79 3dyo h SER 132 Ca 0.34 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.53 3dyo h SER 132 Cb 1.54 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.61 3dyo h SER 132 CO -0.00 0.06 -0.63 -0.50 -0.87 0.00 0.00 176.83 174.89 3dyo h TRP 133 N 0.00 0.00 0.00 4.77 4.06 -0.84 -3.34 115.95 120.60 3dyo h TRP 133 Ca -0.00 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.74 3dyo h TRP 133 Cb 0.26 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.38 3dyo h TRP 133 CO 0.00 0.57 -1.60 1.28 -3.56 0.00 0.00 178.44 175.14 3dyo n LEU 134 N -3.22 0.77 0.25 -4.49 4.77 0.14 -4.22 117.00 111.00 3dyo n LEU 134 Ca 0.01 0.35 0.16 0.00 -0.03 0.00 0.00 56.01 56.50 3dyo n LEU 134 Cb 0.77 0.13 0.67 0.00 -2.33 0.00 0.00 43.42 42.67 3dyo n LEU 134 CO 0.42 0.24 0.98 0.06 -1.33 0.00 0.00 177.39 177.75 3dyo h GLN 135 N 0.00 0.00 -3.43 3.23 3.07 -0.92 -3.44 115.11 113.62 3dyo h GLN 135 Ca -0.22 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.47 3dyo h GLN 135 Cb 1.74 0.00 -0.12 0.00 0.08 0.00 0.00 27.48 29.19 3dyo h GLN 135 CO 0.05 0.00 -0.07 -1.21 0.09 0.00 0.00 178.83 177.70 3dyo s GLU 136 N -3.62 1.21 0.65 0.06 0.41 -1.26 -5.12 118.70 111.03 3dyo s GLU 136 Ca 0.01 -0.84 0.00 0.00 -0.41 0.00 0.00 54.97 53.73 3dyo s GLU 136 Cb 0.09 0.48 0.00 0.00 -1.78 0.00 0.00 34.13 32.92 3dyo s GLU 136 CO 0.50 -0.49 0.00 0.41 -0.49 0.00 0.00 175.26 175.19 3dyo n GLY 137 N -0.27 -2.12 3.13 -1.39 0.00 -1.26 -4.80 105.19 98.48 3dyo n GLY 137 Ca -0.12 -1.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.42 2.49 -0.28 1.61 0.74 0.24 -4.81 119.66 119.23 3dyo s GLN 138 Ca 0.00 -0.68 -0.06 0.00 0.05 0.00 0.00 55.36 54.67 3dyo s GLN 138 Cb 0.00 -1.95 0.01 0.00 1.10 0.00 0.00 33.01 32.17 3dyo s GLN 138 CO 0.00 0.10 0.05 0.99 -0.55 0.00 0.00 175.29 175.87 3dyo s THR 139 N 0.53 3.78 0.24 -0.34 2.01 -1.26 -0.35 115.64 120.24 3dyo s THR 139 Ca -0.16 -0.69 0.11 0.00 0.31 0.00 0.00 61.69 61.27 3dyo s THR 139 Cb -0.17 -2.91 -0.05 0.00 0.01 0.00 0.00 72.50 69.38 3dyo s THR 139 CO 0.06 0.15 -0.17 0.00 -0.69 0.00 0.00 174.62 173.97 3dyo s ARG 140 N 1.48 1.78 -0.01 4.92 1.70 -0.57 0.62 118.95 128.87 3dyo s ARG 140 Ca 0.03 -1.59 0.03 0.00 -0.47 0.00 0.00 55.73 53.73 3dyo s ARG 140 Cb -0.17 -1.90 -0.03 0.00 -0.57 0.00 0.00 34.95 32.28 3dyo s ARG 140 CO 0.01 0.37 -0.08 -1.50 -1.08 0.00 0.00 175.30 173.02 3dyo s ILE 141 N -2.16 3.58 -0.13 4.99 2.07 0.07 -1.36 121.20 128.26 3dyo s ILE 141 Ca 0.27 -0.73 0.01 0.00 -1.41 0.00 0.00 60.65 58.79 3dyo s ILE 141 Cb -0.06 -2.53 0.02 0.00 0.13 0.00 0.00 42.46 40.02 3dyo s ILE 141 CO 0.14 0.44 -0.14 -0.63 -1.91 0.00 0.00 174.94 172.85 3dyo s ILE 142 N -0.94 1.51 -0.39 2.00 1.01 0.65 -1.49 121.20 123.55 3dyo s ILE 142 Ca 0.16 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 60.10 3dyo s ILE 142 Cb -0.11 -1.41 0.06 0.00 0.01 0.00 0.00 42.46 41.01 3dyo s ILE 142 CO 0.06 0.45 0.21 -0.36 0.00 0.00 0.00 174.94 175.30 3dyo s PHE 143 N 1.32 3.30 0.12 3.97 0.40 -0.63 -1.42 117.98 125.04 3dyo s PHE 143 Ca 0.01 -1.35 0.28 0.00 -0.60 0.00 0.00 56.93 55.27 3dyo s PHE 143 Cb -0.14 -2.67 1.11 0.00 0.51 0.00 0.00 43.02 41.84 3dyo s PHE 143 CO -0.07 -0.77 1.90 -0.44 0.70 0.00 0.00 175.22 176.54 3dyo h ASP 144 N 8.38 0.00 -1.62 1.36 3.32 -1.04 -0.14 116.42 126.68 3dyo h ASP 144 Ca -0.24 0.00 0.11 0.00 0.02 0.00 0.00 57.03 56.93 3dyo h ASP 144 Cb 1.09 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.43 3dyo h ASP 144 CO 0.70 0.13 -0.03 -0.83 -1.72 0.00 0.00 179.24 177.49 3dyo s GLY 145 N -4.24 -0.58 -0.04 2.75 0.00 -1.26 -3.31 107.32 100.64 3dyo s GLY 145 Ca 0.01 2.54 -0.02 0.00 0.00 0.00 0.00 44.72 47.25 3dyo s GLY 145 CO 0.60 3.15 0.05 0.14 0.00 0.00 0.00 173.10 177.04 3dyo s VAL 146 N 2.77 -0.07 -0.24 1.40 1.01 -1.25 -1.68 120.40 122.34 3dyo s VAL 146 Ca -0.03 0.38 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 3dyo s VAL 146 Cb -0.10 -0.16 0.01 0.00 0.00 0.00 0.00 36.38 36.13 3dyo s VAL 146 CO -0.19 0.17 -0.05 0.21 0.00 0.00 0.00 175.10 175.25 3dyo s ASN 147 N 1.99 4.31 -0.01 3.32 3.84 -0.32 -3.96 114.94 124.11 3dyo s ASN 147 Ca 0.03 -0.71 0.09 0.00 0.21 0.00 0.00 52.86 52.48 3dyo s ASN 147 Cb -0.12 -1.69 -0.13 0.00 -0.55 0.00 0.00 41.25 38.75 3dyo s ASN 147 CO -0.03 -0.10 0.22 -1.54 -2.79 0.00 0.00 177.10 172.87 3dyo n SER 148 N 4.72 2.55 -3.57 -4.21 3.41 -0.83 -0.74 113.62 114.97 3dyo n SER 148 Ca -0.17 -0.11 -0.14 0.00 -0.26 0.00 0.00 58.87 58.19 3dyo n SER 148 Cb 0.48 1.34 -0.05 0.00 -0.26 0.00 0.00 64.21 65.72 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 -2.49 -1.35 0.10 7.33 0.00 -1.17 -3.95 121.76 120.24 3dyo s ALA 149 Ca -0.02 0.61 -0.23 0.00 0.00 0.00 0.00 51.96 52.31 3dyo s ALA 149 Cb 0.06 0.40 0.06 0.00 0.00 0.00 0.00 23.12 23.64 3dyo s ALA 149 CO 0.37 -0.52 0.57 -0.59 0.00 0.00 0.00 175.76 175.59 3dyo s PHE 150 N -2.49 -0.49 0.08 0.00 -0.12 -0.81 0.06 117.98 114.22 3dyo s PHE 150 Ca -0.05 0.42 0.06 0.00 -0.05 0.00 0.00 56.93 57.31 3dyo s PHE 150 Cb -0.01 0.45 -0.04 0.00 -0.63 0.00 0.00 43.02 42.80 3dyo s PHE 150 CO -0.02 -0.75 -0.06 -1.01 -0.05 0.00 0.00 175.22 173.33 3dyo s HIS 151 N -3.09 2.86 -0.06 3.49 3.76 -0.21 -1.60 115.29 120.44 3dyo s HIS 151 Ca -0.02 -0.09 0.04 0.00 -0.15 0.00 0.00 55.06 54.85 3dyo s HIS 151 Cb -0.00 -1.50 -0.00 0.00 1.11 0.00 0.00 32.58 32.18 3dyo s HIS 151 CO -0.07 0.44 -0.19 -1.17 -0.85 0.00 0.00 174.74 172.89 3dyo s LEU 152 N -2.11 1.94 0.12 0.89 2.96 -0.18 -0.66 118.68 121.63 3dyo s LEU 152 Ca 0.22 -0.42 0.07 0.00 -0.22 0.00 0.00 54.13 53.78 3dyo s LEU 152 Cb -0.11 -1.13 -0.04 0.00 0.50 0.00 0.00 46.19 45.41 3dyo s LEU 152 CO 0.14 0.15 -0.16 0.26 -1.32 0.00 0.00 176.35 175.42 3dyo s TRP 153 N 0.18 1.56 -0.05 5.38 0.51 -0.07 0.03 118.94 126.49 3dyo s TRP 153 Ca -0.09 -0.50 -0.01 0.00 -2.12 0.00 0.00 56.10 53.38 3dyo s TRP 153 Cb -0.14 -0.82 0.03 0.00 -0.81 0.00 0.00 33.47 31.73 3dyo s TRP 153 CO 0.04 0.19 0.02 0.00 -0.51 0.00 0.00 176.95 176.70 3dyo n ASN 155 N 4.88 -4.64 0.00 0.00 3.02 0.79 -1.49 115.26 117.81 3dyo n ASN 155 Ca -0.12 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.65 3dyo n ASN 155 Cb 0.50 -3.88 0.00 0.00 -0.61 0.00 0.00 39.78 35.79 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 -1.69 2.43 3.74 7.41 0.00 -1.23 -5.01 105.19 110.84 3dyo n GLY 156 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 3.82 0.16 1.61 0.52 -0.56 -4.94 118.95 119.54 3dyo s ARG 157 Ca 0.00 -0.25 -0.31 0.00 -0.52 0.00 0.00 55.73 54.65 3dyo s ARG 157 Cb 0.00 -3.24 -0.09 0.00 0.52 0.00 0.00 34.95 32.14 3dyo s ARG 157 CO 0.00 0.46 1.42 -0.46 0.02 0.00 0.00 175.30 176.74 3dyo s TRP 158 N -0.13 3.18 -0.19 -0.53 -0.00 -1.26 -0.80 118.94 119.21 3dyo s TRP 158 Ca 0.09 0.94 -0.04 0.00 -0.00 0.00 0.00 56.10 57.08 3dyo s TRP 158 Cb -0.12 -3.74 -0.10 0.00 -0.00 0.00 0.00 33.47 29.51 3dyo s TRP 158 CO 0.01 -2.56 -0.20 0.28 -0.00 0.00 0.00 176.95 174.47 3dyo n VAL 159 N 3.52 1.05 -2.22 5.86 0.31 0.10 -4.91 118.33 122.03 3dyo n VAL 159 Ca 0.10 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3dyo n VAL 159 Cb 0.41 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 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 2.22 -1.47 3.16 2.92 0.00 -1.17 -4.71 105.19 106.14 3dyo n GLY 160 Ca -0.35 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.66 0.08 0.09 1.61 5.04 -0.72 -1.01 117.35 119.78 3dyo s TYR 161 Ca 0.00 -0.29 -0.16 0.00 -2.44 0.00 0.00 57.07 54.18 3dyo s TYR 161 Cb 0.00 -0.05 0.03 0.00 0.35 0.00 0.00 41.96 42.29 3dyo s TYR 161 CO 0.00 -0.39 0.37 0.20 -1.34 0.00 0.00 175.55 174.39 3dyo s GLY 162 N -1.97 -0.22 0.37 8.97 0.00 -0.63 -1.26 107.32 112.58 3dyo s GLY 162 Ca -0.07 -0.01 0.04 0.00 0.00 0.00 0.00 44.72 44.68 3dyo s GLY 162 CO -0.03 -0.26 0.15 1.20 0.00 0.00 0.00 173.10 174.16 3dyo s GLN 163 N -3.34 1.80 0.00 2.90 -0.21 -0.71 -1.92 119.66 118.18 3dyo s GLN 163 Ca 0.00 -2.07 0.00 0.00 0.02 0.00 0.00 55.36 53.31 3dyo s GLN 163 Cb 0.01 -0.38 0.00 0.00 1.00 0.00 0.00 33.01 33.64 3dyo s GLN 163 CO -0.09 -0.47 0.00 -3.47 -2.12 0.00 0.00 175.29 169.14 3dyo n ASP 164 N -1.19 -1.86 0.00 5.90 -0.08 -1.25 -4.91 116.55 113.15 3dyo n ASP 164 Ca -0.02 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.30 3dyo n ASP 164 Cb 0.65 -0.93 0.21 0.00 2.34 0.00 0.00 41.12 43.39 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 0.00 -0.01 1.67 7.64 -1.25 -3.44 113.62 118.23 3dyo n SER 165 Ca 0.00 0.20 0.01 0.00 1.01 0.00 0.00 58.87 60.09 3dyo n SER 165 Cb 0.00 -0.31 0.01 0.00 -1.01 0.00 0.00 64.21 62.90 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 -1.31 2.82 -4.24 1.43 5.12 -1.26 -3.83 116.66 115.38 3dyo n ARG 166 Ca 0.04 -1.61 -0.15 0.00 -1.93 0.00 0.00 57.85 54.19 3dyo n ARG 166 Cb 0.07 -1.05 -0.10 0.00 -1.16 0.00 0.00 32.46 30.22 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 -1.19 2.48 0.45 0.55 1.43 -1.22 -4.44 118.68 116.74 3dyo s LEU 167 Ca 0.03 -0.93 -0.23 0.00 -1.03 0.00 0.00 54.13 51.97 3dyo s LEU 167 Cb 0.03 -0.42 -0.08 0.00 0.03 0.00 0.00 46.19 45.75 3dyo s LEU 167 CO 0.00 -0.26 1.16 -2.16 0.23 0.00 0.00 176.35 175.32 3dyo s PRO 168 N -3.33 3.83 -0.12 1.29 0.04 -1.21 -4.50 135.00 131.00 3dyo s PRO 168 Ca 0.14 1.78 0.03 0.00 0.04 0.00 0.00 61.00 62.98 3dyo s PRO 168 Cb -0.00 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 32.07 3dyo s PRO 168 CO 0.02 -0.49 -0.21 -1.12 0.04 0.00 0.00 177.00 175.24 3dyo s SER 169 N -1.32 3.30 0.00 6.66 0.01 -0.06 -4.95 113.70 117.33 3dyo s SER 169 Ca 0.62 -0.53 0.05 0.00 1.31 0.00 0.00 55.95 57.41 3dyo s SER 169 Cb -0.29 -1.47 -0.02 0.00 0.21 0.00 0.00 66.02 64.46 3dyo s SER 169 CO 0.35 0.13 -0.17 -1.61 0.41 0.00 0.00 173.24 172.36 3dyo s GLU 170 N 0.52 1.28 0.05 12.44 2.02 -1.26 -1.61 118.70 132.14 3dyo s GLU 170 Ca -0.13 -0.65 0.03 0.00 0.02 0.00 0.00 54.97 54.24 3dyo s GLU 170 Cb -0.17 -1.27 -0.03 0.00 0.10 0.00 0.00 34.13 32.77 3dyo s GLU 170 CO 0.05 0.34 -0.10 -0.06 0.02 0.00 0.00 175.26 175.50 3dyo s PHE 171 N -0.50 0.88 -0.27 1.61 0.40 -0.55 -0.38 117.98 119.17 3dyo s PHE 171 Ca 0.06 -0.48 -0.27 0.00 -0.60 0.00 0.00 56.93 55.64 3dyo s PHE 171 Cb -0.07 -0.51 0.01 0.00 0.51 0.00 0.00 43.02 42.96 3dyo s PHE 171 CO -0.00 -0.03 0.94 0.34 0.70 0.00 0.00 175.22 177.17 3dyo s ASP 172 N -1.63 6.90 0.00 1.36 -1.08 -1.26 -0.75 116.67 120.21 3dyo s ASP 172 Ca -0.07 1.06 0.22 0.00 -0.52 0.00 0.00 52.55 53.24 3dyo s ASP 172 Cb -0.10 -2.49 0.41 0.00 -1.46 0.00 0.00 42.92 39.29 3dyo s ASP 172 CO 0.01 -0.67 1.37 0.18 0.52 0.00 0.00 175.17 176.58 3dyo n LEU 173 N 6.36 3.40 -0.29 -1.34 4.77 0.20 -4.68 117.00 125.42 3dyo n LEU 173 Ca 0.09 -1.55 0.07 0.00 -0.03 0.00 0.00 56.01 54.59 3dyo n LEU 173 Cb 0.47 -0.25 0.18 0.00 -2.33 0.00 0.00 43.42 41.49 3dyo n LEU 173 CO 0.52 0.74 0.80 0.28 -1.33 0.00 0.00 177.39 178.40 3dyo h SER 174 N 4.19 -0.46 -0.22 -1.43 0.02 -1.83 0.48 113.55 114.30 3dyo h SER 174 Ca 0.00 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3dyo h SER 174 Cb 0.95 0.41 0.00 0.00 0.14 0.00 0.00 62.40 63.90 3dyo h SER 174 CO 0.00 -0.24 0.00 0.00 -1.14 0.00 0.00 176.83 175.45 3dyo n ALA 175 N -3.07 2.50 -0.01 3.77 0.00 -1.26 -3.98 120.51 118.45 3dyo n ALA 175 Ca 0.16 -0.61 0.06 0.00 0.00 0.00 0.00 53.44 53.04 3dyo n ALA 175 Cb 0.53 -1.04 -0.10 0.00 0.00 0.00 0.00 19.45 18.84 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 0.54 0.00 -2.29 0.00 3.01 0.16 -5.02 117.46 113.86 3dyo n PHE 176 Ca 0.16 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.34 3dyo n PHE 176 Cb 0.37 -0.31 0.02 0.00 -0.01 0.00 0.00 39.48 39.55 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 -3.95 3.30 0.12 4.37 1.43 -0.73 -4.75 118.68 118.48 3dyo s LEU 177 Ca -0.05 0.98 0.06 0.00 -1.03 0.00 0.00 54.13 54.10 3dyo s LEU 177 Cb 0.08 -3.89 -0.04 0.00 0.03 0.00 0.00 46.19 42.37 3dyo s LEU 177 CO 0.52 -0.92 -0.15 0.00 0.23 0.00 0.00 176.35 176.03 3dyo s ARG 178 N -5.01 1.04 0.22 1.70 1.70 -1.26 -5.05 118.95 112.29 3dyo s ARG 178 Ca 0.53 -1.21 -0.31 0.00 -0.47 0.00 0.00 55.73 54.27 3dyo s ARG 178 Cb -0.11 -1.00 -0.11 0.00 -0.57 0.00 0.00 34.95 33.16 3dyo s ARG 178 CO 0.48 0.20 1.57 0.00 -1.08 0.00 0.00 175.30 176.47 3dyo s ALA 179 N -1.89 3.76 0.00 7.88 0.00 -1.26 -4.55 121.76 125.70 3dyo s ALA 179 Ca 0.08 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.49 3dyo s ALA 179 Cb -0.06 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.43 3dyo s ALA 179 CO 0.03 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.36 3dyo n GLY 180 N 3.01 0.94 3.71 0.00 0.00 -0.19 -4.95 105.19 107.71 3dyo n GLY 180 Ca 0.11 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 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 4.47 0.08 1.61 0.41 -1.26 -0.56 118.70 123.46 3dyo s GLU 181 Ca 0.00 1.65 0.03 0.00 -0.41 0.00 0.00 54.97 56.24 3dyo s GLU 181 Cb 0.00 -3.39 -0.03 0.00 -1.78 0.00 0.00 34.13 28.92 3dyo s GLU 181 CO 0.00 -0.19 -0.09 -0.80 -0.49 0.00 0.00 175.26 173.69 3dyo s ASN 182 N 1.05 1.23 -0.07 -0.19 0.01 0.24 -4.83 114.94 112.38 3dyo s ASN 182 Ca 0.56 -0.81 0.01 0.00 -0.71 0.00 0.00 52.86 51.92 3dyo s ASN 182 Cb -0.26 0.04 0.02 0.00 0.41 0.00 0.00 41.25 41.45 3dyo s ASN 182 CO 0.29 -0.30 -0.07 -0.60 -1.51 0.00 0.00 177.10 174.90 3dyo s ARG 183 N -2.80 1.25 -0.03 -0.60 3.52 -1.26 0.22 118.95 119.25 3dyo s ARG 183 Ca 0.04 -0.22 -0.05 0.00 -0.13 0.00 0.00 55.73 55.36 3dyo s ARG 183 Cb -0.02 -1.21 -0.04 0.00 -1.56 0.00 0.00 34.95 32.11 3dyo s ARG 183 CO -0.01 -0.11 0.21 -0.51 -0.81 0.00 0.00 175.30 174.06 3dyo s LEU 184 N 1.13 4.38 -0.09 -0.88 1.43 -0.44 -0.15 118.68 124.05 3dyo s LEU 184 Ca -0.07 0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.50 3dyo s LEU 184 Cb -0.14 -2.50 0.02 0.00 0.03 0.00 0.00 46.19 43.60 3dyo s LEU 184 CO -0.01 0.30 -0.07 0.00 0.23 0.00 0.00 176.35 176.79 3dyo s ALA 185 N -1.24 1.14 -0.17 4.21 0.00 -0.20 -1.35 121.76 124.16 3dyo s ALA 185 Ca 0.24 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.81 3dyo s ALA 185 Cb -0.13 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.30 3dyo s ALA 185 CO 0.14 -0.23 -0.08 0.08 0.00 0.00 0.00 175.76 175.67 3dyo s VAL 186 N 1.36 1.36 -0.45 0.00 1.01 0.18 -0.89 120.40 122.96 3dyo s VAL 186 Ca -0.02 -0.74 -0.15 0.00 0.00 0.00 0.00 61.98 61.06 3dyo s VAL 186 Cb -0.14 -1.45 0.05 0.00 0.00 0.00 0.00 36.38 34.85 3dyo s VAL 186 CO -0.04 0.21 0.36 -0.32 0.00 0.00 0.00 175.10 175.31 3dyo s MET 187 N 1.53 2.98 -0.27 2.72 1.75 0.16 -0.54 119.30 127.63 3dyo s MET 187 Ca 0.01 -1.23 -0.14 0.00 -1.25 0.00 0.00 55.69 53.08 3dyo s MET 187 Cb -0.15 -4.08 -0.04 0.00 2.84 0.00 0.00 34.83 33.40 3dyo s MET 187 CO -0.08 -0.93 0.33 0.08 -0.65 0.00 0.00 175.02 173.76 3dyo s VAL 188 N 1.66 5.21 -0.10 10.11 1.01 -0.02 -1.04 120.40 137.24 3dyo s VAL 188 Ca 0.04 0.45 -0.13 0.00 0.00 0.00 0.00 61.98 62.34 3dyo s VAL 188 Cb -0.22 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 3dyo s VAL 188 CO 0.08 0.17 0.33 -0.76 0.00 0.00 0.00 175.10 174.92 3dyo s LEU 189 N 1.99 4.35 0.07 3.92 1.43 0.11 -1.37 118.68 129.17 3dyo s LEU 189 Ca 0.13 0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 53.73 3dyo s LEU 189 Cb -0.16 -2.43 -0.11 0.00 0.03 0.00 0.00 46.19 43.53 3dyo s LEU 189 CO 0.10 0.21 1.43 -0.09 0.23 0.00 0.00 176.35 178.23 3dyo h ARG 190 N 5.78 0.47 -6.42 1.70 2.43 -1.62 -2.17 114.38 114.55 3dyo h ARG 190 Ca -0.47 -0.21 -0.68 0.00 -0.81 0.00 0.00 59.98 57.81 3dyo h ARG 190 Cb 1.19 -0.01 -0.20 0.00 -0.42 0.00 0.00 29.97 30.53 3dyo h ARG 190 CO 0.68 0.75 -0.76 -1.58 -1.51 0.00 0.00 179.97 177.56 3dyo s TRP 191 N -4.56 2.72 0.33 2.20 0.52 -1.26 -3.89 118.94 114.99 3dyo s TRP 191 Ca -0.14 -0.15 -0.12 0.00 0.02 0.00 0.00 56.10 55.71 3dyo s TRP 191 Cb 0.07 -1.55 0.02 0.00 -1.15 0.00 0.00 33.47 30.86 3dyo s TRP 191 CO 0.77 0.29 0.63 -1.54 0.02 0.00 0.00 176.95 177.12 3dyo s SER 192 N -1.31 0.21 0.57 2.95 1.04 -1.26 -4.91 113.70 110.98 3dyo s SER 192 Ca 0.15 -1.12 0.30 0.00 0.48 0.00 0.00 55.95 55.76 3dyo s SER 192 Cb -0.11 0.73 1.71 0.00 0.10 0.00 0.00 66.02 68.45 3dyo s SER 192 CO 0.05 -1.42 2.18 -2.24 0.98 0.00 0.00 173.24 172.79 3dyo h ASP 193 N 2.08 0.00 0.24 7.02 3.04 -1.14 0.10 116.42 127.77 3dyo h ASP 193 Ca -0.28 0.00 -0.02 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 0.36 0.06 -0.08 1.23 -2.04 0.00 0.00 179.24 178.77 3dyo h GLY 194 N 0.46 0.00 2.00 7.15 0.00 -1.90 -2.16 103.07 108.62 3dyo h GLY 194 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dyo h GLY 194 CO 0.01 0.00 -0.02 1.76 0.00 0.00 0.00 176.54 178.29 3dyo h SER 195 N 0.00 0.00 1.04 0.19 0.02 -1.14 0.55 113.55 114.21 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 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 3dyo h SER 195 CO 0.01 0.02 0.00 1.88 -1.14 0.00 0.00 176.83 177.60 3dyo h TYR 196 N 0.00 0.00 -0.53 3.45 -1.99 -1.53 -1.93 116.97 114.45 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 0.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.90 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 -2.65 3.55 -2.57 3.88 4.77 0.16 -4.44 117.00 119.71 3dyo n LEU 197 Ca 0.02 -1.79 -0.24 0.00 -0.03 0.00 0.00 56.01 53.98 3dyo n LEU 197 Cb 0.31 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3dyo n LEU 197 CO 0.25 0.84 0.12 -0.62 -1.33 0.00 0.00 177.39 176.65 3dyo n GLU 198 N 1.38 2.96 -1.24 3.23 1.02 -0.72 -0.52 120.64 126.74 3dyo n GLU 198 Ca 0.20 -4.30 -0.31 0.00 -0.02 0.00 0.00 57.16 52.73 3dyo n GLU 198 Cb 0.57 -2.06 0.08 0.00 -0.02 0.00 0.00 31.44 30.01 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 -0.37 7.18 -4.77 1.62 2.03 -0.26 -4.97 116.55 117.01 3dyo n ASP 199 Ca 0.33 -3.65 -0.37 0.00 0.52 0.00 0.00 54.79 51.61 3dyo n ASP 199 Cb 0.66 -0.98 -0.00 0.00 -0.72 0.00 0.00 41.12 40.08 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 -3.45 3.72 -1.00 -0.67 1.11 -1.26 -4.54 119.66 113.58 3dyo s GLN 200 Ca 0.59 1.86 -0.24 0.00 0.01 0.00 0.00 55.36 57.59 3dyo s GLN 200 Cb 0.46 -2.44 -0.03 0.00 -1.01 0.00 0.00 33.01 29.99 3dyo s GLN 200 CO 0.00 -0.61 1.85 0.34 0.01 0.00 0.00 175.29 176.89 3dyo s ASP 201 N -1.24 5.43 0.25 5.90 2.15 -1.25 -4.82 116.67 123.07 3dyo s ASP 201 Ca 0.63 -1.08 -0.21 0.00 0.43 0.00 0.00 52.55 52.32 3dyo s ASP 201 Cb -0.31 -2.57 0.06 0.00 -0.30 0.00 0.00 42.92 39.80 3dyo s ASP 201 CO 0.38 -2.53 0.91 0.00 -0.17 0.00 0.00 175.17 173.76 3dyo s MET 202 N 6.43 1.63 0.36 4.34 0.23 -1.26 -5.02 119.30 126.02 3dyo s MET 202 Ca 0.65 -1.01 -0.28 0.00 -1.03 0.00 0.00 55.69 54.02 3dyo s MET 202 Cb -0.04 0.48 -0.11 0.00 -1.53 0.00 0.00 34.83 33.64 3dyo s MET 202 CO 0.01 -0.76 1.48 -1.58 -2.03 0.00 0.00 175.02 172.14 3dyo s TRP 203 N -2.66 2.67 -0.46 3.16 0.52 -1.26 -4.38 118.94 116.53 3dyo s TRP 203 Ca 0.17 1.15 -0.18 0.00 0.02 0.00 0.00 56.10 57.26 3dyo s TRP 203 Cb -0.03 -3.98 0.04 0.00 -1.15 0.00 0.00 33.47 28.35 3dyo s TRP 203 CO 0.07 -2.91 0.50 1.03 0.02 0.00 0.00 176.95 175.66 3dyo s ARG 204 N -1.84 3.09 0.03 4.98 1.81 0.21 -4.93 118.95 122.30 3dyo s ARG 204 Ca 0.54 -0.89 0.00 0.00 -1.72 0.00 0.00 55.73 53.66 3dyo s ARG 204 Cb -0.46 -4.04 -0.00 0.00 -0.45 0.00 0.00 34.95 30.00 3dyo s ARG 204 CO 0.60 -1.02 0.01 -1.33 -0.68 0.00 0.00 175.30 172.88 3dyo n MET 205 N 5.76 1.21 -3.83 3.54 2.81 -1.26 -2.62 117.12 122.73 3dyo n MET 205 Ca -0.08 -0.25 -0.06 0.00 -1.81 0.00 0.00 57.70 55.50 3dyo n MET 205 Cb 0.46 0.12 0.00 0.00 -0.71 0.00 0.00 33.22 33.09 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 -1.19 -0.12 0.00 7.83 1.04 -1.26 -4.83 113.70 115.18 3dyo s SER 206 Ca 0.01 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.67 3dyo s SER 206 Cb 0.00 0.70 0.00 0.00 0.10 0.00 0.00 66.02 66.82 3dyo s SER 206 CO 0.01 -1.34 0.00 0.61 0.98 0.00 0.00 173.24 173.49 3dyo n GLY 207 N -0.52 0.49 3.39 7.32 0.00 0.09 -2.04 105.19 113.91 3dyo n GLY 207 Ca -0.06 -2.31 -0.45 0.00 0.00 0.00 0.00 46.02 43.20 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 -0.42 5.08 -2.11 -0.61 1.01 -1.16 -1.17 121.20 121.81 3dyo s ILE 208 Ca 0.00 -1.77 0.18 0.00 0.00 0.00 0.00 60.65 59.06 3dyo s ILE 208 Cb 0.00 -4.60 0.11 0.00 0.01 0.00 0.00 42.46 37.98 3dyo s ILE 208 CO 0.00 -1.25 1.03 2.22 0.00 0.00 0.00 174.94 176.95 3dyo n PHE 209 N 5.55 0.00 -4.35 3.97 1.16 -0.67 -0.14 117.46 122.97 3dyo n PHE 209 Ca 0.13 0.00 -0.25 0.00 -1.87 0.00 0.00 57.45 55.46 3dyo n PHE 209 Cb 0.47 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.25 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 -1.61 2.06 0.78 3.97 0.52 -1.02 -4.28 118.95 119.37 3dyo s ARG 210 Ca 0.20 -1.78 -0.14 0.00 -0.52 0.00 0.00 55.73 53.49 3dyo s ARG 210 Cb 0.15 -1.90 0.05 0.00 0.52 0.00 0.00 34.95 33.76 3dyo s ARG 210 CO 0.27 0.12 1.08 -0.25 0.02 0.00 0.00 175.30 176.54 3dyo n ASP 211 N -0.95 0.70 -4.19 0.23 8.00 -1.26 -4.38 116.55 114.70 3dyo n ASP 211 Ca -0.04 0.61 -0.29 0.00 0.71 0.00 0.00 54.79 55.78 3dyo n ASP 211 Cb 0.63 -1.46 -0.16 0.00 -0.02 0.00 0.00 41.12 40.10 3dyo n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dyo s VAL 212 N -2.00 1.72 0.22 2.53 1.01 -1.26 -0.52 120.40 122.09 3dyo s VAL 212 Ca 0.73 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.70 3dyo s VAL 212 Cb -0.31 -1.47 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3dyo s VAL 212 CO 0.51 0.49 0.45 -0.94 0.00 0.00 0.00 175.10 175.60 3dyo s SER 213 N 0.02 -0.10 -0.07 3.32 1.04 -0.51 -0.38 113.70 117.01 3dyo s SER 213 Ca -0.06 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 55.61 3dyo s SER 213 Cb -0.13 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.54 3dyo s SER 213 CO 0.03 -1.07 -0.22 -0.76 0.98 0.00 0.00 173.24 172.21 3dyo s LEU 214 N -2.97 2.00 -0.09 2.42 1.43 -0.43 -0.26 118.68 120.79 3dyo s LEU 214 Ca 0.18 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 3dyo s LEU 214 Cb 0.00 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.97 3dyo s LEU 214 CO 0.04 0.17 -0.17 -0.22 0.23 0.00 0.00 176.35 176.40 3dyo s LEU 215 N 0.18 1.82 -0.20 1.79 2.96 -0.47 -1.44 118.68 123.33 3dyo s LEU 215 Ca -0.12 -0.42 -0.10 0.00 -0.22 0.00 0.00 54.13 53.27 3dyo s LEU 215 Cb -0.16 -1.09 -0.05 0.00 0.50 0.00 0.00 46.19 45.39 3dyo s LEU 215 CO 0.06 0.07 0.13 -2.28 -1.32 0.00 0.00 176.35 173.01 3dyo s HIS 216 N 0.62 3.39 0.08 5.38 5.65 0.65 -1.51 115.29 129.54 3dyo s HIS 216 Ca -0.14 0.30 0.08 0.00 0.25 0.00 0.00 55.06 55.54 3dyo s HIS 216 Cb -0.16 -2.16 -0.03 0.00 -1.18 0.00 0.00 32.58 29.04 3dyo s HIS 216 CO 0.04 0.25 -0.20 0.15 -0.65 0.00 0.00 174.74 174.34 3dyo s LYS 217 N 0.43 1.19 0.78 2.88 -0.14 0.52 -4.69 119.74 120.71 3dyo s LYS 217 Ca 0.08 -1.05 -0.11 0.00 -1.36 0.00 0.00 55.97 53.53 3dyo s LYS 217 Cb -0.11 -1.38 0.06 0.00 -1.68 0.00 0.00 37.83 34.71 3dyo s LYS 217 CO -0.01 0.33 1.09 -2.14 -0.76 0.00 0.00 175.35 173.86 3dyo s PRO 218 N -1.60 2.24 0.25 -1.68 0.02 -1.26 0.83 135.00 133.79 3dyo s PRO 218 Ca 0.06 1.13 -0.02 0.00 0.02 0.00 0.00 61.00 62.19 3dyo s PRO 218 Cb -0.09 -1.90 0.30 0.00 0.02 0.00 0.00 34.50 32.82 3dyo s PRO 218 CO 0.03 -1.65 1.72 1.15 -0.33 0.00 0.00 177.00 177.92 3dyo h THR 219 N -1.13 1.25 -3.57 0.99 2.02 -1.93 -3.34 112.91 107.20 3dyo h THR 219 Ca -0.44 -1.12 -0.67 0.00 0.77 0.00 0.00 66.41 64.95 3dyo h THR 219 Cb 1.23 1.02 -0.17 0.00 -1.74 0.00 0.00 68.15 68.49 3dyo h THR 219 CO 0.52 0.39 -0.03 -0.89 0.37 0.00 0.00 175.52 175.88 3dyo s THR 220 N -4.83 4.95 0.17 3.16 2.01 -1.26 -3.88 115.64 115.96 3dyo s THR 220 Ca -0.09 -0.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.80 3dyo s THR 220 Cb 0.14 -4.11 -0.02 0.00 0.01 0.00 0.00 72.50 68.52 3dyo s THR 220 CO 0.82 -0.48 0.24 0.00 -0.69 0.00 0.00 174.62 174.51 3dyo s GLN 221 N 2.50 1.14 -0.28 4.92 -2.07 -0.74 -4.89 119.66 120.25 3dyo s GLN 221 Ca 0.18 -1.26 -0.29 0.00 -1.82 0.00 0.00 55.36 52.17 3dyo s GLN 221 Cb -0.15 0.35 0.00 0.00 -1.09 0.00 0.00 33.01 32.12 3dyo s GLN 221 CO 0.16 -0.40 1.25 0.42 -1.32 0.00 0.00 175.29 175.40 3dyo s ILE 222 N -4.00 4.24 -0.28 3.63 1.01 -1.26 -1.36 121.20 123.17 3dyo s ILE 222 Ca 0.20 1.43 0.21 0.00 0.00 0.00 0.00 60.65 62.49 3dyo s ILE 222 Cb 0.04 -4.17 -0.30 0.00 0.01 0.00 0.00 42.46 38.04 3dyo s ILE 222 CO 0.02 -0.41 0.57 -1.54 0.00 0.00 0.00 174.94 173.58 3dyo n SER 223 N 7.28 0.41 -3.56 3.58 3.41 0.64 -4.91 113.62 120.48 3dyo n SER 223 Ca 0.14 -0.27 -0.09 0.00 -0.26 0.00 0.00 58.87 58.40 3dyo n SER 223 Cb 0.46 1.70 -0.04 0.00 -0.26 0.00 0.00 64.21 66.07 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 -4.01 -0.33 -0.19 4.04 2.15 -1.20 -4.87 116.67 112.27 3dyo s ASP 224 Ca -0.03 0.20 -0.20 0.00 0.43 0.00 0.00 52.55 52.95 3dyo s ASP 224 Cb 0.14 0.30 0.05 0.00 -0.30 0.00 0.00 42.92 43.11 3dyo s ASP 224 CO 0.86 -0.41 0.55 0.72 -0.17 0.00 0.00 175.17 176.72 3dyo s PHE 225 N -1.96 -0.59 -0.05 -5.34 -0.12 -1.26 -1.22 117.98 107.45 3dyo s PHE 225 Ca 0.02 1.41 0.04 0.00 -0.05 0.00 0.00 56.93 58.35 3dyo s PHE 225 Cb -0.01 0.22 0.00 0.00 -0.63 0.00 0.00 43.02 42.60 3dyo s PHE 225 CO -0.03 -0.32 -0.15 -1.01 -0.05 0.00 0.00 175.22 173.66 3dyo s HIS 226 N 0.11 1.56 -0.12 3.49 3.76 0.90 -4.84 115.29 120.16 3dyo s HIS 226 Ca -0.01 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.44 3dyo s HIS 226 Cb -0.04 -1.07 -0.01 0.00 1.11 0.00 0.00 32.58 32.57 3dyo s HIS 226 CO 0.02 -0.18 -0.16 0.08 -0.85 0.00 0.00 174.74 173.64 3dyo s VAL 227 N 0.18 2.75 0.08 -0.90 1.01 -1.26 -0.88 120.40 121.38 3dyo s VAL 227 Ca -0.06 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.19 3dyo s VAL 227 Cb -0.12 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 3dyo s VAL 227 CO 0.02 0.54 -0.13 0.00 0.00 0.00 0.00 175.10 175.53 3dyo s ALA 228 N 0.28 1.12 -0.08 5.51 0.00 -0.03 -4.85 121.76 123.73 3dyo s ALA 228 Ca -0.12 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 50.81 3dyo s ALA 228 Cb -0.16 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.92 3dyo s ALA 228 CO 0.06 0.10 -0.04 0.95 0.00 0.00 0.00 175.76 176.83 3dyo s THR 229 N -1.57 0.67 0.29 0.00 -4.23 -1.26 -0.87 115.64 108.67 3dyo s THR 229 Ca -0.01 -0.11 0.11 0.00 -1.18 0.00 0.00 61.69 60.50 3dyo s THR 229 Cb -0.08 -0.73 -0.05 0.00 1.34 0.00 0.00 72.50 72.98 3dyo s THR 229 CO 0.02 0.29 -0.17 0.00 -0.54 0.00 0.00 174.62 174.22 3dyo s ARG 230 N 1.50 1.68 0.25 3.99 1.70 -0.88 -4.82 118.95 122.37 3dyo s ARG 230 Ca -0.01 -1.79 0.02 0.00 -0.47 0.00 0.00 55.73 53.47 3dyo s ARG 230 Cb -0.13 -1.68 -0.04 0.00 -0.57 0.00 0.00 34.95 32.53 3dyo s ARG 230 CO -0.04 0.26 0.16 -0.06 -1.08 0.00 0.00 175.30 174.55 3dyo s PHE 231 N -2.59 1.38 0.40 5.89 0.40 -1.26 -1.01 117.98 121.18 3dyo s PHE 231 Ca 0.30 -1.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.16 3dyo s PHE 231 Cb -0.03 -0.66 0.09 0.00 0.51 0.00 0.00 43.02 42.93 3dyo s PHE 231 CO 0.15 -0.65 0.54 0.27 0.70 0.00 0.00 175.22 176.23 3dyo n ASN 232 N -0.66 0.30 -0.36 1.36 6.94 -0.81 -4.93 115.26 117.11 3dyo n ASN 232 Ca 0.03 -1.36 0.01 0.00 -0.02 0.00 0.00 54.58 53.24 3dyo n ASN 232 Cb 0.65 -0.39 0.15 0.00 -2.36 0.00 0.00 39.78 37.83 3dyo n ASN 232 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 3dyo h ASP 233 N -0.57 1.02 -0.27 0.53 3.04 -2.02 -2.75 116.42 115.40 3dyo h ASP 233 Ca -0.18 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.57 3dyo h ASP 233 Cb 0.55 -0.22 -0.03 0.00 -1.04 0.00 0.00 39.33 38.60 3dyo h ASP 233 CO 0.15 0.67 -0.00 -0.90 -2.04 0.00 0.00 179.24 177.12 3dyo n ASP 234 N -4.50 3.52 -1.01 4.15 5.68 -1.26 -4.96 116.55 118.17 3dyo n ASP 234 Ca 0.14 -3.18 -0.13 0.00 -0.50 0.00 0.00 54.79 51.11 3dyo n ASP 234 Cb 0.14 -0.56 -0.06 0.00 -1.14 0.00 0.00 41.12 39.50 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 -0.70 0.00 1.26 2.11 3.01 -1.04 -4.88 117.46 117.22 3dyo n PHE 235 Ca 0.24 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.83 3dyo n PHE 235 Cb 0.92 -2.41 0.33 0.00 -0.01 0.00 0.00 39.48 38.31 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 -0.23 1.55 -3.98 4.37 3.41 -1.26 -4.61 113.62 112.86 3dyo n SER 236 Ca -0.13 -1.30 -0.10 0.00 -0.26 0.00 0.00 58.87 57.08 3dyo n SER 236 Cb 0.45 0.13 -0.11 0.00 -0.26 0.00 0.00 64.21 64.41 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 -2.29 0.33 0.14 4.33 0.52 -1.26 0.34 118.95 121.06 3dyo s ARG 237 Ca 0.28 -0.57 -0.12 0.00 -0.52 0.00 0.00 55.73 54.79 3dyo s ARG 237 Cb 0.20 0.01 0.01 0.00 0.52 0.00 0.00 34.95 35.69 3dyo s ARG 237 CO 0.45 -0.02 0.33 0.00 0.02 0.00 0.00 175.30 176.07 3dyo s ALA 238 N -1.28 -0.46 -0.08 2.13 0.00 -0.49 -1.92 121.76 119.65 3dyo s ALA 238 Ca -0.13 -0.48 0.01 0.00 0.00 0.00 0.00 51.96 51.36 3dyo s ALA 238 Cb -0.09 0.71 0.02 0.00 0.00 0.00 0.00 23.12 23.76 3dyo s ALA 238 CO -0.01 -0.63 -0.10 0.08 0.00 0.00 0.00 175.76 175.10 3dyo s VAL 239 N -3.88 1.06 -0.20 0.00 1.01 -0.18 0.06 120.40 118.27 3dyo s VAL 239 Ca 0.09 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 3dyo s VAL 239 Cb 0.03 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 3dyo s VAL 239 CO -0.07 0.35 0.16 -0.22 0.00 0.00 0.00 175.10 175.32 3dyo s LEU 240 N 0.96 4.21 -0.14 3.92 0.20 0.33 -2.07 118.68 126.09 3dyo s LEU 240 Ca -0.09 0.27 0.01 0.00 0.69 0.00 0.00 54.13 55.00 3dyo s LEU 240 Cb -0.15 -2.13 -0.01 0.00 -0.43 0.00 0.00 46.19 43.47 3dyo s LEU 240 CO 0.00 0.16 -0.16 -0.70 -0.29 0.00 0.00 176.35 175.37 3dyo s GLU 241 N 0.41 3.24 -0.18 1.98 2.12 -0.04 -0.03 118.70 126.20 3dyo s GLU 241 Ca 0.09 -0.75 0.01 0.00 0.36 0.00 0.00 54.97 54.68 3dyo s GLU 241 Cb -0.11 -2.59 0.03 0.00 0.26 0.00 0.00 34.13 31.72 3dyo s GLU 241 CO -0.01 0.09 -0.13 0.00 -0.54 0.00 0.00 175.26 174.67 3dyo s ALA 242 N 0.64 2.04 -0.16 6.30 0.00 -0.14 -0.85 121.76 129.59 3dyo s ALA 242 Ca -0.08 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 50.60 3dyo s ALA 242 Cb -0.16 -1.20 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 3dyo s ALA 242 CO 0.03 -0.61 0.30 -2.00 0.00 0.00 0.00 175.76 173.47 3dyo s GLU 243 N 1.39 4.25 -0.04 0.00 2.12 -0.06 -0.59 118.70 125.77 3dyo s GLU 243 Ca 0.02 0.11 0.05 0.00 0.36 0.00 0.00 54.97 55.50 3dyo s GLU 243 Cb -0.15 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.81 3dyo s GLU 243 CO -0.10 0.24 -0.20 0.08 -0.54 0.00 0.00 175.26 174.75 3dyo s VAL 244 N 0.45 1.62 0.11 3.70 1.01 0.70 -0.07 120.40 127.92 3dyo s VAL 244 Ca 0.17 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.41 3dyo s VAL 244 Cb -0.13 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 3dyo s VAL 244 CO 0.04 0.46 -0.20 -1.10 0.00 0.00 0.00 175.10 174.30 3dyo s GLN 245 N -0.07 1.74 0.30 2.72 -0.21 -0.35 -1.13 119.66 122.65 3dyo s GLN 245 Ca -0.03 -1.19 0.08 0.00 0.02 0.00 0.00 55.36 54.24 3dyo s GLN 245 Cb -0.12 -2.08 -0.06 0.00 1.00 0.00 0.00 33.01 31.76 3dyo s GLN 245 CO 0.02 0.48 -0.09 0.00 -2.12 0.00 0.00 175.29 173.59 3dyo s MET 246 N -2.04 1.64 0.19 2.91 0.23 -0.77 -0.26 119.30 121.20 3dyo s MET 246 Ca 0.17 -1.82 0.09 0.00 -1.03 0.00 0.00 55.69 53.09 3dyo s MET 246 Cb -0.10 -1.39 -0.04 0.00 -1.53 0.00 0.00 34.83 31.76 3dyo s MET 246 CO 0.09 0.11 -0.18 0.00 -2.03 0.00 0.00 175.02 173.00 3dyo n GLY 248 N -0.01 -0.78 3.67 0.00 0.00 -1.25 -1.79 105.19 105.03 3dyo n GLY 248 Ca -0.11 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 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 0.00 4.27 0.31 1.61 2.12 -1.26 -5.00 118.70 120.75 3dyo s GLU 249 Ca 0.00 0.94 -0.29 0.00 0.36 0.00 0.00 54.97 55.98 3dyo s GLU 249 Cb 0.00 -3.58 -0.10 0.00 0.26 0.00 0.00 34.13 30.71 3dyo s GLU 249 CO 0.00 -0.33 1.23 -0.51 -0.54 0.00 0.00 175.26 175.11 3dyo s LEU 250 N 2.16 4.47 -0.02 2.70 1.43 -1.26 -5.02 118.68 123.14 3dyo s LEU 250 Ca 0.36 2.53 -0.02 0.00 -1.03 0.00 0.00 54.13 55.98 3dyo s LEU 250 Cb -0.16 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.42 3dyo s LEU 250 CO 0.12 -0.39 0.05 -0.13 0.23 0.00 0.00 176.35 176.23 3dyo s ARG 251 N -1.67 0.05 0.59 1.70 1.81 -1.26 -5.02 118.95 115.15 3dyo s ARG 251 Ca 0.47 0.10 0.39 0.00 -1.72 0.00 0.00 55.73 54.97 3dyo s ARG 251 Cb -0.37 -0.00 2.12 0.00 -0.45 0.00 0.00 34.95 36.25 3dyo s ARG 251 CO 0.48 -0.03 2.21 -0.44 -0.68 0.00 0.00 175.30 176.84 3dyo h ASP 252 N 6.22 0.00 0.31 0.23 3.32 -2.00 -1.01 116.42 123.50 3dyo h ASP 252 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3dyo h ASP 252 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3dyo h ASP 252 CO 0.47 0.00 -0.11 0.00 -1.72 0.00 0.00 179.24 177.89 3dyo n TYR 253 N -2.90 0.00 -2.35 4.55 0.18 -1.26 -4.90 117.16 110.48 3dyo n TYR 253 Ca -0.02 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.43 3dyo n TYR 253 Cb 0.08 -0.16 -0.02 0.00 -0.38 0.00 0.00 39.34 38.86 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 -2.42 3.67 0.12 -3.48 1.43 -0.38 -1.08 118.68 116.53 3dyo s LEU 254 Ca 0.30 1.78 -0.07 0.00 -1.03 0.00 0.00 54.13 55.11 3dyo s LEU 254 Cb 0.20 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.87 3dyo s LEU 254 CO 0.46 -0.84 0.18 -0.13 0.23 0.00 0.00 176.35 176.26 3dyo s ARG 255 N -3.74 0.95 -0.02 1.70 1.81 0.10 -4.16 118.95 115.59 3dyo s ARG 255 Ca 0.63 -1.14 0.03 0.00 -1.72 0.00 0.00 55.73 53.54 3dyo s ARG 255 Cb -0.14 0.33 -0.00 0.00 -0.45 0.00 0.00 34.95 34.68 3dyo s ARG 255 CO 0.28 -0.31 -0.11 0.08 -0.68 0.00 0.00 175.30 174.56 3dyo s VAL 256 N -3.93 0.95 -0.08 3.52 1.01 -0.69 -1.40 120.40 119.78 3dyo s VAL 256 Ca 0.12 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3dyo s VAL 256 Cb 0.05 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.61 3dyo s VAL 256 CO -0.05 0.28 -0.20 -0.89 0.00 0.00 0.00 175.10 174.24 3dyo s THR 257 N 0.00 1.72 -0.14 3.92 2.01 -0.08 -1.76 115.64 121.32 3dyo s THR 257 Ca -0.01 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.18 3dyo s THR 257 Cb -0.08 -1.51 0.00 0.00 0.01 0.00 0.00 72.50 70.93 3dyo s THR 257 CO 0.00 0.49 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.53 3dyo s VAL 258 N 0.39 2.31 0.01 3.82 1.01 -0.02 -0.37 120.40 127.55 3dyo s VAL 258 Ca -0.16 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 60.97 3dyo s VAL 258 Cb -0.17 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 3dyo s VAL 258 CO 0.07 0.54 -0.15 -0.94 0.00 0.00 0.00 175.10 174.62 3dyo s SER 259 N 0.70 1.74 -0.11 3.32 1.04 -0.56 -0.75 113.70 119.08 3dyo s SER 259 Ca -0.09 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.02 3dyo s SER 259 Cb -0.16 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 65.77 3dyo s SER 259 CO 0.01 0.14 -0.13 -0.22 0.98 0.00 0.00 173.24 174.02 3dyo s LEU 260 N -0.60 2.72 -0.03 2.42 2.96 0.66 -1.22 118.68 125.59 3dyo s LEU 260 Ca 0.05 -0.29 0.06 0.00 -0.22 0.00 0.00 54.13 53.73 3dyo s LEU 260 Cb -0.06 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 45.02 3dyo s LEU 260 CO 0.00 0.22 -0.22 0.26 -1.32 0.00 0.00 176.35 175.29 3dyo s TRP 261 N 0.04 2.05 -0.34 5.38 0.52 -0.51 0.28 118.94 126.36 3dyo s TRP 261 Ca -0.05 -0.46 -0.04 0.00 0.02 0.00 0.00 56.10 55.58 3dyo s TRP 261 Cb -0.14 -1.33 0.06 0.00 -1.15 0.00 0.00 33.47 30.91 3dyo s TRP 261 CO 0.04 -0.09 0.09 -1.14 0.02 0.00 0.00 176.95 175.88 3dyo s GLN 262 N -0.39 2.38 6.46 4.98 2.00 0.28 -1.66 119.66 133.71 3dyo s GLN 262 Ca 0.05 -1.40 0.00 0.00 -2.00 0.00 0.00 55.36 52.01 3dyo s GLN 262 Cb -0.10 -3.39 0.00 0.00 0.80 0.00 0.00 33.01 30.32 3dyo s GLN 262 CO 0.00 -0.77 0.00 0.41 -0.50 0.00 0.00 175.29 174.44 3dyo n GLY 263 N 4.68 3.49 0.01 2.59 0.00 -1.26 0.54 105.19 115.24 3dyo n GLY 263 Ca -0.10 -0.04 0.16 0.00 0.00 0.00 0.00 46.02 46.04 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 14.00 0.80 -4.25 1.61 1.02 -1.26 -4.81 120.64 127.75 3dyo n GLU 264 Ca 0.00 -0.02 -0.35 0.00 -0.02 0.00 0.00 57.16 56.77 3dyo n GLU 264 Cb 0.00 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 29.82 3dyo n GLU 264 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyo s THR 265 N -2.22 4.43 -0.42 2.62 2.01 0.19 -5.04 115.64 117.22 3dyo s THR 265 Ca 0.40 -0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.97 3dyo s THR 265 Cb 0.21 -2.92 0.02 0.00 0.01 0.00 0.00 72.50 69.82 3dyo s THR 265 CO 0.40 0.55 0.88 -1.58 -0.69 0.00 0.00 174.62 174.18 3dyo s GLN 266 N -0.31 3.64 0.08 4.92 0.74 -1.26 0.10 119.66 127.57 3dyo s GLN 266 Ca 0.07 0.26 0.23 0.00 0.05 0.00 0.00 55.36 55.97 3dyo s GLN 266 Cb -0.12 -3.87 0.12 0.00 1.10 0.00 0.00 33.01 30.24 3dyo s GLN 266 CO 0.02 -1.06 1.10 1.33 -0.55 0.00 0.00 175.29 176.13 3dyo n VAL 267 N 6.14 0.24 -3.54 1.34 0.24 0.14 -4.95 118.33 117.94 3dyo n VAL 267 Ca 0.05 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 61.97 3dyo n VAL 267 Cb 0.48 0.08 -0.04 0.00 -1.47 0.00 0.00 33.84 32.89 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 -3.20 -1.86 -0.02 2.33 0.00 -1.10 -4.99 121.76 112.91 3dyo s ALA 268 Ca 0.04 1.31 -0.29 0.00 0.00 0.00 0.00 51.96 53.02 3dyo s ALA 268 Cb 0.14 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 23.17 3dyo s ALA 268 CO 0.78 -0.47 0.65 0.45 0.00 0.00 0.00 175.76 177.17 3dyo s SER 269 N -1.68 -0.62 0.01 0.00 0.15 -1.26 -0.24 113.70 110.05 3dyo s SER 269 Ca -0.00 0.58 -0.13 0.00 0.70 0.00 0.00 55.95 57.10 3dyo s SER 269 Cb -0.01 0.54 0.02 0.00 -1.71 0.00 0.00 66.02 64.86 3dyo s SER 269 CO -0.02 -0.66 0.27 -0.83 1.20 0.00 0.00 173.24 173.21 3dyo s GLY 270 N -1.44 -0.09 0.01 9.45 0.00 0.07 -4.99 107.32 110.34 3dyo s GLY 270 Ca -0.09 0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.70 3dyo s GLY 270 CO 0.06 -0.12 -0.02 -1.59 0.00 0.00 0.00 173.10 171.43 3dyo s THR 271 N -1.93 0.07 0.15 0.90 2.01 -1.26 -0.84 115.64 114.75 3dyo s THR 271 Ca -0.10 -0.46 -0.23 0.00 0.31 0.00 0.00 61.69 61.22 3dyo s THR 271 Cb -0.03 -0.15 0.07 0.00 0.01 0.00 0.00 72.50 72.40 3dyo s THR 271 CO 0.00 -0.24 0.59 0.00 -0.69 0.00 0.00 174.62 174.29 3dyo s ALA 272 N -0.72 -1.58 0.77 7.40 0.00 -0.72 -5.00 121.76 121.91 3dyo s ALA 272 Ca -0.08 0.49 -0.11 0.00 0.00 0.00 0.00 51.96 52.26 3dyo s ALA 272 Cb -0.05 0.86 0.06 0.00 0.00 0.00 0.00 23.12 23.99 3dyo s ALA 272 CO -0.00 -0.76 1.14 -1.25 0.00 0.00 0.00 175.76 174.89 3dyo s PRO 273 N -3.69 2.30 0.75 0.00 0.04 -1.26 -1.71 135.00 131.43 3dyo s PRO 273 Ca 0.01 0.21 -0.11 0.00 0.04 0.00 0.00 61.00 61.15 3dyo s PRO 273 Cb -0.01 -1.99 0.04 0.00 0.04 0.00 0.00 34.50 32.58 3dyo s PRO 273 CO -0.12 -1.37 1.08 -0.06 0.04 0.00 0.00 177.00 176.56 3dyo s PHE 274 N -3.48 2.73 0.00 0.56 0.40 -1.26 -4.86 117.98 112.07 3dyo s PHE 274 Ca 0.60 1.52 0.00 0.00 -0.60 0.00 0.00 56.93 58.45 3dyo s PHE 274 Cb -0.11 -3.00 0.00 0.00 0.51 0.00 0.00 43.02 40.42 3dyo s PHE 274 CO 0.50 -1.63 0.00 0.41 0.70 0.00 0.00 175.22 175.19 3dyo n GLY 275 N -1.44 2.47 3.93 4.36 0.00 -0.02 -4.97 105.19 109.53 3dyo n GLY 275 Ca 0.09 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 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 1.68 1.06 -0.02 0.00 0.38 -4.81 107.32 105.61 3dyo s GLY 276 Ca 0.00 -0.94 -0.12 0.00 0.00 0.00 0.00 44.72 43.65 3dyo s GLY 276 CO 0.00 -0.46 1.07 -1.83 0.00 0.00 0.00 173.10 171.88 3dyo s GLU 277 N -5.41 -0.04 0.18 2.90 -1.05 -1.26 -4.47 118.70 109.56 3dyo s GLU 277 Ca 0.63 0.64 -0.31 0.00 -0.15 0.00 0.00 54.97 55.78 3dyo s GLU 277 Cb -0.10 -1.67 -0.10 0.00 -0.44 0.00 0.00 34.13 31.82 3dyo s GLU 277 CO 0.47 -3.08 1.57 0.42 0.95 0.00 0.00 175.26 175.59 3dyo s ILE 278 N -2.79 2.56 -0.25 1.83 1.01 -1.26 -4.23 121.20 118.07 3dyo s ILE 278 Ca 0.66 0.41 -0.07 0.00 0.00 0.00 0.00 60.65 61.66 3dyo s ILE 278 Cb -0.21 -3.26 -0.13 0.00 0.01 0.00 0.00 42.46 38.87 3dyo s ILE 278 CO 0.60 0.04 -0.28 -0.38 0.00 0.00 0.00 174.94 174.92 3dyo n ILE 279 N 3.72 1.36 -2.87 2.92 2.08 0.72 -4.92 119.36 122.37 3dyo n ILE 279 Ca 0.13 -0.42 0.00 0.00 0.56 0.00 0.00 62.75 63.02 3dyo n ILE 279 Cb 0.38 -1.63 0.00 0.00 -0.75 0.00 0.00 39.64 37.64 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 -3.74 0.00 0.29 4.38 5.68 -0.75 -5.00 116.55 117.42 3dyo n ASP 280 Ca -0.46 -0.59 0.15 0.00 -0.50 0.00 0.00 54.79 53.39 3dyo n ASP 280 Cb 0.89 0.00 0.90 0.00 -1.14 0.00 0.00 41.12 41.77 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 -2.04 -0.48 114.58 115.23 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 0.02 -0.12 0.54 -1.40 0.00 0.00 179.01 178.05 3dyo n ARG 282 N -3.75 1.01 0.00 2.33 5.12 -1.26 -5.06 116.66 115.05 3dyo n ARG 282 Ca -0.03 -0.48 0.00 0.00 -1.93 0.00 0.00 57.85 55.41 3dyo n ARG 282 Cb 0.11 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.92 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 1.25 0.28 0.21 -0.13 0.00 -0.19 -5.07 105.19 101.54 3dyo n GLY 283 Ca 0.16 -1.82 -0.01 0.00 0.00 0.00 0.00 46.02 44.34 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 4.00 3.54 -0.02 0.00 -1.26 -0.20 105.19 111.25 3dyo n GLY 284 Ca 0.00 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 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 -1.90 2.90 -0.22 1.61 1.51 -1.26 -4.88 117.35 115.10 3dyo s TYR 285 Ca 0.02 0.17 0.28 0.00 -1.01 0.00 0.00 57.07 56.54 3dyo s TYR 285 Cb 0.00 -3.92 1.12 0.00 -0.11 0.00 0.00 41.96 39.05 3dyo s TYR 285 CO 0.01 -1.16 1.84 0.00 -1.11 0.00 0.00 175.55 175.13 3dyo h ALA 286 N 9.14 1.00 -0.62 3.71 0.00 -1.94 0.12 119.26 130.66 3dyo h ALA 286 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3dyo h ALA 286 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3dyo h ALA 286 CO 1.03 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 179.88 3dyo n ASP 287 N -2.68 5.21 -4.17 0.00 5.75 -1.26 -3.47 116.55 115.93 3dyo n ASP 287 Ca 0.02 -2.66 -0.11 0.00 -0.01 0.00 0.00 54.79 52.03 3dyo n ASP 287 Cb 0.29 -0.63 -0.10 0.00 -1.03 0.00 0.00 41.12 39.66 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 -2.25 1.11 -0.02 0.11 0.52 -1.05 -1.85 118.95 115.52 3dyo s ARG 288 Ca 0.53 -1.54 -0.23 0.00 -0.52 0.00 0.00 55.73 53.97 3dyo s ARG 288 Cb 0.37 0.27 0.05 0.00 0.52 0.00 0.00 34.95 36.16 3dyo s ARG 288 CO 0.21 -0.35 0.50 0.54 0.02 0.00 0.00 175.30 176.22 3dyo s VAL 289 N -4.11 0.03 -0.12 3.52 0.11 -0.28 -0.84 120.40 118.70 3dyo s VAL 289 Ca 0.33 -0.24 0.02 0.00 -2.93 0.00 0.00 61.98 59.16 3dyo s VAL 289 Cb 0.07 -0.84 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 3dyo s VAL 289 CO 0.08 -0.13 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.66 3dyo s THR 290 N -1.43 1.68 -0.08 5.04 2.01 -1.26 -0.22 115.64 121.38 3dyo s THR 290 Ca -0.11 -0.74 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 3dyo s THR 290 Cb -0.02 -1.52 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 3dyo s THR 290 CO 0.06 0.48 0.08 -0.76 -0.69 0.00 0.00 174.62 173.79 3dyo s LEU 291 N 1.01 4.00 -0.21 4.42 2.01 0.25 -4.94 118.68 125.22 3dyo s LEU 291 Ca -0.05 0.28 0.00 0.00 0.01 0.00 0.00 54.13 54.37 3dyo s LEU 291 Cb -0.15 -2.06 0.02 0.00 0.01 0.00 0.00 46.19 44.02 3dyo s LEU 291 CO -0.03 0.36 -0.14 -0.13 1.01 0.00 0.00 176.35 177.42 3dyo s ARG 292 N -1.18 2.95 -0.09 1.70 0.52 -1.26 -0.97 118.95 120.62 3dyo s ARG 292 Ca 0.17 -0.87 0.04 0.00 -0.52 0.00 0.00 55.73 54.54 3dyo s ARG 292 Cb -0.12 -2.74 -0.01 0.00 0.52 0.00 0.00 34.95 32.61 3dyo s ARG 292 CO 0.06 -0.27 -0.22 -0.51 0.02 0.00 0.00 175.30 174.38 3dyo s LEU 293 N 1.31 2.21 0.14 2.53 1.43 0.96 -4.95 118.68 122.31 3dyo s LEU 293 Ca 0.03 -0.50 -0.24 0.00 -1.03 0.00 0.00 54.13 52.39 3dyo s LEU 293 Cb -0.14 -1.44 -0.08 0.00 0.03 0.00 0.00 46.19 44.56 3dyo s LEU 293 CO -0.09 0.19 0.74 0.20 0.23 0.00 0.00 176.35 177.62 3dyo s ASN 294 N 0.17 7.32 -0.17 2.29 0.01 -1.26 -0.51 114.94 122.80 3dyo s ASN 294 Ca -0.13 1.56 -0.01 0.00 -0.71 0.00 0.00 52.86 53.57 3dyo s ASN 294 Cb -0.16 -2.47 0.05 0.00 0.41 0.00 0.00 41.25 39.07 3dyo s ASN 294 CO 0.07 0.20 -0.02 -0.69 -1.51 0.00 0.00 177.10 175.15 3dyo s VAL 295 N -1.04 0.87 0.15 1.60 1.01 0.11 -4.91 120.40 118.19 3dyo s VAL 295 Ca 0.35 -0.55 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 3dyo s VAL 295 Cb -0.22 -1.15 -0.08 0.00 0.00 0.00 0.00 36.38 34.93 3dyo s VAL 295 CO 0.25 0.04 0.76 -1.61 0.00 0.00 0.00 175.10 174.53 3dyo s GLU 296 N 1.73 4.53 -1.31 2.72 0.41 -1.26 -1.40 118.70 124.12 3dyo s GLU 296 Ca 0.00 1.12 -0.16 0.00 -0.41 0.00 0.00 54.97 55.52 3dyo s GLU 296 Cb -0.16 -3.27 0.01 0.00 -1.78 0.00 0.00 34.13 28.94 3dyo s GLU 296 CO -0.07 0.56 0.50 0.09 -0.49 0.00 0.00 175.26 175.85 3dyo n ASN 297 N 1.69 -2.43 -4.74 -0.19 4.13 0.15 -4.89 115.26 108.99 3dyo n ASN 297 Ca -0.06 -1.16 -0.36 0.00 1.68 0.00 0.00 54.58 54.68 3dyo n ASN 297 Cb 0.49 -2.39 0.06 0.00 -1.54 0.00 0.00 39.78 36.40 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 -6.88 2.60 -0.26 3.52 0.04 -1.26 -4.94 135.00 127.82 3dyo s PRO 298 Ca 0.27 1.87 -0.26 0.00 0.04 0.00 0.00 61.00 62.92 3dyo s PRO 298 Cb -0.13 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.54 3dyo s PRO 298 CO 0.93 -1.51 0.91 0.15 0.04 0.00 0.00 177.00 177.52 3dyo s LYS 299 N -3.53 4.16 0.37 4.56 1.02 -1.26 -4.99 119.74 120.07 3dyo s LYS 299 Ca 0.78 1.03 -0.18 0.00 0.02 0.00 0.00 55.97 57.62 3dyo s LYS 299 Cb -0.32 -3.66 -0.10 0.00 -0.52 0.00 0.00 37.83 33.23 3dyo s LYS 299 CO 0.39 -0.61 0.84 -0.51 -0.92 0.00 0.00 175.35 174.54 3dyo s LEU 300 N 3.05 4.03 -0.07 3.17 1.43 -1.26 -4.46 118.68 124.56 3dyo s LEU 300 Ca 0.38 1.50 -0.11 0.00 -1.03 0.00 0.00 54.13 54.87 3dyo s LEU 300 Cb -0.15 -4.27 -0.05 0.00 0.03 0.00 0.00 46.19 41.75 3dyo s LEU 300 CO 0.08 -0.26 0.27 0.86 0.23 0.00 0.00 176.35 177.53 3dyo s TRP 301 N -2.04 3.65 0.26 0.29 -0.00 0.54 -3.93 118.94 117.70 3dyo s TRP 301 Ca 0.57 0.74 -0.18 0.00 -0.00 0.00 0.00 56.10 57.23 3dyo s TRP 301 Cb -0.10 -2.13 0.01 0.00 -0.00 0.00 0.00 33.47 31.25 3dyo s TRP 301 CO 0.16 0.66 0.62 -1.54 -0.00 0.00 0.00 176.95 176.85 3dyo s SER 302 N -0.93 -0.21 0.45 5.86 1.04 -0.81 -4.65 113.70 114.46 3dyo s SER 302 Ca 0.19 -0.71 0.25 0.00 0.48 0.00 0.00 55.95 56.16 3dyo s SER 302 Cb -0.14 0.67 0.94 0.00 0.10 0.00 0.00 66.02 67.59 3dyo s SER 302 CO 0.08 -1.26 1.83 0.00 0.98 0.00 0.00 173.24 174.88 3dyo h ALA 303 N 2.10 1.02 -0.18 5.32 0.00 -1.91 -1.97 119.26 123.64 3dyo h ALA 303 Ca -0.22 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.41 3dyo h ALA 303 Cb 1.25 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 3dyo h ALA 303 CO 0.28 0.26 -0.27 0.93 0.00 0.00 0.00 179.25 180.45 3dyo h GLU 304 N 0.00 0.50 -2.80 0.00 5.08 -1.94 -3.41 114.58 112.01 3dyo h GLU 304 Ca -0.00 -0.30 -0.57 0.00 -1.00 0.00 0.00 59.36 57.49 3dyo h GLU 304 Cb 0.73 0.03 -0.40 0.00 0.50 0.00 0.00 28.75 29.62 3dyo h GLU 304 CO 0.03 0.90 -0.80 0.42 -1.00 0.00 0.00 179.01 178.55 3dyo s ILE 305 N -4.15 0.27 -1.56 3.13 1.01 -1.14 -5.01 121.20 113.75 3dyo s ILE 305 Ca -0.13 -1.41 -0.11 0.00 0.00 0.00 0.00 60.65 58.99 3dyo s ILE 305 Cb 0.06 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 3dyo s ILE 305 CO 0.79 -0.85 2.68 -0.81 0.00 0.00 0.00 174.94 176.75 3dyo n PRO 306 N 4.52 3.40 -1.91 2.79 -0.04 -0.75 -1.93 135.00 141.08 3dyo n PRO 306 Ca 0.04 -2.37 -0.42 0.00 -0.04 0.00 0.00 63.50 60.71 3dyo n PRO 306 Cb 0.39 -2.98 -0.03 0.00 -0.04 0.00 0.00 33.50 30.84 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 2.53 6.54 0.07 3.54 0.01 -1.25 -4.88 114.94 121.50 3dyo s ASN 307 Ca 0.61 2.72 0.05 0.00 -0.71 0.00 0.00 52.86 55.53 3dyo s ASN 307 Cb 0.16 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 3dyo s ASN 307 CO -0.07 -0.82 -0.15 -0.76 -1.51 0.00 0.00 177.10 173.79 3dyo s LEU 308 N 0.43 2.28 0.48 0.60 1.43 -1.26 -4.21 118.68 118.43 3dyo s LEU 308 Ca 0.66 -0.62 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 3dyo s LEU 308 Cb -0.45 -0.54 -0.00 0.00 0.03 0.00 0.00 46.19 45.23 3dyo s LEU 308 CO 0.38 -0.07 0.27 -0.31 0.23 0.00 0.00 176.35 176.85 3dyo s TYR 309 N -1.28 2.09 -0.12 0.29 1.51 0.14 -4.74 117.35 115.24 3dyo s TYR 309 Ca -0.01 -0.74 0.02 0.00 -1.01 0.00 0.00 57.07 55.33 3dyo s TYR 309 Cb -0.10 -1.91 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 3dyo s TYR 309 CO 0.02 -0.12 -0.18 0.50 -1.11 0.00 0.00 175.55 174.66 3dyo s ARG 310 N -4.09 2.59 -0.18 -0.62 6.06 -0.66 -0.59 118.95 121.47 3dyo s ARG 310 Ca 0.34 -0.70 -0.07 0.00 -2.50 0.00 0.00 55.73 52.80 3dyo s ARG 310 Cb 0.00 -2.14 -0.04 0.00 0.06 0.00 0.00 34.95 32.83 3dyo s ARG 310 CO 0.20 -0.04 0.04 0.00 -2.50 0.00 0.00 175.30 173.00 3dyo s ALA 311 N 0.90 3.32 -0.15 6.12 0.00 -0.20 -1.42 121.76 130.32 3dyo s ALA 311 Ca -0.07 -0.77 -0.00 0.00 0.00 0.00 0.00 51.96 51.12 3dyo s ALA 311 Cb -0.15 -1.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.11 3dyo s ALA 311 CO -0.02 0.18 -0.13 0.08 0.00 0.00 0.00 175.76 175.87 3dyo s VAL 312 N 0.39 2.87 -0.28 0.00 1.01 -0.36 -1.11 120.40 122.92 3dyo s VAL 312 Ca 0.02 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 3dyo s VAL 312 Cb -0.13 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.04 3dyo s VAL 312 CO 0.01 0.51 0.05 -0.69 0.00 0.00 0.00 175.10 174.98 3dyo s VAL 313 N 0.75 3.78 -0.13 2.92 1.01 0.39 -1.50 120.40 127.63 3dyo s VAL 313 Ca -0.06 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 3dyo s VAL 313 Cb -0.15 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.28 3dyo s VAL 313 CO 0.01 0.13 -0.09 -1.61 0.00 0.00 0.00 175.10 173.54 3dyo s GLU 314 N 1.48 3.36 -0.22 2.72 2.02 0.50 -1.23 118.70 127.33 3dyo s GLU 314 Ca 0.03 -0.61 -0.08 0.00 0.02 0.00 0.00 54.97 54.33 3dyo s GLU 314 Cb -0.17 -2.72 -0.04 0.00 0.10 0.00 0.00 34.13 31.31 3dyo s GLU 314 CO 0.01 0.31 0.09 -1.17 0.02 0.00 0.00 175.26 174.52 3dyo s LEU 315 N 0.14 3.79 0.00 1.80 2.96 0.11 -0.90 118.68 126.58 3dyo s LEU 315 Ca -0.04 0.00 -0.10 0.00 -0.22 0.00 0.00 54.13 53.77 3dyo s LEU 315 Cb -0.14 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.59 3dyo s LEU 315 CO 0.04 0.08 0.65 0.00 -1.32 0.00 0.00 176.35 175.80 3dyo n HIS 316 N 4.18 -2.01 -3.53 5.38 1.44 -0.49 -0.42 115.22 119.76 3dyo n HIS 316 Ca -0.16 -1.87 -0.23 0.00 -2.01 0.00 0.00 57.72 53.45 3dyo n HIS 316 Cb 0.52 0.76 -0.01 0.00 0.12 0.00 0.00 29.99 31.38 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 -2.35 5.04 0.31 0.61 -4.23 -0.06 0.03 115.64 114.98 3dyo s THR 317 Ca 0.18 -0.64 0.03 0.00 -1.18 0.00 0.00 61.69 60.08 3dyo s THR 317 Cb -0.03 -3.82 0.29 0.00 1.34 0.00 0.00 72.50 70.28 3dyo s THR 317 CO 0.14 -0.46 1.89 0.00 -0.54 0.00 0.00 174.62 175.64 3dyo h ALA 318 N 0.86 1.59 0.00 3.99 0.00 -1.42 0.18 119.26 124.46 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 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3dyo h ALA 318 CO 0.61 0.23 0.00 -0.40 0.00 0.00 0.00 179.25 179.69 3dyo n ASP 319 N -4.53 0.00 0.00 0.00 5.68 -1.26 -4.86 116.55 111.57 3dyo n ASP 319 Ca 0.15 -0.85 0.00 0.00 -0.50 0.00 0.00 54.79 53.59 3dyo n ASP 319 Cb 0.29 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 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 0.56 0.81 3.68 6.12 0.00 0.65 -5.08 105.19 111.93 3dyo n GLY 320 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.02 4.20 0.29 2.61 2.01 -1.25 -4.79 115.64 116.69 3dyo s THR 321 Ca 0.00 1.52 -0.29 0.00 0.31 0.00 0.00 61.69 63.23 3dyo s THR 321 Cb 0.00 -3.98 -0.09 0.00 0.01 0.00 0.00 72.50 68.44 3dyo s THR 321 CO 0.00 -0.02 1.09 -0.22 -0.69 0.00 0.00 174.62 174.77 3dyo s LEU 322 N 2.46 4.51 -0.21 4.42 2.96 -1.26 -0.88 118.68 130.68 3dyo s LEU 322 Ca 0.56 2.23 -0.14 0.00 -0.22 0.00 0.00 54.13 56.57 3dyo s LEU 322 Cb -0.25 -3.69 -0.09 0.00 0.50 0.00 0.00 46.19 42.67 3dyo s LEU 322 CO 0.21 -0.17 -0.31 -0.38 -1.32 0.00 0.00 176.35 174.38 3dyo n ILE 323 N 1.06 1.39 -3.45 6.68 5.41 0.44 -4.92 119.36 125.96 3dyo n ILE 323 Ca -0.00 -0.17 -0.12 0.00 1.00 0.00 0.00 62.75 63.46 3dyo n ILE 323 Cb 0.45 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.38 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 1.14 -0.00 0.38 -1.05 -0.96 -4.84 118.70 110.79 3dyo s GLU 324 Ca -0.31 -0.34 0.04 0.00 -0.15 0.00 0.00 54.97 54.20 3dyo s GLU 324 Cb 0.10 0.53 -0.01 0.00 -0.44 0.00 0.00 34.13 34.31 3dyo s GLU 324 CO 0.41 -0.48 -0.12 0.00 0.95 0.00 0.00 175.26 176.02 3dyo s ALA 325 N -3.27 0.98 0.29 -0.84 0.00 0.83 -0.71 121.76 119.03 3dyo s ALA 325 Ca 0.01 -0.54 0.07 0.00 0.00 0.00 0.00 51.96 51.50 3dyo s ALA 325 Cb -0.01 -0.23 -0.06 0.00 0.00 0.00 0.00 23.12 22.82 3dyo s ALA 325 CO -0.09 0.23 -0.06 -1.21 0.00 0.00 0.00 175.76 174.62 3dyo s GLU 326 N -0.39 1.58 0.12 0.00 0.41 -0.36 -1.27 118.70 118.79 3dyo s GLU 326 Ca 0.04 -1.80 -0.25 0.00 -0.41 0.00 0.00 54.97 52.54 3dyo s GLU 326 Cb -0.05 -1.22 0.07 0.00 -1.78 0.00 0.00 34.13 31.15 3dyo s GLU 326 CO -0.00 0.05 0.85 0.00 -0.49 0.00 0.00 175.26 175.67 3dyo s ALA 327 N -2.96 -1.64 0.17 5.21 0.00 -1.26 -0.46 121.76 120.82 3dyo s ALA 327 Ca 0.30 0.40 -0.16 0.00 0.00 0.00 0.00 51.96 52.49 3dyo s ALA 327 Cb 0.03 0.64 0.03 0.00 0.00 0.00 0.00 23.12 23.82 3dyo s ALA 327 CO 0.12 -0.89 0.45 0.00 0.00 0.00 0.00 175.76 175.45 3dyo s ASP 329 N -2.86 7.56 -0.12 0.00 1.01 -1.26 -1.03 116.67 119.97 3dyo s ASP 329 Ca 0.08 1.85 0.03 0.00 0.71 0.00 0.00 52.55 55.22 3dyo s ASP 329 Cb 0.01 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.36 3dyo s ASP 329 CO -0.06 0.10 -0.23 -0.69 0.21 0.00 0.00 175.17 174.51 3dyo s VAL 330 N -0.83 2.05 -0.22 -1.27 1.01 0.25 -4.73 120.40 116.66 3dyo s VAL 330 Ca 0.42 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.36 3dyo s VAL 330 Cb -0.25 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 3dyo s VAL 330 CO 0.30 0.55 -0.02 -0.83 0.00 0.00 0.00 175.10 175.11 3dyo s GLY 331 N 0.61 1.65 -0.67 4.51 0.00 -1.26 -0.68 107.32 111.47 3dyo s GLY 331 Ca -0.12 -1.14 -0.27 0.00 0.00 0.00 0.00 44.72 43.19 3dyo s GLY 331 CO 0.03 0.42 1.30 -1.36 0.00 0.00 0.00 173.10 173.49 3dyo s PHE 332 N 1.43 2.33 -0.08 1.90 0.40 -1.26 -4.80 117.98 117.91 3dyo s PHE 332 Ca 0.05 0.18 -0.22 0.00 -0.60 0.00 0.00 56.93 56.34 3dyo s PHE 332 Cb -0.14 -4.54 0.05 0.00 0.51 0.00 0.00 43.02 38.89 3dyo s PHE 332 CO -0.01 -1.95 0.51 -0.98 0.70 0.00 0.00 175.22 173.48 3dyo s ARG 333 N 5.58 0.80 -0.10 0.44 3.03 -1.26 -0.34 118.95 127.09 3dyo s ARG 333 Ca 0.41 0.23 0.00 0.00 2.03 0.00 0.00 55.73 58.39 3dyo s ARG 333 Cb -0.08 0.37 -0.02 0.00 -1.03 0.00 0.00 34.95 34.19 3dyo s ARG 333 CO 0.19 -0.21 -0.10 -2.00 -1.13 0.00 0.00 175.30 172.06 3dyo s GLU 334 N -0.85 3.12 -0.14 3.89 2.12 -1.26 -4.87 118.70 120.71 3dyo s GLU 334 Ca -0.09 -0.61 0.02 0.00 0.36 0.00 0.00 54.97 54.65 3dyo s GLU 334 Cb -0.03 -2.64 0.01 0.00 0.26 0.00 0.00 34.13 31.73 3dyo s GLU 334 CO 0.05 0.42 -0.21 0.08 -0.54 0.00 0.00 175.26 175.06 3dyo s VAL 335 N -0.16 2.13 0.03 3.70 1.01 -1.26 -0.73 120.40 125.11 3dyo s VAL 335 Ca 0.01 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 60.80 3dyo s VAL 335 Cb -0.13 -1.85 0.05 0.00 0.00 0.00 0.00 36.38 34.45 3dyo s VAL 335 CO 0.03 0.55 0.53 0.00 0.00 0.00 0.00 175.10 176.21 3dyo s ARG 336 N 0.80 1.01 -0.18 2.72 1.70 -0.72 -4.63 118.95 119.65 3dyo s ARG 336 Ca -0.07 -0.16 -0.04 0.00 -0.47 0.00 0.00 55.73 54.99 3dyo s ARG 336 Cb -0.16 0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 34.67 3dyo s ARG 336 CO -0.01 -0.35 -0.02 0.42 -1.08 0.00 0.00 175.30 174.25 3dyo s ILE 337 N -2.18 3.87 -0.03 4.99 1.01 -1.26 0.86 121.20 128.46 3dyo s ILE 337 Ca -0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 3dyo s ILE 337 Cb -0.01 -2.73 0.02 0.00 0.01 0.00 0.00 42.46 39.75 3dyo s ILE 337 CO 0.00 0.46 0.08 -0.70 0.00 0.00 0.00 174.94 174.78 3dyo s GLU 338 N 0.75 0.05 -1.24 2.79 2.12 0.18 -4.82 118.70 118.54 3dyo s GLU 338 Ca -0.01 0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.44 3dyo s GLU 338 Cb -0.14 -0.08 0.04 0.00 0.26 0.00 0.00 34.13 34.21 3dyo s GLU 338 CO 0.02 -0.08 0.37 -1.71 -0.54 0.00 0.00 175.26 173.32 3dyo n ASN 339 N 3.59 -4.01 0.00 -1.70 5.15 -1.26 -1.16 115.26 115.87 3dyo n ASN 339 Ca -0.19 -0.22 0.00 0.00 -0.60 0.00 0.00 54.58 53.57 3dyo n ASN 339 Cb 0.55 -3.33 0.00 0.00 -0.53 0.00 0.00 39.78 36.48 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 -1.11 0.68 3.15 8.20 0.00 -1.26 -5.05 105.19 109.80 3dyo n GLY 340 Ca -0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 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 2.09 -0.40 0.99 1.43 -0.31 -2.92 118.68 119.55 3dyo s LEU 341 Ca 0.00 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.45 3dyo s LEU 341 Cb 0.00 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.48 3dyo s LEU 341 CO 0.00 0.14 1.09 -0.22 0.23 0.00 0.00 176.35 177.60 3dyo s LEU 342 N -0.69 3.79 0.00 1.79 2.96 -1.26 -0.65 118.68 124.62 3dyo s LEU 342 Ca 0.05 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.71 3dyo s LEU 342 Cb -0.07 -3.52 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 3dyo s LEU 342 CO 0.00 -1.07 -0.09 -0.76 -1.32 0.00 0.00 176.35 173.12 3dyo s LEU 343 N 4.04 3.05 -0.18 -0.68 1.43 0.25 -1.67 118.68 124.92 3dyo s LEU 343 Ca 0.46 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 3dyo s LEU 343 Cb -0.10 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.40 3dyo s LEU 343 CO 0.24 0.29 -0.18 -0.22 0.23 0.00 0.00 176.35 176.70 3dyo s LEU 344 N -1.33 2.23 -1.45 1.79 0.20 -0.01 -1.76 118.68 118.36 3dyo s LEU 344 Ca 0.16 -0.60 -0.13 0.00 0.69 0.00 0.00 54.13 54.25 3dyo s LEU 344 Cb -0.11 -1.51 0.10 0.00 -0.43 0.00 0.00 46.19 44.24 3dyo s LEU 344 CO 0.06 0.02 0.68 0.59 -0.29 0.00 0.00 176.35 177.40 3dyo n ASN 345 N 4.52 -3.95 0.00 3.68 3.02 0.09 -1.07 115.26 121.54 3dyo n ASN 345 Ca -0.20 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 3dyo n ASN 345 Cb 0.50 -3.23 0.00 0.00 -0.61 0.00 0.00 39.78 36.45 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 -1.35 0.92 3.46 7.41 0.00 -1.26 -5.00 105.19 109.36 3dyo n GLY 346 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.01 2.05 -0.00 1.61 -0.14 -0.24 -4.99 119.74 118.02 3dyo s LYS 347 Ca 0.00 -0.99 -0.30 0.00 -1.36 0.00 0.00 55.97 53.31 3dyo s LYS 347 Cb 0.00 -2.18 -0.05 0.00 -1.68 0.00 0.00 37.83 33.92 3dyo s LYS 347 CO 0.00 0.54 1.32 -1.25 -0.76 0.00 0.00 175.35 175.20 3dyo s PRO 348 N -1.47 4.32 0.57 -1.68 0.04 -1.26 -0.83 135.00 134.68 3dyo s PRO 348 Ca 0.15 1.87 -0.16 0.00 0.04 0.00 0.00 61.00 62.89 3dyo s PRO 348 Cb -0.10 -3.53 -0.05 0.00 0.04 0.00 0.00 34.50 30.86 3dyo s PRO 348 CO 0.05 -0.50 1.04 -0.51 0.04 0.00 0.00 177.00 177.12 3dyo s LEU 349 N 2.14 3.55 -0.39 -3.56 1.43 -0.67 -4.93 118.68 116.25 3dyo s LEU 349 Ca 0.61 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 55.50 3dyo s LEU 349 Cb -0.30 -4.53 0.11 0.00 0.03 0.00 0.00 46.19 41.51 3dyo s LEU 349 CO 0.26 -0.99 0.14 -0.22 0.23 0.00 0.00 176.35 175.76 3dyo s LEU 350 N -4.32 3.68 -0.28 1.79 2.96 -1.26 -4.79 118.68 116.46 3dyo s LEU 350 Ca 0.63 -2.29 -0.29 0.00 -0.22 0.00 0.00 54.13 51.95 3dyo s LEU 350 Cb -0.14 -1.34 -0.01 0.00 0.50 0.00 0.00 46.19 45.20 3dyo s LEU 350 CO 0.34 -0.34 1.38 -0.63 -1.32 0.00 0.00 176.35 175.78 3dyo s ILE 351 N 0.73 4.03 -0.97 6.68 -1.09 0.23 -4.94 121.20 125.87 3dyo s ILE 351 Ca 0.13 1.16 -0.04 0.00 -2.23 0.00 0.00 60.65 59.68 3dyo s ILE 351 Cb -0.21 -4.05 0.25 0.00 -1.58 0.00 0.00 42.46 36.88 3dyo s ILE 351 CO -0.09 -0.43 0.97 0.54 -1.23 0.00 0.00 174.94 174.70 3dyo n ARG 352 N 7.40 3.13 -3.53 2.79 1.74 -1.26 -1.83 116.66 125.09 3dyo n ARG 352 Ca 0.16 -4.50 -0.20 0.00 -0.77 0.00 0.00 57.85 52.54 3dyo n ARG 352 Cb 0.46 -2.45 -0.03 0.00 -1.02 0.00 0.00 32.46 29.42 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 -0.10 2.03 -0.02 -0.13 0.00 0.13 -0.60 107.32 108.64 3dyo s GLY 353 Ca 0.30 -1.80 -0.09 0.00 0.00 0.00 0.00 44.72 43.13 3dyo s GLY 353 CO -0.08 -1.64 0.19 0.54 0.00 0.00 0.00 173.10 172.11 3dyo s VAL 354 N -2.42 0.06 0.01 1.40 0.11 -0.73 -0.44 120.40 118.40 3dyo s VAL 354 Ca 0.48 -0.51 -0.23 0.00 -2.93 0.00 0.00 61.98 58.79 3dyo s VAL 354 Cb -0.05 -0.44 -0.05 0.00 -1.53 0.00 0.00 36.38 34.31 3dyo s VAL 354 CO 0.28 -0.28 0.68 0.20 -3.33 0.00 0.00 175.10 172.66 3dyo s ASN 355 N -1.07 7.08 -0.11 3.54 0.01 -0.17 -0.78 114.94 123.44 3dyo s ASN 355 Ca -0.12 1.29 -0.01 0.00 -0.71 0.00 0.00 52.86 53.31 3dyo s ASN 355 Cb -0.06 -2.42 0.03 0.00 0.41 0.00 0.00 41.25 39.22 3dyo s ASN 355 CO 0.02 0.03 -0.04 -0.60 -1.51 0.00 0.00 177.10 175.00 3dyo s ARG 356 N 0.02 1.15 0.69 -0.60 3.52 -0.53 -0.63 118.95 122.56 3dyo s ARG 356 Ca 0.35 -0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.66 3dyo s ARG 356 Cb -0.19 -1.47 0.00 0.00 -1.56 0.00 0.00 34.95 31.73 3dyo s ARG 356 CO 0.20 -0.33 1.08 -1.01 -0.81 0.00 0.00 175.30 174.43 3dyo s HIS 357 N 1.80 3.37 -0.59 5.12 3.76 -1.26 -3.80 115.29 123.68 3dyo s HIS 357 Ca 0.04 1.13 -0.20 0.00 -0.15 0.00 0.00 55.06 55.88 3dyo s HIS 357 Cb -0.13 -2.97 0.09 0.00 1.11 0.00 0.00 32.58 30.68 3dyo s HIS 357 CO -0.07 -1.09 0.76 -1.21 -0.85 0.00 0.00 174.74 172.28 3dyo s GLU 358 N -5.29 3.08 -0.01 1.40 2.02 -1.26 -4.93 118.70 113.70 3dyo s GLU 358 Ca 0.57 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 54.46 3dyo s GLU 358 Cb -0.11 -4.23 0.02 0.00 0.10 0.00 0.00 34.13 29.91 3dyo s GLU 358 CO 0.53 -1.56 0.02 -1.58 0.02 0.00 0.00 175.26 172.69 3dyo s HIS 359 N 3.04 0.05 -0.06 1.61 2.46 -1.26 -4.58 115.29 116.55 3dyo s HIS 359 Ca 0.15 0.08 0.01 0.00 0.47 0.00 0.00 55.06 55.77 3dyo s HIS 359 Cb -0.21 -0.19 0.02 0.00 -0.13 0.00 0.00 32.58 32.07 3dyo s HIS 359 CO 0.08 -0.07 -0.08 -1.58 -2.47 0.00 0.00 174.74 170.63 3dyo s HIS 360 N 0.75 1.08 0.46 3.88 2.46 0.68 -5.01 115.29 119.59 3dyo s HIS 360 Ca -0.06 -0.37 0.33 0.00 0.47 0.00 0.00 55.06 55.42 3dyo s HIS 360 Cb -0.09 -0.87 1.74 0.00 -0.13 0.00 0.00 32.58 33.23 3dyo s HIS 360 CO -0.02 -0.25 2.16 -1.00 -2.47 0.00 0.00 174.74 173.17 3dyo h PRO 361 N 7.17 0.00 0.00 2.88 0.13 -1.80 0.54 132.00 140.92 3dyo h PRO 361 Ca -0.34 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.48 3dyo h PRO 361 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 3dyo h PRO 361 CO 0.46 0.06 -2.16 -0.11 -0.23 0.00 0.00 178.00 176.02 3dyo n LEU 362 N -3.47 2.68 -0.71 1.56 7.94 -1.26 -1.66 117.00 122.09 3dyo n LEU 362 Ca -0.02 -0.10 0.12 0.00 -1.11 0.00 0.00 56.01 54.90 3dyo n LEU 362 Cb 0.18 -0.60 0.34 0.00 0.53 0.00 0.00 43.42 43.87 3dyo n LEU 362 CO 0.27 0.80 0.76 1.41 -1.11 0.00 0.00 177.39 179.52 3dyo n HIS 363 N -3.05 0.13 0.00 1.96 8.25 -1.18 -4.94 115.22 116.40 3dyo n HIS 363 Ca -0.35 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.04 3dyo n HIS 363 Cb 0.90 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.01 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 1.25 1.90 0.85 -1.41 0.00 0.17 -2.88 105.19 105.07 3dyo n GLY 364 Ca 0.17 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.17 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 3.06 2.67 -2.80 1.61 6.02 -1.26 -0.23 117.38 126.45 3dyo n GLN 365 Ca 0.00 -2.18 -0.42 0.00 -0.01 0.00 0.00 57.00 54.40 3dyo n GLN 365 Cb 0.00 -1.36 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 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 -1.02 4.89 0.05 5.09 1.01 -1.14 -4.87 120.40 124.40 3dyo s VAL 366 Ca 0.30 1.87 0.05 0.00 0.00 0.00 0.00 61.98 64.21 3dyo s VAL 366 Cb 0.16 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 3dyo s VAL 366 CO 0.21 0.14 -0.07 -0.04 0.00 0.00 0.00 175.10 175.34 3dyo s MET 367 N 1.28 2.40 0.12 2.72 -1.94 -1.26 -4.68 119.30 117.93 3dyo s MET 367 Ca 0.47 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.64 3dyo s MET 367 Cb -0.19 -2.43 -0.04 0.00 2.01 0.00 0.00 34.83 34.18 3dyo s MET 367 CO 0.22 0.56 -0.10 0.16 -0.01 0.00 0.00 175.02 175.86 3dyo s ASP 368 N -1.79 1.53 0.20 3.03 -4.77 -1.26 -5.05 116.67 108.56 3dyo s ASP 368 Ca 0.20 -0.92 -0.11 0.00 -3.30 0.00 0.00 52.55 48.42 3dyo s ASP 368 Cb -0.11 0.01 0.21 0.00 -1.09 0.00 0.00 42.92 41.94 3dyo s ASP 368 CO 0.11 -0.32 1.78 -0.08 0.70 0.00 0.00 175.17 177.37 3dyo h GLU 369 N 3.19 0.53 -0.50 2.11 4.81 -1.99 -1.14 114.58 121.58 3dyo h GLU 369 Ca -0.37 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 58.86 3dyo h GLU 369 Cb 1.19 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 3dyo h GLU 369 CO 0.59 0.35 0.29 1.96 -0.73 0.00 0.00 179.01 181.47 3dyo h GLN 370 N 0.55 0.55 -0.61 1.92 7.50 -1.99 -0.18 115.11 122.85 3dyo h GLN 370 Ca 0.27 -0.03 -0.09 0.00 0.50 0.00 0.00 58.65 59.30 3dyo h GLN 370 Cb 0.21 -0.12 -0.02 0.00 0.05 0.00 0.00 27.48 27.59 3dyo h GLN 370 CO -0.20 0.36 0.03 1.15 -1.50 0.00 0.00 178.83 178.67 3dyo h THR 371 N 0.57 1.26 -0.57 -0.54 2.02 -1.87 -1.18 112.91 112.60 3dyo h THR 371 Ca 0.21 -1.11 -0.08 0.00 0.77 0.00 0.00 66.41 66.20 3dyo h THR 371 Cb 0.05 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 3dyo h THR 371 CO -0.11 0.40 0.06 0.24 0.37 0.00 0.00 175.52 176.48 3dyo h MET 372 N 0.96 0.98 -0.81 6.66 2.86 -0.45 -0.62 114.93 124.50 3dyo h MET 372 Ca 0.18 -0.28 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 3dyo h MET 372 Cb 0.51 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.03 3dyo h MET 372 CO 0.02 0.95 0.38 0.28 1.06 0.00 0.00 176.91 179.60 3dyo h VAL 373 N 0.87 1.25 -0.81 -2.22 2.07 -0.85 -0.53 116.25 116.03 3dyo h VAL 373 Ca 0.17 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 3dyo h VAL 373 Cb 0.47 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 3dyo h VAL 373 CO 0.02 0.31 0.51 -0.61 0.02 0.00 0.00 177.57 177.81 3dyo h GLN 374 N 1.16 1.10 -0.33 1.57 4.15 -0.92 0.17 115.11 122.00 3dyo h GLN 374 Ca 0.28 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.56 3dyo h GLN 374 Cb 0.13 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 3dyo h GLN 374 CO -0.03 0.76 0.00 -0.44 -1.93 0.00 0.00 178.83 177.19 3dyo h ASP 375 N 1.11 0.57 -0.56 -0.69 3.32 -0.57 -1.62 116.42 117.98 3dyo h ASP 375 Ca 0.29 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 3dyo h ASP 375 Cb -0.07 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 3dyo h ASP 375 CO -0.06 0.74 0.34 0.40 -1.72 0.00 0.00 179.24 178.94 3dyo h ILE 376 N 0.39 1.17 -0.49 0.35 2.04 -0.47 -0.20 117.51 120.30 3dyo h ILE 376 Ca 0.09 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.56 3dyo h ILE 376 Cb 0.44 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3dyo h ILE 376 CO 0.02 0.17 0.19 -0.07 0.00 0.00 0.00 178.15 178.45 3dyo h LEU 377 N 0.75 0.68 -0.90 1.44 3.38 -0.95 0.07 115.31 119.78 3dyo h LEU 377 Ca 0.20 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 3dyo h LEU 377 Cb -0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 3dyo h LEU 377 CO -0.04 0.67 0.10 -0.07 0.09 0.00 0.00 178.44 179.20 3dyo h LEU 378 N 0.65 0.87 0.04 1.67 3.38 -0.96 0.53 115.31 121.48 3dyo h LEU 378 Ca 0.16 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dyo h LEU 378 Cb 0.21 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3dyo h LEU 378 CO -0.01 0.87 -0.02 0.24 0.09 0.00 0.00 178.44 179.61 3dyo h MET 379 N 0.87 -0.05 -0.73 1.13 2.86 -0.61 -2.02 114.93 116.37 3dyo h MET 379 Ca 0.18 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.77 3dyo h MET 379 Cb 0.37 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 3dyo h MET 379 CO 0.01 0.01 0.22 0.87 1.06 0.00 0.00 176.91 179.08 3dyo h LYS 380 N -0.10 1.14 0.00 1.72 1.57 -0.82 -0.49 116.57 119.59 3dyo h LYS 380 Ca -0.01 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3dyo h LYS 380 Cb 0.09 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 3dyo h LYS 380 CO 0.01 0.97 -0.03 1.96 -0.57 0.00 0.00 179.45 181.79 3dyo h GLN 381 N 1.08 0.00 -0.43 3.15 4.20 -0.73 -1.64 115.11 120.73 3dyo h GLN 381 Ca 0.23 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 3dyo h GLN 381 Cb 0.31 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3dyo h GLN 381 CO -0.01 0.03 0.05 0.09 -0.67 0.00 0.00 178.83 178.32 3dyo n ASN 382 N -3.67 4.31 -1.06 1.46 3.02 -0.75 -4.96 115.26 113.60 3dyo n ASN 382 Ca -0.03 -3.13 -0.12 0.00 -0.03 0.00 0.00 54.58 51.28 3dyo n ASN 382 Cb 0.12 -0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.64 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 -0.29 -4.12 -4.86 6.41 3.02 -0.62 -4.02 115.26 110.79 3dyo n ASN 383 Ca 0.28 0.17 -0.33 0.00 -0.03 0.00 0.00 54.58 54.67 3dyo n ASN 383 Cb 1.08 -2.92 -0.06 0.00 -0.61 0.00 0.00 39.78 37.27 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 -2.49 3.45 0.00 3.10 0.40 -0.27 -4.85 117.98 117.33 3dyo s PHE 384 Ca 0.00 1.05 0.00 0.00 -0.60 0.00 0.00 56.93 57.38 3dyo s PHE 384 Cb 0.00 -2.39 0.00 0.00 0.51 0.00 0.00 43.02 41.14 3dyo s PHE 384 CO 0.00 0.24 0.78 0.27 0.70 0.00 0.00 175.22 177.21 3dyo n ASN 385 N 0.01 1.37 -3.67 1.36 0.23 0.23 -4.27 115.26 110.52 3dyo n ASN 385 Ca 0.00 -1.60 -0.13 0.00 -0.53 0.00 0.00 54.58 52.32 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 -0.60 -1.00 -0.04 -2.53 0.00 -1.09 -0.24 121.76 116.24 3dyo s ALA 386 Ca 0.00 0.33 -0.05 0.00 0.00 0.00 0.00 51.96 52.24 3dyo s ALA 386 Cb 0.00 0.32 0.01 0.00 0.00 0.00 0.00 23.12 23.45 3dyo s ALA 386 CO 0.00 -0.44 0.12 0.54 0.00 0.00 0.00 175.76 175.98 3dyo s VAL 387 N -2.38 0.01 -0.15 0.00 0.11 0.13 -1.77 120.40 116.35 3dyo s VAL 387 Ca -0.06 -0.09 -0.05 0.00 -2.93 0.00 0.00 61.98 58.86 3dyo s VAL 387 Cb -0.01 -0.21 -0.03 0.00 -1.53 0.00 0.00 36.38 34.60 3dyo s VAL 387 CO -0.02 -0.05 0.01 -0.60 -3.33 0.00 0.00 175.10 171.12 3dyo s ARG 388 N -0.11 3.65 -1.00 1.54 3.52 0.04 -1.40 118.95 125.19 3dyo s ARG 388 Ca -0.02 -0.42 -0.15 0.00 -0.13 0.00 0.00 55.73 55.02 3dyo s ARG 388 Cb -0.02 -3.01 -0.09 0.00 -1.56 0.00 0.00 34.95 30.27 3dyo s ARG 388 CO 0.00 0.36 2.12 0.00 -0.81 0.00 0.00 175.30 176.98 3dyo s SER 390 N 3.97 6.79 -0.41 0.00 1.04 -1.25 -1.45 113.70 122.40 3dyo s SER 390 Ca 0.51 1.74 0.09 0.00 0.48 0.00 0.00 55.95 58.77 3dyo s SER 390 Cb 0.13 -2.54 0.28 0.00 0.10 0.00 0.00 66.02 64.00 3dyo s SER 390 CO 0.02 -0.89 0.60 1.41 0.98 0.00 0.00 173.24 175.36 3dyo n HIS 391 N 7.06 0.14 -3.58 5.02 -0.00 -1.26 -4.19 115.22 118.41 3dyo n HIS 391 Ca 0.15 -3.68 -0.05 0.00 -0.00 0.00 0.00 57.72 54.14 3dyo n HIS 391 Cb 0.45 -0.39 -0.02 0.00 -0.00 0.00 0.00 29.99 30.03 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 -1.65 -0.17 0.48 4.41 -0.85 -0.53 -4.26 117.35 114.78 3dyo s TYR 392 Ca 0.37 0.13 -0.24 0.00 -0.52 0.00 0.00 57.07 56.81 3dyo s TYR 392 Cb 0.22 0.51 -0.07 0.00 0.38 0.00 0.00 41.96 43.00 3dyo s TYR 392 CO -0.10 -0.26 1.37 -2.14 -1.52 0.00 0.00 175.55 172.90 3dyo s PRO 393 N -2.43 3.56 0.62 -3.49 0.02 -0.80 -4.51 135.00 127.97 3dyo s PRO 393 Ca 0.08 2.28 0.05 0.00 0.02 0.00 0.00 61.00 63.43 3dyo s PRO 393 Cb -0.01 -2.52 0.10 0.00 0.02 0.00 0.00 34.50 32.08 3dyo s PRO 393 CO -0.05 -0.87 0.86 -0.80 -0.33 0.00 0.00 177.00 175.81 3dyo s ASN 394 N -0.74 4.83 0.34 2.53 0.02 -1.26 -4.85 114.94 115.81 3dyo s ASN 394 Ca 0.64 -0.63 -0.29 0.00 -1.02 0.00 0.00 52.86 51.57 3dyo s ASN 394 Cb -0.41 0.11 -0.12 0.00 0.02 0.00 0.00 41.25 40.86 3dyo s ASN 394 CO 0.51 -1.52 1.44 1.57 0.02 0.00 0.00 177.10 179.12 3dyo n HIS 395 N -2.46 2.68 -0.20 2.20 -0.00 -1.26 -4.85 115.22 111.32 3dyo n HIS 395 Ca 0.15 0.45 0.28 0.00 -0.00 0.00 0.00 57.72 58.59 3dyo n HIS 395 Cb 0.61 -2.50 0.69 0.00 -0.00 0.00 0.00 29.99 28.79 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 3.23 0.07 0.00 1.57 0.13 -1.96 -1.61 132.00 133.42 3dyo h PRO 396 Ca -0.48 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 3dyo h PRO 396 Cb 1.25 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3dyo h PRO 396 CO 0.67 0.05 -0.22 1.25 -0.23 0.00 0.00 178.00 179.51 3dyo h LEU 397 N 0.07 0.00 -0.42 1.56 5.85 -2.01 -2.88 115.31 117.49 3dyo h LEU 397 Ca 0.45 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.23 3dyo h LEU 397 Cb 1.67 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.65 3dyo h LEU 397 CO -0.04 0.22 0.13 -0.25 -0.34 0.00 0.00 178.44 178.16 3dyo h TRP 398 N 0.00 0.23 -0.56 1.25 2.91 -1.64 -0.33 115.95 117.81 3dyo h TRP 398 Ca -0.00 0.02 -0.06 0.00 1.13 0.00 0.00 58.89 59.98 3dyo h TRP 398 Cb 0.57 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 29.15 3dyo h TRP 398 CO 0.00 0.08 0.10 1.88 -1.03 0.00 0.00 178.44 179.47 3dyo h TYR 399 N 0.29 0.93 -0.43 2.65 -1.99 -1.66 -1.09 116.97 115.66 3dyo h TYR 399 Ca 0.20 -0.10 -0.00 0.00 2.00 0.00 0.00 58.73 60.82 3dyo h TYR 399 Cb 0.20 -0.26 -0.02 0.00 2.00 0.00 0.00 36.73 38.64 3dyo h TYR 399 CO -0.16 0.79 0.25 1.15 -0.00 0.00 0.00 178.16 180.19 3dyo h THR 400 N 0.85 1.15 -0.76 -2.88 2.02 -1.22 0.58 112.91 112.64 3dyo h THR 400 Ca 0.18 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 3dyo h THR 400 Cb 0.36 0.60 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 3dyo h THR 400 CO 0.01 0.15 0.39 -0.07 0.37 0.00 0.00 175.52 176.36 3dyo h LEU 401 N 0.57 0.97 -0.49 2.58 3.38 -0.75 -1.89 115.31 119.68 3dyo h LEU 401 Ca 0.15 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3dyo h LEU 401 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3dyo h LEU 401 CO -0.03 0.81 0.18 0.00 0.09 0.00 0.00 178.44 179.49 3dyo h ASP 403 N 0.66 0.49 0.34 0.00 3.32 -0.63 0.20 116.42 120.79 3dyo h ASP 403 Ca 0.16 0.03 -0.33 0.00 0.02 0.00 0.00 57.03 56.92 3dyo h ASP 403 Cb 0.22 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3dyo h ASP 403 CO -0.01 0.31 -1.61 0.03 -1.72 0.00 0.00 179.24 176.25 3dyo h ARG 404 N 0.62 0.33 0.00 3.56 3.08 -0.92 -3.34 114.38 117.71 3dyo h ARG 404 Ca 0.29 -0.56 -0.11 0.00 0.07 0.00 0.00 59.98 59.67 3dyo h ARG 404 Cb 0.20 0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3dyo h ARG 404 CO -0.19 1.21 -0.86 1.88 -1.07 0.00 0.00 179.97 180.95 3dyo h TYR 405 N 0.09 0.00 -1.14 3.04 -1.99 -0.25 -3.45 116.97 113.27 3dyo h TYR 405 Ca -0.28 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.45 3dyo h TYR 405 Cb 2.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.79 3dyo h TYR 405 CO 0.08 0.43 0.00 0.41 -0.00 0.00 0.00 178.16 179.08 3dyo n GLY 406 N 1.27 -0.34 2.91 3.88 0.00 0.02 -4.82 105.19 108.11 3dyo n GLY 406 Ca -0.02 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.24 2.05 0.19 0.99 1.43 -0.96 -4.65 118.68 117.50 3dyo s LEU 407 Ca 0.00 -0.12 -0.29 0.00 -1.03 0.00 0.00 54.13 52.69 3dyo s LEU 407 Cb 0.00 -0.03 -0.08 0.00 0.03 0.00 0.00 46.19 46.11 3dyo s LEU 407 CO 0.00 -0.05 0.90 -0.31 0.23 0.00 0.00 176.35 177.13 3dyo s TYR 408 N -0.32 3.93 -0.01 0.29 4.12 0.66 -4.72 117.35 121.31 3dyo s TYR 408 Ca -0.03 1.82 0.06 0.00 0.02 0.00 0.00 57.07 58.94 3dyo s TYR 408 Cb -0.02 -2.94 -0.02 0.00 -1.52 0.00 0.00 41.96 37.46 3dyo s TYR 408 CO -0.00 0.42 -0.19 0.08 0.02 0.00 0.00 175.55 175.87 3dyo s VAL 409 N -0.91 1.52 -0.40 0.71 1.01 0.17 0.19 120.40 122.69 3dyo s VAL 409 Ca 0.41 -0.85 -0.13 0.00 0.00 0.00 0.00 61.98 61.41 3dyo s VAL 409 Cb -0.25 -1.27 0.03 0.00 0.00 0.00 0.00 36.38 34.89 3dyo s VAL 409 CO 0.30 0.40 0.26 -0.69 0.00 0.00 0.00 175.10 175.38 3dyo s VAL 410 N -0.48 4.92 -0.16 2.92 1.01 -0.49 -0.64 120.40 127.47 3dyo s VAL 410 Ca 0.07 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 3dyo s VAL 410 Cb -0.08 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 3dyo s VAL 410 CO -0.01 -0.30 0.44 -0.62 0.00 0.00 0.00 175.10 174.61 3dyo s ASP 411 N 1.69 6.57 -0.10 3.32 2.15 -0.87 -1.36 116.67 128.07 3dyo s ASP 411 Ca 0.03 0.68 0.02 0.00 0.43 0.00 0.00 52.55 53.72 3dyo s ASP 411 Cb -0.20 -2.26 0.01 0.00 -0.30 0.00 0.00 42.92 40.18 3dyo s ASP 411 CO 0.08 -0.03 -0.17 -0.70 -0.17 0.00 0.00 175.17 174.18 3dyo s GLU 412 N 0.92 2.35 0.44 4.34 2.12 -1.26 -0.60 118.70 127.02 3dyo s GLU 412 Ca 0.23 -0.62 -0.26 0.00 0.36 0.00 0.00 54.97 54.68 3dyo s GLU 412 Cb -0.15 -1.92 -0.08 0.00 0.26 0.00 0.00 34.13 32.23 3dyo s GLU 412 CO 0.09 0.00 1.41 0.00 -0.54 0.00 0.00 175.26 176.22 3dyo s ALA 413 N 0.79 3.26 -1.13 6.30 0.00 -0.28 -1.91 121.76 128.79 3dyo s ALA 413 Ca -0.11 1.43 -0.19 0.00 0.00 0.00 0.00 51.96 53.10 3dyo s ALA 413 Cb -0.16 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.34 3dyo s ALA 413 CO 0.01 -1.12 2.03 -1.71 0.00 0.00 0.00 175.76 174.97 3dyo n ASN 414 N -0.11 3.32 -3.64 0.00 5.15 -1.26 -4.14 115.26 114.58 3dyo n ASN 414 Ca 0.05 -2.77 -0.25 0.00 -0.60 0.00 0.00 54.58 51.01 3dyo n ASN 414 Cb 0.42 -1.44 -0.17 0.00 -0.53 0.00 0.00 39.78 38.06 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 4.71 -0.00 -0.12 -1.44 1.01 -1.26 -4.77 121.20 119.34 3dyo s ILE 415 Ca 0.54 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 61.01 3dyo s ILE 415 Cb 0.12 -0.57 0.06 0.00 0.01 0.00 0.00 42.46 42.08 3dyo s ILE 415 CO 0.03 -0.19 0.26 -0.70 0.00 0.00 0.00 174.94 174.34 3dyo s GLU 416 N 2.10 0.17 -0.33 2.79 2.12 0.32 -1.18 118.70 124.69 3dyo s GLU 416 Ca 0.02 0.66 0.09 0.00 0.36 0.00 0.00 54.97 56.10 3dyo s GLU 416 Cb -0.15 -0.07 0.45 0.00 0.26 0.00 0.00 34.13 34.62 3dyo s GLU 416 CO -0.08 -0.24 1.15 0.25 -0.54 0.00 0.00 175.26 175.80 3dyo n THR 417 N 4.90 2.29 -0.32 -1.70 -2.24 -1.11 -1.11 114.28 114.99 3dyo n THR 417 Ca -0.14 -4.22 0.20 0.00 -2.27 0.00 0.00 64.05 57.63 3dyo n THR 417 Cb 0.51 -0.84 0.47 0.00 -2.10 0.00 0.00 70.33 68.37 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 2.36 0.52 0.46 3.42 -0.00 -1.57 -2.10 115.58 118.68 3dyo h ASN 418 Ca 0.28 0.09 0.00 0.00 -0.00 0.00 0.00 56.30 56.66 3dyo h ASN 418 Cb 1.34 -0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.66 3dyo h ASN 418 CO 0.71 0.13 -0.03 0.61 -0.00 0.00 0.00 177.43 178.85 3dyo n GLY 419 N -1.44 -1.17 3.77 1.57 0.00 -1.22 -4.84 105.19 101.86 3dyo n GLY 419 Ca 0.24 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.48 2.38 -0.14 1.61 -1.94 -0.79 -4.78 119.30 113.16 3dyo s MET 420 Ca 0.31 1.24 -0.00 0.00 -1.71 0.00 0.00 55.69 55.53 3dyo s MET 420 Cb 0.20 -1.91 0.03 0.00 2.01 0.00 0.00 34.83 35.17 3dyo s MET 420 CO 0.45 -1.55 -0.09 0.08 -0.01 0.00 0.00 175.02 173.90 3dyo s VAL 421 N -2.73 1.22 1.19 -6.03 1.01 -1.26 -3.36 120.40 110.44 3dyo s VAL 421 Ca 0.63 -0.51 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 3dyo s VAL 421 Cb -0.18 -1.26 0.28 0.00 0.00 0.00 0.00 36.38 35.22 3dyo s VAL 421 CO 0.52 0.31 1.08 -2.16 0.00 0.00 0.00 175.10 174.84 3dyo s PRO 422 N 1.62 -1.14 0.49 2.72 0.04 -1.26 -4.80 135.00 132.66 3dyo s PRO 422 Ca 0.03 0.13 0.16 0.00 0.04 0.00 0.00 61.00 61.36 3dyo s PRO 422 Cb -0.14 -1.59 1.19 0.00 0.04 0.00 0.00 34.50 34.01 3dyo s PRO 422 CO -0.09 -3.70 2.08 1.98 0.04 0.00 0.00 177.00 177.32 3dyo h MET 423 N -2.58 0.15 -0.66 4.56 4.05 -1.88 -1.66 114.93 116.92 3dyo h MET 423 Ca -0.48 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 58.93 3dyo h MET 423 Cb 1.31 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.08 3dyo h MET 423 CO 0.39 0.10 0.00 0.27 0.23 0.00 0.00 176.91 177.90 3dyo n ASN 424 N -4.49 4.27 -0.31 1.39 6.94 -1.26 -3.94 115.26 117.87 3dyo n ASN 424 Ca 0.02 -2.56 0.08 0.00 -0.02 0.00 0.00 54.58 52.11 3dyo n ASN 424 Cb 0.22 -0.59 0.25 0.00 -2.36 0.00 0.00 39.78 37.30 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 3.08 0.62 0.19 -3.83 2.43 -1.61 0.14 114.38 115.40 3dyo h ARG 425 Ca 0.00 -0.04 -0.31 0.00 -0.81 0.00 0.00 59.98 58.82 3dyo h ARG 425 Cb 1.45 -0.14 0.02 0.00 -0.42 0.00 0.00 29.97 30.88 3dyo h ARG 425 CO 0.30 0.41 -1.47 -0.07 -1.51 0.00 0.00 179.97 177.63 3dyo h LEU 426 N 0.64 0.62 -0.95 3.80 3.38 -1.86 -3.34 115.31 117.60 3dyo h LEU 426 Ca 0.49 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3dyo h LEU 426 Cb 0.72 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3dyo h LEU 426 CO -0.38 1.68 0.00 0.71 0.09 0.00 0.00 178.44 180.54 3dyo h THR 427 N -0.04 0.00 -0.11 0.22 1.35 -1.72 -1.33 112.91 111.29 3dyo h THR 427 Ca -0.28 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 3dyo h THR 427 Cb 1.99 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 3dyo h THR 427 CO 0.18 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 174.78 3dyo n ASP 428 N -2.40 2.93 -4.59 5.36 2.03 0.45 -1.68 116.55 118.66 3dyo n ASP 428 Ca 0.01 -1.95 -0.38 0.00 0.52 0.00 0.00 54.79 53.00 3dyo n ASP 428 Cb 0.22 -0.06 -0.11 0.00 -0.72 0.00 0.00 41.12 40.45 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 -1.88 5.98 0.59 1.67 -1.08 -0.50 -4.56 116.67 116.89 3dyo s ASP 429 Ca 0.31 -0.00 0.36 0.00 -0.52 0.00 0.00 52.55 52.70 3dyo s ASP 429 Cb 0.21 -2.11 1.80 0.00 -1.46 0.00 0.00 42.92 41.36 3dyo s ASP 429 CO 0.31 -0.03 2.16 1.55 0.52 0.00 0.00 175.17 179.68 3dyo h PRO 430 N 8.22 0.00 0.00 4.34 0.13 -1.91 0.58 132.00 143.37 3dyo h PRO 430 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 3dyo h PRO 430 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3dyo h PRO 430 CO 0.57 0.04 0.00 0.00 -0.23 0.00 0.00 178.00 178.37 3dyo h ARG 431 N 0.00 0.00 -0.10 0.86 3.08 -1.93 -2.01 114.38 114.28 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 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3dyo h ARG 431 CO 0.00 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.81 3dyo n TRP 432 N -3.01 0.11 -0.21 3.04 7.02 0.19 -4.40 117.44 120.17 3dyo n TRP 432 Ca -0.00 -0.05 -0.06 0.00 -1.02 0.00 0.00 57.50 56.36 3dyo n TRP 432 Cb 0.23 0.00 0.03 0.00 -2.42 0.00 0.00 31.31 29.16 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 4.43 0.73 0.10 -0.99 5.85 -1.35 -1.91 115.31 122.17 3dyo h LEU 433 Ca 0.00 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 3dyo h LEU 433 Cb 0.95 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3dyo h LEU 433 CO 0.00 0.59 -0.17 -0.65 -0.34 0.00 0.00 178.44 177.87 3dyo h PRO 434 N 0.82 -0.31 -0.62 5.25 0.11 -1.77 0.20 132.00 135.68 3dyo h PRO 434 Ca 0.22 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 3dyo h PRO 434 Cb -0.00 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.15 3dyo h PRO 434 CO -0.04 -0.21 0.34 0.00 -0.21 0.00 0.00 178.00 177.88 3dyo h ALA 435 N 0.52 0.79 -0.40 -0.75 0.00 -1.74 -1.41 119.26 116.27 3dyo h ALA 435 Ca 0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3dyo h ALA 435 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3dyo h ALA 435 CO -0.09 0.31 -0.07 0.52 0.00 0.00 0.00 179.25 179.92 3dyo h MET 436 N 0.84 0.67 -0.94 0.00 2.86 -1.15 -3.00 114.93 114.22 3dyo h MET 436 Ca 0.22 -0.19 0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3dyo h MET 436 Cb 0.04 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.57 3dyo h MET 436 CO -0.04 0.74 0.62 0.66 1.06 0.00 0.00 176.91 179.95 3dyo h SER 437 N 0.62 1.05 0.68 1.22 4.64 0.47 -1.35 113.55 120.88 3dyo h SER 437 Ca 0.12 -0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.36 3dyo h SER 437 Cb 0.49 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3dyo h SER 437 CO 0.03 0.74 -0.26 -0.33 -0.87 0.00 0.00 176.83 176.14 3dyo h GLU 438 N 1.23 0.00 0.00 4.77 5.08 -1.25 0.13 114.58 124.54 3dyo h GLU 438 Ca 0.36 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.63 3dyo h GLU 438 Cb -0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3dyo h GLU 438 CO -0.10 0.26 -0.44 0.00 -1.00 0.00 0.00 179.01 177.74 3dyo h ARG 439 N 0.00 0.00 0.00 2.33 3.08 -1.20 -1.86 114.38 116.73 3dyo h ARG 439 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 3dyo h ARG 439 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 3dyo h ARG 439 CO 0.03 0.44 -0.52 0.28 -1.07 0.00 0.00 179.97 179.13 3dyo h VAL 440 N 0.00 0.72 -0.73 2.04 2.07 -0.89 -3.33 116.25 116.13 3dyo h VAL 440 Ca -0.00 -1.69 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 3dyo h VAL 440 Cb 0.87 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 3dyo h VAL 440 CO 0.06 0.24 0.33 0.71 0.02 0.00 0.00 177.57 178.93 3dyo h THR 441 N -1.00 1.24 0.00 2.57 1.35 -0.84 -2.26 112.91 113.98 3dyo h THR 441 Ca -0.11 -0.70 -0.03 0.00 -0.55 0.00 0.00 66.41 65.01 3dyo h THR 441 Cb 0.77 0.35 -0.00 0.00 -1.73 0.00 0.00 68.15 67.54 3dyo h THR 441 CO -0.07 0.29 -0.15 0.03 -0.25 0.00 0.00 175.52 175.37 3dyo h ARG 442 N 1.03 0.00 -0.05 4.72 3.08 -1.55 -1.21 114.38 120.40 3dyo h ARG 442 Ca 0.25 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 3dyo h ARG 442 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 3dyo h ARG 442 CO -0.03 0.15 -0.06 1.98 -1.07 0.00 0.00 179.97 180.94 3dyo h MET 443 N 0.00 0.13 -0.78 0.04 4.05 -1.55 -2.12 114.93 114.70 3dyo h MET 443 Ca -0.00 -0.07 0.02 0.00 -0.28 0.00 0.00 59.70 59.37 3dyo h MET 443 Cb 0.35 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.12 3dyo h MET 443 CO 0.02 0.61 0.50 0.28 0.23 0.00 0.00 176.91 178.56 3dyo h VAL 444 N -0.35 1.15 0.00 -5.77 2.07 -1.03 -0.92 116.25 111.40 3dyo h VAL 444 Ca 0.01 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 3dyo h VAL 444 Cb 0.60 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3dyo h VAL 444 CO 0.01 0.18 -0.14 1.56 0.02 0.00 0.00 177.57 179.21 3dyo h GLN 445 N 1.00 0.00 0.11 1.57 4.20 -1.21 -1.76 115.11 119.01 3dyo h GLN 445 Ca 0.30 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.70 3dyo h GLN 445 Cb -0.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3dyo h GLN 445 CO -0.09 0.14 -1.62 -0.09 -0.67 0.00 0.00 178.83 176.49 3dyo h ARG 446 N 0.00 0.23 -0.03 1.46 2.43 -0.62 -3.04 114.38 114.81 3dyo h ARG 446 Ca -0.00 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3dyo h ARG 446 Cb 0.36 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 3dyo h ARG 446 CO 0.02 1.08 0.00 -0.25 -1.51 0.00 0.00 179.97 179.31 3dyo n ASP 447 N -3.42 2.06 0.17 -3.80 8.00 -0.43 -4.21 116.55 114.92 3dyo n ASP 447 Ca -0.19 -1.53 0.12 0.00 0.71 0.00 0.00 54.79 53.90 3dyo n ASP 447 Cb 1.05 -0.01 0.62 0.00 -0.02 0.00 0.00 41.12 42.76 3dyo n ASP 447 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 3dyo h ARG 448 N 2.42 0.00 -0.05 -1.24 0.11 -1.54 -0.86 114.38 113.22 3dyo h ARG 448 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3dyo h ARG 448 Cb 0.52 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.60 3dyo h ARG 448 CO 0.00 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.16 3dyo n ASN 449 N -2.30 2.50 -4.67 0.08 3.02 -1.26 -4.87 115.26 107.76 3dyo n ASN 449 Ca -0.01 -1.83 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 3dyo n ASN 449 Cb 0.04 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.16 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 -1.97 3.40 0.37 3.10 3.76 -0.33 -4.86 115.29 118.77 3dyo s HIS 450 Ca 0.32 1.39 0.19 0.00 -0.15 0.00 0.00 55.06 56.81 3dyo s HIS 450 Cb 0.20 -3.14 1.04 0.00 1.11 0.00 0.00 32.58 31.80 3dyo s HIS 450 CO 0.31 -0.33 1.94 -1.00 -0.85 0.00 0.00 174.74 174.81 3dyo h PRO 451 N 7.36 0.00 0.00 8.40 0.13 -1.88 -2.62 132.00 143.39 3dyo h PRO 451 Ca -0.26 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.85 3dyo h PRO 451 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3dyo h PRO 451 CO 0.89 0.24 -0.09 0.66 -0.23 0.00 0.00 178.00 179.47 3dyo h SER 452 N 0.00 0.00 -2.94 1.44 4.64 -1.87 -3.40 113.55 111.43 3dyo h SER 452 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 3dyo h SER 452 Cb 0.50 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.56 3dyo h SER 452 CO 0.03 0.09 1.09 -0.69 -0.87 0.00 0.00 176.83 176.48 3dyo s VAL 453 N -4.49 3.82 -0.19 0.95 1.01 -0.99 0.42 120.40 120.93 3dyo s VAL 453 Ca -0.04 0.91 0.07 0.00 0.00 0.00 0.00 61.98 62.92 3dyo s VAL 453 Cb 0.15 -3.90 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 3dyo s VAL 453 CO 0.60 -0.43 0.24 2.30 0.00 0.00 0.00 175.10 177.82 3dyo n ILE 454 N 6.56 0.00 -3.83 2.22 -5.35 0.18 -4.89 119.36 114.25 3dyo n ILE 454 Ca 0.18 -0.26 -0.13 0.00 -0.27 0.00 0.00 62.75 62.27 3dyo n ILE 454 Cb 0.46 0.71 -0.14 0.00 -1.74 0.00 0.00 39.64 38.94 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 -2.03 -0.01 0.06 7.28 1.01 -1.19 -3.87 121.20 122.45 3dyo s ILE 455 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.70 3dyo s ILE 455 Cb 0.05 -0.10 -0.04 0.00 0.01 0.00 0.00 42.46 42.39 3dyo s ILE 455 CO 0.30 0.02 0.19 0.26 0.00 0.00 0.00 174.94 175.70 3dyo s TRP 456 N 0.25 3.48 -0.04 3.97 0.52 -0.22 -2.04 118.94 124.86 3dyo s TRP 456 Ca -0.02 0.24 0.04 0.00 0.02 0.00 0.00 56.10 56.37 3dyo s TRP 456 Cb -0.03 -1.75 -0.00 0.00 -1.15 0.00 0.00 33.47 30.54 3dyo s TRP 456 CO -0.01 0.59 -0.15 0.45 0.02 0.00 0.00 176.95 177.85 3dyo s SER 457 N -2.45 1.86 0.00 2.95 0.15 0.24 -0.56 113.70 115.89 3dyo s SER 457 Ca 0.34 -0.30 0.20 0.00 0.70 0.00 0.00 55.95 56.88 3dyo s SER 457 Cb -0.13 -0.51 1.00 0.00 -1.71 0.00 0.00 66.02 64.67 3dyo s SER 457 CO 0.27 0.13 1.60 0.18 1.20 0.00 0.00 173.24 176.61 3dyo n LEU 458 N 3.19 0.00 0.00 3.45 4.77 -1.07 -1.13 117.00 126.22 3dyo n LEU 458 Ca -0.18 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3dyo n LEU 458 Cb 0.53 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3dyo n LEU 458 CO 0.25 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 3dyo n GLY 459 N 0.35 0.57 3.34 -0.72 0.00 -1.26 -4.62 105.19 102.85 3dyo n GLY 459 Ca 0.10 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.38 -1.21 1.61 2.47 -0.33 -4.74 114.94 108.36 3dyo s ASN 460 Ca 0.00 0.47 -0.35 0.00 0.42 0.00 0.00 52.86 53.39 3dyo s ASN 460 Cb 0.00 0.54 0.05 0.00 -1.45 0.00 0.00 41.25 40.39 3dyo s ASN 460 CO 0.00 -0.41 0.68 -0.62 -3.72 0.00 0.00 177.10 173.04 3dyo n GLU 461 N 1.62 -0.22 -1.65 0.43 1.02 -1.26 -4.03 120.64 116.55 3dyo n GLU 461 Ca -0.19 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 3dyo n GLU 461 Cb 0.56 -2.47 0.07 0.00 -0.02 0.00 0.00 31.44 29.59 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 -2.14 1.78 0.00 1.62 7.64 -1.26 -1.70 113.62 119.56 3dyo n SER 462 Ca -0.11 -2.67 0.00 0.00 1.01 0.00 0.00 58.87 57.10 3dyo n SER 462 Cb 0.56 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 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 -0.27 0.88 2.97 0.23 0.00 -1.25 -3.98 105.19 103.76 3dyo n GLY 463 Ca 0.14 -0.83 -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 2.09 0.30 1.61 2.46 -1.26 -3.55 115.29 116.94 3dyo s HIS 464 Ca 0.00 -1.28 0.04 0.00 0.47 0.00 0.00 55.06 54.29 3dyo s HIS 464 Cb 0.00 -1.52 -0.06 0.00 -0.13 0.00 0.00 32.58 30.87 3dyo s HIS 464 CO 0.00 -0.67 0.04 0.20 -2.47 0.00 0.00 174.74 171.84 3dyo s GLY 465 N 1.51 1.94 0.57 1.59 0.00 -1.26 -4.83 107.32 106.83 3dyo s GLY 465 Ca 0.02 -1.98 0.25 0.00 0.00 0.00 0.00 44.72 43.01 3dyo s GLY 465 CO -0.09 -1.77 2.21 0.00 0.00 0.00 0.00 173.10 173.45 3dyo h ALA 466 N 2.21 1.71 -0.43 3.20 0.00 -1.79 -0.24 119.26 123.92 3dyo h ALA 466 Ca -0.40 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3dyo h ALA 466 Cb 1.24 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 3dyo h ALA 466 CO 0.68 -0.02 0.23 -0.91 0.00 0.00 0.00 179.25 179.22 3dyo h ASN 467 N 0.00 0.51 -0.53 0.00 2.35 -1.63 -0.82 115.58 115.47 3dyo h ASN 467 Ca 0.01 -0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.62 3dyo h ASN 467 Cb 0.04 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 3dyo h ASN 467 CO -0.00 0.42 -0.08 0.45 -1.65 0.00 0.00 177.43 176.57 3dyo h HIS 468 N 0.59 1.12 -0.65 1.19 3.86 -1.21 -1.46 115.15 118.60 3dyo h HIS 468 Ca 0.15 -0.22 -0.06 0.00 -1.16 0.00 0.00 60.37 59.09 3dyo h HIS 468 Cb 0.02 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.18 3dyo h HIS 468 CO 0.00 1.03 0.19 -0.44 0.86 0.00 0.00 177.93 179.57 3dyo h ASP 469 N 0.91 0.96 -0.71 2.45 3.32 -1.16 0.14 116.42 122.31 3dyo h ASP 469 Ca 0.15 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 3dyo h ASP 469 Cb 0.64 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 3dyo h ASP 469 CO 0.04 0.92 0.36 0.00 -1.72 0.00 0.00 179.24 178.84 3dyo h ALA 470 N 1.07 0.92 0.00 3.45 0.00 -1.12 -1.79 119.26 121.79 3dyo h ALA 470 Ca 0.21 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 3dyo h ALA 470 Cb 0.32 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3dyo h ALA 470 CO -0.00 0.47 -0.82 -0.07 0.00 0.00 0.00 179.25 178.82 3dyo h LEU 471 N 0.99 0.00 0.05 0.00 3.38 -0.93 -1.35 115.31 117.45 3dyo h LEU 471 Ca 0.25 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.22 3dyo h LEU 471 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3dyo h LEU 471 CO -0.03 0.82 -0.08 0.22 0.09 0.00 0.00 178.44 179.46 3dyo h TYR 472 N 0.00 -0.21 -0.64 1.13 3.20 -0.58 -2.12 116.97 117.75 3dyo h TYR 472 Ca -0.01 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.88 3dyo h TYR 472 Cb 1.49 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.81 3dyo h TYR 472 CO 0.00 -0.13 0.41 -0.09 -1.64 0.00 0.00 178.16 176.72 3dyo h ARG 473 N -0.17 0.81 -0.30 1.82 9.65 -1.12 -1.67 114.38 123.40 3dyo h ARG 473 Ca 0.01 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 58.91 3dyo h ARG 473 Cb 0.18 -0.18 -0.06 0.00 -1.39 0.00 0.00 29.97 28.52 3dyo h ARG 473 CO -0.04 0.53 -0.09 2.35 2.80 0.00 0.00 179.97 185.52 3dyo h TRP 474 N 0.83 -0.20 -0.72 2.20 7.01 -0.97 -0.53 115.95 123.57 3dyo h TRP 474 Ca 0.25 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.28 3dyo h TRP 474 Cb -0.05 0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 3dyo h TRP 474 CO -0.04 -0.15 0.46 0.82 -2.79 0.00 0.00 178.44 176.74 3dyo h ILE 475 N -0.02 1.19 -0.82 2.65 2.04 -1.05 0.22 117.51 121.72 3dyo h ILE 475 Ca 0.15 -0.38 0.06 0.00 1.00 0.00 0.00 64.86 65.69 3dyo h ILE 475 Cb 0.25 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.43 3dyo h ILE 475 CO -0.32 0.19 0.53 0.11 0.00 0.00 0.00 178.15 178.66 3dyo h LYS 476 N 0.97 0.88 0.08 2.37 1.79 -0.69 0.72 116.57 122.68 3dyo h LYS 476 Ca 0.26 -0.05 -0.17 0.00 -2.18 0.00 0.00 60.65 58.50 3dyo h LYS 476 Cb -0.08 -0.20 0.02 0.00 -1.58 0.00 0.00 32.23 30.39 3dyo h LYS 476 CO -0.05 0.58 -0.72 1.03 -1.08 0.00 0.00 179.45 179.20 3dyo h SER 477 N 0.90 0.50 0.36 0.86 0.87 -0.11 -3.31 113.55 113.62 3dyo h SER 477 Ca 0.35 -0.86 -0.20 0.00 -1.23 0.00 0.00 61.79 59.85 3dyo h SER 477 Cb 0.21 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 3dyo h SER 477 CO -0.12 1.31 -0.82 0.58 -0.53 0.00 0.00 176.83 177.25 3dyo h VAL 478 N -0.24 1.41 -2.34 2.23 2.07 -0.26 -3.41 116.25 115.71 3dyo h VAL 478 Ca -0.11 -2.33 -0.58 0.00 0.82 0.00 0.00 66.70 64.50 3dyo h VAL 478 Cb 1.49 2.28 -0.38 0.00 -1.52 0.00 0.00 31.29 33.16 3dyo h VAL 478 CO 0.14 0.69 -0.96 -0.62 0.02 0.00 0.00 177.57 176.84 3dyo s ASP 479 N -6.99 1.43 0.00 0.57 2.15 0.21 -4.94 116.67 109.10 3dyo s ASP 479 Ca -0.05 -2.97 0.12 0.00 0.43 0.00 0.00 52.55 50.08 3dyo s ASP 479 Cb 0.10 -0.37 0.63 0.00 -0.30 0.00 0.00 42.92 42.98 3dyo s ASP 479 CO 0.84 -0.18 1.25 -2.65 -0.17 0.00 0.00 175.17 174.27 3dyo n PRO 480 N 2.93 0.22 0.00 4.34 -0.02 -1.24 -3.31 135.00 137.92 3dyo n PRO 480 Ca 0.28 0.13 0.15 0.00 -2.02 0.00 0.00 63.50 62.04 3dyo n PRO 480 Cb 0.47 -1.50 0.71 0.00 -0.02 0.00 0.00 33.50 33.16 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 -1.21 0.41 -3.87 2.55 3.41 -1.26 -4.77 113.62 108.88 3dyo n SER 481 Ca 0.07 -0.75 -0.17 0.00 -0.26 0.00 0.00 58.87 57.76 3dyo n SER 481 Cb 0.08 -0.07 -0.16 0.00 -0.26 0.00 0.00 64.21 63.80 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 -2.30 0.48 0.89 4.33 0.52 -1.21 -4.23 118.95 117.42 3dyo s ARG 482 Ca 0.35 -0.04 -0.11 0.00 -0.52 0.00 0.00 55.73 55.42 3dyo s ARG 482 Cb 0.21 -0.56 0.13 0.00 0.52 0.00 0.00 34.95 35.25 3dyo s ARG 482 CO 0.43 -0.06 1.15 -2.14 0.02 0.00 0.00 175.30 174.70 3dyo s PRO 483 N 0.70 1.21 -0.10 3.54 0.02 -1.25 -4.71 135.00 134.40 3dyo s PRO 483 Ca -0.08 1.56 0.03 0.00 0.02 0.00 0.00 61.00 62.52 3dyo s PRO 483 Cb -0.11 -1.75 -0.01 0.00 0.02 0.00 0.00 34.50 32.65 3dyo s PRO 483 CO -0.01 -2.49 -0.19 0.08 -0.33 0.00 0.00 177.00 174.06 3dyo s VAL 484 N -2.59 2.56 0.20 3.83 1.01 -1.26 -1.06 120.40 123.09 3dyo s VAL 484 Ca 0.67 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.88 3dyo s VAL 484 Cb -0.23 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.08 3dyo s VAL 484 CO 0.57 0.55 -0.15 0.00 0.00 0.00 0.00 175.10 176.06 3dyo s GLN 485 N 0.19 1.33 -0.29 2.72 -2.07 0.27 -0.49 119.66 121.33 3dyo s GLN 485 Ca -0.11 -1.56 -0.16 0.00 -1.82 0.00 0.00 55.36 51.71 3dyo s GLN 485 Cb -0.16 -1.18 0.15 0.00 -1.09 0.00 0.00 33.01 30.73 3dyo s GLN 485 CO 0.06 0.20 0.97 -0.47 -1.32 0.00 0.00 175.29 174.74 3dyo s TYR 486 N -2.79 -0.62 -0.20 9.60 5.04 -1.26 -2.59 117.35 124.53 3dyo s TYR 486 Ca 0.21 1.19 0.20 0.00 -2.44 0.00 0.00 57.07 56.24 3dyo s TYR 486 Cb -0.02 0.37 -0.04 0.00 0.35 0.00 0.00 41.96 42.63 3dyo s TYR 486 CO 0.07 -0.31 0.99 1.49 -1.34 0.00 0.00 175.55 176.46 3dyo h GLU 487 N 6.48 0.00 -6.70 4.97 4.22 -1.85 -3.43 114.58 118.27 3dyo h GLU 487 Ca -0.25 0.00 -0.58 0.00 0.08 0.00 0.00 59.36 58.62 3dyo h GLU 487 Cb 1.17 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.58 3dyo h GLU 487 CO 0.17 0.11 0.01 0.41 -2.18 0.00 0.00 179.01 177.52 3dyo n GLY 488 N 1.25 -0.58 2.09 1.92 0.00 -1.26 -0.06 105.19 108.55 3dyo n GLY 488 Ca -0.03 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 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 1.38 0.56 0.00 -0.02 0.00 -1.23 -3.96 105.19 101.92 3dyo n GLY 489 Ca 0.12 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.33 1.06 3.42 -0.02 0.00 -1.18 -4.72 105.19 101.42 3dyo n GLY 490 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.30 0.00 -2.37 4.61 0.00 0.91 -4.69 120.51 117.67 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 -0.79 0.01 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.19 0.72 -3.35 0.00 5.75 -1.26 -2.02 116.55 116.20 3dyo n ASP 492 Ca 0.00 -1.99 -0.24 0.00 -0.01 0.00 0.00 54.79 52.54 3dyo n ASP 492 Cb 0.10 -0.26 0.21 0.00 -1.03 0.00 0.00 41.12 40.13 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 0.37 0.00 1.66 2.12 -2.24 -1.26 -4.91 114.28 110.02 3dyo n THR 493 Ca 0.04 -0.37 0.11 0.00 -2.27 0.00 0.00 64.05 61.55 3dyo n THR 493 Cb 1.03 -1.17 0.63 0.00 -2.10 0.00 0.00 70.33 68.72 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 -4.47 0.00 -0.98 4.28 -2.24 -1.26 -2.84 114.28 106.77 3dyo n THR 494 Ca 0.12 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.98 3dyo n THR 494 Cb 0.48 -0.49 0.31 0.00 -2.10 0.00 0.00 70.33 68.53 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 -0.90 3.35 -3.28 6.98 0.00 -1.26 -4.94 120.51 120.45 3dyo n ALA 495 Ca 0.16 -2.21 -0.15 0.00 0.00 0.00 0.00 53.44 51.24 3dyo n ALA 495 Cb 0.07 -0.86 -0.15 0.00 0.00 0.00 0.00 19.45 18.51 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 -2.83 0.15 -0.67 0.00 -1.32 -1.13 -4.17 115.64 105.67 3dyo s THR 496 Ca 0.47 0.01 0.25 0.00 -1.21 0.00 0.00 61.69 61.20 3dyo s THR 496 Cb 0.37 -0.20 0.13 0.00 -1.51 0.00 0.00 72.50 71.29 3dyo s THR 496 CO 0.11 0.09 1.47 0.47 -2.21 0.00 0.00 174.62 174.55 3dyo n ASP 497 N 3.59 0.74 -4.08 8.08 8.00 0.36 -4.83 116.55 128.41 3dyo n ASP 497 Ca -0.20 0.27 -0.24 0.00 0.71 0.00 0.00 54.79 55.32 3dyo n ASP 497 Cb 0.55 -0.15 -0.16 0.00 -0.02 0.00 0.00 41.12 41.34 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 -3.14 1.20 -0.29 0.53 1.01 -1.26 -4.51 121.20 114.74 3dyo s ILE 498 Ca 0.08 -0.58 -0.29 0.00 0.00 0.00 0.00 60.65 59.86 3dyo s ILE 498 Cb 0.13 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 3dyo s ILE 498 CO 0.68 0.36 1.51 -0.63 0.00 0.00 0.00 174.94 176.86 3dyo s ILE 499 N 0.18 3.84 -0.50 2.92 1.01 -0.14 -4.71 121.20 123.79 3dyo s ILE 499 Ca -0.05 0.92 0.08 0.00 0.00 0.00 0.00 60.65 61.59 3dyo s ILE 499 Cb -0.11 -3.92 0.29 0.00 0.01 0.00 0.00 42.46 38.73 3dyo s ILE 499 CO 0.02 -0.45 0.74 0.00 0.00 0.00 0.00 174.94 175.25 3dyo s PRO 501 N -2.40 1.91 -0.17 0.00 0.04 -1.26 -3.57 135.00 129.55 3dyo s PRO 501 Ca 0.41 1.22 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 3dyo s PRO 501 Cb 0.23 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.91 3dyo s PRO 501 CO -0.08 -1.90 -0.10 0.00 0.04 0.00 0.00 177.00 174.96 3dyo s MET 502 N -4.85 3.35 -1.18 4.56 0.23 -1.26 -0.90 119.30 119.25 3dyo s MET 502 Ca 0.62 -0.67 0.00 0.00 -1.03 0.00 0.00 55.69 54.62 3dyo s MET 502 Cb -0.18 -2.79 0.00 0.00 -1.53 0.00 0.00 34.83 30.32 3dyo s MET 502 CO 0.57 0.00 0.00 0.66 -2.03 0.00 0.00 175.02 174.22 3dyo n TYR 503 N 4.17 0.00 -2.34 3.16 4.02 0.80 -4.95 117.16 122.02 3dyo n TYR 503 Ca -0.18 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.30 3dyo n TYR 503 Cb 0.52 -2.16 -0.03 0.00 -0.02 0.00 0.00 39.34 37.64 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 -2.35 3.44 0.71 -0.72 0.00 -1.26 -4.89 121.76 116.69 3dyo s ALA 504 Ca 0.00 1.04 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 3dyo s ALA 504 Cb 0.00 -3.39 0.06 0.00 0.00 0.00 0.00 23.12 19.79 3dyo s ALA 504 CO 0.00 -0.35 1.03 1.03 0.00 0.00 0.00 175.76 177.48 3dyo s ARG 505 N -1.52 2.26 -0.02 0.00 0.52 -1.26 -4.78 118.95 114.15 3dyo s ARG 505 Ca 0.46 -0.14 -0.23 0.00 -0.52 0.00 0.00 55.73 55.31 3dyo s ARG 505 Cb -0.35 -2.14 -0.21 0.00 0.52 0.00 0.00 34.95 32.77 3dyo s ARG 505 CO 0.45 -1.23 1.12 0.28 0.02 0.00 0.00 175.30 175.94 3dyo h VAL 506 N -0.63 1.48 0.00 3.52 2.07 -1.94 -1.96 116.25 118.78 3dyo h VAL 506 Ca -0.45 -1.76 -0.03 0.00 0.82 0.00 0.00 66.70 65.28 3dyo h VAL 506 Cb 1.31 2.50 -0.01 0.00 -1.52 0.00 0.00 31.29 33.58 3dyo h VAL 506 CO 0.61 0.49 -1.21 0.47 0.02 0.00 0.00 177.57 177.95 3dyo n ASP 507 N -4.51 4.10 -4.69 0.57 8.00 -1.26 -3.32 116.55 115.44 3dyo n ASP 507 Ca -0.09 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.02 3dyo n ASP 507 Cb 0.47 0.90 -0.06 0.00 -0.02 0.00 0.00 41.12 42.42 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 -2.19 4.31 0.34 -1.24 2.12 -1.26 -4.72 118.70 116.07 3dyo s GLU 508 Ca -0.02 0.61 -0.13 0.00 0.36 0.00 0.00 54.97 55.80 3dyo s GLU 508 Cb 0.02 -3.50 -0.08 0.00 0.26 0.00 0.00 34.13 30.83 3dyo s GLU 508 CO 0.16 -0.03 0.73 -0.51 -0.54 0.00 0.00 175.26 175.07 3dyo s ASP 509 N 0.91 6.67 -0.43 -1.70 1.01 -1.26 -3.75 116.67 118.11 3dyo s ASP 509 Ca 0.30 1.19 0.02 0.00 0.71 0.00 0.00 52.55 54.77 3dyo s ASP 509 Cb -0.16 -2.34 0.15 0.00 1.01 0.00 0.00 42.92 41.58 3dyo s ASP 509 CO 0.12 -0.26 0.29 -1.10 0.21 0.00 0.00 175.17 174.42 3dyo s GLN 510 N -3.29 1.05 -1.13 8.23 -0.21 -0.47 -4.88 119.66 118.95 3dyo s GLN 510 Ca 0.52 -1.96 -0.12 0.00 0.02 0.00 0.00 55.36 53.83 3dyo s GLN 510 Cb -0.10 -1.83 -0.07 0.00 1.00 0.00 0.00 33.01 32.01 3dyo s GLN 510 CO 0.23 -1.26 2.29 -0.35 -2.12 0.00 0.00 175.29 174.07 3dyo n PRO 511 N 3.33 2.45 -2.24 2.91 -0.04 -1.26 -0.33 135.00 139.81 3dyo n PRO 511 Ca 0.17 -1.89 -0.36 0.00 -0.04 0.00 0.00 63.50 61.38 3dyo n PRO 511 Cb 0.40 -2.77 -0.00 0.00 -0.04 0.00 0.00 33.50 31.09 3dyo n PRO 511 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dyo s PHE 512 N 3.44 2.73 0.45 0.54 0.40 -1.26 -4.86 117.98 119.41 3dyo s PHE 512 Ca 0.52 1.54 -0.24 0.00 -0.60 0.00 0.00 56.93 58.14 3dyo s PHE 512 Cb 0.13 -3.34 -0.08 0.00 0.51 0.00 0.00 43.02 40.25 3dyo s PHE 512 CO -0.02 -1.60 1.27 -2.14 0.70 0.00 0.00 175.22 173.44 3dyo s PRO 513 N -3.07 3.75 0.00 0.24 0.02 -1.26 -2.31 135.00 132.38 3dyo s PRO 513 Ca 0.70 2.06 0.00 0.00 0.02 0.00 0.00 61.00 63.78 3dyo s PRO 513 Cb -0.26 -2.56 0.00 0.00 0.02 0.00 0.00 34.50 31.69 3dyo s PRO 513 CO 0.30 -0.64 0.00 0.00 -0.33 0.00 0.00 177.00 176.33 3dyo n ALA 514 N -0.26 0.00 -3.07 -1.55 0.00 -1.26 -4.52 120.51 109.84 3dyo n ALA 514 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 3dyo n ALA 514 Cb 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.88 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 0.57 -1.22 0.00 0.24 -1.20 -4.82 118.33 111.90 3dyo n VAL 515 Ca 0.00 -4.60 -0.34 0.00 -2.04 0.00 0.00 64.34 57.37 3dyo n VAL 515 Cb 0.00 -0.38 0.12 0.00 -1.47 0.00 0.00 33.84 32.11 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 -2.71 1.81 -0.62 7.34 0.04 -0.98 -4.52 135.00 135.36 3dyo s PRO 516 Ca 0.40 1.76 -0.00 0.00 0.04 0.00 0.00 61.00 63.20 3dyo s PRO 516 Cb 0.35 -1.79 0.16 0.00 0.04 0.00 0.00 34.50 33.25 3dyo s PRO 516 CO -0.08 -2.09 0.41 0.15 0.04 0.00 0.00 177.00 175.44 3dyo s LYS 517 N -4.07 2.44 0.69 4.56 1.02 0.55 -4.86 119.74 120.07 3dyo s LYS 517 Ca 0.73 -2.66 -0.13 0.00 0.02 0.00 0.00 55.97 53.93 3dyo s LYS 517 Cb -0.29 -3.61 0.01 0.00 -0.52 0.00 0.00 37.83 33.43 3dyo s LYS 517 CO 0.49 -1.17 1.09 -1.58 -0.92 0.00 0.00 175.35 173.26 3dyo s TRP 518 N -0.31 2.75 0.23 3.18 0.52 -1.26 -1.37 118.94 122.68 3dyo s TRP 518 Ca 0.18 1.53 -0.31 0.00 0.02 0.00 0.00 56.10 57.52 3dyo s TRP 518 Cb -0.20 -3.06 -0.14 0.00 -1.15 0.00 0.00 33.47 28.91 3dyo s TRP 518 CO -0.03 -1.55 1.23 0.45 0.02 0.00 0.00 176.95 177.07 3dyo n SER 519 N -2.80 1.94 -0.14 2.95 2.88 -1.25 -4.44 113.62 112.76 3dyo n SER 519 Ca 0.09 1.15 0.02 0.00 -1.33 0.00 0.00 58.87 58.80 3dyo n SER 519 Cb 0.53 -1.32 0.30 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 2.67 1.17 -0.51 2.46 3.07 -1.34 0.15 117.51 125.17 3dyo h ILE 520 Ca -0.43 -0.31 -0.00 0.00 1.55 0.00 0.00 64.86 65.66 3dyo h ILE 520 Cb 1.31 0.23 -0.02 0.00 -0.27 0.00 0.00 36.82 38.07 3dyo h ILE 520 CO 0.70 0.16 0.30 0.11 -1.05 0.00 0.00 178.15 178.38 3dyo h LYS 521 N 0.87 0.69 -0.43 0.16 1.57 -1.84 -2.87 116.57 114.72 3dyo h LYS 521 Ca 0.23 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.81 3dyo h LYS 521 Cb -0.09 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 3dyo h LYS 521 CO -0.05 0.51 -0.28 -0.22 -0.57 0.00 0.00 179.45 178.84 3dyo h LYS 522 N 0.68 0.94 -0.86 3.15 3.64 -1.60 -3.28 116.57 119.25 3dyo h LYS 522 Ca 0.18 -0.43 0.11 0.00 -1.27 0.00 0.00 60.65 59.23 3dyo h LYS 522 Cb -0.00 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.73 3dyo h LYS 522 CO -0.03 1.09 0.49 2.35 -2.27 0.00 0.00 179.45 181.08 3dyo h TRP 523 N 0.79 0.89 0.00 1.91 2.91 -0.78 -1.90 115.95 119.78 3dyo h TRP 523 Ca 0.09 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.13 3dyo h TRP 523 Cb 0.86 -0.27 -0.00 0.00 -0.51 0.00 0.00 29.16 29.24 3dyo h TRP 523 CO 0.05 0.34 -0.07 -0.07 -1.03 0.00 0.00 178.44 177.67 3dyo h LEU 524 N 0.80 0.00 -2.47 0.65 3.38 -1.59 -2.57 115.31 113.51 3dyo h LEU 524 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3dyo h LEU 524 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3dyo h LEU 524 CO -0.26 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 176.79 3dyo n SER 525 N -4.43 3.39 -4.51 -0.43 3.41 -0.73 -4.52 113.62 105.79 3dyo n SER 525 Ca -0.03 -1.95 -0.40 0.00 -0.26 0.00 0.00 58.87 56.23 3dyo n SER 525 Cb 0.15 -0.29 0.03 0.00 -0.26 0.00 0.00 64.21 63.83 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 1.30 1.32 -4.67 1.04 4.77 -0.97 -4.72 117.00 115.07 3dyo n LEU 526 Ca 0.18 0.85 -0.51 0.00 -0.03 0.00 0.00 56.01 56.50 3dyo n LEU 526 Cb 0.55 -1.22 -0.06 0.00 -2.33 0.00 0.00 43.42 40.37 3dyo n LEU 526 CO 0.14 -2.55 1.25 -2.65 -1.33 0.00 0.00 177.39 172.25 3dyo n PRO 527 N 0.02 1.64 -0.17 3.23 -0.02 -1.26 -0.54 135.00 137.90 3dyo n PRO 527 Ca 0.11 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3dyo n PRO 527 Cb 0.44 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 3.70 2.17 3.73 -1.23 0.00 -1.26 -5.02 105.19 107.27 3dyo n GLY 528 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.17 4.65 0.00 1.61 2.56 0.30 -4.93 118.70 122.72 3dyo s GLU 529 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 54.97 56.51 3dyo s GLU 529 Cb 0.00 -3.35 0.00 0.00 2.00 0.00 0.00 34.13 32.78 3dyo s GLU 529 CO 0.00 0.14 0.01 0.25 -0.56 0.00 0.00 175.26 175.10 3dyo n THR 530 N 2.78 0.00 -1.69 -1.70 -2.24 -1.26 -4.79 114.28 105.38 3dyo n THR 530 Ca 0.03 -0.13 -0.30 0.00 -2.27 0.00 0.00 64.05 61.38 3dyo n THR 530 Cb 0.48 1.07 0.07 0.00 -2.10 0.00 0.00 70.33 69.86 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 -0.23 2.41 0.64 -0.78 0.52 -1.26 -4.09 118.95 116.16 3dyo s ARG 531 Ca 0.00 0.57 -0.13 0.00 -0.52 0.00 0.00 55.73 55.65 3dyo s ARG 531 Cb 0.00 -1.96 -0.02 0.00 0.52 0.00 0.00 34.95 33.49 3dyo s ARG 531 CO 0.00 -1.37 1.05 -1.25 0.02 0.00 0.00 175.30 173.75 3dyo s PRO 532 N -5.24 3.21 -0.15 3.54 0.04 -1.15 -4.80 135.00 130.45 3dyo s PRO 532 Ca 0.60 1.02 0.01 0.00 0.04 0.00 0.00 61.00 62.67 3dyo s PRO 532 Cb -0.13 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.40 3dyo s PRO 532 CO 0.53 -0.88 -0.18 -1.17 0.04 0.00 0.00 177.00 175.34 3dyo s LEU 533 N -5.02 1.94 -0.13 -3.56 0.20 0.47 -0.97 118.68 111.61 3dyo s LEU 533 Ca 0.60 -0.56 -0.02 0.00 0.69 0.00 0.00 54.13 54.84 3dyo s LEU 533 Cb -0.14 -1.33 0.04 0.00 -0.43 0.00 0.00 46.19 44.33 3dyo s LEU 533 CO 0.47 0.01 0.01 -0.63 -0.29 0.00 0.00 176.35 175.92 3dyo s ILE 534 N 1.18 0.47 0.22 6.68 1.01 -0.72 -1.04 121.20 129.01 3dyo s ILE 534 Ca 0.00 -0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 3dyo s ILE 534 Cb -0.14 -0.78 -0.09 0.00 0.01 0.00 0.00 42.46 41.45 3dyo s ILE 534 CO -0.08 0.05 1.39 -0.76 0.00 0.00 0.00 174.94 175.54 3dyo s LEU 535 N 1.91 4.40 0.36 2.97 1.02 -0.63 -4.16 118.68 124.55 3dyo s LEU 535 Ca 0.02 2.53 0.20 0.00 0.02 0.00 0.00 54.13 56.90 3dyo s LEU 535 Cb -0.14 -3.61 0.31 0.00 0.02 0.00 0.00 46.19 42.76 3dyo s LEU 535 CO -0.07 -0.63 1.57 0.00 0.02 0.00 0.00 176.35 177.24 3dyo s GLU 537 N -3.15 0.37 0.28 0.00 2.02 -1.22 -4.34 118.70 112.66 3dyo s GLU 537 Ca 0.05 0.57 -0.21 0.00 0.02 0.00 0.00 54.97 55.40 3dyo s GLU 537 Cb 0.07 0.09 0.03 0.00 0.10 0.00 0.00 34.13 34.42 3dyo s GLU 537 CO 0.70 -0.10 0.76 1.52 0.02 0.00 0.00 175.26 178.17 3dyo s TYR 538 N 0.68 -0.13 -0.89 1.61 -0.85 -0.92 -0.14 117.35 116.72 3dyo s TYR 538 Ca -0.04 -0.35 -0.06 0.00 -0.52 0.00 0.00 57.07 56.10 3dyo s TYR 538 Cb -0.05 0.72 -0.01 0.00 0.38 0.00 0.00 41.96 43.00 3dyo s TYR 538 CO -0.05 -1.24 0.71 0.00 -1.52 0.00 0.00 175.55 173.46 3dyo n ALA 539 N -0.48 -2.60 -1.80 9.51 0.00 -1.26 -1.15 120.51 122.73 3dyo n ALA 539 Ca -0.05 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 3dyo n ALA 539 Cb 0.59 -2.25 -0.03 0.00 0.00 0.00 0.00 19.45 17.76 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 -3.14 1.46 -0.42 0.00 2.46 -0.60 -3.78 115.29 111.28 3dyo s HIS 540 Ca 0.15 0.74 -0.03 0.00 0.47 0.00 0.00 55.06 56.39 3dyo s HIS 540 Cb -0.05 -3.98 0.08 0.00 -0.13 0.00 0.00 32.58 28.51 3dyo s HIS 540 CO 0.82 -3.23 2.66 0.00 -2.47 0.00 0.00 174.74 172.52 3dyo n ALA 541 N 11.82 6.22 -2.62 1.58 0.00 0.81 -4.45 120.51 133.87 3dyo n ALA 541 Ca 0.27 -2.77 -0.43 0.00 0.00 0.00 0.00 53.44 50.52 3dyo n ALA 541 Cb 0.48 -2.01 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 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 -1.67 3.96 4.75 0.00 0.00 -1.26 -3.57 119.30 121.52 3dyo s MET 542 Ca 0.54 0.77 0.00 0.00 0.00 0.00 0.00 55.69 57.00 3dyo s MET 542 Cb 0.36 -3.75 0.00 0.00 0.00 0.00 0.00 34.83 31.43 3dyo s MET 542 CO -0.17 -0.85 0.00 0.41 0.00 0.00 0.00 175.02 174.41 3dyo n GLY 543 N 4.13 1.60 3.55 2.11 0.00 -1.26 -4.25 105.19 111.07 3dyo n GLY 543 Ca 0.08 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 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 6.12 0.00 1.61 3.84 -1.26 -4.87 114.94 116.38 3dyo s ASN 544 Ca 0.00 -0.66 0.00 0.00 0.21 0.00 0.00 52.86 52.41 3dyo s ASN 544 Cb 0.00 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.14 3dyo s ASN 544 CO 0.00 -1.84 0.00 -0.24 -2.79 0.00 0.00 177.10 172.23 3dyo n SER 545 N 9.78 0.00 0.00 -4.21 2.88 -1.26 -4.73 113.62 116.08 3dyo n SER 545 Ca 0.15 -0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.26 3dyo n SER 545 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 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 0.00 -4.75 2.46 4.32 -1.20 -4.73 117.00 113.10 3dyo n LEU 546 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 56.01 55.58 3dyo n LEU 546 Cb 0.00 -0.48 -0.03 0.00 -1.62 0.00 0.00 43.42 41.30 3dyo n LEU 546 CO 0.00 0.00 1.04 -0.83 -1.22 0.00 0.00 177.39 176.38 3dyo s GLY 547 N -2.60 2.48 0.00 -0.72 0.00 0.93 -1.87 107.32 105.54 3dyo s GLY 547 Ca 0.00 1.23 0.00 0.00 0.00 0.00 0.00 44.72 45.95 3dyo s GLY 547 CO 0.00 2.14 0.00 0.61 0.00 0.00 0.00 173.10 175.85 3dyo n GLY 548 N 2.05 0.76 0.21 0.20 0.00 0.19 -4.02 105.19 104.58 3dyo n GLY 548 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 0.04 0.00 1.61 3.57 -1.55 -0.72 116.94 119.89 3dyo h PHE 549 Ca 0.00 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3dyo h PHE 549 Cb 0.00 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 38.81 3dyo h PHE 549 CO 0.00 -0.09 -0.03 0.00 -2.23 0.00 0.00 178.31 175.96 3dyo h ALA 550 N 1.47 1.40 -0.80 2.41 0.00 -1.85 -1.64 119.26 120.24 3dyo h ALA 550 Ca 0.28 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 3dyo h ALA 550 Cb 0.42 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3dyo h ALA 550 CO -0.42 0.03 0.32 -0.22 0.00 0.00 0.00 179.25 178.96 3dyo h LYS 551 N 0.00 1.20 -0.37 0.00 3.64 -1.52 -0.51 116.57 119.01 3dyo h LYS 551 Ca -0.00 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.13 3dyo h LYS 551 Cb 0.08 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3dyo h LYS 551 CO 0.00 0.97 0.08 1.88 -2.27 0.00 0.00 179.45 180.11 3dyo h TYR 552 N 1.17 0.63 -0.65 1.91 -1.99 -1.32 -2.84 116.97 113.88 3dyo h TYR 552 Ca 0.27 -0.08 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 3dyo h TYR 552 Cb 0.21 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.74 3dyo h TYR 552 CO 0.02 0.63 0.20 -1.49 -0.00 0.00 0.00 178.16 177.52 3dyo h TRP 553 N 0.45 1.02 -0.71 4.88 4.06 -1.39 0.13 115.95 124.39 3dyo h TRP 553 Ca 0.12 -0.09 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 3dyo h TRP 553 Cb 0.32 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.15 3dyo h TRP 553 CO 0.02 0.82 0.31 0.37 -3.56 0.00 0.00 178.44 176.40 3dyo h GLN 554 N 0.96 1.05 -0.36 0.49 4.15 -1.10 -1.33 115.11 118.97 3dyo h GLN 554 Ca 0.21 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.39 3dyo h GLN 554 Cb 0.28 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 3dyo h GLN 554 CO -0.01 0.85 -0.03 0.00 -1.93 0.00 0.00 178.83 177.71 3dyo h ALA 555 N 1.15 0.48 -1.00 3.38 0.00 -1.05 -1.69 119.26 120.53 3dyo h ALA 555 Ca 0.24 -0.27 0.08 0.00 0.00 0.00 0.00 54.91 54.96 3dyo h ALA 555 Cb 0.17 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 3dyo h ALA 555 CO -0.02 0.28 0.64 0.74 0.00 0.00 0.00 179.25 180.89 3dyo h PHE 556 N 0.45 1.18 0.00 0.00 0.05 -0.58 -0.78 116.94 117.25 3dyo h PHE 556 Ca 0.10 0.03 -0.17 0.00 3.82 0.00 0.00 57.97 61.75 3dyo h PHE 556 Cb 0.51 -0.38 -0.02 0.00 2.00 0.00 0.00 35.95 38.05 3dyo h PHE 556 CO 0.04 0.57 -0.79 0.00 -0.18 0.00 0.00 178.31 177.96 3dyo h ARG 557 N 1.12 0.00 0.00 1.51 3.08 -0.99 -3.27 114.38 115.83 3dyo h ARG 557 Ca 0.45 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.30 3dyo h ARG 557 Cb 0.26 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 3dyo h ARG 557 CO -0.20 0.79 -1.00 0.37 -1.07 0.00 0.00 179.97 178.86 3dyo h GLN 558 N 0.00 0.00 -4.82 0.04 4.15 -0.65 -3.44 115.11 110.39 3dyo h GLN 558 Ca -0.01 0.00 -0.68 0.00 0.77 0.00 0.00 58.65 58.74 3dyo h GLN 558 Cb 1.40 0.00 -0.27 0.00 0.21 0.00 0.00 27.48 28.82 3dyo h GLN 558 CO 0.10 0.85 -0.63 0.71 -1.93 0.00 0.00 178.83 177.93 3dyo s TYR 559 N -2.75 3.14 0.25 3.99 1.51 -0.36 -5.00 117.35 118.13 3dyo s TYR 559 Ca 0.01 -1.04 -0.05 0.00 -1.01 0.00 0.00 57.07 54.98 3dyo s TYR 559 Cb 0.09 -2.23 0.48 0.00 -0.11 0.00 0.00 41.96 40.19 3dyo s TYR 559 CO 0.81 -0.59 1.67 -1.35 -1.11 0.00 0.00 175.55 174.98 3dyo h PRO 560 N 8.21 0.22 0.00 -1.71 0.11 -1.87 -1.58 132.00 135.38 3dyo h PRO 560 Ca -0.31 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3dyo h PRO 560 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3dyo h PRO 560 CO 0.60 0.15 0.00 0.54 -0.21 0.00 0.00 178.00 179.07 3dyo n ARG 561 N -5.20 0.17 -2.93 1.05 1.74 -1.26 -4.39 116.66 105.83 3dyo n ARG 561 Ca 0.15 0.07 -0.43 0.00 -0.77 0.00 0.00 57.85 56.87 3dyo n ARG 561 Cb 0.49 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.80 4.43 -0.28 0.55 1.43 -0.60 -0.39 118.68 121.03 3dyo s LEU 562 Ca 0.17 -0.71 0.11 0.00 -1.03 0.00 0.00 54.13 52.67 3dyo s LEU 562 Cb 0.16 -2.60 0.60 0.00 0.03 0.00 0.00 46.19 44.38 3dyo s LEU 562 CO 0.41 -1.21 1.59 0.00 0.23 0.00 0.00 176.35 177.37 3dyo n GLN 563 N 7.20 2.80 0.00 1.70 6.02 -0.20 -4.68 117.38 130.22 3dyo n GLN 563 Ca -0.02 -3.04 0.00 0.00 -0.01 0.00 0.00 57.00 53.93 3dyo n GLN 563 Cb 0.46 -1.98 0.00 0.00 1.02 0.00 0.00 30.24 29.74 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 -0.63 -0.11 3.94 1.08 0.00 -1.26 -0.60 105.19 107.60 3dyo n GLY 564 Ca 0.34 -1.92 0.04 0.00 0.00 0.00 0.00 46.02 44.48 3dyo n GLY 564 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dyo s GLY 565 N 0.00 -0.22 -0.30 -0.02 0.00 -0.76 -1.60 107.32 104.42 3dyo s GLY 565 Ca 0.00 0.23 -0.03 0.00 0.00 0.00 0.00 44.72 44.92 3dyo s GLY 565 CO 0.00 5.24 0.01 -1.36 0.00 0.00 0.00 173.10 176.99 3dyo s PHE 566 N -2.04 3.22 0.57 1.90 0.40 -0.58 -0.69 117.98 120.75 3dyo s PHE 566 Ca 0.28 -1.67 -0.21 0.00 -0.60 0.00 0.00 56.93 54.73 3dyo s PHE 566 Cb 0.01 -2.14 -0.04 0.00 0.51 0.00 0.00 43.02 41.36 3dyo s PHE 566 CO -0.02 -0.76 1.32 0.08 0.70 0.00 0.00 175.22 176.54 3dyo s VAL 567 N 1.31 2.17 -0.38 -0.44 1.01 0.42 -2.16 120.40 122.33 3dyo s VAL 567 Ca -0.03 0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 3dyo s VAL 567 Cb -0.19 -3.06 0.07 0.00 0.00 0.00 0.00 36.38 33.20 3dyo s VAL 567 CO -0.01 -0.01 0.18 0.86 0.00 0.00 0.00 175.10 176.12 3dyo s TRP 568 N -1.36 3.34 0.08 5.22 -0.11 -0.30 -1.00 118.94 124.81 3dyo s TRP 568 Ca 0.74 -1.66 -0.02 0.00 1.22 0.00 0.00 56.10 56.39 3dyo s TRP 568 Cb -0.38 -2.70 0.01 0.00 -1.50 0.00 0.00 33.47 28.90 3dyo s TRP 568 CO 0.44 -0.82 0.13 -0.40 -4.62 0.00 0.00 176.95 171.68 3dyo n ASP 569 N 4.81 -0.38 0.30 5.86 5.75 -0.40 -0.13 116.55 132.35 3dyo n ASP 569 Ca -0.10 -1.35 -0.14 0.00 -0.01 0.00 0.00 54.79 53.20 3dyo n ASP 569 Cb 0.43 0.66 -0.07 0.00 -1.03 0.00 0.00 41.12 41.12 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 1.20 -0.74 -3.91 2.11 2.91 -1.12 -0.88 115.95 115.53 3dyo h TRP 570 Ca -0.06 -0.02 -0.44 0.00 1.13 0.00 0.00 58.89 59.50 3dyo h TRP 570 Cb 0.25 0.24 -0.30 0.00 -0.51 0.00 0.00 29.16 28.84 3dyo h TRP 570 CO 0.00 -0.42 -0.79 0.54 -1.03 0.00 0.00 178.44 176.74 3dyo s VAL 571 N -4.51 0.85 0.23 2.65 0.11 -1.26 -1.39 120.40 117.08 3dyo s VAL 571 Ca -0.13 -0.42 -0.32 0.00 -2.93 0.00 0.00 61.98 58.18 3dyo s VAL 571 Cb 0.01 -0.74 -0.12 0.00 -1.53 0.00 0.00 36.38 34.00 3dyo s VAL 571 CO 0.43 0.26 1.64 0.47 -3.33 0.00 0.00 175.10 174.56 3dyo n ASP 572 N 3.13 3.72 -2.98 3.54 8.00 -0.48 -4.41 116.55 127.07 3dyo n ASP 572 Ca -0.17 1.09 -0.33 0.00 0.71 0.00 0.00 54.79 56.10 3dyo n ASP 572 Cb 0.55 -1.54 -0.04 0.00 -0.02 0.00 0.00 41.12 40.07 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 3.25 3.51 -2.97 -1.24 6.02 -0.53 -3.97 117.38 121.44 3dyo n GLN 573 Ca 0.14 -2.78 -0.28 0.00 -0.01 0.00 0.00 57.00 54.07 3dyo n GLN 573 Cb 0.34 -2.41 -0.02 0.00 1.02 0.00 0.00 30.24 29.17 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 0.60 6.41 0.12 1.08 1.04 -1.26 -4.70 113.70 116.99 3dyo s SER 574 Ca 0.58 0.91 0.10 0.00 0.48 0.00 0.00 55.95 58.02 3dyo s SER 574 Cb 0.27 -2.23 -0.04 0.00 0.10 0.00 0.00 66.02 64.12 3dyo s SER 574 CO -0.14 -0.38 -0.26 -0.76 0.98 0.00 0.00 173.24 172.68 3dyo s LEU 575 N -4.04 2.31 0.10 2.42 1.43 -0.01 -4.36 118.68 116.54 3dyo s LEU 575 Ca 0.47 -0.74 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 3dyo s LEU 575 Cb -0.10 -1.16 -0.06 0.00 0.03 0.00 0.00 46.19 44.90 3dyo s LEU 575 CO 0.35 0.16 0.96 -0.63 0.23 0.00 0.00 176.35 177.42 3dyo s ILE 576 N -1.07 4.54 0.27 -0.59 -1.09 -0.66 0.11 121.20 122.71 3dyo s ILE 576 Ca 0.13 2.07 0.08 0.00 -2.23 0.00 0.00 60.65 60.69 3dyo s ILE 576 Cb -0.10 -4.32 -0.06 0.00 -1.58 0.00 0.00 42.46 36.40 3dyo s ILE 576 CO 0.06 0.30 -0.10 -0.54 -1.23 0.00 0.00 174.94 173.43 3dyo s LYS 577 N 0.09 1.56 0.02 2.79 1.02 -0.32 -4.92 119.74 119.97 3dyo s LYS 577 Ca 0.47 -1.76 0.07 0.00 0.02 0.00 0.00 55.97 54.77 3dyo s LYS 577 Cb -0.23 -1.29 -0.02 0.00 -0.52 0.00 0.00 37.83 35.76 3dyo s LYS 577 CO 0.30 0.12 -0.20 0.71 -0.92 0.00 0.00 175.35 175.35 3dyo s TYR 578 N -2.89 1.79 0.21 3.18 1.51 -1.26 -0.38 117.35 119.52 3dyo s TYR 578 Ca 0.28 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.96 3dyo s TYR 578 Cb 0.02 -1.11 0.05 0.00 -0.11 0.00 0.00 41.96 40.80 3dyo s TYR 578 CO 0.12 0.03 0.29 -0.40 -1.11 0.00 0.00 175.55 174.48 3dyo n ASP 579 N 2.19 0.14 0.23 2.29 5.68 0.34 -4.85 116.55 122.58 3dyo n ASP 579 Ca -0.16 -1.18 0.16 0.00 -0.50 0.00 0.00 54.79 53.11 3dyo n ASP 579 Cb 0.53 -0.21 0.76 0.00 -1.14 0.00 0.00 41.12 41.07 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 0.00 -0.57 0.11 4.11 -2.01 -0.32 114.58 115.90 3dyo h GLU 580 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.34 3dyo h GLU 580 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3dyo h GLU 580 CO 0.08 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.25 3dyo n ASN 581 N -2.68 3.50 0.00 3.06 3.02 -1.26 -4.92 115.26 115.98 3dyo n ASN 581 Ca -0.01 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 3dyo n ASN 581 Cb 0.16 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 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 1.54 0.49 3.74 7.41 0.00 -0.13 -5.02 105.19 113.22 3dyo n GLY 582 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3dyo n GLY 582 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dyo s ASN 583 N -2.00 7.31 0.39 1.61 0.01 -1.26 -4.72 114.94 116.28 3dyo s ASN 583 Ca 0.00 1.56 -0.16 0.00 -0.71 0.00 0.00 52.86 53.56 3dyo s ASN 583 Cb 0.00 -2.51 -0.09 0.00 0.41 0.00 0.00 41.25 39.07 3dyo s ASN 583 CO 0.00 -0.01 0.83 -2.16 -1.51 0.00 0.00 177.10 174.25 3dyo s PRO 584 N -0.07 4.00 0.03 -0.60 0.04 -1.26 -0.50 135.00 136.64 3dyo s PRO 584 Ca 0.41 0.77 -0.08 0.00 0.04 0.00 0.00 61.00 62.14 3dyo s PRO 584 Cb -0.21 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.00 3dyo s PRO 584 CO 0.25 0.01 0.16 1.67 0.04 0.00 0.00 177.00 179.14 3dyo s TRP 585 N -2.20 0.08 -0.13 0.56 1.48 0.49 -4.92 118.94 114.31 3dyo s TRP 585 Ca 0.56 -0.29 -0.23 0.00 -1.06 0.00 0.00 56.10 55.07 3dyo s TRP 585 Cb -0.10 -0.06 -0.03 0.00 -1.16 0.00 0.00 33.47 32.13 3dyo s TRP 585 CO 0.21 -0.39 0.73 -1.12 -4.06 0.00 0.00 176.95 172.32 3dyo s SER 586 N -1.96 6.91 0.23 -2.66 0.01 -1.26 -1.18 113.70 113.79 3dyo s SER 586 Ca -0.07 1.11 0.09 0.00 1.31 0.00 0.00 55.95 58.39 3dyo s SER 586 Cb -0.02 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 3dyo s SER 586 CO -0.03 -0.24 -0.04 0.00 0.41 0.00 0.00 173.24 173.35 3dyo s ALA 587 N 1.44 3.09 0.00 1.44 0.00 0.12 -4.89 121.76 122.95 3dyo s ALA 587 Ca 0.36 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 50.75 3dyo s ALA 587 Cb -0.17 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.18 3dyo s ALA 587 CO 0.15 0.36 0.00 2.48 0.00 0.00 0.00 175.76 178.74 3dyo n TYR 588 N -0.49 0.00 -1.57 0.00 0.18 -1.26 -0.83 117.16 113.18 3dyo n TYR 588 Ca -0.08 0.00 -0.49 0.00 1.88 0.00 0.00 57.90 59.21 3dyo n TYR 588 Cb 0.57 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.50 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 1.74 -0.03 1.52 -7.48 0.00 -0.60 -1.90 105.19 98.44 3dyo n GLY 589 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 1.94 3.13 0.00 -0.02 0.00 -1.26 -4.03 105.19 104.95 3dyo n GLY 590 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 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 0.13 0.00 -0.68 1.61 8.00 -0.80 -2.03 116.55 122.79 3dyo n ASP 591 Ca 0.00 0.11 0.07 0.00 0.71 0.00 0.00 54.79 55.68 3dyo n ASP 591 Cb 0.00 -0.31 0.19 0.00 -0.02 0.00 0.00 41.12 40.98 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 -1.31 0.62 -0.66 1.24 3.01 -1.26 -4.90 117.46 114.20 3dyo n PHE 592 Ca 0.07 -0.69 0.00 0.00 1.01 0.00 0.00 57.45 57.84 3dyo n PHE 592 Cb 0.13 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 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 -0.08 0.82 3.72 1.37 0.00 -0.86 -4.86 105.19 105.29 3dyo n GLY 593 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.96 6.81 -0.15 1.61 -4.77 -1.26 -5.00 116.67 110.96 3dyo s ASP 594 Ca 0.00 2.36 -0.26 0.00 -3.30 0.00 0.00 52.55 51.35 3dyo s ASP 594 Cb 0.00 -2.59 0.06 0.00 -1.09 0.00 0.00 42.92 39.30 3dyo s ASP 594 CO 0.00 -0.66 0.65 0.28 0.70 0.00 0.00 175.17 176.14 3dyo s THR 595 N 1.00 0.00 1.04 2.11 -1.32 -1.26 -4.06 115.64 113.15 3dyo s THR 595 Ca 0.64 -0.03 -0.12 0.00 -1.21 0.00 0.00 61.69 60.97 3dyo s THR 595 Cb -0.37 -0.94 0.21 0.00 -1.51 0.00 0.00 72.50 69.89 3dyo s THR 595 CO 0.31 -0.02 1.07 -2.84 -2.21 0.00 0.00 174.62 170.94 3dyo s PRO 596 N -0.44 0.07 0.21 7.08 0.02 -1.26 -5.16 135.00 135.53 3dyo s PRO 596 Ca -0.06 0.94 -0.11 0.00 0.02 0.00 0.00 61.00 61.79 3dyo s PRO 596 Cb -0.03 -1.66 -0.00 0.00 0.02 0.00 0.00 34.50 32.83 3dyo s PRO 596 CO 0.05 -3.09 0.41 0.54 -0.33 0.00 0.00 177.00 174.58 3dyo s ASN 597 N -2.85 -0.06 -0.31 2.53 2.20 -1.26 -4.74 114.94 110.46 3dyo s ASN 597 Ca 0.67 -0.89 0.09 0.00 -0.94 0.00 0.00 52.86 51.79 3dyo s ASN 597 Cb -0.22 0.53 0.55 0.00 -2.00 0.00 0.00 41.25 40.11 3dyo s ASN 597 CO 0.61 -1.04 1.55 0.47 -2.94 0.00 0.00 177.10 175.75 3dyo n ASP 598 N -0.32 2.98 0.00 3.54 8.00 0.26 -4.94 116.55 126.06 3dyo n ASP 598 Ca -0.04 -3.63 0.00 0.00 0.71 0.00 0.00 54.79 51.83 3dyo n ASP 598 Cb 0.63 -0.66 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 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 -1.01 0.00 0.00 -1.24 1.85 -1.26 -1.65 116.66 113.35 3dyo n ARG 599 Ca 0.37 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 57.32 3dyo n ARG 599 Cb 1.14 0.00 0.63 0.00 -1.05 0.00 0.00 32.46 33.18 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 0.62 0.00 2.89 0.00 -1.26 -1.55 117.38 132.07 3dyo n GLN 600 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 57.00 57.02 3dyo n GLN 600 Cb 0.00 -1.50 0.02 0.00 0.00 0.00 0.00 30.24 28.76 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 -1.05 0.00 1.28 2.61 3.01 -0.66 -1.00 117.46 121.65 3dyo n PHE 601 Ca 0.15 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.75 3dyo n PHE 601 Cb 0.09 -0.43 0.57 0.00 -0.01 0.00 0.00 39.48 39.71 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 -2.64 2.21 -0.04 0.00 -1.94 -0.17 -1.46 119.30 115.26 3dyo s MET 603 Ca 0.24 -1.92 0.11 0.00 -1.71 0.00 0.00 55.69 52.41 3dyo s MET 603 Cb 0.20 -3.69 0.20 0.00 2.01 0.00 0.00 34.83 33.54 3dyo s MET 603 CO 0.51 -1.12 1.09 0.09 -0.01 0.00 0.00 175.02 175.58 3dyo n ASN 604 N 4.50 0.79 -4.90 3.03 5.03 -1.26 -4.07 115.26 118.38 3dyo n ASN 604 Ca -0.02 -2.34 -0.28 0.00 0.87 0.00 0.00 54.58 52.81 3dyo n ASN 604 Cb 0.41 -0.29 0.00 0.00 -1.02 0.00 0.00 39.78 38.88 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 -1.77 1.53 0.47 7.41 0.00 -1.23 -1.28 107.32 112.45 3dyo s GLY 605 Ca 0.18 -0.43 0.26 0.00 0.00 0.00 0.00 44.72 44.74 3dyo s GLY 605 CO -0.05 -0.24 1.80 1.41 0.00 0.00 0.00 173.10 176.02 3dyo h LEU 606 N 0.10 0.00 -8.55 0.66 3.38 0.09 -3.44 115.31 107.55 3dyo h LEU 606 Ca -0.46 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.99 3dyo h LEU 606 Cb 1.20 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.73 3dyo h LEU 606 CO 0.62 0.12 -0.81 0.68 0.09 0.00 0.00 178.44 179.13 3dyo s VAL 607 N -3.49 1.50 0.87 1.22 -7.23 -0.61 -0.79 120.40 111.87 3dyo s VAL 607 Ca 0.03 -1.37 -0.11 0.00 -1.81 0.00 0.00 61.98 58.72 3dyo s VAL 607 Cb 0.08 -1.37 0.12 0.00 0.56 0.00 0.00 36.38 35.77 3dyo s VAL 607 CO 0.62 -0.04 1.09 -0.36 -0.31 0.00 0.00 175.10 176.10 3dyo s PHE 608 N -1.08 2.34 0.53 2.82 0.40 0.22 -1.39 117.98 121.82 3dyo s PHE 608 Ca 0.04 1.34 0.26 0.00 -0.60 0.00 0.00 56.93 57.96 3dyo s PHE 608 Cb -0.10 -3.14 1.41 0.00 0.51 0.00 0.00 43.02 41.71 3dyo s PHE 608 CO 0.03 -2.29 1.99 0.00 0.70 0.00 0.00 175.22 175.65 3dyo h ALA 609 N -1.48 2.49 -0.34 5.36 0.00 -1.89 0.22 119.26 123.62 3dyo h ALA 609 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3dyo h ALA 609 Cb 1.27 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3dyo h ALA 609 CO 0.53 -0.66 0.00 -0.40 0.00 0.00 0.00 179.25 178.72 3dyo n ASP 610 N -4.34 2.29 0.00 0.00 5.75 -1.26 -4.55 116.55 114.44 3dyo n ASP 610 Ca 0.10 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 3dyo n ASP 610 Cb 0.62 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.37 3dyo n ASP 610 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3dyo n ARG 611 N 0.49 0.00 -2.38 0.11 3.00 0.78 -5.02 116.66 113.64 3dyo n ARG 611 Ca 0.12 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.56 3dyo n ARG 611 Cb 0.41 -2.51 -0.04 0.00 0.00 0.00 0.00 32.46 30.33 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 -3.26 3.44 0.51 0.55 2.01 -1.26 -4.76 115.64 112.87 3dyo s THR 612 Ca 0.00 1.31 -0.18 0.00 0.31 0.00 0.00 61.69 63.13 3dyo s THR 612 Cb 0.00 -3.84 -0.08 0.00 0.01 0.00 0.00 72.50 68.60 3dyo s THR 612 CO 0.00 0.26 1.01 -2.84 -0.69 0.00 0.00 174.62 172.36 3dyo s PRO 613 N -0.81 3.79 0.45 4.92 0.02 -1.26 -0.61 135.00 141.50 3dyo s PRO 613 Ca 0.50 1.17 -0.02 0.00 0.02 0.00 0.00 61.00 62.67 3dyo s PRO 613 Cb -0.33 -2.10 -0.02 0.00 0.02 0.00 0.00 34.50 32.07 3dyo s PRO 613 CO 0.40 -0.41 0.70 -1.01 -0.33 0.00 0.00 177.00 176.35 3dyo s HIS 614 N -2.30 3.37 0.47 6.54 3.76 0.03 -4.79 115.29 122.38 3dyo s HIS 614 Ca 0.63 0.46 0.17 0.00 -0.15 0.00 0.00 55.06 56.17 3dyo s HIS 614 Cb -0.13 -2.27 1.16 0.00 1.11 0.00 0.00 32.58 32.44 3dyo s HIS 614 CO 0.26 -0.30 2.02 -1.35 -0.85 0.00 0.00 174.74 174.53 3dyo h PRO 615 N 0.35 0.23 0.00 8.40 0.11 -1.93 -2.32 132.00 136.84 3dyo h PRO 615 Ca -0.47 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dyo h PRO 615 Cb 1.23 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3dyo h PRO 615 CO 0.60 0.15 -0.00 0.00 -0.21 0.00 0.00 178.00 178.54 3dyo h ALA 616 N 1.77 1.67 -0.70 -0.75 0.00 -1.86 -2.85 119.26 116.54 3dyo h ALA 616 Ca 0.21 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.23 3dyo h ALA 616 Cb 0.51 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.21 3dyo h ALA 616 CO -0.04 0.00 0.28 1.25 0.00 0.00 0.00 179.25 180.74 3dyo h LEU 617 N 0.00 0.28 -1.21 0.00 5.85 -1.60 -0.83 115.31 117.81 3dyo h LEU 617 Ca -0.00 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 3dyo h LEU 617 Cb 0.00 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3dyo h LEU 617 CO 0.00 0.14 -0.16 0.00 -0.34 0.00 0.00 178.44 178.08 3dyo h THR 618 N 0.45 1.22 -0.56 1.05 1.03 -1.70 0.03 112.91 114.43 3dyo h THR 618 Ca 0.37 -0.98 -0.01 0.00 -0.01 0.00 0.00 66.41 65.78 3dyo h THR 618 Cb 0.50 1.24 -0.03 0.00 -1.07 0.00 0.00 68.15 68.79 3dyo h THR 618 CO -0.35 0.31 0.32 -0.08 -0.01 0.00 0.00 175.52 175.71 3dyo h GLU 619 N 0.32 0.77 -0.34 0.00 4.57 -1.31 -1.87 114.58 116.73 3dyo h GLU 619 Ca 0.06 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 3dyo h GLU 619 Cb 0.48 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 3dyo h GLU 619 CO 0.03 0.58 0.17 0.00 -1.18 0.00 0.00 179.01 178.61 3dyo h ALA 620 N 1.15 0.43 -0.84 2.92 0.00 -0.75 -1.37 119.26 120.80 3dyo h ALA 620 Ca 0.20 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3dyo h ALA 620 Cb 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 3dyo h ALA 620 CO -0.03 -0.02 0.52 -0.22 0.00 0.00 0.00 179.25 179.50 3dyo h LYS 621 N 0.41 0.92 -0.13 0.00 3.64 -0.71 -0.56 116.57 120.15 3dyo h LYS 621 Ca 0.12 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 3dyo h LYS 621 Cb 0.10 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 3dyo h LYS 621 CO -0.02 0.61 -0.23 1.25 -2.27 0.00 0.00 179.45 178.80 3dyo h HIS 622 N 0.95 0.47 0.00 1.91 2.76 -1.09 -2.94 115.15 117.20 3dyo h HIS 622 Ca 0.37 -0.17 -0.08 0.00 -2.20 0.00 0.00 60.37 58.30 3dyo h HIS 622 Cb 0.17 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 3dyo h HIS 622 CO -0.04 0.84 -0.36 1.96 -1.30 0.00 0.00 177.93 179.04 3dyo h GLN 623 N -0.03 0.00 -0.22 5.26 1.08 -1.03 -2.63 115.11 117.54 3dyo h GLN 623 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 3dyo h GLN 623 Cb 0.80 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.23 3dyo h GLN 623 CO 0.05 0.36 0.00 1.04 -0.95 0.00 0.00 178.83 179.33 3dyo n GLN 624 N -4.09 1.47 -1.49 1.46 6.02 -0.24 -4.95 117.38 115.57 3dyo n GLN 624 Ca -0.02 -0.71 -0.38 0.00 -0.01 0.00 0.00 57.00 55.88 3dyo n GLN 624 Cb 0.40 -1.17 0.04 0.00 1.02 0.00 0.00 30.24 30.53 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 0.08 0.56 -0.07 -1.09 6.02 -0.99 -4.90 117.38 116.99 3dyo n GLN 625 Ca 0.07 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.39 3dyo n GLN 625 Cb 0.18 -1.77 0.14 0.00 1.02 0.00 0.00 30.24 29.80 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 -1.71 0.18 -4.70 1.08 3.01 -1.26 -4.86 117.46 109.20 3dyo n PHE 626 Ca 0.12 -0.09 -0.24 0.00 1.01 0.00 0.00 57.45 58.25 3dyo n PHE 626 Cb 0.48 -0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.79 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 -1.77 1.41 0.13 1.38 0.40 -1.26 -0.74 117.98 117.52 3dyo s PHE 627 Ca 0.31 -0.32 0.08 0.00 -0.60 0.00 0.00 56.93 56.40 3dyo s PHE 627 Cb 0.21 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.76 3dyo s PHE 627 CO 0.30 -0.08 -0.10 -0.65 0.70 0.00 0.00 175.22 175.39 3dyo s GLN 628 N -0.16 2.08 0.06 0.44 -1.52 -0.48 -4.92 119.66 115.16 3dyo s GLN 628 Ca 0.02 -1.12 0.03 0.00 -1.95 0.00 0.00 55.36 52.34 3dyo s GLN 628 Cb -0.08 -2.24 -0.03 0.00 -0.22 0.00 0.00 33.01 30.44 3dyo s GLN 628 CO 0.00 0.48 -0.09 -0.06 -0.25 0.00 0.00 175.29 175.38 3dyo s PHE 629 N -1.37 0.84 0.03 0.91 0.40 -1.26 -0.43 117.98 117.10 3dyo s PHE 629 Ca 0.22 -0.59 0.02 0.00 -0.60 0.00 0.00 56.93 55.99 3dyo s PHE 629 Cb -0.10 -0.48 -0.02 0.00 0.51 0.00 0.00 43.02 42.92 3dyo s PHE 629 CO 0.14 -0.06 -0.08 1.03 0.70 0.00 0.00 175.22 176.95 3dyo s ARG 630 N -2.17 0.54 -0.14 0.44 0.52 -0.19 -4.97 118.95 112.98 3dyo s ARG 630 Ca -0.03 -0.65 0.02 0.00 -0.52 0.00 0.00 55.73 54.55 3dyo s ARG 630 Cb -0.06 -0.37 0.01 0.00 0.52 0.00 0.00 34.95 35.05 3dyo s ARG 630 CO -0.00 0.08 -0.21 -1.17 0.02 0.00 0.00 175.30 174.01 3dyo s LEU 631 N -1.27 2.06 -0.25 2.53 2.96 -1.26 -0.11 118.68 123.33 3dyo s LEU 631 Ca -0.07 -0.58 -0.02 0.00 -0.22 0.00 0.00 54.13 53.24 3dyo s LEU 631 Cb -0.08 -1.40 0.08 0.00 0.50 0.00 0.00 46.19 45.29 3dyo s LEU 631 CO 0.00 0.07 0.07 -0.55 -1.32 0.00 0.00 176.35 174.63 3dyo s SER 632 N 0.85 3.47 1.39 3.68 0.15 0.01 -5.02 113.70 118.23 3dyo s SER 632 Ca -0.07 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.36 3dyo s SER 632 Cb -0.15 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 63.47 3dyo s SER 632 CO -0.02 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.66 3dyo n GLY 633 N 4.99 3.06 0.83 9.45 0.00 -1.26 -1.86 105.19 120.39 3dyo n GLY 633 Ca -0.06 -0.23 0.10 0.00 0.00 0.00 0.00 46.02 45.83 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 12.78 1.85 -3.69 1.61 3.00 -1.26 -4.97 117.38 126.69 3dyo n GLN 634 Ca 0.00 -1.76 -0.35 0.00 -0.01 0.00 0.00 57.00 54.87 3dyo n GLN 634 Cb 0.00 -1.39 -0.08 0.00 0.00 0.00 0.00 30.24 28.77 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 -1.58 5.39 -0.18 5.09 2.01 -0.78 0.19 115.64 125.78 3dyo s THR 635 Ca 0.25 0.25 -0.05 0.00 0.31 0.00 0.00 61.69 62.44 3dyo s THR 635 Cb 0.17 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 3dyo s THR 635 CO 0.25 0.42 0.01 -0.63 -0.69 0.00 0.00 174.62 173.98 3dyo s ILE 636 N 0.44 4.19 -0.28 1.82 1.01 0.14 -0.81 121.20 127.72 3dyo s ILE 636 Ca 0.09 -0.24 -0.10 0.00 0.00 0.00 0.00 60.65 60.40 3dyo s ILE 636 Cb -0.12 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 3dyo s ILE 636 CO -0.01 0.46 0.16 -0.70 0.00 0.00 0.00 174.94 174.85 3dyo s GLU 637 N 0.61 3.83 -0.21 2.79 2.12 0.85 0.83 118.70 129.52 3dyo s GLU 637 Ca -0.00 -0.39 -0.05 0.00 0.36 0.00 0.00 54.97 54.89 3dyo s GLU 637 Cb -0.14 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.66 3dyo s GLU 637 CO 0.02 -0.20 -0.02 0.08 -0.54 0.00 0.00 175.26 174.60 3dyo s VAL 638 N 1.71 3.74 -0.10 3.70 1.01 0.20 -1.03 120.40 129.64 3dyo s VAL 638 Ca 0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 3dyo s VAL 638 Cb -0.16 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.50 3dyo s VAL 638 CO 0.09 0.43 -0.07 -0.89 0.00 0.00 0.00 175.10 174.66 3dyo s THR 639 N 1.15 3.70 -0.03 3.92 2.01 0.43 -1.18 115.64 125.65 3dyo s THR 639 Ca 0.02 -0.46 -0.15 0.00 0.31 0.00 0.00 61.69 61.41 3dyo s THR 639 Cb -0.14 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.76 3dyo s THR 639 CO 0.01 0.56 0.40 -0.55 -0.69 0.00 0.00 174.62 174.35 3dyo s SER 640 N -0.36 6.76 0.00 3.53 0.15 0.16 -1.38 113.70 122.56 3dyo s SER 640 Ca 0.05 0.91 0.18 0.00 0.70 0.00 0.00 55.95 57.79 3dyo s SER 640 Cb -0.12 -2.25 0.50 0.00 -1.71 0.00 0.00 66.02 62.44 3dyo s SER 640 CO 0.02 0.27 1.42 -0.62 1.20 0.00 0.00 173.24 175.53 3dyo n GLU 641 N 2.16 2.75 -2.39 5.44 1.02 0.08 -2.30 120.64 127.40 3dyo n GLU 641 Ca -0.13 -2.40 -0.33 0.00 -0.02 0.00 0.00 57.16 54.29 3dyo n GLU 641 Cb 0.52 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.47 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 -1.02 3.18 -0.08 -0.32 1.51 -1.26 -4.83 117.35 114.53 3dyo s TYR 642 Ca 0.38 1.53 0.16 0.00 -1.01 0.00 0.00 57.07 58.13 3dyo s TYR 642 Cb 0.20 -2.93 -0.23 0.00 -0.11 0.00 0.00 41.96 38.88 3dyo s TYR 642 CO 0.26 -0.67 0.24 1.28 -1.11 0.00 0.00 175.55 175.55 3dyo n LEU 643 N -1.42 0.00 -0.00 -1.29 4.77 -1.26 -1.49 117.00 116.30 3dyo n LEU 643 Ca 0.08 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3dyo n LEU 643 Cb 0.53 0.17 -0.00 0.00 -2.33 0.00 0.00 43.42 41.79 3dyo n LEU 643 CO 0.43 0.17 -0.51 0.49 -1.33 0.00 0.00 177.39 176.64 3dyo n PHE 644 N -2.30 0.00 -3.99 -1.77 3.01 -1.26 -4.84 117.46 106.30 3dyo n PHE 644 Ca -0.13 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.10 3dyo n PHE 644 Cb 0.68 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 40.11 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 -2.00 3.30 0.54 -1.08 1.70 -1.26 -4.80 118.95 115.34 3dyo s ARG 645 Ca -0.00 -0.75 -0.08 0.00 -0.47 0.00 0.00 55.73 54.43 3dyo s ARG 645 Cb 0.00 -2.85 -0.04 0.00 -0.57 0.00 0.00 34.95 31.50 3dyo s ARG 645 CO 0.01 0.47 0.88 -1.01 -1.08 0.00 0.00 175.30 174.57 3dyo s HIS 646 N -1.88 3.59 -1.38 5.89 3.76 -1.26 -3.24 115.29 120.78 3dyo s HIS 646 Ca 0.34 1.01 -0.13 0.00 -0.15 0.00 0.00 55.06 56.13 3dyo s HIS 646 Cb -0.10 -2.47 0.09 0.00 1.11 0.00 0.00 32.58 31.21 3dyo s HIS 646 CO 0.28 -0.44 2.04 -1.13 -0.85 0.00 0.00 174.74 174.64 3dyo n SER 647 N -2.44 4.42 -0.46 1.40 3.41 -0.45 -4.66 113.62 114.84 3dyo n SER 647 Ca 0.03 -2.94 0.03 0.00 -0.26 0.00 0.00 58.87 55.72 3dyo n SER 647 Cb 0.55 -1.60 0.10 0.00 -0.26 0.00 0.00 64.21 62.99 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 5.46 1.29 -2.97 4.04 5.68 -1.26 -3.71 116.55 125.09 3dyo n ASP 648 Ca 0.47 -2.04 -0.14 0.00 -0.50 0.00 0.00 54.79 52.59 3dyo n ASP 648 Cb 0.39 -0.20 0.02 0.00 -1.14 0.00 0.00 41.12 40.20 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 0.12 -0.47 -3.62 -1.12 5.15 -1.26 -5.06 115.26 109.01 3dyo n ASN 649 Ca 0.07 -3.25 -0.15 0.00 -0.60 0.00 0.00 54.58 50.65 3dyo n ASN 649 Cb 0.22 0.44 -0.07 0.00 -0.53 0.00 0.00 39.78 39.84 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 -1.32 0.86 0.01 1.20 8.01 -1.24 -4.16 118.70 122.05 3dyo s GLU 650 Ca 0.32 0.73 0.01 0.00 0.01 0.00 0.00 54.97 56.03 3dyo s GLU 650 Cb 0.33 0.41 -0.01 0.00 -4.31 0.00 0.00 34.13 30.56 3dyo s GLU 650 CO -0.06 -0.16 -0.03 -0.48 0.01 0.00 0.00 175.26 174.53 3dyo s LEU 651 N -0.10 2.10 -0.24 1.80 2.34 0.41 -1.84 118.68 123.15 3dyo s LEU 651 Ca -0.03 -0.24 -0.20 0.00 0.06 0.00 0.00 54.13 53.72 3dyo s LEU 651 Cb -0.03 -0.07 -0.02 0.00 -0.56 0.00 0.00 46.19 45.50 3dyo s LEU 651 CO 0.03 -0.09 0.59 -0.22 -1.06 0.00 0.00 176.35 175.61 3dyo s LEU 652 N -0.65 4.08 -0.18 1.48 2.96 0.12 -1.04 118.68 125.45 3dyo s LEU 652 Ca -0.05 0.69 -0.11 0.00 -0.22 0.00 0.00 54.13 54.44 3dyo s LEU 652 Cb -0.05 -2.81 -0.05 0.00 0.50 0.00 0.00 46.19 43.79 3dyo s LEU 652 CO -0.00 -0.31 0.17 -2.28 -1.32 0.00 0.00 176.35 172.60 3dyo s HIS 653 N 2.26 3.44 0.06 5.38 5.65 0.18 -0.48 115.29 131.78 3dyo s HIS 653 Ca 0.25 0.42 0.07 0.00 0.25 0.00 0.00 55.06 56.05 3dyo s HIS 653 Cb -0.16 -2.18 -0.03 0.00 -1.18 0.00 0.00 32.58 29.04 3dyo s HIS 653 CO 0.09 0.33 -0.18 1.67 -0.65 0.00 0.00 174.74 176.00 3dyo s TRP 654 N 0.23 1.57 -0.11 3.88 1.48 0.04 -1.55 118.94 124.49 3dyo s TRP 654 Ca 0.11 -0.39 -0.08 0.00 -1.06 0.00 0.00 56.10 54.67 3dyo s TRP 654 Cb -0.12 -0.91 0.03 0.00 -1.16 0.00 0.00 33.47 31.32 3dyo s TRP 654 CO 0.00 0.10 0.27 1.41 -4.06 0.00 0.00 176.95 174.68 3dyo s MET 655 N -1.44 0.30 -0.13 3.25 1.75 0.04 -0.99 119.30 122.08 3dyo s MET 655 Ca 0.04 0.44 0.01 0.00 -1.25 0.00 0.00 55.69 54.93 3dyo s MET 655 Cb -0.09 0.08 -0.01 0.00 2.84 0.00 0.00 34.83 37.65 3dyo s MET 655 CO 0.02 -0.07 -0.15 0.08 -0.65 0.00 0.00 175.02 174.25 3dyo s VAL 656 N 0.48 2.86 0.04 10.11 1.01 0.68 -1.23 120.40 134.36 3dyo s VAL 656 Ca -0.03 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3dyo s VAL 656 Cb -0.04 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 3dyo s VAL 656 CO -0.03 0.53 -0.07 0.00 0.00 0.00 0.00 175.10 175.53 3dyo s ALA 657 N 0.38 0.56 -0.28 5.51 0.00 -0.74 -0.36 121.76 126.82 3dyo s ALA 657 Ca -0.12 -0.81 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 3dyo s ALA 657 Cb -0.16 0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.06 3dyo s ALA 657 CO 0.06 -0.06 0.01 -1.17 0.00 0.00 0.00 175.76 174.59 3dyo s LEU 658 N -1.72 3.64 -1.49 0.00 2.96 -0.69 -1.01 118.68 120.38 3dyo s LEU 658 Ca -0.08 -0.96 -0.01 0.00 -0.22 0.00 0.00 54.13 52.85 3dyo s LEU 658 Cb -0.08 -1.75 0.01 0.00 0.50 0.00 0.00 46.19 44.87 3dyo s LEU 658 CO -0.00 -0.20 0.26 0.47 -1.32 0.00 0.00 176.35 175.56 3dyo n ASP 659 N 4.72 0.07 0.00 3.68 8.00 -0.57 0.77 116.55 133.22 3dyo n ASP 659 Ca -0.15 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.23 3dyo n ASP 659 Cb 0.46 -2.40 0.00 0.00 -0.02 0.00 0.00 41.12 39.16 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 -2.19 2.50 3.54 0.44 0.00 -1.26 -4.87 105.19 103.34 3dyo n GLY 660 Ca -0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.37 3.46 0.17 1.61 1.02 0.23 -4.61 119.74 121.25 3dyo s LYS 661 Ca 0.00 -0.18 -0.33 0.00 0.02 0.00 0.00 55.97 55.48 3dyo s LYS 661 Cb 0.00 -3.89 -0.15 0.00 -0.52 0.00 0.00 37.83 33.27 3dyo s LYS 661 CO 0.00 -0.89 1.26 -2.30 -0.92 0.00 0.00 175.35 172.50 3dyo n PRO 662 N 6.18 1.36 0.00 -1.68 -0.02 -1.26 -1.70 135.00 137.88 3dyo n PRO 662 Ca -0.01 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 3dyo n PRO 662 Cb 0.48 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 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 2.20 0.91 -3.52 2.45 4.77 0.51 -4.88 117.00 119.45 3dyo n LEU 663 Ca 0.15 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.02 3dyo n LEU 663 Cb 0.25 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 3dyo n LEU 663 CO 0.62 0.15 0.62 0.00 -1.33 0.00 0.00 177.39 177.45 3dyo s ALA 664 N -1.90 -1.81 0.20 -1.18 0.00 -1.05 -4.98 121.76 111.04 3dyo s ALA 664 Ca 0.00 1.18 -0.23 0.00 0.00 0.00 0.00 51.96 52.91 3dyo s ALA 664 Cb 0.00 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.23 3dyo s ALA 664 CO 0.00 -0.52 0.73 -1.54 0.00 0.00 0.00 175.76 174.43 3dyo s SER 665 N -1.84 -0.35 0.03 0.00 1.04 -1.26 -0.23 113.70 111.08 3dyo s SER 665 Ca -0.01 -0.35 -0.19 0.00 0.48 0.00 0.00 55.95 55.88 3dyo s SER 665 Cb -0.01 0.63 0.06 0.00 0.10 0.00 0.00 66.02 66.81 3dyo s SER 665 CO -0.02 -1.12 0.89 0.61 0.98 0.00 0.00 173.24 174.57 3dyo n GLY 666 N -0.42 0.48 3.28 7.32 0.00 -0.16 -4.98 105.19 110.70 3dyo n GLY 666 Ca -0.09 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.77 3dyo n GLY 666 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3dyo s GLU 667 N -2.02 0.65 -0.09 1.61 -1.05 -1.26 -0.78 118.70 115.77 3dyo s GLU 667 Ca 0.20 0.03 -0.05 0.00 -0.15 0.00 0.00 54.97 55.01 3dyo s GLU 667 Cb -0.01 0.30 0.04 0.00 -0.44 0.00 0.00 34.13 34.02 3dyo s GLU 667 CO 0.01 -0.17 0.21 0.08 0.95 0.00 0.00 175.26 176.34 3dyo s VAL 668 N -0.94 -0.04 0.51 1.83 1.01 0.36 -4.99 120.40 118.15 3dyo s VAL 668 Ca -0.10 0.13 -0.22 0.00 0.00 0.00 0.00 61.98 61.79 3dyo s VAL 668 Cb -0.04 -0.32 -0.06 0.00 0.00 0.00 0.00 36.38 35.96 3dyo s VAL 668 CO 0.04 0.05 1.27 -2.16 0.00 0.00 0.00 175.10 174.31 3dyo s PRO 669 N 1.03 3.43 -0.18 2.72 0.04 -1.26 0.14 135.00 140.93 3dyo s PRO 669 Ca -0.08 2.04 -0.07 0.00 0.04 0.00 0.00 61.00 62.93 3dyo s PRO 669 Cb -0.09 -2.33 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 3dyo s PRO 669 CO -0.06 -0.90 0.06 -0.51 0.04 0.00 0.00 177.00 175.63 3dyo s LEU 670 N -3.28 3.83 -0.38 -3.56 1.43 -0.77 -4.71 118.68 111.24 3dyo s LEU 670 Ca 0.68 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.90 3dyo s LEU 670 Cb -0.35 -1.96 0.16 0.00 0.03 0.00 0.00 46.19 44.06 3dyo s LEU 670 CO 0.42 0.19 0.28 -0.62 0.23 0.00 0.00 176.35 176.86 3dyo s ASP 671 N 0.28 2.07 -0.08 2.29 2.15 -1.26 -4.72 116.67 117.39 3dyo s ASP 671 Ca 0.04 -2.67 0.04 0.00 0.43 0.00 0.00 52.55 50.39 3dyo s ASP 671 Cb -0.12 -0.40 0.00 0.00 -0.30 0.00 0.00 42.92 42.10 3dyo s ASP 671 CO 0.00 -0.23 -0.20 -0.69 -0.17 0.00 0.00 175.17 173.88 3dyo s VAL 672 N 0.52 1.74 0.62 1.11 1.01 -1.26 -4.87 120.40 119.26 3dyo s VAL 672 Ca 0.26 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 61.27 3dyo s VAL 672 Cb -0.08 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 3dyo s VAL 672 CO -0.11 0.49 1.04 0.00 0.00 0.00 0.00 175.10 176.52 3dyo s ALA 673 N 0.34 2.88 0.17 5.51 0.00 -1.26 -1.35 121.76 128.06 3dyo s ALA 673 Ca -0.15 0.11 -0.34 0.00 0.00 0.00 0.00 51.96 51.59 3dyo s ALA 673 Cb -0.16 -3.15 -0.14 0.00 0.00 0.00 0.00 23.12 19.67 3dyo s ALA 673 CO 0.06 -0.80 1.48 -0.35 0.00 0.00 0.00 175.76 176.15 3dyo n PRO 674 N -2.51 1.90 -0.87 0.00 -0.04 -1.20 0.92 135.00 133.20 3dyo n PRO 674 Ca 0.07 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 3dyo n PRO 674 Cb 0.54 -2.39 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 2.87 -0.64 -1.83 0.54 1.13 -0.56 -4.93 117.38 113.96 3dyo n GLN 675 Ca 0.16 0.16 -0.15 0.00 -1.94 0.00 0.00 57.00 55.23 3dyo n GLN 675 Cb 0.27 -3.95 0.08 0.00 0.11 0.00 0.00 30.24 26.75 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 -1.26 0.50 3.22 1.08 0.00 0.26 -4.67 105.19 104.32 3dyo n GLY 676 Ca 0.00 -1.98 -0.18 0.00 0.00 0.00 0.00 46.02 43.87 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 -4.23 0.97 -0.03 1.61 1.02 -1.26 0.37 119.74 118.20 3dyo s LYS 677 Ca 0.44 -1.18 -0.01 0.00 0.02 0.00 0.00 55.97 55.23 3dyo s LYS 677 Cb -0.02 -0.87 0.01 0.00 -0.52 0.00 0.00 37.83 36.44 3dyo s LYS 677 CO 0.29 0.17 0.06 -1.14 -0.92 0.00 0.00 175.35 173.81 3dyo s GLN 678 N -2.50 0.04 -0.17 1.68 0.74 -0.32 -4.86 119.66 114.27 3dyo s GLN 678 Ca 0.07 0.14 -0.07 0.00 0.05 0.00 0.00 55.36 55.54 3dyo s GLN 678 Cb -0.06 -0.06 -0.04 0.00 1.10 0.00 0.00 33.01 33.95 3dyo s GLN 678 CO 0.03 -0.06 0.08 -0.51 -0.55 0.00 0.00 175.29 174.27 3dyo s LEU 679 N 0.42 3.94 -0.16 3.68 1.43 -1.26 -0.63 118.68 126.10 3dyo s LEU 679 Ca -0.03 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 3dyo s LEU 679 Cb -0.05 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.21 3dyo s LEU 679 CO -0.01 0.23 -0.13 -0.63 0.23 0.00 0.00 176.35 176.03 3dyo s ILE 680 N 0.06 1.57 -0.33 -0.59 1.01 0.24 -4.94 121.20 118.23 3dyo s ILE 680 Ca 0.06 -0.71 -0.20 0.00 0.00 0.00 0.00 60.65 59.81 3dyo s ILE 680 Cb -0.12 -1.52 -0.00 0.00 0.01 0.00 0.00 42.46 40.83 3dyo s ILE 680 CO 0.00 0.39 0.61 -1.61 0.00 0.00 0.00 174.94 174.34 3dyo s GLU 681 N 1.47 3.79 0.24 2.79 8.01 -1.26 0.27 118.70 134.01 3dyo s GLU 681 Ca 0.04 0.15 -0.30 0.00 0.01 0.00 0.00 54.97 54.87 3dyo s GLU 681 Cb -0.14 -3.77 -0.09 0.00 -4.31 0.00 0.00 34.13 25.83 3dyo s GLU 681 CO -0.10 -0.64 0.99 -0.51 0.01 0.00 0.00 175.26 175.01 3dyo s LEU 682 N 2.61 4.60 0.74 1.80 1.02 0.51 -4.97 118.68 125.00 3dyo s LEU 682 Ca 0.24 2.03 -0.16 0.00 0.02 0.00 0.00 54.13 56.26 3dyo s LEU 682 Cb -0.15 -3.61 -0.05 0.00 0.02 0.00 0.00 46.19 42.40 3dyo s LEU 682 CO 0.13 0.04 0.35 -2.65 0.02 0.00 0.00 176.35 174.24 3dyo n PRO 683 N 1.56 0.20 -1.67 1.29 -0.02 -1.26 -4.80 135.00 130.29 3dyo n PRO 683 Ca -0.01 0.10 -0.50 0.00 -2.02 0.00 0.00 63.50 61.07 3dyo n PRO 683 Cb 0.47 -1.68 -0.05 0.00 -0.02 0.00 0.00 33.50 32.21 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 -0.33 1.76 -2.46 -0.52 2.13 -1.26 -4.87 120.64 115.08 3dyo n GLU 684 Ca 0.09 0.64 -0.34 0.00 0.66 0.00 0.00 57.16 58.20 3dyo n GLU 684 Cb 0.50 -2.39 0.01 0.00 0.27 0.00 0.00 31.44 29.83 3dyo n GLU 684 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 3dyo n LEU 685 N 4.67 6.15 0.00 4.31 -0.00 -1.26 -5.06 117.00 125.80 3dyo n LEU 685 Ca 0.21 -5.26 0.00 0.00 -0.00 0.00 0.00 56.01 50.96 3dyo n LEU 685 Cb 0.24 -0.84 0.00 0.00 -0.00 0.00 0.00 43.42 42.82 3dyo n LEU 685 CO 0.70 2.08 0.00 -0.81 -0.00 0.00 0.00 177.39 179.36 3dyo n PRO 686 N -0.34 0.00 -2.04 1.47 -0.04 -1.26 -4.77 135.00 128.02 3dyo n PRO 686 Ca 0.44 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.49 3dyo n PRO 686 Cb 0.38 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.82 3dyo n PRO 686 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3dyo s GLN 687 N 0.00 4.30 0.52 0.54 1.11 -1.26 -4.97 119.66 119.90 3dyo s GLN 687 Ca 0.00 2.30 -0.19 0.00 0.01 0.00 0.00 55.36 57.48 3dyo s GLN 687 Cb 0.00 -3.06 -0.07 0.00 -1.01 0.00 0.00 33.01 28.87 3dyo s GLN 687 CO 0.00 -0.29 1.04 -1.25 0.01 0.00 0.00 175.29 174.81 3dyo s PRO 688 N -1.66 3.65 -0.97 2.91 0.04 -1.26 -4.97 135.00 132.74 3dyo s PRO 688 Ca 0.51 1.30 -0.03 0.00 0.04 0.00 0.00 61.00 62.82 3dyo s PRO 688 Cb -0.41 -2.08 0.27 0.00 0.04 0.00 0.00 34.50 32.32 3dyo s PRO 688 CO 0.54 -0.55 1.11 0.39 0.04 0.00 0.00 177.00 178.53 3dyo n GLU 689 N -1.32 3.50 0.00 4.56 -0.58 -1.26 -4.95 120.64 120.59 3dyo n GLU 689 Ca 0.09 -4.54 0.00 0.00 -0.42 0.00 0.00 57.16 52.29 3dyo n GLU 689 Cb 0.53 -2.45 0.00 0.00 -0.57 0.00 0.00 31.44 28.95 3dyo n GLU 689 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3dyo n SER 690 N 1.75 0.00 -4.78 1.62 2.88 -1.26 -5.14 113.62 108.69 3dyo n SER 690 Ca 0.25 0.00 -0.35 0.00 -1.33 0.00 0.00 58.87 57.45 3dyo n SER 690 Cb 0.37 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.83 3dyo n SER 690 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dyo s ALA 691 N -2.00 2.68 0.00 -1.46 0.00 -1.26 -4.78 121.76 114.93 3dyo s ALA 691 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.72 3dyo s ALA 691 Cb 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.78 3dyo s ALA 691 CO 0.00 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.37 3dyo n GLY 692 N 0.00 2.58 3.65 0.00 0.00 -0.32 -4.94 105.19 106.17 3dyo n GLY 692 Ca 0.11 -1.79 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 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 -1.72 4.04 -0.02 1.61 2.00 -1.26 -1.40 119.66 122.91 3dyo s GLN 693 Ca 0.00 -0.30 -0.21 0.00 -2.00 0.00 0.00 55.36 52.85 3dyo s GLN 693 Cb 0.00 -3.37 -0.05 0.00 0.80 0.00 0.00 33.01 30.39 3dyo s GLN 693 CO 0.00 0.19 0.62 -0.51 -0.50 0.00 0.00 175.29 175.09 3dyo s LEU 694 N 0.65 4.40 -0.02 3.68 1.43 -0.23 -1.52 118.68 127.07 3dyo s LEU 694 Ca 0.06 1.18 0.05 0.00 -1.03 0.00 0.00 54.13 54.39 3dyo s LEU 694 Cb -0.13 -2.97 -0.01 0.00 0.03 0.00 0.00 46.19 43.11 3dyo s LEU 694 CO 0.01 0.05 -0.18 0.26 0.23 0.00 0.00 176.35 176.72 3dyo s TRP 695 N 0.03 1.68 -0.21 0.29 0.52 -0.18 0.62 118.94 121.69 3dyo s TRP 695 Ca 0.33 -0.35 -0.07 0.00 0.02 0.00 0.00 56.10 56.03 3dyo s TRP 695 Cb -0.18 -1.09 -0.03 0.00 -1.15 0.00 0.00 33.47 31.01 3dyo s TRP 695 CO 0.18 -0.05 0.05 -1.17 0.02 0.00 0.00 176.95 175.97 3dyo s LEU 696 N -0.35 3.55 -0.10 2.99 2.96 0.11 -1.80 118.68 126.05 3dyo s LEU 696 Ca 0.05 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 3dyo s LEU 696 Cb -0.08 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.69 3dyo s LEU 696 CO -0.00 0.08 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.99 3dyo s THR 697 N 0.94 2.20 0.15 3.68 2.01 -0.36 -0.14 115.64 124.12 3dyo s THR 697 Ca 0.03 -0.97 0.10 0.00 0.31 0.00 0.00 61.69 61.16 3dyo s THR 697 Cb -0.14 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 3dyo s THR 697 CO 0.03 0.56 -0.24 0.68 -0.69 0.00 0.00 174.62 174.95 3dyo s VAL 698 N 0.30 2.16 -0.11 3.82 -7.23 0.04 -0.78 120.40 118.60 3dyo s VAL 698 Ca -0.17 -1.83 -0.12 0.00 -1.81 0.00 0.00 61.98 58.06 3dyo s VAL 698 Cb -0.17 -1.96 0.03 0.00 0.56 0.00 0.00 36.38 34.84 3dyo s VAL 698 CO 0.08 -0.04 0.32 -0.13 -0.31 0.00 0.00 175.10 175.02 3dyo s ARG 699 N -2.30 0.41 -0.22 4.82 0.52 -0.59 -2.05 118.95 119.54 3dyo s ARG 699 Ca 0.15 0.37 -0.14 0.00 -0.52 0.00 0.00 55.73 55.59 3dyo s ARG 699 Cb -0.09 0.20 -0.04 0.00 0.52 0.00 0.00 34.95 35.54 3dyo s ARG 699 CO 0.07 -0.06 0.31 0.08 0.02 0.00 0.00 175.30 175.72 3dyo s VAL 700 N -0.02 5.25 0.03 3.52 1.01 0.18 -0.65 120.40 129.72 3dyo s VAL 700 Ca -0.02 0.51 0.07 0.00 0.00 0.00 0.00 61.98 62.55 3dyo s VAL 700 Cb -0.03 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 3dyo s VAL 700 CO 0.01 0.28 -0.21 -0.69 0.00 0.00 0.00 175.10 174.49 3dyo s VAL 701 N 1.27 2.55 -0.49 2.92 1.01 -0.20 -1.28 120.40 126.17 3dyo s VAL 701 Ca 0.15 -1.19 -0.13 0.00 0.00 0.00 0.00 61.98 60.81 3dyo s VAL 701 Cb -0.14 -2.02 0.11 0.00 0.00 0.00 0.00 36.38 34.32 3dyo s VAL 701 CO 0.07 0.40 0.40 -1.10 0.00 0.00 0.00 175.10 174.87 3dyo s GLN 702 N -1.21 2.81 0.40 2.72 -0.21 -0.13 -0.45 119.66 123.59 3dyo s GLN 702 Ca 0.13 -1.60 0.11 0.00 0.02 0.00 0.00 55.36 54.02 3dyo s GLN 702 Cb -0.10 -4.09 0.83 0.00 1.00 0.00 0.00 33.01 30.65 3dyo s GLN 702 CO 0.03 -1.17 1.93 -1.35 -2.12 0.00 0.00 175.29 172.62 3dyo h PRO 703 N 8.68 0.18 -5.86 2.91 0.11 -1.88 1.58 132.00 137.73 3dyo h PRO 703 Ca -0.26 -0.04 -0.65 0.00 0.11 0.00 0.00 66.00 65.16 3dyo h PRO 703 Cb 1.09 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.11 3dyo h PRO 703 CO 0.92 0.33 -0.52 -0.80 -0.21 0.00 0.00 178.00 177.72 3dyo s ASN 704 N -6.91 6.14 0.76 -2.05 0.02 -1.26 -3.67 114.94 107.97 3dyo s ASN 704 Ca -0.05 0.29 -0.12 0.00 -1.02 0.00 0.00 52.86 51.95 3dyo s ASN 704 Cb 0.15 -1.88 0.06 0.00 0.02 0.00 0.00 41.25 39.60 3dyo s ASN 704 CO 0.72 0.27 1.12 0.00 0.02 0.00 0.00 177.10 179.24 3dyo s ALA 705 N -1.26 2.15 0.40 0.60 0.00 -1.26 -4.42 121.76 117.96 3dyo s ALA 705 Ca 0.25 0.48 0.05 0.00 0.00 0.00 0.00 51.96 52.74 3dyo s ALA 705 Cb -0.12 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3dyo s ALA 705 CO 0.16 -1.84 0.17 0.95 0.00 0.00 0.00 175.76 175.21 3dyo s THR 706 N -2.59 0.40 0.42 0.00 -4.23 0.11 -4.91 115.64 104.85 3dyo s THR 706 Ca 0.65 -2.00 0.35 0.00 -1.18 0.00 0.00 61.69 59.51 3dyo s THR 706 Cb -0.21 -2.35 0.37 0.00 1.34 0.00 0.00 72.50 71.65 3dyo s THR 706 CO 0.51 0.00 2.16 0.00 -0.54 0.00 0.00 174.62 176.75 3dyo h ALA 707 N 1.84 1.13 0.00 3.99 0.00 -2.00 -3.10 119.26 121.13 3dyo h ALA 707 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3dyo h ALA 707 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3dyo h ALA 707 CO 0.50 0.06 -0.01 -2.67 0.00 0.00 0.00 179.25 177.13 3dyo n TRP 708 N -3.33 0.00 -3.61 0.00 4.27 -1.26 -5.05 117.44 108.47 3dyo n TRP 708 Ca -0.02 -0.64 -0.14 0.00 -3.89 0.00 0.00 57.50 52.81 3dyo n TRP 708 Cb 0.20 -0.08 -0.06 0.00 -1.36 0.00 0.00 31.31 30.00 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 -1.62 -0.40 0.43 -0.67 1.04 -1.17 -4.68 113.70 106.64 3dyo s SER 709 Ca 0.11 0.16 -0.18 0.00 0.48 0.00 0.00 55.95 56.52 3dyo s SER 709 Cb 0.10 0.47 -0.10 0.00 0.10 0.00 0.00 66.02 66.59 3dyo s SER 709 CO 0.01 -0.68 0.91 -1.61 0.98 0.00 0.00 173.24 172.85 3dyo s GLU 710 N -2.30 4.10 0.45 4.02 2.02 -1.26 0.06 118.70 125.79 3dyo s GLU 710 Ca -0.06 0.97 -0.24 0.00 0.02 0.00 0.00 54.97 55.65 3dyo s GLU 710 Cb -0.01 -2.22 -0.09 0.00 0.10 0.00 0.00 34.13 31.91 3dyo s GLU 710 CO -0.01 -0.06 1.22 0.00 0.02 0.00 0.00 175.26 176.43 3dyo n ALA 711 N -0.87 1.09 -0.45 5.21 0.00 -1.26 -1.63 120.51 122.60 3dyo n ALA 711 Ca 0.06 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.72 3dyo n ALA 711 Cb 0.54 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 0.89 1.11 3.70 0.00 0.00 0.54 -4.91 105.19 106.53 3dyo n GLY 712 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.00 2.42 -3.47 1.61 -0.00 -0.64 -4.59 115.22 108.54 3dyo n HIS 713 Ca 0.00 0.41 -0.38 0.00 0.46 0.00 0.00 57.72 58.21 3dyo n HIS 713 Cb 0.00 -2.49 -0.08 0.00 -0.12 0.00 0.00 29.99 27.29 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 -0.32 5.24 -0.06 3.57 1.01 -1.26 -0.95 121.20 128.43 3dyo s ILE 714 Ca 0.63 0.51 0.15 0.00 0.00 0.00 0.00 60.65 61.95 3dyo s ILE 714 Cb -0.58 -3.65 -0.23 0.00 0.01 0.00 0.00 42.46 38.00 3dyo s ILE 714 CO 0.53 0.26 0.27 -1.54 0.00 0.00 0.00 174.94 174.46 3dyo n SER 715 N 4.59 1.31 -3.47 3.58 3.41 -0.40 -5.02 113.62 117.61 3dyo n SER 715 Ca -0.10 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.38 3dyo n SER 715 Cb 0.51 1.49 -0.03 0.00 -0.26 0.00 0.00 64.21 65.93 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 -2.91 -1.71 0.18 7.33 0.00 -1.24 -4.67 121.76 118.74 3dyo s ALA 716 Ca -0.06 0.86 -0.23 0.00 0.00 0.00 0.00 51.96 52.52 3dyo s ALA 716 Cb 0.09 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.75 3dyo s ALA 716 CO 0.66 -0.63 0.72 1.67 0.00 0.00 0.00 175.76 178.17 3dyo s TRP 717 N -2.89 -0.34 -0.03 0.00 -2.14 -1.26 -0.64 118.94 111.64 3dyo s TRP 717 Ca -0.01 0.04 -0.29 0.00 2.66 0.00 0.00 56.10 58.50 3dyo s TRP 717 Cb -0.01 0.62 0.10 0.00 -3.10 0.00 0.00 33.47 31.08 3dyo s TRP 717 CO -0.06 -0.95 0.82 -1.14 -2.66 0.00 0.00 176.95 172.96 3dyo s GLN 718 N -3.68 0.89 0.09 3.25 2.00 -0.87 -4.98 119.66 116.36 3dyo s GLN 718 Ca 0.06 -0.06 0.03 0.00 -2.00 0.00 0.00 55.36 53.39 3dyo s GLN 718 Cb -0.03 0.42 -0.04 0.00 0.80 0.00 0.00 33.01 34.16 3dyo s GLN 718 CO -0.03 -0.33 -0.08 -0.65 -0.50 0.00 0.00 175.29 173.69 3dyo s GLN 719 N -2.15 0.81 0.00 1.67 -0.21 -1.26 -0.78 119.66 117.74 3dyo s GLN 719 Ca -0.02 -1.20 -0.08 0.00 0.02 0.00 0.00 55.36 54.09 3dyo s GLN 719 Cb -0.01 -0.36 0.00 0.00 1.00 0.00 0.00 33.01 33.64 3dyo s GLN 719 CO -0.02 0.03 0.15 -1.58 -2.12 0.00 0.00 175.29 171.76 3dyo s TRP 720 N -2.86 0.03 0.11 0.91 0.51 0.80 -4.98 118.94 113.46 3dyo s TRP 720 Ca 0.07 -0.11 -0.29 0.00 -2.12 0.00 0.00 56.10 53.64 3dyo s TRP 720 Cb -0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 33.47 32.56 3dyo s TRP 720 CO -0.02 -0.30 0.94 1.03 -0.51 0.00 0.00 176.95 178.09 3dyo s ARG 721 N -1.40 4.68 0.00 4.98 0.52 -1.26 0.10 118.95 126.57 3dyo s ARG 721 Ca -0.15 1.41 0.00 0.00 -0.52 0.00 0.00 55.73 56.47 3dyo s ARG 721 Cb -0.07 -3.37 0.00 0.00 0.52 0.00 0.00 34.95 32.03 3dyo s ARG 721 CO 0.02 0.24 0.00 1.28 0.02 0.00 0.00 175.30 176.86 3dyo n LEU 722 N 2.71 0.00 -4.77 2.53 4.77 0.20 -4.87 117.00 117.57 3dyo n LEU 722 Ca 0.01 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.65 3dyo n LEU 722 Cb 0.49 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 3dyo n LEU 722 CO 0.51 0.00 0.78 0.00 -1.33 0.00 0.00 177.39 177.34 3dyo s ALA 723 N -2.72 2.56 -0.01 -1.18 0.00 -1.26 -4.67 121.76 114.48 3dyo s ALA 723 Ca 0.00 0.75 0.04 0.00 0.00 0.00 0.00 51.96 52.75 3dyo s ALA 723 Cb 0.00 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 3dyo s ALA 723 CO 0.00 -1.07 -0.12 -2.00 0.00 0.00 0.00 175.76 172.57 3dyo s GLU 724 N -3.62 1.03 -0.26 0.00 2.12 -1.26 -1.07 118.70 115.64 3dyo s GLU 724 Ca 0.71 -0.42 0.03 0.00 0.36 0.00 0.00 54.97 55.65 3dyo s GLU 724 Cb -0.24 -0.98 0.06 0.00 0.26 0.00 0.00 34.13 33.23 3dyo s GLU 724 CO 0.34 0.24 -0.10 -0.80 -0.54 0.00 0.00 175.26 174.40 3dyo s ASN 725 N -0.18 4.46 0.49 -1.70 0.01 -0.49 -4.96 114.94 112.56 3dyo s ASN 725 Ca 0.03 -1.44 -0.22 0.00 -0.71 0.00 0.00 52.86 50.52 3dyo s ASN 725 Cb -0.06 -1.55 -0.07 0.00 0.41 0.00 0.00 41.25 39.98 3dyo s ASN 725 CO -0.00 -0.20 1.13 -0.76 -1.51 0.00 0.00 177.10 175.76 3dyo s LEU 726 N 1.09 3.92 -0.34 0.60 1.43 -1.26 -1.18 118.68 122.95 3dyo s LEU 726 Ca -0.08 2.21 -0.29 0.00 -1.03 0.00 0.00 54.13 54.94 3dyo s LEU 726 Cb -0.20 -4.38 0.00 0.00 0.03 0.00 0.00 46.19 41.64 3dyo s LEU 726 CO -0.05 -0.98 1.33 -0.55 0.23 0.00 0.00 176.35 176.32 3dyo s SER 727 N -1.57 6.58 -0.01 2.29 0.15 -1.26 -4.85 113.70 115.04 3dyo s SER 727 Ca 0.67 1.07 0.07 0.00 0.70 0.00 0.00 55.95 58.46 3dyo s SER 727 Cb -0.26 -2.54 0.19 0.00 -1.71 0.00 0.00 66.02 61.70 3dyo s SER 727 CO 0.30 -1.18 1.15 1.33 1.20 0.00 0.00 173.24 176.04 3dyo n VAL 728 N 6.47 1.07 -3.40 4.45 0.24 -1.26 -4.93 118.33 120.97 3dyo n VAL 728 Ca 0.15 -1.06 -0.44 0.00 -2.04 0.00 0.00 64.34 60.95 3dyo n VAL 728 Cb 0.47 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 33.22 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 -1.11 5.07 0.54 3.34 -4.23 -1.26 -5.03 115.64 112.97 3dyo s THR 729 Ca 0.14 -1.23 -0.21 0.00 -1.18 0.00 0.00 61.69 59.22 3dyo s THR 729 Cb 0.08 -4.10 -0.06 0.00 1.34 0.00 0.00 72.50 69.77 3dyo s THR 729 CO 0.09 -0.64 1.19 0.00 -0.54 0.00 0.00 174.62 174.72 3dyo n LEU 730 N 5.17 4.53 0.00 4.79 -0.00 -1.26 -4.97 117.00 125.26 3dyo n LEU 730 Ca -0.12 0.94 0.00 0.00 -0.00 0.00 0.00 56.01 56.83 3dyo n LEU 730 Cb 0.43 -1.49 0.00 0.00 -0.00 0.00 0.00 43.42 42.36 3dyo n LEU 730 CO 0.48 -1.08 0.00 -2.65 -0.00 0.00 0.00 177.39 174.14 3dyo n PRO 731 N -0.81 0.00 -2.65 1.47 -0.02 -1.26 -4.93 135.00 126.80 3dyo n PRO 731 Ca 0.11 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.57 3dyo n PRO 731 Cb 0.44 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 33.98 3dyo n PRO 731 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dyo n ALA 732 N 0.00 -3.24 -0.00 3.55 0.00 -1.26 -5.09 120.51 114.46 3dyo n ALA 732 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 3dyo n ALA 732 Cb 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 16.98 3dyo n ALA 732 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyo n ALA 733 N 0.11 -0.01 -3.97 0.00 0.00 -1.26 -4.73 120.51 110.64 3dyo n ALA 733 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.96 3dyo n ALA 733 Cb 0.71 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 20.01 3dyo n ALA 733 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3dyo s SER 734 N 0.00 4.28 0.00 0.00 1.04 -1.26 -4.97 113.70 112.79 3dyo s SER 734 Ca 0.00 -1.56 0.00 0.00 0.48 0.00 0.00 55.95 54.87 3dyo s SER 734 Cb 0.00 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.75 3dyo s SER 734 CO 0.00 -0.28 0.00 1.41 0.98 0.00 0.00 173.24 175.35 3dyo n HIS 735 N 4.51 0.00 -1.65 5.02 8.25 -1.26 -4.35 115.22 125.73 3dyo n HIS 735 Ca -0.07 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.05 3dyo n HIS 735 Cb 0.43 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.60 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 -0.79 2.32 -0.07 -1.41 0.00 -1.26 -5.02 121.76 115.53 3dyo s ALA 736 Ca 0.00 0.78 0.05 0.00 0.00 0.00 0.00 51.96 52.79 3dyo s ALA 736 Cb 0.00 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.69 3dyo s ALA 736 CO 0.00 -1.53 -0.21 0.42 0.00 0.00 0.00 175.76 174.44 3dyo s ILE 737 N -2.04 2.45 0.70 0.00 1.01 -1.26 -3.91 121.20 118.15 3dyo s ILE 737 Ca 0.72 -0.92 -0.13 0.00 0.00 0.00 0.00 60.65 60.32 3dyo s ILE 737 Cb -0.26 -1.93 0.02 0.00 0.01 0.00 0.00 42.46 40.30 3dyo s ILE 737 CO 0.41 0.57 1.10 -2.84 0.00 0.00 0.00 174.94 174.18 3dyo s PRO 738 N -0.23 2.63 -0.03 2.79 0.02 -1.26 -4.94 135.00 133.98 3dyo s PRO 738 Ca -0.01 1.27 0.05 0.00 0.02 0.00 0.00 61.00 62.33 3dyo s PRO 738 Cb -0.13 -1.94 -0.01 0.00 0.02 0.00 0.00 34.50 32.44 3dyo s PRO 738 CO 0.03 -1.36 -0.18 -1.58 -0.33 0.00 0.00 177.00 173.58 3dyo s HIS 739 N -2.60 1.68 -0.14 6.54 2.46 0.15 -4.82 115.29 118.56 3dyo s HIS 739 Ca 0.64 -0.41 -0.15 0.00 0.47 0.00 0.00 55.06 55.62 3dyo s HIS 739 Cb -0.19 -1.11 -0.05 0.00 -0.13 0.00 0.00 32.58 31.11 3dyo s HIS 739 CO 0.47 -0.10 0.34 -1.17 -2.47 0.00 0.00 174.74 171.82 3dyo s LEU 740 N -0.18 4.27 -0.18 8.88 2.96 -1.26 -0.47 118.68 132.70 3dyo s LEU 740 Ca 0.01 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.54 3dyo s LEU 740 Cb -0.09 -2.46 0.02 0.00 0.50 0.00 0.00 46.19 44.16 3dyo s LEU 740 CO 0.01 0.09 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.05 3dyo s THR 741 N 0.38 2.03 -0.13 3.68 2.01 0.61 -4.99 115.64 119.23 3dyo s THR 741 Ca 0.19 -0.96 -0.04 0.00 0.31 0.00 0.00 61.69 61.20 3dyo s THR 741 Cb -0.14 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.48 3dyo s THR 741 CO 0.06 0.50 0.00 -0.89 -0.69 0.00 0.00 174.62 173.60 3dyo s THR 742 N 1.29 4.30 0.41 -0.82 2.01 -1.26 -1.00 115.64 120.57 3dyo s THR 742 Ca 0.04 -0.23 0.03 0.00 0.31 0.00 0.00 61.69 61.85 3dyo s THR 742 Cb -0.13 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 3dyo s THR 742 CO -0.12 0.54 0.10 -0.94 -0.69 0.00 0.00 174.62 173.51 3dyo s SER 743 N -0.24 2.88 0.17 3.53 1.04 0.60 -5.02 113.70 116.66 3dyo s SER 743 Ca 0.06 -1.62 -0.13 0.00 0.48 0.00 0.00 55.95 54.73 3dyo s SER 743 Cb -0.12 0.41 0.07 0.00 0.10 0.00 0.00 66.02 66.47 3dyo s SER 743 CO 0.02 -0.87 1.81 -0.33 0.98 0.00 0.00 173.24 174.85 3dyo h GLU 744 N 1.79 0.76 -0.00 4.02 4.39 -2.03 -3.21 114.58 120.30 3dyo h GLU 744 Ca -0.37 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.26 3dyo h GLU 744 Cb 1.27 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 3dyo h GLU 744 CO 0.61 0.55 -0.72 0.00 -1.16 0.00 0.00 179.01 178.29 3dyo n MET 745 N -4.65 0.24 -3.83 2.33 0.00 -1.26 -4.85 117.12 105.10 3dyo n MET 745 Ca 0.03 -0.18 -0.10 0.00 0.00 0.00 0.00 57.70 57.46 3dyo n MET 745 Cb 0.05 -1.50 -0.05 0.00 0.00 0.00 0.00 33.22 31.72 3dyo n MET 745 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3dyo s ASP 746 N -2.89 -0.11 -0.21 3.17 1.01 -1.21 0.70 116.67 117.13 3dyo s ASP 746 Ca 0.12 -0.64 0.01 0.00 0.71 0.00 0.00 52.55 52.75 3dyo s ASP 746 Cb 0.17 0.50 0.03 0.00 1.01 0.00 0.00 42.92 44.62 3dyo s ASP 746 CO 0.75 -0.95 -0.15 -0.36 0.21 0.00 0.00 175.17 174.67 3dyo s PHE 747 N -3.90 2.94 -0.07 4.23 2.99 0.03 -0.29 117.98 123.90 3dyo s PHE 747 Ca 0.12 -1.71 0.02 0.00 0.00 0.00 0.00 56.93 55.36 3dyo s PHE 747 Cb 0.01 -1.96 -0.03 0.00 0.00 0.00 0.00 43.02 41.05 3dyo s PHE 747 CO -0.03 -0.79 -0.11 0.00 -0.00 0.00 0.00 175.22 174.29 3dyo s ILE 749 N -0.64 1.54 -0.07 0.00 1.01 0.34 -0.28 121.20 123.10 3dyo s ILE 749 Ca 0.09 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.12 3dyo s ILE 749 Cb -0.11 -1.40 -0.01 0.00 0.01 0.00 0.00 42.46 40.95 3dyo s ILE 749 CO 0.01 0.45 -0.20 -1.61 0.00 0.00 0.00 174.94 173.59 3dyo s GLU 750 N 0.92 2.69 -0.38 2.79 8.01 0.38 -1.02 118.70 132.09 3dyo s GLU 750 Ca -0.08 -0.82 0.02 0.00 0.01 0.00 0.00 54.97 54.11 3dyo s GLU 750 Cb -0.15 -2.30 0.16 0.00 -4.31 0.00 0.00 34.13 27.53 3dyo s GLU 750 CO -0.01 0.41 0.31 -1.17 0.01 0.00 0.00 175.26 174.81 3dyo s LEU 751 N -0.20 0.88 0.00 1.80 2.96 0.11 0.31 118.68 124.53 3dyo s LEU 751 Ca -0.01 -2.43 0.00 0.00 -0.22 0.00 0.00 54.13 51.47 3dyo s LEU 751 Cb -0.13 -0.17 0.00 0.00 0.50 0.00 0.00 46.19 46.38 3dyo s LEU 751 CO 0.03 -0.24 0.00 0.61 -1.32 0.00 0.00 176.35 175.44 3dyo n GLY 752 N 3.55 3.36 0.05 7.98 0.00 -1.26 -2.07 105.19 116.80 3dyo n GLY 752 Ca 0.19 -0.13 0.14 0.00 0.00 0.00 0.00 46.02 46.23 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 8.41 0.21 -4.64 1.61 6.94 -1.26 -4.82 115.26 121.70 3dyo n ASN 753 Ca 0.00 -0.33 -0.35 0.00 -0.02 0.00 0.00 54.58 53.88 3dyo n ASN 753 Cb 0.00 -0.18 -0.10 0.00 -2.36 0.00 0.00 39.78 37.14 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 -2.54 3.30 0.05 -3.83 1.02 -0.88 0.34 119.74 117.19 3dyo s LYS 754 Ca 0.28 -0.41 0.04 0.00 0.02 0.00 0.00 55.97 55.91 3dyo s LYS 754 Cb 0.20 -2.90 -0.02 0.00 -0.52 0.00 0.00 37.83 34.59 3dyo s LYS 754 CO 0.47 0.54 -0.12 0.50 -0.92 0.00 0.00 175.35 175.82 3dyo s ARG 755 N -0.44 0.79 -0.02 1.68 3.52 -1.01 0.04 118.95 123.52 3dyo s ARG 755 Ca 0.08 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.90 3dyo s ARG 755 Cb -0.12 -0.76 0.01 0.00 -1.56 0.00 0.00 34.95 32.53 3dyo s ARG 755 CO 0.02 0.18 -0.02 -1.58 -0.81 0.00 0.00 175.30 173.08 3dyo s TRP 756 N -1.04 0.39 -0.18 5.12 0.51 -0.19 -0.12 118.94 123.43 3dyo s TRP 756 Ca -0.02 -0.06 0.01 0.00 -2.12 0.00 0.00 56.10 53.91 3dyo s TRP 756 Cb -0.09 -0.37 0.02 0.00 -0.81 0.00 0.00 33.47 32.23 3dyo s TRP 756 CO 0.01 -0.08 -0.19 -1.14 -0.51 0.00 0.00 176.95 175.04 3dyo s GLN 757 N 0.52 2.89 -0.32 4.98 0.74 0.61 -0.50 119.66 128.58 3dyo s GLN 757 Ca -0.05 -0.81 -0.07 0.00 0.05 0.00 0.00 55.36 54.47 3dyo s GLN 757 Cb -0.09 -2.52 0.02 0.00 1.10 0.00 0.00 33.01 31.52 3dyo s GLN 757 CO -0.01 -0.22 0.11 -0.06 -0.55 0.00 0.00 175.29 174.56 3dyo s PHE 758 N 1.31 3.19 -0.01 1.67 0.40 0.09 0.02 117.98 124.66 3dyo s PHE 758 Ca 0.05 -1.08 -0.30 0.00 -0.60 0.00 0.00 56.93 54.99 3dyo s PHE 758 Cb -0.13 -2.29 -0.05 0.00 0.51 0.00 0.00 43.02 41.06 3dyo s PHE 758 CO -0.13 -0.62 1.37 1.21 0.70 0.00 0.00 175.22 177.75 3dyo s ASN 759 N 1.48 6.88 0.40 1.36 3.84 -0.81 -0.79 114.94 127.31 3dyo s ASN 759 Ca 0.01 2.07 0.23 0.00 0.21 0.00 0.00 52.86 55.38 3dyo s ASN 759 Cb -0.18 -2.56 0.36 0.00 -0.55 0.00 0.00 41.25 38.32 3dyo s ASN 759 CO 0.03 -0.69 1.59 0.03 -2.79 0.00 0.00 177.10 175.27 3dyo h ARG 760 N 7.74 0.00 0.08 0.43 3.08 -0.06 0.13 114.38 125.78 3dyo h ARG 760 Ca -0.37 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.39 3dyo h ARG 760 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 3dyo h ARG 760 CO 0.90 0.00 -1.47 1.96 -1.07 0.00 0.00 179.97 180.29 3dyo h GLN 761 N 0.00 0.17 0.02 0.04 1.08 -1.91 -3.38 115.11 111.14 3dyo h GLN 761 Ca 0.00 -0.29 -0.34 0.00 -1.45 0.00 0.00 58.65 56.57 3dyo h GLN 761 Cb 0.97 0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 28.46 3dyo h GLN 761 CO 0.00 1.01 -2.06 -1.13 -0.95 0.00 0.00 178.83 175.70 3dyo n SER 762 N -3.38 0.96 0.00 1.46 3.41 -1.23 -4.83 113.62 110.01 3dyo n SER 762 Ca -0.14 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 3dyo n SER 762 Cb 1.03 0.08 0.00 0.00 -0.26 0.00 0.00 64.21 65.05 3dyo n SER 762 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dyo n GLY 763 N 1.78 0.73 3.48 5.00 0.00 0.44 -4.71 105.19 111.90 3dyo n GLY 763 Ca -0.28 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.00 2.40 -0.33 1.61 0.40 -1.22 -4.91 117.98 113.93 3dyo s PHE 764 Ca 0.00 -0.31 -0.28 0.00 -0.60 0.00 0.00 56.93 55.74 3dyo s PHE 764 Cb 0.00 -1.16 -0.03 0.00 0.51 0.00 0.00 43.02 42.34 3dyo s PHE 764 CO 0.00 0.54 1.93 -1.17 0.70 0.00 0.00 175.22 177.22 3dyo s LEU 765 N -2.88 3.47 0.03 -0.37 2.96 -1.26 -1.93 118.68 118.69 3dyo s LEU 765 Ca 0.24 1.36 0.22 0.00 -0.22 0.00 0.00 54.13 55.73 3dyo s LEU 765 Cb -0.08 -3.40 -0.18 0.00 0.50 0.00 0.00 46.19 43.04 3dyo s LEU 765 CO 0.12 -1.87 0.76 -1.54 -1.32 0.00 0.00 176.35 172.50 3dyo n SER 766 N 11.05 0.42 -3.51 3.68 3.41 0.10 -1.51 113.62 127.27 3dyo n SER 766 Ca 0.25 -0.17 -0.15 0.00 -0.26 0.00 0.00 58.87 58.54 3dyo n SER 766 Cb 0.47 1.33 -0.05 0.00 -0.26 0.00 0.00 64.21 65.70 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 -3.34 1.11 -0.10 4.33 2.00 -1.05 -4.44 119.66 118.17 3dyo s GLN 767 Ca -0.02 -0.10 -0.11 0.00 -2.00 0.00 0.00 55.36 53.14 3dyo s GLN 767 Cb 0.14 0.51 0.03 0.00 0.80 0.00 0.00 33.01 34.49 3dyo s GLN 767 CO 0.86 -0.40 0.30 1.41 -0.50 0.00 0.00 175.29 176.96 3dyo s MET 768 N -2.27 0.38 0.12 1.67 -2.45 -1.26 -0.29 119.30 115.20 3dyo s MET 768 Ca -0.06 0.36 0.05 0.00 -1.25 0.00 0.00 55.69 54.79 3dyo s MET 768 Cb -0.01 0.18 -0.04 0.00 1.25 0.00 0.00 34.83 36.22 3dyo s MET 768 CO 0.00 -0.05 -0.13 -1.58 1.05 0.00 0.00 175.02 174.31 3dyo s TRP 769 N 0.01 1.32 -0.25 4.11 0.51 0.83 0.15 118.94 125.62 3dyo s TRP 769 Ca -0.01 -0.58 0.01 0.00 -2.12 0.00 0.00 56.10 53.40 3dyo s TRP 769 Cb -0.02 -0.70 0.07 0.00 -0.81 0.00 0.00 33.47 32.00 3dyo s TRP 769 CO 0.01 0.11 -0.03 0.42 -0.51 0.00 0.00 176.95 176.95 3dyo s ILE 770 N -2.20 1.51 0.00 2.03 1.01 -0.49 -2.40 121.20 120.65 3dyo s ILE 770 Ca 0.08 -1.30 0.00 0.00 0.00 0.00 0.00 60.65 59.43 3dyo s ILE 770 Cb -0.04 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.59 3dyo s ILE 770 CO 0.02 -0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.39 3dyo n GLY 771 N 4.66 1.64 1.18 6.18 0.00 0.15 -1.93 105.19 117.08 3dyo n GLY 771 Ca -0.10 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.48 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 4.63 3.64 -4.55 1.61 5.75 -1.26 -4.86 116.55 121.51 3dyo n ASP 772 Ca 0.00 -1.98 -0.43 0.00 -0.01 0.00 0.00 54.79 52.37 3dyo n ASP 772 Cb 0.00 -0.38 -0.05 0.00 -1.03 0.00 0.00 41.12 39.66 3dyo n ASP 772 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3dyo s LYS 773 N -1.13 3.47 0.42 0.11 -0.14 -0.81 -5.04 119.74 116.62 3dyo s LYS 773 Ca 0.42 0.01 -0.26 0.00 -1.36 0.00 0.00 55.97 54.78 3dyo s LYS 773 Cb 0.23 -3.93 -0.09 0.00 -1.68 0.00 0.00 37.83 32.36 3dyo s LYS 773 CO 0.30 -1.13 1.35 0.15 -0.76 0.00 0.00 175.35 175.26 3dyo s LYS 774 N 3.42 3.87 0.00 1.68 1.02 -1.26 -1.39 119.74 127.07 3dyo s LYS 774 Ca 0.32 2.26 0.09 0.00 0.02 0.00 0.00 55.97 58.66 3dyo s LYS 774 Cb -0.12 -2.72 -0.06 0.00 -0.52 0.00 0.00 37.83 34.41 3dyo s LYS 774 CO 0.23 -0.61 0.48 1.04 -0.92 0.00 0.00 175.35 175.58 3dyo n GLN 775 N 0.01 3.22 -5.04 1.68 1.13 0.12 -4.81 117.38 113.69 3dyo n GLN 775 Ca 0.04 -0.23 -0.31 0.00 -1.94 0.00 0.00 57.00 54.56 3dyo n GLN 775 Cb 0.43 -0.99 -0.15 0.00 0.11 0.00 0.00 30.24 29.64 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 -2.12 2.29 -0.05 1.08 1.43 -1.26 -0.51 118.68 119.53 3dyo s LEU 776 Ca 0.05 -0.44 0.19 0.00 -1.03 0.00 0.00 54.13 52.90 3dyo s LEU 776 Cb 0.07 -1.39 -0.28 0.00 0.03 0.00 0.00 46.19 44.62 3dyo s LEU 776 CO 0.33 0.30 0.35 0.18 0.23 0.00 0.00 176.35 177.75 3dyo n LEU 777 N 2.13 0.00 -3.79 1.79 4.77 0.20 -4.75 117.00 117.35 3dyo n LEU 777 Ca -0.16 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.69 3dyo n LEU 777 Cb 0.52 0.08 -0.12 0.00 -2.33 0.00 0.00 43.42 41.57 3dyo n LEU 777 CO 0.24 0.08 -0.13 -0.89 -1.33 0.00 0.00 177.39 175.36 3dyo s THR 778 N -3.16 -0.00 0.65 -5.08 2.01 -1.01 -4.91 115.64 104.14 3dyo s THR 778 Ca -0.07 0.02 -0.17 0.00 0.31 0.00 0.00 61.69 61.77 3dyo s THR 778 Cb 0.11 -0.31 -0.03 0.00 0.01 0.00 0.00 72.50 72.28 3dyo s THR 778 CO 0.78 0.01 0.94 -2.65 -0.69 0.00 0.00 174.62 173.01 3dyo n PRO 779 N 3.10 0.72 -2.36 4.92 -0.02 -1.26 -3.30 135.00 136.80 3dyo n PRO 779 Ca -0.14 0.29 -0.43 0.00 -2.02 0.00 0.00 63.50 61.20 3dyo n PRO 779 Cb 0.58 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 3dyo n PRO 779 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3dyo s LEU 780 N -2.36 4.05 0.10 2.45 2.96 -0.57 -4.53 118.68 120.78 3dyo s LEU 780 Ca 0.75 1.54 0.03 0.00 -0.22 0.00 0.00 54.13 56.24 3dyo s LEU 780 Cb -0.39 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.73 3dyo s LEU 780 CO 0.48 -0.95 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.34 3dyo s ARG 781 N 3.92 0.87 0.73 1.98 0.52 -0.07 -4.30 118.95 122.59 3dyo s ARG 781 Ca 0.58 -1.24 -0.13 0.00 -0.52 0.00 0.00 55.73 54.42 3dyo s ARG 781 Cb -0.21 -0.45 0.04 0.00 0.52 0.00 0.00 34.95 34.85 3dyo s ARG 781 CO 0.20 0.05 1.13 -0.51 0.02 0.00 0.00 175.30 176.20 3dyo s ASP 782 N -2.70 4.50 -0.07 0.23 1.11 -1.26 0.66 116.67 119.15 3dyo s ASP 782 Ca 0.08 2.06 -0.03 0.00 0.18 0.00 0.00 52.55 54.85 3dyo s ASP 782 Cb -0.00 -2.55 0.04 0.00 1.07 0.00 0.00 42.92 41.47 3dyo s ASP 782 CO -0.01 -2.04 0.15 -1.58 1.18 0.00 0.00 175.17 172.87 3dyo s GLN 783 N -4.30 0.10 0.00 8.23 0.74 0.27 -4.72 119.66 119.98 3dyo s GLN 783 Ca 0.67 0.36 0.03 0.00 0.05 0.00 0.00 55.36 56.48 3dyo s GLN 783 Cb -0.22 -0.16 0.08 0.00 1.10 0.00 0.00 33.01 33.81 3dyo s GLN 783 CO 0.48 -0.16 0.93 1.19 -0.55 0.00 0.00 175.29 177.18 3dyo n PHE 784 N 4.12 0.10 -4.33 1.67 3.01 -1.26 -2.19 117.46 118.59 3dyo n PHE 784 Ca -0.25 -0.34 -0.17 0.00 1.01 0.00 0.00 57.45 57.69 3dyo n PHE 784 Cb 0.52 -0.03 -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 -0.78 1.06 0.04 4.37 -4.23 -1.26 -2.70 115.64 112.14 3dyo s THR 785 Ca 0.06 -2.04 0.01 0.00 -1.18 0.00 0.00 61.69 58.55 3dyo s THR 785 Cb 0.04 -2.33 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 3dyo s THR 785 CO 0.05 -0.34 -0.06 0.00 -0.54 0.00 0.00 174.62 173.73 3dyo s ARG 786 N -3.85 0.51 -0.05 3.99 1.70 -1.26 -4.77 118.95 115.22 3dyo s ARG 786 Ca 0.28 -0.82 -0.30 0.00 -0.47 0.00 0.00 55.73 54.42 3dyo s ARG 786 Cb 0.05 -0.13 -0.06 0.00 -0.57 0.00 0.00 34.95 34.24 3dyo s ARG 786 CO 0.08 0.00 1.75 0.00 -1.08 0.00 0.00 175.30 176.06 3dyo s ALA 787 N -1.88 3.55 0.19 7.88 0.00 -1.26 -4.83 121.76 125.41 3dyo s ALA 787 Ca -0.08 1.00 -0.33 0.00 0.00 0.00 0.00 51.96 52.55 3dyo s ALA 787 Cb -0.07 -3.79 -0.13 0.00 0.00 0.00 0.00 23.12 19.13 3dyo s ALA 787 CO -0.01 -1.53 1.57 -0.35 0.00 0.00 0.00 175.76 175.43 3dyo n PRO 788 N 7.33 2.25 -1.45 0.00 -0.04 -1.26 -1.15 135.00 140.68 3dyo n PRO 788 Ca 0.18 0.81 -0.30 0.00 -0.04 0.00 0.00 63.50 64.15 3dyo n PRO 788 Cb 0.43 -2.57 0.09 0.00 -0.04 0.00 0.00 33.50 31.41 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 2.73 0.39 1.53 1.43 -1.26 -4.60 118.68 119.58 3dyo s LEU 789 Ca 0.75 1.49 0.08 0.00 -1.03 0.00 0.00 54.13 55.42 3dyo s LEU 789 Cb -0.64 -4.15 0.84 0.00 0.03 0.00 0.00 46.19 42.27 3dyo s LEU 789 CO 0.40 -1.97 1.99 0.44 0.23 0.00 0.00 176.35 177.45 3dyo h ASP 790 N -1.08 0.55 0.43 2.29 3.32 -1.87 -0.39 116.42 119.66 3dyo h ASP 790 Ca -0.46 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.55 3dyo h ASP 790 Cb 1.25 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.68 3dyo h ASP 790 CO 0.57 0.36 -0.16 0.78 -1.72 0.00 0.00 179.24 179.06 3dyo h ASN 791 N 0.63 0.00 0.78 6.45 2.35 -1.85 -0.43 115.58 123.51 3dyo h ASN 791 Ca 0.26 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.82 3dyo h ASN 791 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 3dyo h ASN 791 CO -0.08 0.16 -0.88 0.44 -1.65 0.00 0.00 177.43 175.43 3dyo h ASP 792 N 0.00 0.08 0.18 5.81 3.32 -1.39 -3.36 116.42 121.07 3dyo h ASP 792 Ca -0.00 -0.07 -0.34 0.00 0.02 0.00 0.00 57.03 56.63 3dyo h ASP 792 Cb 0.42 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.95 3dyo h ASP 792 CO 0.02 0.92 -1.69 0.40 -1.72 0.00 0.00 179.24 177.17 3dyo h ILE 793 N 0.03 0.97 0.00 0.35 2.04 -0.85 0.25 117.51 120.31 3dyo h ILE 793 Ca -0.02 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.33 3dyo h ILE 793 Cb 1.54 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 40.40 3dyo h ILE 793 CO 0.12 0.84 0.00 0.61 0.00 0.00 0.00 178.15 179.72 3dyo n GLY 794 N 1.84 3.34 0.97 5.37 0.00 -0.22 -1.68 105.19 114.81 3dyo n GLY 794 Ca -0.24 -0.21 0.10 0.00 0.00 0.00 0.00 46.02 45.67 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 0.57 -1.75 1.61 0.24 -1.26 -4.92 118.33 112.82 3dyo n VAL 795 Ca 0.00 -0.67 -0.42 0.00 -2.04 0.00 0.00 64.34 61.22 3dyo n VAL 795 Cb 0.00 0.54 -0.01 0.00 -1.47 0.00 0.00 33.84 32.90 3dyo n VAL 795 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3dyo n SER 796 N 1.07 3.69 -3.98 -1.34 2.88 -0.68 -4.79 113.62 110.47 3dyo n SER 796 Ca 0.18 1.18 -0.09 0.00 -1.33 0.00 0.00 58.87 58.81 3dyo n SER 796 Cb 0.48 -1.59 -0.11 0.00 -0.75 0.00 0.00 64.21 62.24 3dyo n SER 796 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3dyo s GLU 797 N -1.16 0.31 0.26 -1.46 2.02 -0.15 -4.89 118.70 113.62 3dyo s GLU 797 Ca 0.60 -0.59 -0.04 0.00 0.02 0.00 0.00 54.97 54.95 3dyo s GLU 797 Cb -0.50 0.08 0.33 0.00 0.10 0.00 0.00 34.13 34.13 3dyo s GLU 797 CO 0.55 -0.04 1.90 0.00 0.02 0.00 0.00 175.26 177.69 3dyo h ALA 798 N 4.71 1.32 0.00 5.21 0.00 -1.99 0.44 119.26 128.95 3dyo h ALA 798 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 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 0.41 0.54 0.00 -2.37 0.00 0.00 0.00 179.25 177.83 3dyo n THR 799 N -4.45 0.29 -2.85 0.00 5.66 -1.26 -4.28 114.28 107.38 3dyo n THR 799 Ca 0.13 0.07 -0.04 0.00 -3.05 0.00 0.00 64.05 61.17 3dyo n THR 799 Cb 0.10 -0.67 0.00 0.00 -1.55 0.00 0.00 70.33 68.21 3dyo n THR 799 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3dyo s ARG 800 N -2.74 1.03 0.27 1.09 3.52 0.14 -5.14 118.95 117.12 3dyo s ARG 800 Ca 0.18 -0.98 -0.29 0.00 -0.13 0.00 0.00 55.73 54.50 3dyo s ARG 800 Cb 0.16 -0.08 -0.09 0.00 -1.56 0.00 0.00 34.95 33.37 3dyo s ARG 800 CO 0.39 -1.31 1.12 0.42 -0.81 0.00 0.00 175.30 175.11 3dyo s ILE 801 N 0.99 3.45 -0.46 4.11 -1.09 -0.42 -0.98 121.20 126.81 3dyo s ILE 801 Ca 0.28 1.44 -0.13 0.00 -2.23 0.00 0.00 60.65 60.01 3dyo s ILE 801 Cb -0.01 -3.92 0.08 0.00 -1.58 0.00 0.00 42.46 37.04 3dyo s ILE 801 CO -0.06 0.33 0.36 -0.62 -1.23 0.00 0.00 174.94 173.73 3dyo s ASP 802 N -0.75 5.97 0.39 3.58 -1.08 -1.26 -4.87 116.67 118.65 3dyo s ASP 802 Ca 0.45 -1.48 0.27 0.00 -0.52 0.00 0.00 52.55 51.27 3dyo s ASP 802 Cb -0.32 -2.12 1.44 0.00 -1.46 0.00 0.00 42.92 40.46 3dyo s ASP 802 CO 0.41 -0.64 1.81 1.55 0.52 0.00 0.00 175.17 178.82 3dyo h PRO 803 N 8.65 0.00 0.00 4.34 0.13 -1.96 -1.89 132.00 141.26 3dyo h PRO 803 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3dyo h PRO 803 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3dyo h PRO 803 CO 0.86 0.00 -0.75 -0.97 -0.23 0.00 0.00 178.00 176.91 3dyo h ASN 804 N 0.00 0.00 -3.94 1.44 -0.00 -1.96 -3.37 115.58 107.75 3dyo h ASN 804 Ca 0.00 -0.17 -0.54 0.00 -0.00 0.00 0.00 56.30 55.59 3dyo h ASN 804 Cb 0.01 0.00 0.10 0.00 -0.00 0.00 0.00 38.32 38.44 3dyo h ASN 804 CO 0.00 0.08 0.77 0.00 -0.00 0.00 0.00 177.43 178.29 3dyo s ALA 805 N -3.22 3.57 0.24 1.57 0.00 -0.71 -4.73 121.76 118.48 3dyo s ALA 805 Ca 0.04 1.56 -0.05 0.00 0.00 0.00 0.00 51.96 53.51 3dyo s ALA 805 Cb 0.12 -3.60 0.44 0.00 0.00 0.00 0.00 23.12 20.07 3dyo s ALA 805 CO 0.75 -1.04 1.70 -1.49 0.00 0.00 0.00 175.76 175.68 3dyo h TRP 806 N 3.02 0.35 -0.80 0.00 4.06 -1.83 0.12 115.95 120.88 3dyo h TRP 806 Ca -0.51 0.04 0.08 0.00 2.06 0.00 0.00 58.89 60.56 3dyo h TRP 806 Cb 1.24 -0.04 -0.05 0.00 -1.00 0.00 0.00 29.16 29.30 3dyo h TRP 806 CO 0.53 -0.03 0.52 -0.24 -3.56 0.00 0.00 178.44 175.67 3dyo h VAL 807 N 0.33 0.99 -0.10 1.49 3.04 -1.29 0.56 116.25 121.26 3dyo h VAL 807 Ca 0.40 -0.27 -0.16 0.00 -1.01 0.00 0.00 66.70 65.65 3dyo h VAL 807 Cb 0.65 0.12 -0.01 0.00 -2.01 0.00 0.00 31.29 30.04 3dyo h VAL 807 CO -0.46 0.15 -0.63 -0.33 -1.01 0.00 0.00 177.57 175.29 3dyo h GLU 808 N 0.80 0.38 -0.43 4.17 4.39 -1.06 0.01 114.58 122.83 3dyo h GLU 808 Ca 0.36 -0.27 -0.06 0.00 0.34 0.00 0.00 59.36 59.73 3dyo h GLU 808 Cb 0.35 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 3dyo h GLU 808 CO -0.13 0.88 0.04 0.00 -1.16 0.00 0.00 179.01 178.64 3dyo h ARG 809 N 0.27 0.73 -0.11 2.33 3.08 -0.39 0.16 114.38 120.46 3dyo h ARG 809 Ca -0.01 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 3dyo h ARG 809 Cb 1.16 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 3dyo h ARG 809 CO 0.11 0.78 0.05 -1.49 -1.07 0.00 0.00 179.97 178.35 3dyo h TRP 810 N 0.58 0.16 -0.20 3.04 6.55 -0.75 -0.51 115.95 124.82 3dyo h TRP 810 Ca 0.13 -0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.96 3dyo h TRP 810 Cb 0.43 -0.05 -0.01 0.00 -0.86 0.00 0.00 29.16 28.67 3dyo h TRP 810 CO 0.03 0.22 0.12 0.87 -1.05 0.00 0.00 178.44 178.63 3dyo h LYS 811 N 0.05 0.28 -0.35 0.49 1.57 -0.86 -1.39 116.57 116.36 3dyo h LYS 811 Ca 0.04 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3dyo h LYS 811 Cb 0.12 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3dyo h LYS 811 CO -0.00 0.25 0.20 0.00 -0.57 0.00 0.00 179.45 179.32 3dyo h ALA 812 N 1.01 1.68 0.00 3.86 0.00 -0.49 -1.38 119.26 123.95 3dyo h ALA 812 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3dyo h ALA 812 Cb 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3dyo h ALA 812 CO -0.01 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.51 3dyo n ALA 813 N -2.48 2.28 -0.85 0.00 0.00 -0.22 -4.89 120.51 114.35 3dyo n ALA 813 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3dyo n ALA 813 Cb 0.09 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 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 1.06 0.50 0.34 0.00 0.00 -0.52 -4.83 105.19 101.74 3dyo n GLY 814 Ca 0.10 -0.69 -0.02 0.00 0.00 0.00 0.00 46.02 45.40 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 1.07 0.00 1.61 3.86 -1.47 0.22 115.15 120.44 3dyo h HIS 815 Ca 0.00 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3dyo h HIS 815 Cb 0.00 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.13 3dyo h HIS 815 CO 0.00 0.76 0.00 1.88 0.86 0.00 0.00 177.93 181.43 3dyo h TYR 816 N 1.09 0.00 -0.01 2.45 -1.99 -1.86 -3.26 116.97 113.39 3dyo h TYR 816 Ca 0.27 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.00 3dyo h TYR 816 Cb 0.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.78 3dyo h TYR 816 CO 0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 178.16 177.74 3dyo n GLN 817 N -2.85 1.48 -1.70 4.88 0.00 -0.61 -5.03 117.38 113.56 3dyo n GLN 817 Ca 0.04 -0.81 -0.42 0.00 0.00 0.00 0.00 57.00 55.81 3dyo n GLN 817 Cb 0.47 -1.35 0.00 0.00 0.00 0.00 0.00 30.24 29.36 3dyo n GLN 817 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3dyo n ALA 818 N -0.19 1.29 -2.90 2.61 0.00 0.66 -4.98 120.51 117.01 3dyo n ALA 818 Ca 0.07 0.30 -0.34 0.00 0.00 0.00 0.00 53.44 53.48 3dyo n ALA 818 Cb 0.38 -2.26 -0.12 0.00 0.00 0.00 0.00 19.45 17.45 3dyo n ALA 818 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3dyo s GLU 819 N -2.07 3.59 -0.10 0.00 2.02 -1.23 -4.90 118.70 116.02 3dyo s GLU 819 Ca 0.59 -0.50 -0.30 0.00 0.02 0.00 0.00 54.97 54.78 3dyo s GLU 819 Cb -0.53 -2.91 -0.02 0.00 0.10 0.00 0.00 34.13 30.77 3dyo s GLU 819 CO 0.60 0.31 1.17 0.00 0.02 0.00 0.00 175.26 177.35 3dyo s ALA 820 N 0.20 3.53 -0.23 5.21 0.00 -1.26 -2.05 121.76 127.16 3dyo s ALA 820 Ca -0.01 0.51 -0.05 0.00 0.00 0.00 0.00 51.96 52.40 3dyo s ALA 820 Cb -0.14 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.44 3dyo s ALA 820 CO 0.03 -0.85 -0.01 0.00 0.00 0.00 0.00 175.76 174.93 3dyo s ALA 821 N 2.55 2.93 0.04 0.00 0.00 0.10 -4.93 121.76 122.45 3dyo s ALA 821 Ca 0.53 -1.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.05 3dyo s ALA 821 Cb -0.22 -1.81 -0.07 0.00 0.00 0.00 0.00 23.12 21.02 3dyo s ALA 821 CO 0.18 -0.41 1.45 -1.17 0.00 0.00 0.00 175.76 175.81 3dyo s LEU 822 N 1.46 4.34 -0.02 0.00 2.96 -1.26 -0.85 118.68 125.30 3dyo s LEU 822 Ca 0.05 2.24 0.17 0.00 -0.22 0.00 0.00 54.13 56.37 3dyo s LEU 822 Cb -0.15 -3.57 -0.26 0.00 0.50 0.00 0.00 46.19 42.72 3dyo s LEU 822 CO -0.01 -0.74 0.37 0.18 -1.32 0.00 0.00 176.35 174.83 3dyo n LEU 823 N 5.12 0.00 -3.60 -0.68 4.77 0.47 -4.93 117.00 118.16 3dyo n LEU 823 Ca 0.13 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 3dyo n LEU 823 Cb 0.43 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 3dyo n LEU 823 CO 0.59 0.00 0.76 -1.58 -1.33 0.00 0.00 177.39 175.84 3dyo s GLN 824 N -3.17 0.57 -0.29 3.23 0.74 -0.77 -4.87 119.66 115.10 3dyo s GLN 824 Ca -0.06 0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.65 3dyo s GLN 824 Cb 0.11 0.27 0.18 0.00 1.10 0.00 0.00 33.01 34.67 3dyo s GLN 824 CO 0.70 -0.14 0.55 0.00 -0.55 0.00 0.00 175.29 175.84 3dyo s THR 826 N 2.78 1.23 -0.03 0.00 -4.23 0.14 -4.95 115.64 110.58 3dyo s THR 826 Ca 0.17 -2.06 0.01 0.00 -1.18 0.00 0.00 61.69 58.64 3dyo s THR 826 Cb -0.14 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.28 3dyo s THR 826 CO -0.22 -0.28 -0.05 0.00 -0.54 0.00 0.00 174.62 173.54 3dyo s ALA 827 N -3.29 0.57 -0.01 3.99 0.00 -1.26 -0.85 121.76 120.92 3dyo s ALA 827 Ca 0.30 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.17 3dyo s ALA 827 Cb 0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 3dyo s ALA 827 CO 0.10 0.05 -0.09 -0.51 0.00 0.00 0.00 175.76 175.31 3dyo s ASP 828 N 0.47 1.12 -0.20 0.00 1.01 0.24 -4.99 116.67 114.33 3dyo s ASP 828 Ca -0.06 -0.17 -0.11 0.00 0.71 0.00 0.00 52.55 52.92 3dyo s ASP 828 Cb -0.09 -0.14 -0.05 0.00 1.01 0.00 0.00 42.92 43.65 3dyo s ASP 828 CO -0.00 0.11 0.16 0.28 0.21 0.00 0.00 175.17 175.93 3dyo s THR 829 N -0.20 5.39 0.08 -1.27 -1.32 -1.26 -0.33 115.64 116.73 3dyo s THR 829 Ca 0.03 0.24 0.01 0.00 -1.21 0.00 0.00 61.69 60.77 3dyo s THR 829 Cb -0.04 -3.50 0.01 0.00 -1.51 0.00 0.00 72.50 67.46 3dyo s THR 829 CO -0.00 0.42 0.10 0.18 -2.21 0.00 0.00 174.62 173.10 3dyo n LEU 830 N 3.66 0.00 0.27 9.08 4.77 0.21 -4.97 117.00 130.02 3dyo n LEU 830 Ca -0.15 -0.35 -0.16 0.00 -0.03 0.00 0.00 56.01 55.32 3dyo n LEU 830 Cb 0.52 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.48 3dyo n LEU 830 CO 0.37 -0.50 0.70 0.00 -1.33 0.00 0.00 177.39 176.63 3dyo h ALA 831 N 0.49 -0.68 -0.09 -1.18 0.00 -2.02 -3.31 119.26 112.47 3dyo h ALA 831 Ca -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3dyo h ALA 831 Cb 0.17 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3dyo h ALA 831 CO 0.06 -0.89 -0.05 -0.40 0.00 0.00 0.00 179.25 177.97 3dyo n ASP 832 N -5.40 2.70 -3.76 0.00 5.75 -1.26 -4.95 116.55 109.63 3dyo n ASP 832 Ca -0.11 -3.19 -0.06 0.00 -0.01 0.00 0.00 54.79 51.42 3dyo n ASP 832 Cb 0.30 -0.48 -0.02 0.00 -1.03 0.00 0.00 41.12 39.89 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 -2.92 -1.46 -0.06 2.12 0.00 -1.25 -3.59 121.76 114.60 3dyo s ALA 833 Ca 0.36 0.00 0.05 0.00 0.00 0.00 0.00 51.96 52.37 3dyo s ALA 833 Cb 0.31 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 24.16 3dyo s ALA 833 CO 0.03 -1.00 -0.21 0.08 0.00 0.00 0.00 175.76 174.66 3dyo s VAL 834 N -3.61 2.40 -0.23 0.00 1.01 0.87 0.63 120.40 121.48 3dyo s VAL 834 Ca 0.10 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.15 3dyo s VAL 834 Cb -0.03 -1.91 0.04 0.00 0.00 0.00 0.00 36.38 34.48 3dyo s VAL 834 CO 0.03 0.57 -0.13 -0.22 0.00 0.00 0.00 175.10 175.34 3dyo s LEU 835 N -0.24 2.89 -0.14 3.92 2.96 0.55 -0.28 118.68 128.35 3dyo s LEU 835 Ca -0.01 -1.00 -0.04 0.00 -0.22 0.00 0.00 54.13 52.87 3dyo s LEU 835 Cb -0.13 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 3dyo s LEU 835 CO 0.03 -0.10 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.31 3dyo s ILE 836 N 1.22 4.14 -0.13 6.68 -1.09 -0.34 0.83 121.20 132.51 3dyo s ILE 836 Ca -0.02 -0.28 0.02 0.00 -2.23 0.00 0.00 60.65 58.15 3dyo s ILE 836 Cb -0.17 -2.80 0.01 0.00 -1.58 0.00 0.00 42.46 37.92 3dyo s ILE 836 CO -0.08 0.52 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.05 3dyo s THR 837 N -0.03 2.00 0.11 2.92 2.01 -0.03 0.25 115.64 122.88 3dyo s THR 837 Ca 0.02 -0.94 0.04 0.00 0.31 0.00 0.00 61.69 61.12 3dyo s THR 837 Cb -0.13 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 3dyo s THR 837 CO 0.02 0.54 -0.10 0.42 -0.69 0.00 0.00 174.62 174.81 3dyo s THR 838 N 0.81 0.97 -0.11 -0.82 -4.23 -0.46 0.26 115.64 112.07 3dyo s THR 838 Ca -0.07 -1.82 -0.07 0.00 -1.18 0.00 0.00 61.69 58.55 3dyo s THR 838 Cb -0.16 -1.56 0.04 0.00 1.34 0.00 0.00 72.50 72.17 3dyo s THR 838 CO -0.01 -0.67 0.28 0.00 -0.54 0.00 0.00 174.62 173.68 3dyo s ALA 839 N -2.90 -0.66 0.10 3.99 0.00 -0.08 -0.15 121.76 122.06 3dyo s ALA 839 Ca 0.10 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.12 3dyo s ALA 839 Cb 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 3dyo s ALA 839 CO -0.01 -0.19 -0.08 -1.01 0.00 0.00 0.00 175.76 174.47 3dyo s HIS 840 N 1.04 0.95 -0.06 0.00 3.76 0.15 0.18 115.29 121.30 3dyo s HIS 840 Ca -0.07 -0.81 0.03 0.00 -0.15 0.00 0.00 55.06 54.05 3dyo s HIS 840 Cb -0.08 -0.53 0.01 0.00 1.11 0.00 0.00 32.58 33.08 3dyo s HIS 840 CO -0.07 -0.09 -0.14 0.00 -0.85 0.00 0.00 174.74 173.59 3dyo s ALA 841 N -3.18 1.37 -0.20 -1.40 0.00 -0.03 -0.85 121.76 117.47 3dyo s ALA 841 Ca 0.09 -0.50 -0.13 0.00 0.00 0.00 0.00 51.96 51.42 3dyo s ALA 841 Cb 0.02 -0.57 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 3dyo s ALA 841 CO -0.03 0.15 0.27 -1.58 0.00 0.00 0.00 175.76 174.57 3dyo s TRP 842 N 0.53 3.39 0.20 0.00 0.51 0.17 0.02 118.94 123.76 3dyo s TRP 842 Ca -0.13 0.47 0.04 0.00 -2.12 0.00 0.00 56.10 54.35 3dyo s TRP 842 Cb -0.15 -2.35 -0.05 0.00 -0.81 0.00 0.00 33.47 30.11 3dyo s TRP 842 CO 0.04 0.13 -0.03 -0.65 -0.51 0.00 0.00 176.95 175.93 3dyo s GLN 843 N 0.85 1.24 -0.11 4.98 -0.21 -0.87 -0.53 119.66 125.01 3dyo s GLN 843 Ca 0.14 -1.60 -0.04 0.00 0.02 0.00 0.00 55.36 53.88 3dyo s GLN 843 Cb -0.13 -0.58 0.05 0.00 1.00 0.00 0.00 33.01 33.35 3dyo s GLN 843 CO 0.04 -0.05 0.14 -1.58 -2.12 0.00 0.00 175.29 171.72 3dyo s HIS 844 N -3.42 -0.07 -1.18 0.91 2.46 0.39 -3.51 115.29 110.86 3dyo s HIS 844 Ca 0.25 0.29 -0.14 0.00 0.47 0.00 0.00 55.06 55.93 3dyo s HIS 844 Cb 0.05 -0.41 -0.02 0.00 -0.13 0.00 0.00 32.58 32.07 3dyo s HIS 844 CO 0.06 -0.36 0.77 1.04 -2.47 0.00 0.00 174.74 173.78 3dyo n GLN 845 N 5.31 -2.15 0.00 2.88 6.02 -1.26 -0.40 117.38 127.77 3dyo n GLN 845 Ca -0.05 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 3dyo n GLN 845 Cb 0.50 -4.58 0.00 0.00 1.02 0.00 0.00 30.24 27.17 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 -1.62 2.75 3.87 1.08 0.00 -1.26 -4.97 105.19 105.03 3dyo n GLY 846 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.03 3.72 -0.33 1.61 2.20 0.46 -5.04 119.74 122.33 3dyo s LYS 847 Ca 0.00 0.13 -0.19 0.00 -0.36 0.00 0.00 55.97 55.54 3dyo s LYS 847 Cb 0.00 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.24 3dyo s LYS 847 CO 0.00 0.62 0.59 0.99 -0.36 0.00 0.00 175.35 177.19 3dyo s THR 848 N -1.29 4.95 -0.16 3.43 2.01 -1.26 0.15 115.64 123.47 3dyo s THR 848 Ca 0.29 0.63 -0.27 0.00 0.31 0.00 0.00 61.69 62.64 3dyo s THR 848 Cb -0.14 -4.00 -0.24 0.00 0.01 0.00 0.00 72.50 68.13 3dyo s THR 848 CO 0.16 -0.20 0.63 -0.07 -0.69 0.00 0.00 174.62 174.44 3dyo h LEU 849 N 9.18 0.01 -8.04 4.42 3.38 -1.16 -3.42 115.31 119.67 3dyo h LEU 849 Ca -0.27 -0.87 -0.22 0.00 0.09 0.00 0.00 57.88 56.61 3dyo h LEU 849 Cb 1.12 -0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.65 3dyo h LEU 849 CO 0.80 1.13 -0.71 -0.36 0.09 0.00 0.00 178.44 179.39 3dyo s PHE 850 N -2.26 0.42 -0.06 1.13 0.40 -1.21 -1.38 117.98 115.01 3dyo s PHE 850 Ca -0.22 -0.49 0.02 0.00 -0.60 0.00 0.00 56.93 55.65 3dyo s PHE 850 Cb -0.01 -0.27 0.01 0.00 0.51 0.00 0.00 43.02 43.27 3dyo s PHE 850 CO 0.67 -0.14 -0.13 0.42 0.70 0.00 0.00 175.22 176.74 3dyo s ILE 851 N -1.36 1.17 -0.16 0.64 1.01 -0.13 -0.66 121.20 121.71 3dyo s ILE 851 Ca -0.13 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.03 3dyo s ILE 851 Cb -0.10 -1.06 0.02 0.00 0.01 0.00 0.00 42.46 41.33 3dyo s ILE 851 CO -0.00 0.36 -0.21 -0.55 0.00 0.00 0.00 174.94 174.54 3dyo s SER 852 N 0.58 3.14 -0.17 3.58 0.15 -0.03 -1.04 113.70 119.91 3dyo s SER 852 Ca -0.13 -0.63 0.01 0.00 0.70 0.00 0.00 55.95 55.90 3dyo s SER 852 Cb -0.15 -1.47 0.01 0.00 -1.71 0.00 0.00 66.02 62.70 3dyo s SER 852 CO 0.04 0.03 -0.19 -0.13 1.20 0.00 0.00 173.24 174.19 3dyo s ARG 853 N 1.08 3.06 0.21 5.44 0.52 -0.61 0.34 118.95 128.99 3dyo s ARG 853 Ca -0.00 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.42 3dyo s ARG 853 Cb -0.14 -2.56 -0.05 0.00 0.52 0.00 0.00 34.95 32.72 3dyo s ARG 853 CO -0.08 -0.11 0.02 0.15 0.02 0.00 0.00 175.30 175.30 3dyo s LYS 854 N 1.07 1.23 -0.01 3.54 1.02 0.79 -1.08 119.74 126.31 3dyo s LYS 854 Ca -0.01 -1.62 0.01 0.00 0.02 0.00 0.00 55.97 54.38 3dyo s LYS 854 Cb -0.14 -0.36 -0.00 0.00 -0.52 0.00 0.00 37.83 36.81 3dyo s LYS 854 CO -0.07 -0.16 -0.05 0.95 -0.92 0.00 0.00 175.35 175.11 3dyo s THR 855 N -3.62 0.38 -0.16 2.17 -4.23 -0.93 -1.35 115.64 107.90 3dyo s THR 855 Ca 0.28 -0.19 0.00 0.00 -1.18 0.00 0.00 61.69 60.61 3dyo s THR 855 Cb 0.06 -0.33 0.03 0.00 1.34 0.00 0.00 72.50 73.60 3dyo s THR 855 CO 0.07 0.12 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.86 3dyo s TYR 856 N 0.01 2.01 -0.26 3.99 1.51 0.14 -1.22 117.35 123.53 3dyo s TYR 856 Ca 0.00 -1.23 -0.05 0.00 -1.01 0.00 0.00 57.07 54.79 3dyo s TYR 856 Cb -0.03 -1.48 0.00 0.00 -0.11 0.00 0.00 41.96 40.34 3dyo s TYR 856 CO -0.00 -0.66 0.02 0.50 -1.11 0.00 0.00 175.55 174.30 3dyo s ARG 857 N 1.53 3.20 -0.19 -0.62 3.52 0.55 -1.20 118.95 125.75 3dyo s ARG 857 Ca 0.02 -0.76 -0.03 0.00 -0.13 0.00 0.00 55.73 54.82 3dyo s ARG 857 Cb -0.15 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.04 3dyo s ARG 857 CO -0.09 -0.33 -0.05 0.42 -0.81 0.00 0.00 175.30 174.44 3dyo s ILE 858 N 1.48 3.48 0.42 4.11 1.01 0.62 -0.26 121.20 132.06 3dyo s ILE 858 Ca 0.04 -0.48 0.04 0.00 0.00 0.00 0.00 60.65 60.25 3dyo s ILE 858 Cb -0.16 -2.55 0.04 0.00 0.01 0.00 0.00 42.46 39.80 3dyo s ILE 858 CO -0.00 0.45 0.34 -0.90 0.00 0.00 0.00 174.94 174.83 3dyo n ASP 859 N 4.29 2.28 0.24 3.58 5.68 -1.17 -0.09 116.55 131.36 3dyo n ASP 859 Ca -0.18 -2.42 0.16 0.00 -0.50 0.00 0.00 54.79 51.85 3dyo n ASP 859 Cb 0.52 -0.06 0.69 0.00 -1.14 0.00 0.00 41.12 41.13 3dyo n ASP 859 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 3dyo h GLY 860 N 0.47 0.00 1.09 6.12 0.00 -1.68 -1.71 103.07 107.36 3dyo h GLY 860 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3dyo h GLY 860 CO 0.41 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.81 3dyo n SER 861 N -2.81 0.00 0.00 0.19 3.41 -1.26 -4.58 113.62 108.57 3dyo n SER 861 Ca 0.01 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.78 3dyo n SER 861 Cb 0.24 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 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 1.00 0.99 3.78 5.00 0.00 -0.64 -5.00 105.19 110.31 3dyo n GLY 862 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.25 4.59 -0.26 1.61 -0.21 -1.26 -4.53 119.66 119.34 3dyo s GLN 863 Ca 0.00 1.25 -0.04 0.00 0.02 0.00 0.00 55.36 56.60 3dyo s GLN 863 Cb 0.00 -3.03 0.02 0.00 1.00 0.00 0.00 33.01 31.00 3dyo s GLN 863 CO 0.00 0.42 -0.01 1.41 -2.12 0.00 0.00 175.29 174.99 3dyo s MET 864 N -1.64 2.99 -0.20 2.91 -2.45 -0.03 -3.03 119.30 117.84 3dyo s MET 864 Ca 0.44 -0.89 -0.12 0.00 -1.25 0.00 0.00 55.69 53.87 3dyo s MET 864 Cb -0.21 -3.13 -0.05 0.00 1.25 0.00 0.00 34.83 32.69 3dyo s MET 864 CO 0.26 -0.39 0.21 0.00 1.05 0.00 0.00 175.02 176.15 3dyo s ALA 865 N 1.41 3.63 -0.07 4.11 0.00 0.64 0.45 121.76 131.93 3dyo s ALA 865 Ca 0.02 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.34 3dyo s ALA 865 Cb -0.17 -2.33 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 3dyo s ALA 865 CO -0.02 -0.02 -0.20 0.42 0.00 0.00 0.00 175.76 175.94 3dyo s ILE 866 N 0.72 2.55 -0.08 0.00 1.01 0.14 -0.33 121.20 125.21 3dyo s ILE 866 Ca 0.11 -0.89 0.05 0.00 0.00 0.00 0.00 60.65 59.92 3dyo s ILE 866 Cb -0.13 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 3dyo s ILE 866 CO 0.03 0.57 -0.24 -0.89 0.00 0.00 0.00 174.94 174.40 3dyo s THR 867 N -0.22 2.12 -0.06 2.92 2.01 -0.36 -0.79 115.64 121.27 3dyo s THR 867 Ca -0.01 -1.02 0.01 0.00 0.31 0.00 0.00 61.69 60.98 3dyo s THR 867 Cb -0.13 -1.79 0.02 0.00 0.01 0.00 0.00 72.50 70.61 3dyo s THR 867 CO 0.03 0.56 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.76 3dyo s VAL 868 N 0.05 0.78 -0.17 3.82 1.01 0.65 -2.18 120.40 124.36 3dyo s VAL 868 Ca -0.10 -0.26 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 3dyo s VAL 868 Cb -0.16 -0.76 0.04 0.00 0.00 0.00 0.00 36.38 35.50 3dyo s VAL 868 CO 0.06 0.28 -0.07 -1.81 0.00 0.00 0.00 175.10 173.56 3dyo s ASP 869 N 0.88 2.88 0.08 3.32 1.01 -0.24 -0.98 116.67 123.62 3dyo s ASP 869 Ca -0.11 -0.67 0.09 0.00 0.71 0.00 0.00 52.55 52.58 3dyo s ASP 869 Cb -0.15 -0.99 -0.03 0.00 1.01 0.00 0.00 42.92 42.76 3dyo s ASP 869 CO 0.01 -0.16 -0.25 -0.69 0.21 0.00 0.00 175.17 174.28 3dyo s VAL 870 N 1.58 2.08 -0.09 -1.27 1.01 -0.12 -1.58 120.40 122.01 3dyo s VAL 870 Ca 0.01 -1.49 0.01 0.00 0.00 0.00 0.00 61.98 60.50 3dyo s VAL 870 Cb -0.15 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 3dyo s VAL 870 CO -0.08 0.23 -0.10 -1.61 0.00 0.00 0.00 175.10 173.54 3dyo s GLU 871 N -1.53 3.01 -0.11 2.72 2.02 -0.21 0.10 118.70 124.70 3dyo s GLU 871 Ca 0.11 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.49 3dyo s GLU 871 Cb -0.10 -2.60 0.02 0.00 0.10 0.00 0.00 34.13 31.55 3dyo s GLU 871 CO 0.03 0.46 -0.12 0.08 0.02 0.00 0.00 175.26 175.73 3dyo s VAL 872 N -0.28 1.30 0.09 2.63 1.01 0.17 -0.95 120.40 124.37 3dyo s VAL 872 Ca 0.03 -0.49 -0.34 0.00 0.00 0.00 0.00 61.98 61.18 3dyo s VAL 872 Cb -0.13 -1.23 -0.13 0.00 0.00 0.00 0.00 36.38 34.89 3dyo s VAL 872 CO 0.03 0.41 1.65 0.00 0.00 0.00 0.00 175.10 177.18 3dyo n ALA 873 N 4.52 1.16 0.27 5.51 0.00 -0.48 -4.61 120.51 126.88 3dyo n ALA 873 Ca -0.17 0.41 0.15 0.00 0.00 0.00 0.00 53.44 53.83 3dyo n ALA 873 Cb 0.51 -2.38 0.87 0.00 0.00 0.00 0.00 19.45 18.45 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 6.71 0.00 -0.32 0.00 4.64 -1.94 -0.54 113.55 122.10 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 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3dyo h SER 874 CO 0.90 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.96 3dyo n ASP 875 N -3.89 2.55 -4.88 4.97 5.75 -1.26 -4.88 116.55 114.90 3dyo n ASP 875 Ca -0.02 -1.88 -0.28 0.00 -0.01 0.00 0.00 54.79 52.60 3dyo n ASP 875 Cb 0.15 -0.21 -0.04 0.00 -1.03 0.00 0.00 41.12 39.99 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 -1.59 5.06 0.34 2.12 -1.32 -0.21 -5.04 115.64 115.00 3dyo s THR 876 Ca 0.35 -0.67 -0.28 0.00 -1.21 0.00 0.00 61.69 59.87 3dyo s THR 876 Cb 0.19 -3.53 -0.12 0.00 -1.51 0.00 0.00 72.50 67.53 3dyo s THR 876 CO 0.27 0.02 1.33 -2.65 -2.21 0.00 0.00 174.62 171.39 3dyo n PRO 877 N -0.07 2.22 -1.65 7.08 -0.02 -1.26 -4.86 135.00 136.44 3dyo n PRO 877 Ca -0.07 0.78 -0.48 0.00 -2.02 0.00 0.00 63.50 61.71 3dyo n PRO 877 Cb 0.53 -2.39 -0.05 0.00 -0.02 0.00 0.00 33.50 31.57 3dyo n PRO 877 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3dyo n HIS 878 N 0.51 2.04 -1.86 6.00 8.25 -1.26 -4.92 115.22 123.98 3dyo n HIS 878 Ca 0.05 0.39 -0.31 0.00 -0.26 0.00 0.00 57.72 57.58 3dyo n HIS 878 Cb 0.36 -2.48 0.02 0.00 1.12 0.00 0.00 29.99 29.01 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 0.72 3.37 0.44 -0.41 0.04 -1.26 -4.86 135.00 133.04 3dyo s PRO 879 Ca 0.80 0.92 0.21 0.00 0.04 0.00 0.00 61.00 62.97 3dyo s PRO 879 Cb -0.76 -2.05 1.04 0.00 0.04 0.00 0.00 34.50 32.77 3dyo s PRO 879 CO 0.41 -0.76 1.92 0.00 0.04 0.00 0.00 177.00 178.61 3dyo h ALA 880 N -0.18 1.25 -2.83 8.56 0.00 -1.87 -3.41 119.26 120.79 3dyo h ALA 880 Ca -0.45 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.26 3dyo h ALA 880 Cb 1.20 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.83 3dyo h ALA 880 CO 0.59 0.31 0.28 -0.98 0.00 0.00 0.00 179.25 179.45 3dyo s ARG 881 N -4.05 1.24 -0.32 0.00 1.70 -1.22 -0.13 118.95 116.17 3dyo s ARG 881 Ca -0.02 -0.50 -0.01 0.00 -0.47 0.00 0.00 55.73 54.73 3dyo s ARG 881 Cb 0.13 0.54 0.10 0.00 -0.57 0.00 0.00 34.95 35.15 3dyo s ARG 881 CO 0.65 -0.55 0.11 0.42 -1.08 0.00 0.00 175.30 174.85 3dyo s ILE 882 N -3.62 0.86 0.00 4.99 1.01 -0.04 -4.09 121.20 120.31 3dyo s ILE 882 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 60.65 59.21 3dyo s ILE 882 Cb -0.02 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.80 3dyo s ILE 882 CO -0.09 -0.70 0.00 0.61 0.00 0.00 0.00 174.94 174.75 3dyo n GLY 883 N 4.74 2.42 3.37 6.18 0.00 -0.93 -0.33 105.19 120.64 3dyo n GLY 883 Ca -0.01 -0.86 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 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 2.52 0.12 0.99 1.43 -0.13 0.95 118.68 124.56 3dyo s LEU 884 Ca 0.00 -0.96 -0.08 0.00 -1.03 0.00 0.00 54.13 52.06 3dyo s LEU 884 Cb 0.00 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.38 3dyo s LEU 884 CO 0.00 -0.07 0.21 0.54 0.23 0.00 0.00 176.35 177.26 3dyo s ASN 885 N -3.11 0.11 0.08 2.29 4.22 0.21 -1.24 114.94 117.50 3dyo s ASN 885 Ca 0.22 -0.79 -0.26 0.00 -2.14 0.00 0.00 52.86 49.89 3dyo s ASN 885 Cb -0.04 0.37 0.08 0.00 1.28 0.00 0.00 41.25 42.95 3dyo s ASN 885 CO 0.09 -0.79 0.83 0.00 -2.04 0.00 0.00 177.10 175.18 3dyo s GLN 887 N -3.34 2.86 0.43 0.00 0.74 -1.21 -0.87 119.66 118.28 3dyo s GLN 887 Ca 0.06 -1.05 -0.21 0.00 0.05 0.00 0.00 55.36 54.20 3dyo s GLN 887 Cb -0.01 -3.71 -0.10 0.00 1.10 0.00 0.00 33.01 30.29 3dyo s GLN 887 CO -0.07 -0.67 0.97 -0.51 -0.55 0.00 0.00 175.29 174.46 3dyo s LEU 888 N 1.55 3.95 0.18 3.68 1.43 1.00 0.61 118.68 131.09 3dyo s LEU 888 Ca 0.02 1.76 0.13 0.00 -1.03 0.00 0.00 54.13 55.01 3dyo s LEU 888 Cb -0.19 -4.50 -0.06 0.00 0.03 0.00 0.00 46.19 41.47 3dyo s LEU 888 CO 0.06 -0.43 1.27 0.00 0.23 0.00 0.00 176.35 177.48 3dyo h ALA 889 N 1.93 0.57 -1.67 4.21 0.00 -1.09 -1.88 119.26 121.34 3dyo h ALA 889 Ca -0.49 -0.70 -0.43 0.00 0.00 0.00 0.00 54.91 53.29 3dyo h ALA 889 Cb 1.19 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.98 3dyo h ALA 889 CO 0.61 0.91 -0.16 1.14 0.00 0.00 0.00 179.25 181.75 3dyo s GLN 890 N -2.86 2.73 -0.18 0.00 -2.07 -1.26 -4.16 119.66 111.87 3dyo s GLN 890 Ca 0.02 -0.99 0.00 0.00 -1.82 0.00 0.00 55.36 52.57 3dyo s GLN 890 Cb 0.08 -2.63 0.01 0.00 -1.09 0.00 0.00 33.01 29.38 3dyo s GLN 890 CO 0.78 -0.44 -0.17 0.08 -1.32 0.00 0.00 175.29 174.22 3dyo s VAL 891 N -2.53 2.34 0.34 3.63 1.01 -1.26 -3.43 120.40 120.50 3dyo s VAL 891 Ca 0.55 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.76 3dyo s VAL 891 Cb -0.10 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 3dyo s VAL 891 CO 0.35 0.52 0.08 0.00 0.00 0.00 0.00 175.10 176.05 3dyo s ALA 892 N 1.23 3.35 0.05 5.51 0.00 -1.26 -5.04 121.76 125.59 3dyo s ALA 892 Ca 0.03 -1.91 -0.16 0.00 0.00 0.00 0.00 51.96 49.92 3dyo s ALA 892 Cb -0.14 -0.53 -0.25 0.00 0.00 0.00 0.00 23.12 22.20 3dyo s ALA 892 CO -0.09 0.04 1.13 0.93 0.00 0.00 0.00 175.76 177.77 3dyo h GLU 893 N 1.67 0.61 -6.07 0.00 4.39 -2.00 -3.43 114.58 109.75 3dyo h GLU 893 Ca -0.43 -0.71 -0.60 0.00 0.34 0.00 0.00 59.36 57.96 3dyo h GLU 893 Cb 1.25 0.21 -0.12 0.00 -0.10 0.00 0.00 28.75 29.99 3dyo h GLU 893 CO 0.65 1.30 -0.68 1.03 -1.16 0.00 0.00 179.01 180.15 3dyo s ARG 894 N -3.16 1.93 -0.06 2.33 1.81 -1.26 -1.14 118.95 119.39 3dyo s ARG 894 Ca -0.11 -1.77 0.01 0.00 -1.72 0.00 0.00 55.73 52.15 3dyo s ARG 894 Cb 0.06 -1.85 0.02 0.00 -0.45 0.00 0.00 34.95 32.72 3dyo s ARG 894 CO 0.90 0.22 -0.09 0.08 -0.68 0.00 0.00 175.30 175.73 3dyo s VAL 895 N -2.52 0.89 -0.10 3.52 1.01 0.36 -4.61 120.40 118.94 3dyo s VAL 895 Ca 0.32 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.01 3dyo s VAL 895 Cb -0.01 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.52 3dyo s VAL 895 CO 0.17 0.31 -0.16 0.21 0.00 0.00 0.00 175.10 175.63 3dyo s ASN 896 N 0.92 2.41 0.04 3.32 3.84 -0.96 -0.68 114.94 123.83 3dyo s ASN 896 Ca -0.10 -0.42 -0.05 0.00 0.21 0.00 0.00 52.86 52.49 3dyo s ASN 896 Cb -0.15 -1.09 -0.01 0.00 -0.55 0.00 0.00 41.25 39.45 3dyo s ASN 896 CO 0.01 0.04 0.09 -1.66 -2.79 0.00 0.00 177.10 172.78 3dyo s TRP 897 N 0.84 0.23 -0.37 0.43 -2.14 -0.04 0.15 118.94 118.04 3dyo s TRP 897 Ca -0.10 -0.57 -0.06 0.00 2.66 0.00 0.00 56.10 58.03 3dyo s TRP 897 Cb -0.15 -0.16 0.06 0.00 -3.10 0.00 0.00 33.47 30.12 3dyo s TRP 897 CO 0.01 -0.38 0.16 -1.17 -2.66 0.00 0.00 176.95 172.91 3dyo s LEU 898 N -2.26 4.66 0.00 -4.66 2.96 0.10 -0.34 118.68 119.15 3dyo s LEU 898 Ca -0.03 -1.39 0.00 0.00 -0.22 0.00 0.00 54.13 52.49 3dyo s LEU 898 Cb 0.00 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.81 3dyo s LEU 898 CO -0.06 -0.41 0.00 0.61 -1.32 0.00 0.00 176.35 175.17 3dyo n GLY 899 N 4.80 -0.73 3.72 7.98 0.00 -0.78 -0.21 105.19 119.98 3dyo n GLY 899 Ca -0.10 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 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 4.41 0.00 0.99 1.43 -0.77 -1.72 118.68 123.03 3dyo s LEU 900 Ca 0.00 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.08 3dyo s LEU 900 Cb 0.00 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.63 3dyo s LEU 900 CO 0.00 -0.34 0.00 0.61 0.23 0.00 0.00 176.35 176.85 3dyo n GLY 901 N 2.74 0.63 0.09 -3.19 0.00 -0.15 -4.43 105.19 100.88 3dyo n GLY 901 Ca 0.06 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.40 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 -7.34 1.61 0.13 -1.93 0.86 132.00 125.32 3dyo h PRO 902 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 3dyo h PRO 902 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 3dyo h PRO 902 CO 0.00 0.00 0.27 -0.65 -0.23 0.00 0.00 178.00 177.39 3dyo s GLN 903 N -3.20 2.36 0.19 0.86 -0.21 -1.26 -4.99 119.66 113.41 3dyo s GLN 903 Ca 0.05 -0.07 -0.32 0.00 0.02 0.00 0.00 55.36 55.04 3dyo s GLN 903 Cb 0.12 -2.13 -0.15 0.00 1.00 0.00 0.00 33.01 31.84 3dyo s GLN 903 CO 0.71 -1.18 1.20 -1.91 -2.12 0.00 0.00 175.29 171.99 3dyo n GLU 904 N -2.94 1.34 -3.75 2.91 2.13 -1.26 -4.89 120.64 114.17 3dyo n GLU 904 Ca 0.07 0.48 -0.13 0.00 0.66 0.00 0.00 57.16 58.24 3dyo n GLU 904 Cb 0.60 -1.99 -0.11 0.00 0.27 0.00 0.00 31.44 30.21 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 0.02 -0.36 0.35 4.31 2.20 0.14 -4.92 114.94 116.68 3dyo s ASN 905 Ca 0.71 0.69 0.08 0.00 -0.94 0.00 0.00 52.86 53.40 3dyo s ASN 905 Cb -0.80 0.70 -0.07 0.00 -2.00 0.00 0.00 41.25 39.08 3dyo s ASN 905 CO 0.52 -0.13 -0.05 -0.31 -2.94 0.00 0.00 177.10 174.19 3dyo s TYR 906 N 0.15 2.36 0.30 1.54 1.51 -0.80 -3.79 117.35 118.63 3dyo s TYR 906 Ca -0.00 -0.60 0.04 0.00 -1.01 0.00 0.00 57.07 55.49 3dyo s TYR 906 Cb -0.02 -1.46 0.64 0.00 -0.11 0.00 0.00 41.96 41.00 3dyo s TYR 906 CO 0.01 0.48 1.85 -1.35 -1.11 0.00 0.00 175.55 175.42 3dyo h PRO 907 N 1.98 0.88 -0.34 -1.71 0.11 -1.85 0.12 132.00 131.20 3dyo h PRO 907 Ca -0.42 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dyo h PRO 907 Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3dyo h PRO 907 CO 0.73 0.58 0.00 -0.40 -0.21 0.00 0.00 178.00 178.70 3dyo n ASP 908 N -4.60 2.99 -3.11 -2.05 5.75 -1.26 -4.37 116.55 109.89 3dyo n ASP 908 Ca 0.19 -1.93 -0.20 0.00 -0.01 0.00 0.00 54.79 52.84 3dyo n ASP 908 Cb 0.39 -0.22 -0.04 0.00 -1.03 0.00 0.00 41.12 40.23 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 1.19 0.81 0.00 0.11 0.63 0.39 -0.64 116.66 119.15 3dyo n ARG 909 Ca 0.18 -3.03 0.00 0.00 -0.92 0.00 0.00 57.85 54.09 3dyo n ARG 909 Cb 0.53 -1.37 0.00 0.00 0.45 0.00 0.00 32.46 32.08 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 1.06 0.35 0.10 6.15 -0.00 -0.97 -1.90 117.00 121.80 3dyo n LEU 910 Ca 0.20 -0.35 0.01 0.00 -0.00 0.00 0.00 56.01 55.86 3dyo n LEU 910 Cb 0.59 0.00 0.32 0.00 -0.00 0.00 0.00 43.42 44.33 3dyo n LEU 910 CO 0.16 0.09 0.80 0.71 -0.00 0.00 0.00 177.39 179.15 3dyo h THR 911 N 2.27 1.23 0.00 1.47 1.35 -1.90 -2.71 112.91 114.62 3dyo h THR 911 Ca 0.00 -1.06 -0.11 0.00 -0.55 0.00 0.00 66.41 64.69 3dyo h THR 911 Cb 0.86 1.37 -0.02 0.00 -1.73 0.00 0.00 68.15 68.63 3dyo h THR 911 CO 0.00 0.32 -0.53 0.00 -0.25 0.00 0.00 175.52 175.06 3dyo h ALA 912 N 1.54 0.90 -2.84 6.62 0.00 -1.88 -3.45 119.26 120.15 3dyo h ALA 912 Ca 0.04 -0.48 -0.52 0.00 0.00 0.00 0.00 54.91 53.95 3dyo h ALA 912 Cb 0.53 -0.08 0.07 0.00 0.00 0.00 0.00 17.79 18.31 3dyo h ALA 912 CO 0.04 0.66 0.59 0.00 0.00 0.00 0.00 179.25 180.53 3dyo s ALA 913 N -3.47 3.25 0.06 0.00 0.00 -1.02 -4.99 121.76 115.59 3dyo s ALA 913 Ca 0.00 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.21 3dyo s ALA 913 Cb 0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 3dyo s ALA 913 CO 0.73 -0.75 -0.20 0.00 0.00 0.00 0.00 175.76 175.55 3dyo s PHE 915 N -0.96 3.42 0.01 0.00 5.36 -1.26 -0.98 117.98 123.57 3dyo s PHE 915 Ca 0.15 1.35 -0.03 0.00 -0.96 0.00 0.00 56.93 57.44 3dyo s PHE 915 Cb -0.10 -3.09 0.01 0.00 -0.34 0.00 0.00 43.02 39.49 3dyo s PHE 915 CO 0.06 -0.28 0.14 -3.47 -1.46 0.00 0.00 175.22 170.21 3dyo n ASP 916 N 5.40 -0.19 -4.59 6.13 -0.08 -0.70 -4.95 116.55 117.56 3dyo n ASP 916 Ca 0.07 -1.08 -0.39 0.00 -1.51 0.00 0.00 54.79 51.88 3dyo n ASP 916 Cb 0.48 0.30 -0.10 0.00 2.34 0.00 0.00 41.12 44.15 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 -2.00 3.95 0.18 -0.67 6.06 -1.26 -1.86 118.95 123.35 3dyo s ARG 917 Ca 0.03 -0.15 0.10 0.00 -2.50 0.00 0.00 55.73 53.21 3dyo s ARG 917 Cb -0.00 -3.67 -0.04 0.00 0.06 0.00 0.00 34.95 31.29 3dyo s ARG 917 CO 0.00 -0.26 -0.14 -1.58 -2.50 0.00 0.00 175.30 170.82 3dyo s TRP 918 N 1.93 2.53 -0.24 5.12 0.52 0.54 -4.98 118.94 124.36 3dyo s TRP 918 Ca 0.11 -0.26 -0.03 0.00 0.02 0.00 0.00 56.10 55.94 3dyo s TRP 918 Cb -0.16 -1.24 0.13 0.00 -1.15 0.00 0.00 33.47 31.05 3dyo s TRP 918 CO 0.10 0.51 0.38 0.34 0.02 0.00 0.00 176.95 178.31 3dyo s ASP 919 N -2.78 0.16 0.22 2.95 -1.08 -1.26 -0.86 116.67 114.03 3dyo s ASP 919 Ca 0.24 0.34 0.01 0.00 -0.52 0.00 0.00 52.55 52.62 3dyo s ASP 919 Cb -0.08 1.15 -0.05 0.00 -1.46 0.00 0.00 42.92 42.47 3dyo s ASP 919 CO 0.13 -0.29 0.07 -0.76 0.52 0.00 0.00 175.17 174.84 3dyo s LEU 920 N 2.55 1.75 0.52 -1.34 1.43 0.14 -4.93 118.68 118.80 3dyo s LEU 920 Ca 0.11 -1.30 -0.21 0.00 -1.03 0.00 0.00 54.13 51.69 3dyo s LEU 920 Cb -0.15 0.05 -0.06 0.00 0.03 0.00 0.00 46.19 46.06 3dyo s LEU 920 CO -0.15 -0.69 1.17 -2.16 0.23 0.00 0.00 176.35 174.75 3dyo s PRO 921 N -4.01 3.45 0.31 1.29 0.04 -1.26 -0.49 135.00 134.32 3dyo s PRO 921 Ca 0.33 1.76 0.07 0.00 0.04 0.00 0.00 61.00 63.19 3dyo s PRO 921 Cb 0.07 -2.17 0.77 0.00 0.04 0.00 0.00 34.50 33.21 3dyo s PRO 921 CO 0.10 -0.81 1.77 1.25 0.04 0.00 0.00 177.00 179.34 3dyo h LEU 922 N 1.52 0.76 -2.03 -3.56 5.85 -1.40 0.17 115.31 116.62 3dyo h LEU 922 Ca -0.50 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.32 3dyo h LEU 922 Cb 1.26 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 3dyo h LEU 922 CO 0.58 0.24 -0.05 0.77 -0.34 0.00 0.00 178.44 179.64 3dyo h SER 923 N 0.73 0.00 0.33 1.25 4.64 -1.90 -1.39 113.55 117.21 3dyo h SER 923 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 3dyo h SER 923 Cb 0.97 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3dyo h SER 923 CO -0.40 0.05 0.00 0.47 -0.87 0.00 0.00 176.83 176.07 3dyo n ASP 924 N -4.25 0.00 -0.56 4.97 8.00 0.61 -2.48 116.55 122.83 3dyo n ASP 924 Ca -0.03 -0.19 0.14 0.00 0.71 0.00 0.00 54.79 55.42 3dyo n ASP 924 Cb 0.13 -0.22 0.45 0.00 -0.02 0.00 0.00 41.12 41.46 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 -1.22 1.78 -5.13 -1.24 2.81 -0.52 -4.78 117.12 108.82 3dyo n MET 925 Ca 0.12 -1.13 -0.32 0.00 -1.81 0.00 0.00 57.70 54.56 3dyo n MET 925 Cb 0.16 -1.47 -0.16 0.00 -0.71 0.00 0.00 33.22 31.04 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 -1.99 2.57 -0.29 2.03 5.04 -1.03 -4.48 117.35 119.19 3dyo s TYR 926 Ca 0.36 -0.76 -0.09 0.00 -2.44 0.00 0.00 57.07 54.14 3dyo s TYR 926 Cb 0.21 -1.68 -0.02 0.00 0.35 0.00 0.00 41.96 40.82 3dyo s TYR 926 CO 0.33 -0.24 0.14 0.99 -1.34 0.00 0.00 175.55 175.42 3dyo s THR 927 N 0.04 4.63 -1.50 4.34 2.01 -1.26 -4.97 115.64 118.93 3dyo s THR 927 Ca -0.08 -0.27 -0.10 0.00 0.31 0.00 0.00 61.69 61.55 3dyo s THR 927 Cb -0.15 -3.29 0.01 0.00 0.01 0.00 0.00 72.50 69.08 3dyo s THR 927 CO 0.05 0.17 2.57 -0.81 -0.69 0.00 0.00 174.62 175.91 3dyo n PRO 928 N 4.98 3.67 -1.71 4.92 -0.04 -1.26 -4.86 135.00 140.69 3dyo n PRO 928 Ca -0.14 -2.67 -0.43 0.00 -0.04 0.00 0.00 63.50 60.21 3dyo n PRO 928 Cb 0.50 -2.90 -0.01 0.00 -0.04 0.00 0.00 33.50 31.05 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 3.85 2.50 -0.31 0.54 4.02 -1.26 -4.89 117.16 121.61 3dyo n TYR 929 Ca 0.65 0.42 -0.03 0.00 -0.01 0.00 0.00 57.90 58.93 3dyo n TYR 929 Cb 0.28 -2.50 0.09 0.00 -0.02 0.00 0.00 39.34 37.20 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 2.98 1.19 -3.48 -0.72 2.07 -1.96 -3.30 116.25 113.03 3dyo h VAL 930 Ca -0.47 -0.38 -0.69 0.00 0.82 0.00 0.00 66.70 65.98 3dyo h VAL 930 Cb 1.26 -0.01 -0.19 0.00 -1.52 0.00 0.00 31.29 30.83 3dyo h VAL 930 CO 0.71 0.20 -0.16 0.12 0.02 0.00 0.00 177.57 178.47 3dyo s PHE 931 N -6.12 3.15 0.55 1.57 5.36 -1.26 -0.72 117.98 120.50 3dyo s PHE 931 Ca -0.13 -0.43 -0.19 0.00 -0.96 0.00 0.00 56.93 55.22 3dyo s PHE 931 Cb 0.16 -3.05 -0.06 0.00 -0.34 0.00 0.00 43.02 39.74 3dyo s PHE 931 CO 0.79 -0.77 1.10 -2.14 -1.46 0.00 0.00 175.22 172.74 3dyo s PRO 932 N 2.21 3.38 0.10 10.12 0.02 -1.24 -4.95 135.00 144.64 3dyo s PRO 932 Ca 0.12 1.50 -0.07 0.00 0.02 0.00 0.00 61.00 62.58 3dyo s PRO 932 Cb -0.18 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.35 3dyo s PRO 932 CO 0.13 -0.80 0.33 -1.13 -0.33 0.00 0.00 177.00 175.20 3dyo n SER 933 N -1.42 -0.70 -4.57 2.53 3.41 -1.26 -4.72 113.62 106.89 3dyo n SER 933 Ca 0.11 -1.42 -0.50 0.00 -0.26 0.00 0.00 58.87 56.79 3dyo n SER 933 Cb 0.52 1.15 -0.05 0.00 -0.26 0.00 0.00 64.21 65.57 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 -0.23 1.08 -3.67 4.33 4.07 -0.30 -4.94 120.64 120.98 3dyo n GLU 934 Ca -0.02 0.39 -0.09 0.00 -0.06 0.00 0.00 57.16 57.37 3dyo n GLU 934 Cb 0.21 -1.92 -0.02 0.00 -0.06 0.00 0.00 31.44 29.64 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 0.13 -0.37 -0.19 4.31 2.20 -1.26 -4.91 114.94 114.85 3dyo s ASN 935 Ca 0.77 -0.36 0.00 0.00 -0.94 0.00 0.00 52.86 52.33 3dyo s ASN 935 Cb -0.90 0.65 0.00 0.00 -2.00 0.00 0.00 41.25 38.99 3dyo s ASN 935 CO 0.51 -1.14 0.00 0.61 -2.94 0.00 0.00 177.10 174.14 3dyo n GLY 936 N -0.40 0.51 3.76 0.45 0.00 -1.26 -4.82 105.19 103.43 3dyo n GLY 936 Ca -0.10 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.40 3.90 -0.04 0.99 2.96 -1.26 -4.64 118.68 120.20 3dyo s LEU 937 Ca 0.00 2.48 0.05 0.00 -0.22 0.00 0.00 54.13 56.44 3dyo s LEU 937 Cb 0.00 -4.31 -0.01 0.00 0.50 0.00 0.00 46.19 42.38 3dyo s LEU 937 CO 0.00 -1.25 -0.20 -0.13 -1.32 0.00 0.00 176.35 173.46 3dyo s ARG 938 N -2.87 1.93 0.47 1.98 3.00 -0.43 0.24 118.95 123.28 3dyo s ARG 938 Ca 0.68 -0.70 0.05 0.00 0.00 0.00 0.00 55.73 55.76 3dyo s ARG 938 Cb -0.33 -1.70 0.05 0.00 0.00 0.00 0.00 34.95 32.97 3dyo s ARG 938 CO 0.39 0.31 0.40 0.00 0.00 0.00 0.00 175.30 176.41 3dyo n GLY 940 N -0.62 -0.49 3.69 0.00 0.00 -1.18 -1.84 105.19 104.74 3dyo n GLY 940 Ca 0.01 0.07 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.87 5.10 -0.10 2.61 2.01 0.85 -3.90 115.64 119.34 3dyo s THR 941 Ca 0.29 1.09 0.21 0.00 0.31 0.00 0.00 61.69 63.58 3dyo s THR 941 Cb -0.15 -3.89 -0.24 0.00 0.01 0.00 0.00 72.50 68.23 3dyo s THR 941 CO 0.35 0.21 0.56 0.54 -0.69 0.00 0.00 174.62 175.59 3dyo n ARG 942 N 4.39 0.65 -3.71 4.92 5.12 0.71 -0.67 116.66 128.07 3dyo n ARG 942 Ca -0.04 -0.07 -0.11 0.00 -1.93 0.00 0.00 57.85 55.70 3dyo n ARG 942 Cb 0.51 -1.61 -0.11 0.00 -1.16 0.00 0.00 32.46 30.09 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 -3.27 0.41 -0.04 5.56 2.12 -1.15 -0.66 118.70 121.66 3dyo s GLU 943 Ca -0.06 0.69 0.03 0.00 0.36 0.00 0.00 54.97 55.98 3dyo s GLU 943 Cb 0.11 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.57 3dyo s GLU 943 CO 0.87 -0.12 -0.11 -1.17 -0.54 0.00 0.00 175.26 174.19 3dyo s LEU 944 N 0.97 1.72 -0.10 2.70 2.96 0.74 -0.72 118.68 126.95 3dyo s LEU 944 Ca -0.06 -0.24 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3dyo s LEU 944 Cb -0.06 -0.68 0.00 0.00 0.50 0.00 0.00 46.19 45.95 3dyo s LEU 944 CO -0.08 0.06 -0.21 0.20 -1.32 0.00 0.00 176.35 175.00 3dyo s ASN 945 N 0.37 2.84 -0.17 3.68 0.01 0.12 -0.55 114.94 121.24 3dyo s ASN 945 Ca -0.07 -0.52 -0.08 0.00 -0.71 0.00 0.00 52.86 51.48 3dyo s ASN 945 Cb -0.12 -1.30 0.07 0.00 0.41 0.00 0.00 41.25 40.31 3dyo s ASN 945 CO 0.02 0.12 0.39 -0.47 -1.51 0.00 0.00 177.10 175.65 3dyo s TYR 946 N 0.50 -0.65 0.00 2.20 5.04 -0.80 -2.25 117.35 121.38 3dyo s TYR 946 Ca -0.16 1.33 0.00 0.00 -2.44 0.00 0.00 57.07 55.80 3dyo s TYR 946 Cb -0.17 0.24 0.00 0.00 0.35 0.00 0.00 41.96 42.38 3dyo s TYR 946 CO 0.06 -0.40 0.00 0.41 -1.34 0.00 0.00 175.55 174.28 3dyo n GLY 947 N 4.84 3.03 0.13 8.97 0.00 -1.26 -0.48 105.19 120.42 3dyo n GLY 947 Ca -0.16 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 45.78 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 14.00 0.73 -3.45 1.61 -0.04 -1.26 -4.90 135.00 141.69 3dyo n PRO 948 Ca 0.00 -0.25 -0.30 0.00 -0.04 0.00 0.00 63.50 62.91 3dyo n PRO 948 Cb 0.00 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -2.44 3.46 -0.02 0.54 3.76 0.37 -1.25 115.29 119.71 3dyo s HIS 949 Ca 0.30 0.67 -0.00 0.00 -0.15 0.00 0.00 55.06 55.87 3dyo s HIS 949 Cb 0.20 -2.11 0.03 0.00 1.11 0.00 0.00 32.58 31.81 3dyo s HIS 949 CO 0.47 0.27 0.04 -1.14 -0.85 0.00 0.00 174.74 173.52 3dyo s GLN 950 N -3.15 -0.04 -0.06 1.40 0.74 0.47 -1.91 119.66 117.11 3dyo s GLN 950 Ca 0.44 0.20 0.04 0.00 0.05 0.00 0.00 55.36 56.10 3dyo s GLN 950 Cb -0.11 -0.26 -0.00 0.00 1.10 0.00 0.00 33.01 33.74 3dyo s GLN 950 CO 0.26 -0.18 -0.19 -1.58 -0.55 0.00 0.00 175.29 173.05 3dyo s TRP 951 N 1.13 1.98 0.08 1.67 0.51 0.28 -0.34 118.94 124.26 3dyo s TRP 951 Ca -0.08 -0.65 0.07 0.00 -2.12 0.00 0.00 56.10 53.31 3dyo s TRP 951 Cb -0.13 -1.34 -0.03 0.00 -0.81 0.00 0.00 33.47 31.16 3dyo s TRP 951 CO -0.03 -0.24 -0.17 1.03 -0.51 0.00 0.00 176.95 177.03 3dyo s ARG 952 N 0.14 0.97 0.00 4.98 0.52 -0.78 -0.18 118.95 124.61 3dyo s ARG 952 Ca -0.08 -1.05 0.00 0.00 -0.52 0.00 0.00 55.73 54.08 3dyo s ARG 952 Cb -0.14 -1.10 0.00 0.00 0.52 0.00 0.00 34.95 34.23 3dyo s ARG 952 CO 0.04 0.25 0.00 0.41 0.02 0.00 0.00 175.30 176.02 3dyo n GLY 953 N 1.21 -0.42 2.75 -3.53 0.00 0.16 -1.61 105.19 103.76 3dyo n GLY 953 Ca -0.20 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 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 0.77 0.23 1.61 2.15 -1.23 -4.16 116.67 112.03 3dyo s ASP 954 Ca 0.00 -1.73 0.01 0.00 0.43 0.00 0.00 52.55 51.26 3dyo s ASP 954 Cb 0.00 0.66 -0.00 0.00 -0.30 0.00 0.00 42.92 43.28 3dyo s ASP 954 CO 0.00 -0.22 0.28 2.22 -0.17 0.00 0.00 175.17 177.28 3dyo n PHE 955 N 3.96 -0.93 -4.48 -5.34 1.16 0.15 -4.86 117.46 107.12 3dyo n PHE 955 Ca 0.14 -1.66 -0.30 0.00 -1.87 0.00 0.00 57.45 53.76 3dyo n PHE 955 Cb 0.47 0.31 -0.12 0.00 -1.61 0.00 0.00 39.48 38.53 3dyo n PHE 955 CO 0.00 0.00 0.00 1.14 -1.87 0.00 0.00 176.76 176.03 3dyo s GLN 956 N -2.65 1.80 0.16 3.97 0.00 0.35 -0.10 119.66 123.18 3dyo s GLN 956 Ca 0.22 -1.15 -0.15 0.00 -0.00 0.00 0.00 55.36 54.28 3dyo s GLN 956 Cb -0.00 -2.08 0.02 0.00 0.00 0.00 0.00 33.01 30.95 3dyo s GLN 956 CO 0.15 0.49 0.42 -0.59 0.00 0.00 0.00 175.29 175.77 3dyo s PHE 957 N -1.03 -0.06 0.02 9.60 -0.12 -0.04 0.01 117.98 126.36 3dyo s PHE 957 Ca 0.16 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 56.76 3dyo s PHE 957 Cb -0.10 0.25 -0.02 0.00 -0.63 0.00 0.00 43.02 42.52 3dyo s PHE 957 CO 0.07 -0.78 -0.03 0.54 -0.05 0.00 0.00 175.22 174.97 3dyo s ASN 958 N -2.86 0.26 -0.12 1.98 2.20 -0.43 -1.32 114.94 114.65 3dyo s ASN 958 Ca 0.08 -0.48 -0.06 0.00 -0.94 0.00 0.00 52.86 51.46 3dyo s ASN 958 Cb 0.01 0.09 0.05 0.00 -2.00 0.00 0.00 41.25 39.40 3dyo s ASN 958 CO -0.06 -0.28 0.28 -0.51 -2.94 0.00 0.00 177.10 173.59 3dyo s ILE 959 N -1.38 -0.04 0.04 0.54 2.07 -1.26 -0.81 121.20 120.36 3dyo s ILE 959 Ca -0.15 0.14 -0.16 0.00 -1.41 0.00 0.00 60.65 59.07 3dyo s ILE 959 Cb -0.09 -0.43 0.05 0.00 0.13 0.00 0.00 42.46 42.12 3dyo s ILE 959 CO -0.01 0.06 0.72 -1.54 -1.91 0.00 0.00 174.94 172.26 3dyo n SER 960 N 4.25 -0.88 -1.22 4.50 3.41 -0.94 -4.52 113.62 118.22 3dyo n SER 960 Ca -0.25 -1.33 0.08 0.00 -0.26 0.00 0.00 58.87 57.11 3dyo n SER 960 Cb 0.53 1.41 0.27 0.00 -0.26 0.00 0.00 64.21 66.16 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 -0.52 2.84 -5.16 4.33 5.12 -1.26 -0.50 116.66 121.52 3dyo n ARG 961 Ca 0.01 -2.18 -0.31 0.00 -1.93 0.00 0.00 57.85 53.44 3dyo n ARG 961 Cb 0.36 -1.64 -0.17 0.00 -1.16 0.00 0.00 32.46 29.85 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 -1.57 2.44 0.76 -1.55 1.51 -1.26 0.82 117.35 118.50 3dyo s TYR 962 Ca 0.40 -0.98 -0.12 0.00 -1.01 0.00 0.00 57.07 55.36 3dyo s TYR 962 Cb 0.24 -1.64 0.05 0.00 -0.11 0.00 0.00 41.96 40.50 3dyo s TYR 962 CO 0.22 -0.40 1.10 -1.54 -1.11 0.00 0.00 175.55 173.83 3dyo s SER 963 N 0.35 4.88 0.39 2.29 1.04 -1.26 -4.83 113.70 116.56 3dyo s SER 963 Ca -0.18 1.18 0.08 0.00 0.48 0.00 0.00 55.95 57.51 3dyo s SER 963 Cb -0.18 -1.93 0.79 0.00 0.10 0.00 0.00 66.02 64.81 3dyo s SER 963 CO 0.08 -1.71 1.96 1.56 0.98 0.00 0.00 173.24 176.12 3dyo h GLN 964 N -0.91 0.39 -0.56 4.02 1.08 -1.99 -0.85 115.11 116.29 3dyo h GLN 964 Ca -0.46 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 56.66 3dyo h GLN 964 Cb 1.27 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.60 3dyo h GLN 964 CO 0.62 0.39 0.28 0.37 -0.95 0.00 0.00 178.83 179.54 3dyo h GLN 965 N 0.39 0.81 -0.40 1.46 4.15 -1.99 -0.51 115.11 119.02 3dyo h GLN 965 Ca 0.09 -0.12 -0.05 0.00 0.77 0.00 0.00 58.65 59.34 3dyo h GLN 965 Cb 0.20 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 3dyo h GLN 965 CO 0.00 0.66 0.04 0.37 -1.93 0.00 0.00 178.83 177.97 3dyo h GLN 966 N 0.76 0.68 -0.56 1.69 4.15 -1.75 -1.53 115.11 118.56 3dyo h GLN 966 Ca 0.19 -0.20 0.04 0.00 0.77 0.00 0.00 58.65 59.46 3dyo h GLN 966 Cb 0.11 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.69 3dyo h GLN 966 CO -0.03 0.74 0.31 -0.07 -1.93 0.00 0.00 178.83 177.86 3dyo h LEU 967 N 0.52 0.48 -0.99 -2.39 3.38 -0.74 -1.96 115.31 113.60 3dyo h LEU 967 Ca 0.12 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.02 3dyo h LEU 967 Cb 0.41 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3dyo h LEU 967 CO 0.01 0.33 -0.39 0.00 0.09 0.00 0.00 178.44 178.48 3dyo h MET 968 N 0.61 0.00 -0.09 1.13 -0.00 -0.97 -2.81 114.93 112.79 3dyo h MET 968 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.94 3dyo h MET 968 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.69 3dyo h MET 968 CO -0.13 0.39 0.00 0.39 -0.00 0.00 0.00 176.91 177.56 3dyo n GLU 969 N -3.62 1.85 -4.54 -0.10 1.02 -0.59 -4.86 120.64 109.81 3dyo n GLU 969 Ca -0.01 -1.26 -0.33 0.00 -0.02 0.00 0.00 57.16 55.55 3dyo n GLU 969 Cb 0.50 -1.46 -0.16 0.00 -0.02 0.00 0.00 31.44 30.31 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 -1.90 2.53 -0.92 2.62 2.01 -0.78 -5.01 115.64 114.19 3dyo s THR 970 Ca 0.35 -0.81 0.25 0.00 0.31 0.00 0.00 61.69 61.79 3dyo s THR 970 Cb 0.20 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.70 3dyo s THR 970 CO 0.31 0.52 1.46 -1.54 -0.69 0.00 0.00 174.62 174.68 3dyo n SER 971 N 4.09 0.48 -3.85 3.53 3.41 -1.26 -4.19 113.62 115.83 3dyo n SER 971 Ca -0.19 -0.07 -0.15 0.00 -0.26 0.00 0.00 58.87 58.20 3dyo n SER 971 Cb 0.52 0.13 -0.15 0.00 -0.26 0.00 0.00 64.21 64.45 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 -3.04 0.18 0.37 7.33 3.76 -1.26 -4.36 115.29 118.28 3dyo s HIS 972 Ca 0.10 0.01 0.08 0.00 -0.15 0.00 0.00 55.06 55.10 3dyo s HIS 972 Cb 0.17 -0.23 0.80 0.00 1.11 0.00 0.00 32.58 34.43 3dyo s HIS 972 CO 0.68 -0.06 1.94 0.07 -0.85 0.00 0.00 174.74 176.52 3dyo h ARG 973 N 6.70 0.67 0.00 1.40 0.11 -1.13 -1.24 114.38 120.89 3dyo h ARG 973 Ca -0.35 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 59.69 3dyo h ARG 973 Cb 1.16 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.09 3dyo h ARG 973 CO 0.49 0.44 0.00 -2.39 0.10 0.00 0.00 179.97 178.61 3dyo n HIS 974 N -4.50 0.26 1.22 4.08 1.44 -1.26 -1.92 115.22 114.54 3dyo n HIS 974 Ca 0.12 0.11 0.13 0.00 -2.01 0.00 0.00 57.72 56.07 3dyo n HIS 974 Cb 0.31 -0.67 0.33 0.00 0.12 0.00 0.00 29.99 30.08 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 -1.74 2.20 -4.84 2.39 4.77 -0.47 -4.93 117.00 114.38 3dyo n LEU 975 Ca 0.02 -0.76 -0.32 0.00 -0.03 0.00 0.00 56.01 54.92 3dyo n LEU 975 Cb 0.16 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.18 3dyo n LEU 975 CO 0.13 0.38 0.63 -0.76 -1.33 0.00 0.00 177.39 176.44 3dyo s LEU 976 N -1.94 3.76 0.00 2.23 1.43 -0.81 -5.04 118.68 118.30 3dyo s LEU 976 Ca 0.34 1.53 0.03 0.00 -1.03 0.00 0.00 54.13 55.00 3dyo s LEU 976 Cb 0.20 -4.43 -0.01 0.00 0.03 0.00 0.00 46.19 41.99 3dyo s LEU 976 CO 0.32 -0.48 -0.10 -1.38 0.23 0.00 0.00 176.35 174.93 3dyo s HIS 977 N -2.44 0.89 0.23 0.29 -3.43 -1.26 -5.10 115.29 104.47 3dyo s HIS 977 Ca 0.58 -0.20 -0.32 0.00 -0.80 0.00 0.00 55.06 54.33 3dyo s HIS 977 Cb -0.10 -0.57 -0.12 0.00 -1.43 0.00 0.00 32.58 30.36 3dyo s HIS 977 CO 0.26 -0.01 1.65 0.00 -2.00 0.00 0.00 174.74 174.63 3dyo n ALA 978 N 2.67 2.48 -1.99 -1.38 0.00 -1.26 -4.81 120.51 116.21 3dyo n ALA 978 Ca -0.14 0.40 -0.24 0.00 0.00 0.00 0.00 53.44 53.45 3dyo n ALA 978 Cb 0.56 -2.47 0.12 0.00 0.00 0.00 0.00 19.45 17.66 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 0.47 1.50 0.37 0.00 2.02 0.24 -5.03 118.70 118.27 3dyo s GLU 979 Ca 0.71 -1.04 -0.27 0.00 0.02 0.00 0.00 54.97 54.39 3dyo s GLU 979 Cb -0.53 -2.26 -0.09 0.00 0.10 0.00 0.00 34.13 31.35 3dyo s GLU 979 CO 0.39 -1.61 1.21 -2.00 0.02 0.00 0.00 175.26 173.28 3dyo s GLU 980 N -5.25 4.20 1.44 1.61 2.12 -1.26 -4.74 118.70 116.81 3dyo s GLU 980 Ca 0.68 1.98 0.00 0.00 0.36 0.00 0.00 54.97 57.98 3dyo s GLU 980 Cb -0.05 -2.86 0.00 0.00 0.26 0.00 0.00 34.13 31.48 3dyo s GLU 980 CO 0.46 -0.23 0.00 0.41 -0.54 0.00 0.00 175.26 175.35 3dyo n GLY 981 N 0.76 -1.59 3.09 -1.50 0.00 -1.26 -4.83 105.19 99.86 3dyo n GLY 981 Ca 0.02 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 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 1.61 -0.24 2.61 2.01 -0.71 -4.75 115.64 116.19 3dyo s THR 982 Ca 0.00 -0.72 -0.21 0.00 0.31 0.00 0.00 61.69 61.07 3dyo s THR 982 Cb 0.00 -1.46 -0.02 0.00 0.01 0.00 0.00 72.50 71.04 3dyo s THR 982 CO 0.00 0.46 0.66 0.26 -0.69 0.00 0.00 174.62 175.32 3dyo s TRP 983 N 0.87 3.31 -0.15 4.92 0.52 0.35 -0.00 118.94 128.76 3dyo s TRP 983 Ca -0.08 0.90 -0.01 0.00 0.02 0.00 0.00 56.10 56.93 3dyo s TRP 983 Cb -0.15 -2.86 -0.01 0.00 -1.15 0.00 0.00 33.47 29.29 3dyo s TRP 983 CO -0.00 -0.30 -0.12 -1.17 0.02 0.00 0.00 176.95 175.38 3dyo s LEU 984 N 2.40 2.71 -0.23 2.99 2.96 -0.05 -2.22 118.68 127.24 3dyo s LEU 984 Ca 0.28 -0.37 -0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3dyo s LEU 984 Cb -0.16 -1.63 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 3dyo s LEU 984 CO 0.09 0.11 -0.02 0.20 -1.32 0.00 0.00 176.35 175.41 3dyo s ASN 985 N 0.67 4.44 -0.17 3.68 0.01 0.01 -1.75 114.94 121.83 3dyo s ASN 985 Ca -0.06 -0.41 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 3dyo s ASN 985 Cb -0.15 -1.76 0.04 0.00 0.41 0.00 0.00 41.25 39.78 3dyo s ASN 985 CO 0.02 -0.04 -0.08 -0.51 -1.51 0.00 0.00 177.10 174.98 3dyo s ILE 986 N 1.49 1.33 -0.10 0.60 2.07 -0.37 -1.31 121.20 124.90 3dyo s ILE 986 Ca 0.05 -0.73 0.00 0.00 -1.41 0.00 0.00 60.65 58.57 3dyo s ILE 986 Cb -0.15 -1.43 -0.02 0.00 0.13 0.00 0.00 42.46 40.99 3dyo s ILE 986 CO -0.02 0.20 -0.09 -1.81 -1.91 0.00 0.00 174.94 171.31 3dyo s ASP 987 N 1.54 4.42 0.12 4.50 1.01 0.10 -0.96 116.67 127.41 3dyo s ASP 987 Ca 0.01 -0.15 -0.09 0.00 0.71 0.00 0.00 52.55 53.03 3dyo s ASP 987 Cb -0.15 -1.36 -0.11 0.00 1.01 0.00 0.00 42.92 42.32 3dyo s ASP 987 CO -0.08 0.27 1.32 1.23 0.21 0.00 0.00 175.17 178.11 3dyo h GLY 988 N 5.94 0.68 -4.70 0.21 0.00 -0.97 0.10 103.07 104.33 3dyo h GLY 988 Ca -0.39 -1.04 -0.15 0.00 0.00 0.00 0.00 47.33 45.75 3dyo h GLY 988 CO 0.55 0.93 -0.55 -1.36 0.00 0.00 0.00 176.54 176.11 3dyo s PHE 989 N -3.55 0.13 -0.11 5.60 0.40 -0.76 -4.68 117.98 114.99 3dyo s PHE 989 Ca -0.08 -0.30 -0.09 0.00 -0.60 0.00 0.00 56.93 55.86 3dyo s PHE 989 Cb 0.09 -0.10 0.04 0.00 0.51 0.00 0.00 43.02 43.55 3dyo s PHE 989 CO 0.89 -0.27 0.29 -1.58 0.70 0.00 0.00 175.22 175.24 3dyo s HIS 990 N -1.59 -0.35 0.67 0.36 2.46 -1.26 -0.86 115.29 114.72 3dyo s HIS 990 Ca -0.14 0.84 -0.15 0.00 0.47 0.00 0.00 55.06 56.08 3dyo s HIS 990 Cb -0.07 0.11 0.01 0.00 -0.13 0.00 0.00 32.58 32.49 3dyo s HIS 990 CO -0.00 -0.20 1.12 1.41 -2.47 0.00 0.00 174.74 174.60 3dyo s MET 991 N 0.60 2.71 0.99 2.88 1.75 0.81 -4.74 119.30 124.30 3dyo s MET 991 Ca -0.04 1.42 -0.11 0.00 -1.25 0.00 0.00 55.69 55.72 3dyo s MET 991 Cb -0.05 -1.94 0.19 0.00 2.84 0.00 0.00 34.83 35.87 3dyo s MET 991 CO -0.04 -1.32 1.10 0.20 -0.65 0.00 0.00 175.02 174.31 3dyo s GLY 992 N -2.55 1.63 -0.00 2.11 0.00 -0.50 -4.74 107.32 103.27 3dyo s GLY 992 Ca 0.68 0.29 0.22 0.00 0.00 0.00 0.00 44.72 45.90 3dyo s GLY 992 CO 0.42 0.81 0.76 0.29 0.00 0.00 0.00 173.10 175.38 3dyo n ILE 993 N -4.41 0.02 -4.74 0.90 -5.35 -1.26 -4.94 119.36 99.58 3dyo n ILE 993 Ca 0.08 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 3dyo n ILE 993 Cb 0.53 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.95 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 1.39 -0.00 0.00 3.28 0.00 -1.26 -4.75 105.19 103.85 3dyo n GLY 994 Ca 0.01 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.26 0.46 -0.02 0.00 -1.26 -0.05 105.19 104.07 3dyo n GLY 995 Ca 0.00 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.29 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 0.20 -5.17 1.61 3.32 -1.80 -1.58 116.42 112.99 3dyo h ASP 996 Ca 0.00 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3dyo h ASP 996 Cb 0.00 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.46 3dyo h ASP 996 CO 0.00 0.05 -0.04 1.51 -1.72 0.00 0.00 179.24 179.04 3dyo s ASP 997 N -5.37 -0.14 -0.23 6.45 1.47 -1.26 -4.19 116.67 113.40 3dyo s ASP 997 Ca -0.07 -0.80 0.10 0.00 1.18 0.00 0.00 52.55 52.97 3dyo s ASP 997 Cb 0.23 0.61 0.43 0.00 -0.34 0.00 0.00 42.92 43.85 3dyo s ASP 997 CO 0.79 -1.16 1.23 -1.20 0.68 0.00 0.00 175.17 175.52 3dyo n SER 998 N -0.38 2.23 0.00 2.11 7.64 -1.26 -4.65 113.62 119.31 3dyo n SER 998 Ca -0.04 -3.88 0.00 0.00 1.01 0.00 0.00 58.87 55.96 3dyo n SER 998 Cb 0.61 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 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 -1.06 0.00 -3.87 1.43 2.14 -1.26 -4.21 117.44 110.62 3dyo n TRP 999 Ca 0.23 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.70 3dyo n TRP 999 Cb 0.75 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 31.16 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 -0.04 0.06 0.11 -0.67 1.04 -1.26 -4.47 113.70 108.47 3dyo s SER 1000Ca 0.00 -0.36 -0.36 0.00 0.48 0.00 0.00 55.95 55.71 3dyo s SER 1000Cb 0.00 0.26 -0.16 0.00 0.10 0.00 0.00 66.02 66.22 3dyo s SER 1000CO 0.00 -0.51 1.38 -2.65 0.98 0.00 0.00 173.24 172.44 3dyo n PRO 1001N 0.85 1.40 0.00 4.02 -0.02 -1.26 -4.80 135.00 135.19 3dyo n PRO 1001Ca -0.20 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 3dyo n PRO 1001Cb 0.58 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 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 2.68 0.83 -4.63 2.55 3.41 -1.26 -5.01 113.62 112.18 3dyo n SER 1002Ca 0.18 -1.36 -0.43 0.00 -0.26 0.00 0.00 58.87 57.00 3dyo n SER 1002Cb 0.22 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 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 -0.36 4.64 0.74 -3.33 1.01 -1.26 -4.36 120.40 117.48 3dyo s VAL 1003Ca 0.00 1.61 -0.15 0.00 0.00 0.00 0.00 61.98 63.43 3dyo s VAL 1003Cb 0.00 -4.30 0.04 0.00 0.00 0.00 0.00 36.38 32.12 3dyo s VAL 1003CO 0.00 -0.34 1.24 -0.55 0.00 0.00 0.00 175.10 175.45 3dyo s SER 1004N 1.55 4.06 0.36 3.32 0.15 -1.26 -4.82 113.70 117.06 3dyo s SER 1004Ca 0.41 2.46 0.06 0.00 0.70 0.00 0.00 55.95 59.57 3dyo s SER 1004Cb -0.13 -2.60 0.74 0.00 -1.71 0.00 0.00 66.02 62.31 3dyo s SER 1004CO 0.12 -2.36 1.94 0.00 1.20 0.00 0.00 173.24 174.15 3dyo h ALA 1005N -0.28 1.71 0.00 5.45 0.00 -1.96 0.10 119.26 124.29 3dyo h ALA 1005Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3dyo h ALA 1005Cb 1.31 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3dyo h ALA 1005CO 0.49 0.15 0.00 -0.85 0.00 0.00 0.00 179.25 179.05 3dyo n GLU 1006N -4.49 0.11 -0.19 0.00 0.00 -1.26 -1.78 120.64 113.03 3dyo n GLU 1006Ca 0.12 0.46 0.06 0.00 0.00 0.00 0.00 57.16 57.80 3dyo n GLU 1006Cb 0.26 -1.77 0.16 0.00 0.00 0.00 0.00 31.44 30.10 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 -1.99 0.50 -3.70 -1.84 3.01 0.01 -4.97 117.46 108.48 3dyo n PHE 1007Ca 0.01 -0.52 -0.31 0.00 1.01 0.00 0.00 57.45 57.64 3dyo n PHE 1007Cb 0.13 -0.04 -0.04 0.00 -0.01 0.00 0.00 39.48 39.51 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 -1.11 3.58 -1.27 -1.08 -0.21 -0.73 -1.41 119.66 117.42 3dyo s GLN 1008Ca 0.25 -0.17 -0.13 0.00 0.02 0.00 0.00 55.36 55.33 3dyo s GLN 1008Cb 0.14 -2.87 0.14 0.00 1.00 0.00 0.00 33.01 31.42 3dyo s GLN 1008CO 0.16 0.47 1.72 1.28 -2.12 0.00 0.00 175.29 176.79 3dyo n LEU 1009N -0.01 5.85 -0.60 2.90 4.77 -1.26 -4.69 117.00 123.94 3dyo n LEU 1009Ca -0.03 -4.41 0.07 0.00 -0.03 0.00 0.00 56.01 51.60 3dyo n LEU 1009Cb 0.52 -1.59 0.17 0.00 -2.33 0.00 0.00 43.42 40.19 3dyo n LEU 1009CO 0.49 0.91 0.64 -1.54 -1.33 0.00 0.00 177.39 176.56 3dyo n SER 1010N 5.47 3.13 0.11 -1.43 3.41 -1.26 -4.38 113.62 118.66 3dyo n SER 1010Ca 0.41 -2.50 0.11 0.00 -0.26 0.00 0.00 58.87 56.64 3dyo n SER 1010Cb 0.41 -0.34 0.46 0.00 -0.26 0.00 0.00 64.21 64.47 3dyo n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo n ALA 1011N -0.19 1.66 0.00 7.33 0.00 -1.26 -4.89 120.51 123.16 3dyo n ALA 1011Ca 0.14 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3dyo n ALA 1011Cb 0.60 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3dyo n ALA 1011CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyo n GLY 1012N -0.01 1.40 3.03 0.00 0.00 -1.26 -4.88 105.19 103.47 3dyo n GLY 1012Ca 0.02 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 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 1.79 0.06 1.61 0.52 -1.26 -0.65 118.95 121.02 3dyo s ARG 1013Ca 0.00 -0.44 0.06 0.00 -0.52 0.00 0.00 55.73 54.83 3dyo s ARG 1013Cb 0.00 -1.49 -0.03 0.00 0.52 0.00 0.00 34.95 33.95 3dyo s ARG 1013CO 0.00 0.02 -0.16 0.71 0.02 0.00 0.00 175.30 175.89 3dyo s TYR 1014N 0.72 1.37 -0.01 -0.53 1.51 0.11 -4.98 117.35 115.54 3dyo s TYR 1014Ca -0.13 -0.41 0.04 0.00 -1.01 0.00 0.00 57.07 55.55 3dyo s TYR 1014Cb -0.16 -0.79 -0.01 0.00 -0.11 0.00 0.00 41.96 40.90 3dyo s TYR 1014CO 0.03 0.08 -0.12 -1.58 -1.11 0.00 0.00 175.55 172.85 3dyo s HIS 1015N -1.07 1.08 0.03 2.71 2.46 -1.26 -0.95 115.29 118.29 3dyo s HIS 1015Ca 0.02 -0.22 -0.14 0.00 0.47 0.00 0.00 55.06 55.19 3dyo s HIS 1015Cb -0.09 -0.70 0.02 0.00 -0.13 0.00 0.00 32.58 31.68 3dyo s HIS 1015CO 0.02 -0.04 0.31 1.52 -2.47 0.00 0.00 174.74 174.08 3dyo s TYR 1016N -0.20 -0.12 -0.03 3.88 -0.85 -0.15 -5.01 117.35 114.87 3dyo s TYR 1016Ca 0.03 0.02 -0.04 0.00 -0.52 0.00 0.00 57.07 56.57 3dyo s TYR 1016Cb -0.05 0.10 0.01 0.00 0.38 0.00 0.00 41.96 42.39 3dyo s TYR 1016CO -0.00 -0.48 0.10 1.14 -1.52 0.00 0.00 175.55 174.79 3dyo s GLN 1017N -2.33 0.19 0.00 -3.49 -2.07 -1.26 -0.25 119.66 110.45 3dyo s GLN 1017Ca -0.07 0.02 0.01 0.00 -1.82 0.00 0.00 55.36 53.51 3dyo s GLN 1017Cb -0.02 0.09 -0.01 0.00 -1.09 0.00 0.00 33.01 31.98 3dyo s GLN 1017CO -0.02 -0.03 -0.05 -0.51 -1.32 0.00 0.00 175.29 173.36 3dyo s LEU 1018N -0.26 2.03 -0.21 2.60 1.43 0.03 -4.33 118.68 119.98 3dyo s LEU 1018Ca -0.03 -0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 52.88 3dyo s LEU 1018Cb -0.02 -0.23 -0.03 0.00 0.03 0.00 0.00 46.19 45.94 3dyo s LEU 1018CO 0.00 0.03 0.01 -0.69 0.23 0.00 0.00 176.35 175.94 3dyo s VAL 1019N -0.23 4.05 -0.19 -1.59 1.01 -0.63 0.27 120.40 123.09 3dyo s VAL 1019Ca 0.01 -0.28 -0.05 0.00 0.00 0.00 0.00 61.98 61.66 3dyo s VAL 1019Cb -0.03 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3dyo s VAL 1019CO -0.00 0.42 -0.01 0.86 0.00 0.00 0.00 175.10 176.36 3dyo s TRP 1020N 1.06 3.03 0.17 5.22 -0.11 0.17 -1.86 118.94 126.63 3dyo s TRP 1020Ca 0.02 -0.41 -0.04 0.00 1.22 0.00 0.00 56.10 56.89 3dyo s TRP 1020Cb -0.14 -2.04 -0.03 0.00 -1.50 0.00 0.00 33.47 29.76 3dyo s TRP 1020CO 0.02 -0.17 0.18 0.00 -4.62 0.00 0.00 176.95 172.35 3dyo s GLN 1022N -4.06 1.92 0.00 0.00 1.03 -1.26 -0.39 119.66 116.90 3dyo s GLN 1022Ca 0.27 -1.08 0.00 0.00 0.04 0.00 0.00 55.36 54.59 3dyo s GLN 1022Cb 0.05 -2.14 0.00 0.00 0.03 0.00 0.00 33.01 30.96 3dyo s GLN 1022CO 0.05 0.51 0.00 0.36 -2.54 0.00 0.00 175.29 173.67