#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyo s ARG 14 N 0.00 3.67 0.57 5.56 0.52 -1.26 -4.83 118.95 123.19 3dyo s ARG 14 Ca 0.00 -3.13 0.27 0.00 -0.52 0.00 0.00 55.73 52.36 3dyo s ARG 14 Cb 0.00 -4.25 1.56 0.00 0.52 0.00 0.00 34.95 32.78 3dyo s ARG 14 CO 0.00 -1.25 2.05 -0.44 0.02 0.00 0.00 175.30 175.68 3dyo h ASP 15 N 6.54 0.00 0.00 0.23 3.32 -1.94 -1.82 116.42 122.75 3dyo h ASP 15 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3dyo h ASP 15 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 3dyo h ASP 15 CO 0.90 0.00 0.00 -2.67 -1.72 0.00 0.00 179.24 175.75 3dyo n TRP 16 N -3.93 0.00 -2.47 4.55 2.14 -1.26 -2.62 117.44 113.84 3dyo n TRP 16 Ca 0.04 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.54 3dyo n TRP 16 Cb 0.42 0.00 0.05 0.00 -0.81 0.00 0.00 31.31 30.97 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 -1.00 2.17 -3.43 -2.67 1.02 -0.68 -1.08 120.64 114.97 3dyo n GLU 17 Ca 0.15 -3.57 -0.17 0.00 -0.02 0.00 0.00 57.16 53.55 3dyo n GLU 17 Cb 0.07 -1.68 -0.11 0.00 -0.02 0.00 0.00 31.44 29.70 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 -3.54 1.49 0.00 1.62 2.47 -1.08 -4.77 114.94 111.13 3dyo s ASN 18 Ca 0.36 -0.48 0.24 0.00 0.42 0.00 0.00 52.86 53.40 3dyo s ASN 18 Cb 0.36 0.49 1.37 0.00 -1.45 0.00 0.00 41.25 42.02 3dyo s ASN 18 CO -0.03 -0.36 1.79 -0.81 -3.72 0.00 0.00 177.10 173.97 3dyo n PRO 19 N 5.32 0.66 0.00 0.43 -0.04 -1.26 -1.67 135.00 138.44 3dyo n PRO 19 Ca -0.04 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.57 3dyo n PRO 19 Cb 0.48 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.85 3dyo n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dyo n GLY 20 N 0.53 -1.37 2.73 0.55 0.00 -1.26 -4.32 105.19 102.05 3dyo n GLY 20 Ca 0.16 -0.23 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 3dyo n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dyo s VAL 21 N -3.01 0.52 -0.91 1.61 1.01 -0.67 -4.95 120.40 114.00 3dyo s VAL 21 Ca 0.12 -0.59 0.12 0.00 0.00 0.00 0.00 61.98 61.63 3dyo s VAL 21 Cb 0.18 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 3dyo s VAL 21 CO 0.63 -0.24 0.64 0.35 0.00 0.00 0.00 175.10 176.47 3dyo n THR 22 N 5.05 0.00 -3.60 3.92 -2.24 -1.26 -4.75 114.28 111.39 3dyo n THR 22 Ca -0.09 -0.31 -0.03 0.00 -2.27 0.00 0.00 64.05 61.35 3dyo n THR 22 Cb 0.47 1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 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 -1.80 0.31 -0.08 -0.78 1.03 -1.26 -1.03 119.66 116.05 3dyo s GLN 23 Ca 0.08 -0.13 -0.03 0.00 0.04 0.00 0.00 55.36 55.32 3dyo s GLN 23 Cb 0.10 0.13 0.04 0.00 0.03 0.00 0.00 33.01 33.31 3dyo s GLN 23 CO 0.38 -0.14 0.16 -0.51 -2.54 0.00 0.00 175.29 172.65 3dyo s LEU 24 N -2.34 0.36 -0.67 2.60 1.43 -0.44 -4.84 118.68 114.78 3dyo s LEU 24 Ca 0.11 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.54 3dyo s LEU 24 Cb 0.00 0.37 0.00 0.00 0.03 0.00 0.00 46.19 46.59 3dyo s LEU 24 CO -0.04 -0.19 0.00 0.59 0.23 0.00 0.00 176.35 176.94 3dyo n ASN 25 N 4.67 -4.63 -4.83 2.29 3.02 -1.26 -1.91 115.26 112.61 3dyo n ASN 25 Ca -0.18 0.16 -0.33 0.00 -0.03 0.00 0.00 54.58 54.20 3dyo n ASN 25 Cb 0.51 -2.69 -0.06 0.00 -0.61 0.00 0.00 39.78 36.93 3dyo n ASN 25 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3dyo s ARG 26 N -2.14 4.13 0.57 3.52 3.52 -1.26 -4.73 118.95 122.56 3dyo s ARG 26 Ca 0.00 0.87 -0.14 0.00 -0.13 0.00 0.00 55.73 56.34 3dyo s ARG 26 Cb 0.00 -2.38 -0.05 0.00 -1.56 0.00 0.00 34.95 30.95 3dyo s ARG 26 CO 0.00 0.11 1.01 -0.51 -0.81 0.00 0.00 175.30 175.10 3dyo s LEU 27 N -2.95 3.43 0.65 -0.88 1.43 0.17 -5.01 118.68 115.52 3dyo s LEU 27 Ca 0.56 1.54 -0.18 0.00 -1.03 0.00 0.00 54.13 55.02 3dyo s LEU 27 Cb -0.11 -4.50 -0.02 0.00 0.03 0.00 0.00 46.19 41.60 3dyo s LEU 27 CO 0.16 -0.80 1.07 0.00 0.23 0.00 0.00 176.35 177.01 3dyo n ALA 28 N -2.17 0.40 -1.84 4.21 0.00 -1.26 -4.67 120.51 115.18 3dyo n ALA 28 Ca 0.07 -0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 3dyo n ALA 28 Cb 0.54 -2.18 0.05 0.00 0.00 0.00 0.00 19.45 17.85 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 -1.55 2.84 0.02 0.00 0.00 -1.26 -4.99 121.76 116.83 3dyo s ALA 29 Ca 0.78 -0.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.15 3dyo s ALA 29 Cb -0.39 -3.04 0.11 0.00 0.00 0.00 0.00 23.12 19.80 3dyo s ALA 29 CO 0.45 -1.16 1.23 -3.38 0.00 0.00 0.00 175.76 172.89 3dyo s HIS 30 N -3.32 -0.05 0.83 0.00 -3.43 -1.26 -4.88 115.29 103.18 3dyo s HIS 30 Ca 0.58 -0.09 -0.11 0.00 -0.80 0.00 0.00 55.06 54.64 3dyo s HIS 30 Cb -0.11 0.57 0.09 0.00 -1.43 0.00 0.00 32.58 31.69 3dyo s HIS 30 CO 0.52 -0.38 1.09 -2.14 -2.00 0.00 0.00 174.74 171.83 3dyo s PRO 31 N -2.56 1.77 0.08 -0.38 0.02 -1.11 -4.23 135.00 128.58 3dyo s PRO 31 Ca 0.14 1.00 -0.35 0.00 0.02 0.00 0.00 61.00 61.81 3dyo s PRO 31 Cb 0.03 -1.85 -0.15 0.00 0.02 0.00 0.00 34.50 32.55 3dyo s PRO 31 CO -0.03 -1.94 1.53 -2.30 -0.33 0.00 0.00 177.00 173.93 3dyo n PRO 32 N -3.70 1.72 -4.45 5.54 -0.02 -1.26 -4.98 135.00 127.84 3dyo n PRO 32 Ca 0.08 0.62 -0.24 0.00 -2.02 0.00 0.00 63.50 61.94 3dyo n PRO 32 Cb 0.54 -2.34 -0.10 0.00 -0.02 0.00 0.00 33.50 31.58 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 1.22 2.34 0.00 6.00 2.99 -1.26 -4.79 117.98 124.48 3dyo s PHE 33 Ca 0.83 -0.32 0.00 0.00 0.00 0.00 0.00 56.93 57.44 3dyo s PHE 33 Cb -0.81 -1.03 0.00 0.00 0.00 0.00 0.00 43.02 41.19 3dyo s PHE 33 CO 0.44 0.70 0.00 0.00 -0.00 0.00 0.00 175.22 176.37 3dyo n ALA 34 N -0.66 0.00 -3.97 5.36 0.00 -1.26 -5.04 120.51 114.94 3dyo n ALA 34 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.05 3dyo n ALA 34 Cb 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.04 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 -2.45 -4.78 0.00 2.88 -1.26 -4.22 113.62 103.80 3dyo n SER 35 Ca 0.00 -1.13 -0.35 0.00 -1.33 0.00 0.00 58.87 56.06 3dyo n SER 35 Cb 0.01 -2.55 -0.00 0.00 -0.75 0.00 0.00 64.21 60.92 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 -3.79 2.75 -0.61 0.66 0.51 -0.89 -4.50 118.94 113.07 3dyo s TRP 36 Ca 0.26 1.55 0.08 0.00 -2.12 0.00 0.00 56.10 55.86 3dyo s TRP 36 Cb -0.12 -3.27 0.22 0.00 -0.81 0.00 0.00 33.47 29.49 3dyo s TRP 36 CO 0.92 -1.46 1.18 0.54 -0.51 0.00 0.00 176.95 177.62 3dyo n ARG 37 N -1.13 2.90 -3.74 4.98 5.12 -1.26 -0.86 116.66 122.68 3dyo n ARG 37 Ca 0.11 -1.90 -0.18 0.00 -1.93 0.00 0.00 57.85 53.94 3dyo n ARG 37 Cb 0.51 -1.20 -0.17 0.00 -1.16 0.00 0.00 32.46 30.44 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 -1.04 0.67 0.28 0.55 3.84 -1.26 -4.96 114.94 113.02 3dyo s ASN 38 Ca 0.16 0.05 -0.02 0.00 0.21 0.00 0.00 52.86 53.26 3dyo s ASN 38 Cb 0.09 -0.13 0.42 0.00 -0.55 0.00 0.00 41.25 41.07 3dyo s ASN 38 CO 0.11 -0.19 1.93 0.28 -2.79 0.00 0.00 177.10 176.44 3dyo h SER 39 N 7.88 1.00 -0.25 -4.21 0.02 -1.97 -2.60 113.55 113.43 3dyo h SER 39 Ca -0.28 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.56 3dyo h SER 39 Cb 1.12 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 3dyo h SER 39 CO 0.31 0.69 -0.14 -0.33 -1.14 0.00 0.00 176.83 176.23 3dyo h GLU 40 N 1.17 0.67 -0.46 3.45 4.39 -1.98 0.69 114.58 122.50 3dyo h GLU 40 Ca 0.36 -0.22 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 3dyo h GLU 40 Cb 0.00 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 3dyo h GLU 40 CO -0.11 0.78 -0.13 0.93 -1.16 0.00 0.00 179.01 179.32 3dyo h GLU 41 N 0.60 0.86 -0.36 2.33 4.39 -1.86 0.07 114.58 120.61 3dyo h GLU 41 Ca 0.10 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 59.48 3dyo h GLU 41 Cb 0.58 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3dyo h GLU 41 CO 0.04 0.94 0.17 0.00 -1.16 0.00 0.00 179.01 179.00 3dyo h ALA 42 N 1.08 0.47 -0.04 3.43 0.00 -1.26 0.42 119.26 123.36 3dyo h ALA 42 Ca 0.12 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3dyo h ALA 42 Cb 0.64 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 3dyo h ALA 42 CO 0.04 0.04 -0.19 -0.09 0.00 0.00 0.00 179.25 179.06 3dyo h ARG 43 N 0.45 -0.27 0.00 0.00 2.43 -0.45 -2.16 114.38 114.38 3dyo h ARG 43 Ca 0.12 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3dyo h ARG 43 Cb 0.13 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3dyo h ARG 43 CO -0.01 -0.18 0.00 0.25 -1.51 0.00 0.00 179.97 178.51 3dyo n THR 44 N -5.32 0.02 -1.54 0.20 -2.24 -0.03 -4.91 114.28 100.47 3dyo n THR 44 Ca -0.04 0.01 -0.17 0.00 -2.27 0.00 0.00 64.05 61.57 3dyo n THR 44 Cb 0.24 -0.56 -0.07 0.00 -2.10 0.00 0.00 70.33 67.84 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 -1.06 -5.07 -4.81 3.42 2.03 0.07 -4.97 116.55 106.17 3dyo n ASP 45 Ca 0.20 0.40 -0.29 0.00 0.52 0.00 0.00 54.79 55.62 3dyo n ASP 45 Cb 0.12 -4.09 0.11 0.00 -0.72 0.00 0.00 41.12 36.54 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 -3.53 1.74 0.88 -0.67 0.52 -0.81 -4.99 118.95 112.09 3dyo s ARG 46 Ca 0.00 0.46 -0.10 0.00 -0.52 0.00 0.00 55.73 55.57 3dyo s ARG 46 Cb 0.00 -1.89 0.12 0.00 0.52 0.00 0.00 34.95 33.70 3dyo s ARG 46 CO 0.00 -1.82 1.12 -2.14 0.02 0.00 0.00 175.30 172.48 3dyo s PRO 47 N -5.24 1.34 -0.06 3.54 0.02 -1.26 -4.79 135.00 128.54 3dyo s PRO 47 Ca 0.62 1.34 0.04 0.00 0.02 0.00 0.00 61.00 63.03 3dyo s PRO 47 Cb -0.14 -1.78 -0.02 0.00 0.02 0.00 0.00 34.50 32.58 3dyo s PRO 47 CO 0.53 -2.34 -0.19 0.45 -0.33 0.00 0.00 177.00 175.12 3dyo s SER 48 N -2.95 3.55 0.06 2.53 0.15 -1.26 -4.98 113.70 110.80 3dyo s SER 48 Ca 0.65 -0.37 0.16 0.00 0.70 0.00 0.00 55.95 57.09 3dyo s SER 48 Cb -0.21 -0.94 0.69 0.00 -1.71 0.00 0.00 66.02 63.85 3dyo s SER 48 CO 0.58 0.27 1.51 0.00 1.20 0.00 0.00 173.24 176.79 3dyo n GLN 49 N 2.79 0.04 0.00 5.44 1.13 -1.26 -2.11 117.38 123.41 3dyo n GLN 49 Ca -0.17 0.30 0.14 0.00 -1.94 0.00 0.00 57.00 55.33 3dyo n GLN 49 Cb 0.52 -1.59 0.54 0.00 0.11 0.00 0.00 30.24 29.82 3dyo n GLN 49 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3dyo n GLN 50 N -1.67 1.16 -4.00 -1.09 3.00 -1.26 -4.70 117.38 108.82 3dyo n GLN 50 Ca 0.03 -0.59 -0.31 0.00 -0.01 0.00 0.00 57.00 56.12 3dyo n GLN 50 Cb 0.18 -1.49 -0.15 0.00 0.00 0.00 0.00 30.24 28.78 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 -2.24 3.46 -0.03 1.08 2.96 -0.90 -0.59 118.68 122.42 3dyo s LEU 51 Ca 0.33 -1.55 -0.02 0.00 -0.22 0.00 0.00 54.13 52.67 3dyo s LEU 51 Cb 0.20 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 3dyo s LEU 51 CO 0.42 -0.27 0.12 -0.13 -1.32 0.00 0.00 176.35 175.18 3dyo s ARG 52 N 1.17 3.26 -0.10 1.98 0.52 0.36 -4.73 118.95 121.41 3dyo s ARG 52 Ca -0.02 -0.36 -0.21 0.00 -0.52 0.00 0.00 55.73 54.62 3dyo s ARG 52 Cb -0.19 -3.00 -0.04 0.00 0.52 0.00 0.00 34.95 32.24 3dyo s ARG 52 CO -0.07 0.68 0.60 0.45 0.02 0.00 0.00 175.30 176.97 3dyo s SER 53 N -1.66 6.82 -0.09 0.23 0.15 -1.26 0.11 113.70 118.00 3dyo s SER 53 Ca 0.23 0.99 0.17 0.00 0.70 0.00 0.00 55.95 58.04 3dyo s SER 53 Cb -0.12 -2.35 0.62 0.00 -1.71 0.00 0.00 66.02 62.46 3dyo s SER 53 CO 0.14 -0.08 1.54 0.18 1.20 0.00 0.00 173.24 176.21 3dyo n LEU 54 N 3.87 4.29 -4.77 3.45 4.77 0.52 -4.92 117.00 124.21 3dyo n LEU 54 Ca -0.04 -2.41 -0.35 0.00 -0.03 0.00 0.00 56.01 53.19 3dyo n LEU 54 Cb 0.51 -0.51 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 3dyo n LEU 54 CO 0.45 0.80 0.79 0.20 -1.33 0.00 0.00 177.39 178.30 3dyo s ASN 55 N -1.06 5.51 0.00 -1.43 -0.87 -1.24 -4.86 114.94 110.98 3dyo s ASN 55 Ca 0.45 2.21 0.00 0.00 -1.57 0.00 0.00 52.86 53.96 3dyo s ASN 55 Cb 0.29 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.94 3dyo s ASN 55 CO 0.22 -1.37 0.00 0.61 -2.57 0.00 0.00 177.10 173.99 3dyo n GLY 56 N 0.18 0.42 3.65 0.66 0.00 -0.53 -5.00 105.19 104.57 3dyo n GLY 56 Ca 0.12 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 3dyo n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyo s GLU 57 N -1.64 4.20 0.26 1.61 2.02 -1.26 -1.03 118.70 122.86 3dyo s GLU 57 Ca 0.00 0.98 0.01 0.00 0.02 0.00 0.00 54.97 55.98 3dyo s GLU 57 Cb 0.00 -3.64 0.01 0.00 0.10 0.00 0.00 34.13 30.60 3dyo s GLU 57 CO 0.00 -0.51 0.05 0.91 0.02 0.00 0.00 175.26 175.73 3dyo n TRP 58 N 5.97 0.18 -4.84 1.61 7.02 0.76 -4.93 117.44 123.21 3dyo n TRP 58 Ca 0.06 -1.23 -0.33 0.00 -1.02 0.00 0.00 57.50 54.98 3dyo n TRP 58 Cb 0.47 -0.18 -0.13 0.00 -2.42 0.00 0.00 31.31 29.05 3dyo n TRP 58 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3dyo s ARG 59 N -2.97 2.61 0.01 -0.99 1.81 0.46 -1.37 118.95 118.51 3dyo s ARG 59 Ca 0.04 -0.67 0.01 0.00 -1.72 0.00 0.00 55.73 53.38 3dyo s ARG 59 Cb -0.00 -2.43 -0.01 0.00 -0.45 0.00 0.00 34.95 32.06 3dyo s ARG 59 CO 0.02 0.60 -0.02 0.12 -0.68 0.00 0.00 175.30 175.33 3dyo s PHE 60 N -0.65 0.22 -0.02 -0.53 5.36 0.62 -0.65 117.98 122.33 3dyo s PHE 60 Ca 0.10 -0.15 0.01 0.00 -0.96 0.00 0.00 56.93 55.92 3dyo s PHE 60 Cb -0.11 -0.14 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 3dyo s PHE 60 CO 0.01 -0.04 -0.01 0.00 -1.46 0.00 0.00 175.22 173.72 3dyo s ALA 61 N -0.38 0.29 -0.08 11.12 0.00 -0.15 -0.55 121.76 132.00 3dyo s ALA 61 Ca -0.03 0.10 -0.13 0.00 0.00 0.00 0.00 51.96 51.89 3dyo s ALA 61 Cb -0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 3dyo s ALA 61 CO -0.00 -0.04 0.34 -0.46 0.00 0.00 0.00 175.76 175.60 3dyo s TRP 62 N 0.73 3.61 0.11 0.00 -0.00 -1.26 -0.96 118.94 121.17 3dyo s TRP 62 Ca -0.07 0.79 0.05 0.00 -0.00 0.00 0.00 56.10 56.86 3dyo s TRP 62 Cb -0.10 -2.27 -0.04 0.00 -0.00 0.00 0.00 33.47 31.06 3dyo s TRP 62 CO -0.01 0.49 -0.12 -0.06 -0.00 0.00 0.00 176.95 177.25 3dyo s PHE 63 N -0.44 1.22 -0.82 5.86 0.40 -0.26 -4.98 117.98 118.95 3dyo s PHE 63 Ca 0.20 -0.61 0.25 0.00 -0.60 0.00 0.00 56.93 56.17 3dyo s PHE 63 Cb -0.15 -0.65 0.53 0.00 0.51 0.00 0.00 43.02 43.26 3dyo s PHE 63 CO 0.09 0.07 1.44 -0.35 0.70 0.00 0.00 175.22 177.17 3dyo n PRO 64 N 0.52 0.15 -3.63 0.24 -0.04 -1.26 0.81 135.00 131.80 3dyo n PRO 64 Ca -0.16 0.05 -0.09 0.00 -0.04 0.00 0.00 63.50 63.27 3dyo n PRO 64 Cb 0.57 -1.60 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 3dyo n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dyo s ALA 65 N -3.08 -2.00 0.26 0.55 0.00 -1.21 0.09 121.76 116.36 3dyo s ALA 65 Ca 0.09 1.79 -0.02 0.00 0.00 0.00 0.00 51.96 53.82 3dyo s ALA 65 Cb 0.16 -1.32 0.56 0.00 0.00 0.00 0.00 23.12 22.51 3dyo s ALA 65 CO 0.69 -0.24 1.68 -1.00 0.00 0.00 0.00 175.76 176.90 3dyo h PRO 66 N 3.66 0.29 -0.46 0.00 0.13 -1.90 0.58 132.00 134.31 3dyo h PRO 66 Ca -0.25 -0.02 0.13 0.00 -0.87 0.00 0.00 66.00 64.99 3dyo h PRO 66 Cb 1.18 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 3dyo h PRO 66 CO 0.16 0.19 0.57 0.93 -0.23 0.00 0.00 178.00 179.63 3dyo h GLU 67 N 0.30 0.00 -0.05 0.86 3.07 -1.95 0.29 114.58 117.10 3dyo h GLU 67 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 3dyo h GLU 67 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 3dyo h GLU 67 CO -0.53 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.08 3dyo n ALA 68 N -2.25 2.60 -2.68 3.43 0.00 0.20 -4.82 120.51 117.00 3dyo n ALA 68 Ca 0.09 -0.31 -0.40 0.00 0.00 0.00 0.00 53.44 52.82 3dyo n ALA 68 Cb 0.75 -1.27 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 3dyo n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dyo s VAL 69 N -1.95 4.96 -0.16 0.00 1.01 0.10 -5.01 120.40 119.37 3dyo s VAL 69 Ca 0.36 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.68 3dyo s VAL 69 Cb 0.18 -4.12 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 3dyo s VAL 69 CO 0.29 0.24 0.99 -2.16 0.00 0.00 0.00 175.10 174.46 3dyo s PRO 70 N 0.75 4.35 0.50 2.72 0.04 -1.26 -4.95 135.00 137.14 3dyo s PRO 70 Ca 0.41 1.33 0.39 0.00 0.04 0.00 0.00 61.00 63.17 3dyo s PRO 70 Cb -0.19 -3.58 1.57 0.00 0.04 0.00 0.00 34.50 32.34 3dyo s PRO 70 CO 0.21 -0.42 1.62 1.05 0.04 0.00 0.00 177.00 179.50 3dyo h GLU 71 N 7.25 0.03 -0.89 4.56 9.09 -1.98 0.43 114.58 133.08 3dyo h GLU 71 Ca -0.27 -0.00 0.21 0.00 0.05 0.00 0.00 59.36 59.36 3dyo h GLU 71 Cb 1.12 -0.01 -0.12 0.00 -1.65 0.00 0.00 28.75 28.09 3dyo h GLU 71 CO 0.89 0.02 0.40 1.03 0.05 0.00 0.00 179.01 181.40 3dyo h SER 72 N 0.03 0.35 0.30 3.06 0.87 -1.92 0.21 113.55 116.45 3dyo h SER 72 Ca 0.85 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 61.55 3dyo h SER 72 Cb 3.06 0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 65.14 3dyo h SER 72 CO -0.22 0.02 -0.04 -0.25 -0.53 0.00 0.00 176.83 175.80 3dyo h TRP 73 N 0.42 0.00 -0.57 2.24 7.01 -0.14 1.37 115.95 126.28 3dyo h TRP 73 Ca 0.55 0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.50 3dyo h TRP 73 Cb 1.03 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 28.06 3dyo h TRP 73 CO -0.13 0.04 0.16 -0.07 -2.79 0.00 0.00 178.44 175.65 3dyo h LEU 74 N 0.00 0.85 0.16 0.65 3.38 -0.72 -3.14 115.31 116.49 3dyo h LEU 74 Ca -0.00 -0.22 -0.33 0.00 0.09 0.00 0.00 57.88 57.41 3dyo h LEU 74 Cb 0.20 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3dyo h LEU 74 CO 0.01 0.85 -1.67 -0.08 0.09 0.00 0.00 178.44 177.63 3dyo h GLU 75 N 0.81 0.34 -3.19 1.13 4.57 -1.31 -3.36 114.58 113.57 3dyo h GLU 75 Ca 0.18 -0.58 -0.08 0.00 -1.18 0.00 0.00 59.36 57.70 3dyo h GLU 75 Cb 0.32 0.22 -0.16 0.00 -0.16 0.00 0.00 28.75 28.97 3dyo h GLU 75 CO -0.00 1.24 -0.16 0.00 -1.18 0.00 0.00 179.01 178.91 3dyo n ASP 77 N 0.42 0.45 -4.55 0.00 2.03 -1.26 -3.42 116.55 110.22 3dyo n ASP 77 Ca -0.18 0.91 -0.42 0.00 0.52 0.00 0.00 54.79 55.62 3dyo n ASP 77 Cb 0.60 -1.30 -0.08 0.00 -0.72 0.00 0.00 41.12 39.63 3dyo n ASP 77 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3dyo s LEU 78 N -0.41 4.37 0.51 -2.67 1.43 -1.26 -4.90 118.68 115.75 3dyo s LEU 78 Ca 0.67 -0.05 0.18 0.00 -1.03 0.00 0.00 54.13 53.90 3dyo s LEU 78 Cb -0.51 -2.61 1.27 0.00 0.03 0.00 0.00 46.19 44.38 3dyo s LEU 78 CO 0.54 -0.51 2.10 1.55 0.23 0.00 0.00 176.35 180.25 3dyo h PRO 79 N 8.49 0.05 0.00 1.29 0.13 -2.02 0.40 132.00 140.34 3dyo h PRO 79 Ca -0.27 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3dyo h PRO 79 Cb 1.12 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3dyo h PRO 79 CO 0.79 0.03 0.00 -0.85 -0.23 0.00 0.00 178.00 177.74 3dyo n GLU 80 N -4.49 0.30 -1.47 0.86 0.28 -1.26 -4.81 120.64 110.05 3dyo n GLU 80 Ca 0.01 0.02 -0.30 0.00 -0.16 0.00 0.00 57.16 56.73 3dyo n GLU 80 Cb 0.24 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 31.71 3dyo n GLU 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3dyo s ALA 81 N -2.68 2.12 0.29 -1.84 0.00 0.14 -4.96 121.76 114.84 3dyo s ALA 81 Ca 0.23 -0.14 0.12 0.00 0.00 0.00 0.00 51.96 52.17 3dyo s ALA 81 Cb 0.19 -3.13 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 3dyo s ALA 81 CO 0.45 -1.83 -0.17 -0.51 0.00 0.00 0.00 175.76 173.69 3dyo s ASP 82 N -3.78 3.69 -0.27 0.00 1.01 0.28 -4.89 116.67 112.71 3dyo s ASP 82 Ca 0.61 -1.01 -0.09 0.00 0.71 0.00 0.00 52.55 52.77 3dyo s ASP 82 Cb -0.15 -0.35 -0.04 0.00 1.01 0.00 0.00 42.92 43.39 3dyo s ASP 82 CO 0.55 0.01 0.14 -0.89 0.21 0.00 0.00 175.17 175.19 3dyo s THR 83 N -2.50 4.83 0.12 -1.27 2.01 -1.26 0.23 115.64 117.79 3dyo s THR 83 Ca 0.30 -0.04 0.01 0.00 0.31 0.00 0.00 61.69 62.27 3dyo s THR 83 Cb -0.04 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 3dyo s THR 83 CO 0.16 0.26 -0.02 0.68 -0.69 0.00 0.00 174.62 175.00 3dyo s VAL 84 N 1.68 0.52 0.22 3.82 -7.23 -0.47 -4.94 120.40 114.01 3dyo s VAL 84 Ca 0.06 -1.92 -0.30 0.00 -1.81 0.00 0.00 61.98 58.01 3dyo s VAL 84 Cb -0.16 -1.84 -0.08 0.00 0.56 0.00 0.00 36.38 34.86 3dyo s VAL 84 CO 0.07 -0.72 1.14 -0.69 -0.31 0.00 0.00 175.10 174.60 3dyo s VAL 85 N -3.75 3.61 -0.06 1.32 1.01 -1.26 -0.17 120.40 121.11 3dyo s VAL 85 Ca 0.16 1.45 0.03 0.00 0.00 0.00 0.00 61.98 63.62 3dyo s VAL 85 Cb 0.06 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.53 3dyo s VAL 85 CO -0.02 0.28 -0.13 -0.69 0.00 0.00 0.00 175.10 174.53 3dyo s VAL 86 N -0.49 1.18 0.57 2.92 1.01 -0.20 -3.96 120.40 121.43 3dyo s VAL 86 Ca 0.49 -0.53 -0.18 0.00 0.00 0.00 0.00 61.98 61.76 3dyo s VAL 86 Cb -0.32 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 3dyo s VAL 86 CO 0.38 0.36 1.13 -2.16 0.00 0.00 0.00 175.10 174.80 3dyo s PRO 87 N 0.44 3.22 0.05 2.72 0.04 -1.26 -1.45 135.00 138.76 3dyo s PRO 87 Ca -0.11 1.56 -0.27 0.00 0.04 0.00 0.00 61.00 62.22 3dyo s PRO 87 Cb -0.14 -1.99 0.09 0.00 0.04 0.00 0.00 34.50 32.50 3dyo s PRO 87 CO 0.03 -0.95 0.85 -1.54 0.04 0.00 0.00 177.00 175.43 3dyo s SER 88 N -1.97 -0.38 -0.21 6.66 1.04 0.13 -4.93 113.70 114.04 3dyo s SER 88 Ca 0.71 -0.06 -0.07 0.00 0.48 0.00 0.00 55.95 57.02 3dyo s SER 88 Cb -0.23 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 3dyo s SER 88 CO 0.31 -0.73 0.05 0.20 0.98 0.00 0.00 173.24 174.05 3dyo s ASN 89 N -2.59 5.27 0.46 7.02 -0.87 -1.26 -2.77 114.94 120.21 3dyo s ASN 89 Ca 0.05 -0.09 0.14 0.00 -1.57 0.00 0.00 52.86 51.39 3dyo s ASN 89 Cb -0.01 -1.92 1.07 0.00 -0.02 0.00 0.00 41.25 40.37 3dyo s ASN 89 CO -0.08 0.08 2.05 4.11 -2.57 0.00 0.00 177.10 180.69 3dyo h TRP 90 N 7.41 0.09 -0.60 2.20 0.09 -1.77 -0.60 115.95 122.77 3dyo h TRP 90 Ca -0.36 -0.00 0.09 0.00 0.09 0.00 0.00 58.89 58.70 3dyo h TRP 90 Cb 1.18 -0.03 -0.04 0.00 0.08 0.00 0.00 29.16 30.35 3dyo h TRP 90 CO 0.61 0.15 0.40 1.96 0.09 0.00 0.00 178.44 181.65 3dyo h GLN 91 N 0.09 0.44 0.00 0.12 7.50 -1.78 0.65 115.11 122.13 3dyo h GLN 91 Ca 0.02 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.14 3dyo h GLN 91 Cb 0.16 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 27.59 3dyo h GLN 91 CO 0.01 0.29 0.00 -1.33 -1.50 0.00 0.00 178.83 176.30 3dyo n MET 92 N -4.47 0.08 0.00 1.46 2.81 -0.23 -1.92 117.12 114.85 3dyo n MET 92 Ca 0.09 0.14 0.10 0.00 -1.81 0.00 0.00 57.70 56.23 3dyo n MET 92 Cb 0.34 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.37 3dyo n MET 92 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3dyo n HIS 93 N -1.44 0.00 -0.68 2.03 8.25 0.22 -4.98 115.22 118.62 3dyo n HIS 93 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 3dyo n HIS 93 Cb 0.21 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.32 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 1.31 0.74 0.25 -1.41 0.00 -0.81 -4.96 105.19 100.31 3dyo n GLY 94 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.20 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 -3.02 1.61 -1.99 -1.74 -3.45 116.97 108.38 3dyo h TYR 95 Ca 0.00 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.75 3dyo h TYR 95 Cb 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.71 3dyo h TYR 95 CO 0.00 0.10 0.24 0.16 -0.00 0.00 0.00 178.16 178.67 3dyo s ASP 96 N -6.73 -0.12 0.09 3.88 1.47 -1.26 -5.04 116.67 108.96 3dyo s ASP 96 Ca -0.04 -0.88 -0.19 0.00 1.18 0.00 0.00 52.55 52.61 3dyo s ASP 96 Cb 0.15 0.79 -0.07 0.00 -0.34 0.00 0.00 42.92 43.45 3dyo s ASP 96 CO 0.65 -1.52 0.59 0.00 0.68 0.00 0.00 175.17 175.57 3dyo s ALA 97 N -3.12 3.57 0.34 2.11 0.00 -1.26 -4.40 121.76 118.99 3dyo s ALA 97 Ca 0.13 0.04 -0.26 0.00 0.00 0.00 0.00 51.96 51.88 3dyo s ALA 97 Cb -0.05 -2.65 -0.09 0.00 0.00 0.00 0.00 23.12 20.32 3dyo s ALA 97 CO 0.09 0.40 1.00 -1.25 0.00 0.00 0.00 175.76 176.00 3dyo s PRO 98 N -1.23 4.47 -0.10 0.00 0.04 -1.26 -4.98 135.00 131.93 3dyo s PRO 98 Ca 0.31 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.83 3dyo s PRO 98 Cb -0.19 -2.81 -0.02 0.00 0.04 0.00 0.00 34.50 31.52 3dyo s PRO 98 CO 0.20 0.15 -0.13 0.42 0.04 0.00 0.00 177.00 177.67 3dyo s ILE 99 N -1.53 3.11 -0.49 0.56 1.01 -1.07 -4.64 121.20 118.15 3dyo s ILE 99 Ca 0.51 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.46 3dyo s ILE 99 Cb -0.22 -2.28 0.13 0.00 0.01 0.00 0.00 42.46 40.10 3dyo s ILE 99 CO 0.28 0.55 0.31 -0.47 0.00 0.00 0.00 174.94 175.60 3dyo s TYR 100 N -0.02 3.52 0.01 3.97 5.04 -1.26 0.35 117.35 128.97 3dyo s TYR 100 Ca -0.03 -2.43 0.08 0.00 -2.44 0.00 0.00 57.07 52.25 3dyo s TYR 100 Cb -0.14 -3.27 -0.02 0.00 0.35 0.00 0.00 41.96 38.88 3dyo s TYR 100 CO 0.04 -0.94 -0.23 -0.08 -1.34 0.00 0.00 175.55 173.00 3dyo s THR 101 N 0.79 1.82 0.00 4.34 -1.32 -1.26 -0.87 115.64 119.13 3dyo s THR 101 Ca 0.11 -1.12 0.00 0.00 -1.21 0.00 0.00 61.69 59.47 3dyo s THR 101 Cb -0.22 -1.54 0.00 0.00 -1.51 0.00 0.00 72.50 69.23 3dyo s THR 101 CO -0.04 0.39 0.00 -3.20 -2.21 0.00 0.00 174.62 169.56 3dyo n ASN 102 N 2.18 0.00 -0.11 8.08 2.85 -1.26 -3.98 115.26 123.02 3dyo n ASN 102 Ca -0.16 0.08 -0.21 0.00 -0.11 0.00 0.00 54.58 54.18 3dyo n ASN 102 Cb 0.52 -0.12 -0.10 0.00 1.24 0.00 0.00 39.78 41.32 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 -1.11 1.52 -1.70 3.44 0.31 -1.26 -3.85 118.33 115.68 3dyo n VAL 103 Ca 0.00 -0.05 -0.43 0.00 -0.01 0.00 0.00 64.34 63.85 3dyo n VAL 103 Cb 0.00 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 30.84 3dyo n VAL 103 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 3dyo n THR 104 N -4.42 0.16 -1.77 2.52 -1.04 -1.26 -3.20 114.28 105.27 3dyo n THR 104 Ca -0.33 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.28 3dyo n THR 104 Cb 0.67 -1.97 0.06 0.00 -1.82 0.00 0.00 70.33 67.27 3dyo n THR 104 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3dyo s TYR 105 N 1.84 2.14 -2.07 -1.42 1.51 -1.26 -4.86 117.35 113.22 3dyo s TYR 105 Ca 0.79 1.46 0.27 0.00 -1.01 0.00 0.00 57.07 58.58 3dyo s TYR 105 Cb -0.53 -3.71 1.54 0.00 -0.11 0.00 0.00 41.96 39.15 3dyo s TYR 105 CO 0.36 -2.88 2.00 -0.35 -1.11 0.00 0.00 175.55 173.57 3dyo n PRO 106 N -1.69 1.12 -4.16 -1.71 -0.04 -1.26 -4.77 135.00 122.49 3dyo n PRO 106 Ca 0.15 -0.17 -0.15 0.00 -0.04 0.00 0.00 63.50 63.29 3dyo n PRO 106 Cb 0.47 -1.44 -0.11 0.00 -0.04 0.00 0.00 33.50 32.39 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 -1.99 0.91 0.35 0.52 -4.36 -1.26 -5.05 121.20 110.32 3dyo s ILE 107 Ca 0.41 -1.50 -0.27 0.00 -0.26 0.00 0.00 60.65 59.03 3dyo s ILE 107 Cb 0.19 -1.20 -0.12 0.00 1.25 0.00 0.00 42.46 42.59 3dyo s ILE 107 CO 0.32 -0.47 1.18 0.41 0.24 0.00 0.00 174.94 176.62 3dyo n THR 108 N 0.82 2.15 -2.39 8.37 -1.04 -1.26 -4.81 114.28 116.12 3dyo n THR 108 Ca -0.18 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.05 60.93 3dyo n THR 108 Cb 0.57 -1.38 -0.03 0.00 -1.82 0.00 0.00 70.33 67.67 3dyo n THR 108 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dyo s VAL 109 N -1.13 3.62 -0.45 12.58 1.01 -1.26 -4.77 120.40 130.01 3dyo s VAL 109 Ca 0.58 0.38 0.07 0.00 0.00 0.00 0.00 61.98 63.01 3dyo s VAL 109 Cb -0.59 -4.61 0.29 0.00 0.00 0.00 0.00 36.38 31.48 3dyo s VAL 109 CO 0.60 -1.53 0.92 -3.20 0.00 0.00 0.00 175.10 171.89 3dyo n ASN 110 N 10.34 -1.69 -4.70 3.32 5.15 -1.26 -5.10 115.26 121.31 3dyo n ASN 110 Ca 0.09 -3.37 -0.43 0.00 -0.60 0.00 0.00 54.58 50.27 3dyo n ASN 110 Cb 0.50 1.20 -0.01 0.00 -0.53 0.00 0.00 39.78 40.94 3dyo n ASN 110 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 3dyo n PRO 111 N 0.83 2.16 -0.70 1.20 -0.04 -1.26 0.15 135.00 137.33 3dyo n PRO 111 Ca 0.12 0.76 0.06 0.00 -0.04 0.00 0.00 63.50 64.40 3dyo n PRO 111 Cb 0.65 -2.35 0.33 0.00 -0.04 0.00 0.00 33.50 32.09 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 0.70 4.05 -2.73 0.54 -0.04 -1.26 -5.09 135.00 131.16 3dyo n PRO 112 Ca 0.05 -2.59 -0.34 0.00 -0.04 0.00 0.00 63.50 60.57 3dyo n PRO 112 Cb 0.36 -2.06 -0.06 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 -2.31 3.33 0.36 0.54 0.40 0.40 -4.37 117.98 116.33 3dyo s PHE 113 Ca 0.45 1.64 0.06 0.00 -0.60 0.00 0.00 56.93 58.48 3dyo s PHE 113 Cb 0.33 -2.94 -0.07 0.00 0.51 0.00 0.00 43.02 40.85 3dyo s PHE 113 CO 0.15 -0.24 0.02 0.14 0.70 0.00 0.00 175.22 175.99 3dyo s VAL 114 N -1.96 1.65 0.40 -0.44 -7.23 -1.26 -4.39 120.40 107.16 3dyo s VAL 114 Ca 0.60 -2.02 -0.26 0.00 -1.81 0.00 0.00 61.98 58.49 3dyo s VAL 114 Cb -0.14 -2.87 -0.09 0.00 0.56 0.00 0.00 36.38 33.84 3dyo s VAL 114 CO 0.18 -0.03 1.31 -2.84 -0.31 0.00 0.00 175.10 173.42 3dyo s PRO 115 N -3.78 4.02 0.37 4.82 0.02 -1.26 -4.90 135.00 134.28 3dyo s PRO 115 Ca 0.35 2.18 0.04 0.00 0.02 0.00 0.00 61.00 63.60 3dyo s PRO 115 Cb 0.09 -2.80 0.71 0.00 0.02 0.00 0.00 34.50 32.51 3dyo s PRO 115 CO 0.17 -0.46 2.00 1.79 -0.33 0.00 0.00 177.00 180.16 3dyo h THR 116 N 2.55 1.15 -2.77 0.99 1.35 -2.00 -3.29 112.91 110.90 3dyo h THR 116 Ca -0.50 -0.37 -0.64 0.00 -0.55 0.00 0.00 66.41 64.35 3dyo h THR 116 Cb 1.24 0.50 -0.15 0.00 -1.73 0.00 0.00 68.15 68.01 3dyo h THR 116 CO 0.63 0.16 0.48 -1.61 -0.25 0.00 0.00 175.52 174.93 3dyo s GLU 117 N -5.46 3.13 -0.40 4.72 8.01 -1.26 -4.76 118.70 122.68 3dyo s GLU 117 Ca -0.09 -0.82 0.02 0.00 0.01 0.00 0.00 54.97 54.09 3dyo s GLU 117 Cb 0.17 -4.21 0.12 0.00 -4.31 0.00 0.00 34.13 25.91 3dyo s GLU 117 CO 0.75 -1.73 0.18 1.21 0.01 0.00 0.00 175.26 175.69 3dyo s ASN 118 N 3.53 3.88 -0.46 -0.19 2.47 0.11 -4.97 114.94 119.31 3dyo s ASN 118 Ca 0.22 -2.33 -0.42 0.00 0.42 0.00 0.00 52.86 50.75 3dyo s ASN 118 Cb -0.17 -1.06 -0.18 0.00 -1.45 0.00 0.00 41.25 38.39 3dyo s ASN 118 CO 0.11 -0.32 1.60 -2.65 -3.72 0.00 0.00 177.10 172.12 3dyo n PRO 119 N 3.95 0.00 -4.44 0.43 -0.02 -1.17 -3.35 135.00 130.39 3dyo n PRO 119 Ca 0.05 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.20 3dyo n PRO 119 Cb 0.37 -1.37 -0.14 0.00 -0.02 0.00 0.00 33.50 32.34 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 3.51 3.12 -0.30 3.45 2.01 0.24 -1.30 115.64 126.38 3dyo s THR 120 Ca 1.00 -0.61 -0.09 0.00 0.31 0.00 0.00 61.69 62.29 3dyo s THR 120 Cb -1.37 -2.35 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 3dyo s THR 120 CO 0.71 0.49 0.13 -0.83 -0.69 0.00 0.00 174.62 174.43 3dyo s GLY 121 N 0.76 1.84 -0.49 4.40 0.00 -0.18 -1.11 107.32 112.55 3dyo s GLY 121 Ca -0.04 -1.35 -0.13 0.00 0.00 0.00 0.00 44.72 43.19 3dyo s GLY 121 CO 0.01 0.66 0.40 0.00 0.00 0.00 0.00 173.10 174.18 3dyo s TYR 123 N 1.54 3.26 0.03 0.00 1.51 -0.49 -0.98 117.35 122.22 3dyo s TYR 123 Ca 0.04 0.13 -0.17 0.00 -1.01 0.00 0.00 57.07 56.06 3dyo s TYR 123 Cb -0.26 -1.67 0.03 0.00 -0.11 0.00 0.00 41.96 39.95 3dyo s TYR 123 CO 0.03 0.54 0.38 -1.54 -1.11 0.00 0.00 175.55 173.85 3dyo s SER 124 N -2.25 -0.24 -0.12 2.29 1.04 0.18 -0.71 113.70 113.90 3dyo s SER 124 Ca 0.29 -0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.61 3dyo s SER 124 Cb -0.12 0.39 0.04 0.00 0.10 0.00 0.00 66.02 66.43 3dyo s SER 124 CO 0.21 -0.62 0.29 -0.22 0.98 0.00 0.00 173.24 173.88 3dyo s LEU 125 N -1.91 0.55 -0.19 2.42 2.96 -1.01 -0.41 118.68 121.09 3dyo s LEU 125 Ca -0.06 0.61 -0.02 0.00 -0.22 0.00 0.00 54.13 54.43 3dyo s LEU 125 Cb -0.01 0.95 -0.01 0.00 0.50 0.00 0.00 46.19 47.62 3dyo s LEU 125 CO -0.01 -0.14 -0.08 -0.89 -1.32 0.00 0.00 176.35 173.90 3dyo s THR 126 N 0.79 3.17 0.22 3.68 2.01 -1.26 -0.56 115.64 123.69 3dyo s THR 126 Ca -0.05 -0.58 -0.10 0.00 0.31 0.00 0.00 61.69 61.26 3dyo s THR 126 Cb -0.06 -2.40 -0.01 0.00 0.01 0.00 0.00 72.50 70.04 3dyo s THR 126 CO -0.05 0.47 0.39 0.72 -0.69 0.00 0.00 174.62 175.45 3dyo s PHE 127 N 1.11 0.46 0.24 4.92 -0.12 0.24 -4.96 117.98 119.87 3dyo s PHE 127 Ca 0.01 -0.80 0.08 0.00 -0.05 0.00 0.00 56.93 56.17 3dyo s PHE 127 Cb -0.15 0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 3dyo s PHE 127 CO -0.02 -0.88 0.06 0.54 -0.05 0.00 0.00 175.22 174.87 3dyo s ASN 128 N -3.02 4.90 -0.04 1.98 2.20 -1.26 0.17 114.94 119.87 3dyo s ASN 128 Ca 0.23 -0.47 0.03 0.00 -0.94 0.00 0.00 52.86 51.71 3dyo s ASN 128 Cb 0.01 -1.06 0.01 0.00 -2.00 0.00 0.00 41.25 38.21 3dyo s ASN 128 CO 0.07 0.01 -0.10 -0.69 -2.94 0.00 0.00 177.10 173.45 3dyo s VAL 129 N -2.13 0.92 0.23 3.54 1.01 0.48 -4.95 120.40 119.50 3dyo s VAL 129 Ca 0.31 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.59 3dyo s VAL 129 Cb -0.08 -0.83 -0.09 0.00 0.00 0.00 0.00 36.38 35.39 3dyo s VAL 129 CO 0.21 0.29 1.05 -0.62 0.00 0.00 0.00 175.10 176.03 3dyo s ASP 130 N 0.35 7.39 0.44 3.32 2.15 -1.26 -1.24 116.67 127.82 3dyo s ASP 130 Ca -0.07 2.10 0.19 0.00 0.43 0.00 0.00 52.55 55.20 3dyo s ASP 130 Cb -0.11 -2.61 1.13 0.00 -0.30 0.00 0.00 42.92 41.03 3dyo s ASP 130 CO 0.01 -0.07 1.89 -0.08 -0.17 0.00 0.00 175.17 176.75 3dyo h GLU 131 N 4.37 0.33 -0.18 4.34 4.81 -1.96 0.10 114.58 126.40 3dyo h GLU 131 Ca -0.45 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.81 3dyo h GLU 131 Cb 1.21 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 3dyo h GLU 131 CO 0.69 0.22 0.15 0.66 -0.73 0.00 0.00 179.01 180.00 3dyo h SER 132 N 0.34 0.00 1.02 1.04 4.64 -1.98 1.21 113.55 119.83 3dyo h SER 132 Ca 0.41 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.65 3dyo h SER 132 Cb 1.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 3dyo h SER 132 CO -0.13 0.00 -0.41 -0.50 -0.87 0.00 0.00 176.83 174.93 3dyo h TRP 133 N 0.00 0.00 0.00 4.77 4.06 -1.09 -3.05 115.95 120.64 3dyo h TRP 133 Ca 0.09 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.86 3dyo h TRP 133 Cb 0.39 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.52 3dyo h TRP 133 CO 0.00 0.41 -1.52 1.28 -3.56 0.00 0.00 178.44 175.05 3dyo n LEU 134 N -3.43 0.76 -0.37 -4.49 4.77 0.29 -4.27 117.00 110.25 3dyo n LEU 134 Ca 0.00 0.33 0.02 0.00 -0.03 0.00 0.00 56.01 56.33 3dyo n LEU 134 Cb 0.57 0.10 0.17 0.00 -2.33 0.00 0.00 43.42 41.93 3dyo n LEU 134 CO 0.38 0.16 1.27 1.56 -1.33 0.00 0.00 177.39 179.43 3dyo h GLN 135 N 0.00 1.17 -3.75 3.23 1.08 0.11 -3.45 115.11 113.51 3dyo h GLN 135 Ca -0.18 -0.07 -0.08 0.00 -1.45 0.00 0.00 58.65 56.86 3dyo h GLN 135 Cb 1.60 -0.26 -0.12 0.00 -0.05 0.00 0.00 27.48 28.65 3dyo h GLN 135 CO 0.04 0.78 -0.24 -1.83 -0.95 0.00 0.00 178.83 176.63 3dyo s GLU 136 N -6.04 1.21 0.95 1.46 -1.05 -1.23 -5.10 118.70 108.89 3dyo s GLU 136 Ca -0.12 -1.10 0.00 0.00 -0.15 0.00 0.00 54.97 53.59 3dyo s GLU 136 Cb 0.20 0.41 0.00 0.00 -0.44 0.00 0.00 34.13 34.30 3dyo s GLU 136 CO 0.81 -0.46 0.00 0.41 0.95 0.00 0.00 175.26 176.97 3dyo n GLY 137 N -0.24 -2.10 3.28 -3.83 0.00 -1.26 -4.76 105.19 96.27 3dyo n GLY 137 Ca -0.08 -1.45 -0.33 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 -0.02 3.23 -0.26 1.61 0.74 0.53 -4.81 119.66 120.68 3dyo s GLN 138 Ca 0.00 -0.75 -0.06 0.00 0.05 0.00 0.00 55.36 54.60 3dyo s GLN 138 Cb 0.00 -2.57 -0.01 0.00 1.10 0.00 0.00 33.01 31.53 3dyo s GLN 138 CO 0.00 0.09 0.03 0.99 -0.55 0.00 0.00 175.29 175.86 3dyo s THR 139 N 0.62 3.84 0.12 -0.34 2.01 -1.26 -0.77 115.64 119.86 3dyo s THR 139 Ca -0.09 -0.49 0.11 0.00 0.31 0.00 0.00 61.69 61.53 3dyo s THR 139 Cb -0.16 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 3dyo s THR 139 CO 0.03 0.27 -0.27 0.00 -0.69 0.00 0.00 174.62 173.96 3dyo s ARG 140 N 1.52 1.42 0.02 4.92 1.70 -0.03 0.16 118.95 128.66 3dyo s ARG 140 Ca 0.05 -1.32 0.03 0.00 -0.47 0.00 0.00 55.73 54.02 3dyo s ARG 140 Cb -0.16 -1.88 -0.04 0.00 -0.57 0.00 0.00 34.95 32.31 3dyo s ARG 140 CO 0.01 0.45 -0.04 -1.50 -1.08 0.00 0.00 175.30 173.13 3dyo s ILE 141 N -1.04 3.79 -0.06 4.99 2.07 -0.82 0.20 121.20 130.33 3dyo s ILE 141 Ca 0.13 -0.81 0.01 0.00 -1.41 0.00 0.00 60.65 58.58 3dyo s ILE 141 Cb -0.10 -2.69 0.02 0.00 0.13 0.00 0.00 42.46 39.82 3dyo s ILE 141 CO 0.06 0.33 -0.07 -0.63 -1.91 0.00 0.00 174.94 172.71 3dyo s ILE 142 N -1.08 0.74 -0.38 2.00 1.01 0.43 -2.39 121.20 121.54 3dyo s ILE 142 Ca 0.19 -0.23 -0.07 0.00 0.00 0.00 0.00 60.65 60.54 3dyo s ILE 142 Cb -0.11 -0.74 0.06 0.00 0.01 0.00 0.00 42.46 41.68 3dyo s ILE 142 CO 0.10 0.28 0.18 -0.36 0.00 0.00 0.00 174.94 175.14 3dyo s PHE 143 N 0.94 3.31 0.44 3.97 0.40 -0.59 -0.35 117.98 126.10 3dyo s PHE 143 Ca -0.10 -1.52 0.12 0.00 -0.60 0.00 0.00 56.93 54.82 3dyo s PHE 143 Cb -0.15 -2.62 0.96 0.00 0.51 0.00 0.00 43.02 41.72 3dyo s PHE 143 CO 0.00 -0.79 2.01 -0.44 0.70 0.00 0.00 175.22 176.71 3dyo h ASP 144 N 8.29 0.17 -2.12 1.36 3.32 -0.97 -0.11 116.42 126.37 3dyo h ASP 144 Ca -0.22 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.80 3dyo h ASP 144 Cb 1.08 -0.04 -0.24 0.00 0.22 0.00 0.00 39.33 40.35 3dyo h ASP 144 CO 0.67 0.24 -0.26 -0.83 -1.72 0.00 0.00 179.24 177.34 3dyo s GLY 145 N -4.01 -0.58 -0.09 2.75 0.00 -1.26 -2.99 107.32 101.14 3dyo s GLY 145 Ca -0.06 1.86 -0.02 0.00 0.00 0.00 0.00 44.72 46.51 3dyo s GLY 145 CO 0.71 2.80 0.01 0.14 0.00 0.00 0.00 173.10 176.76 3dyo s VAL 146 N 2.75 0.36 -0.21 1.40 1.01 -1.25 -1.78 120.40 122.68 3dyo s VAL 146 Ca -0.01 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 3dyo s VAL 146 Cb -0.12 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 3dyo s VAL 146 CO -0.16 0.17 -0.03 0.21 0.00 0.00 0.00 175.10 175.29 3dyo s ASN 147 N 1.97 4.54 -0.00 3.32 3.84 -0.23 -4.14 114.94 124.24 3dyo s ASN 147 Ca 0.04 -0.30 0.08 0.00 0.21 0.00 0.00 52.86 52.89 3dyo s ASN 147 Cb -0.13 -1.77 -0.09 0.00 -0.55 0.00 0.00 41.25 38.71 3dyo s ASN 147 CO -0.06 0.02 0.31 -1.54 -2.79 0.00 0.00 177.10 173.05 3dyo n SER 148 N 4.50 0.73 -3.53 -4.21 3.41 -0.75 -1.28 113.62 112.50 3dyo n SER 148 Ca -0.18 -0.59 -0.10 0.00 -0.26 0.00 0.00 58.87 57.74 3dyo n SER 148 Cb 0.51 1.05 -0.02 0.00 -0.26 0.00 0.00 64.21 65.49 3dyo n SER 148 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo s ALA 149 N -1.84 -1.55 -0.06 7.33 0.00 -1.17 -3.93 121.76 120.53 3dyo s ALA 149 Ca 0.02 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.05 3dyo s ALA 149 Cb 0.06 0.82 0.11 0.00 0.00 0.00 0.00 23.12 24.11 3dyo s ALA 149 CO 0.32 -0.83 0.97 -0.59 0.00 0.00 0.00 175.76 175.63 3dyo s PHE 150 N -3.69 -0.31 0.02 0.00 -0.12 -0.63 -1.20 117.98 112.04 3dyo s PHE 150 Ca 0.04 0.24 0.04 0.00 -0.05 0.00 0.00 56.93 57.20 3dyo s PHE 150 Cb -0.02 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 42.86 3dyo s PHE 150 CO -0.08 -0.45 -0.09 -1.01 -0.05 0.00 0.00 175.22 173.54 3dyo s HIS 151 N -2.71 2.81 -0.04 3.49 3.76 -0.79 -1.63 115.29 120.19 3dyo s HIS 151 Ca 0.05 -0.09 0.04 0.00 -0.15 0.00 0.00 55.06 54.91 3dyo s HIS 151 Cb -0.01 -1.57 -0.00 0.00 1.11 0.00 0.00 32.58 32.11 3dyo s HIS 151 CO -0.07 0.35 -0.16 -1.17 -0.85 0.00 0.00 174.74 172.85 3dyo s LEU 152 N -1.47 1.89 0.10 0.89 2.96 0.72 -1.64 118.68 122.13 3dyo s LEU 152 Ca 0.17 -0.32 0.07 0.00 -0.22 0.00 0.00 54.13 53.82 3dyo s LEU 152 Cb -0.11 -0.89 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 3dyo s LEU 152 CO 0.07 0.13 -0.17 0.26 -1.32 0.00 0.00 176.35 175.33 3dyo s TRP 153 N 0.08 1.50 -0.03 5.38 0.51 0.76 0.96 118.94 128.10 3dyo s TRP 153 Ca -0.04 -0.47 -0.01 0.00 -2.12 0.00 0.00 56.10 53.46 3dyo s TRP 153 Cb -0.11 -0.81 0.03 0.00 -0.81 0.00 0.00 33.47 31.77 3dyo s TRP 153 CO 0.02 0.15 0.04 0.00 -0.51 0.00 0.00 176.95 176.65 3dyo n ASN 155 N 4.77 -3.44 0.00 0.00 3.02 -0.17 -0.89 115.26 118.55 3dyo n ASN 155 Ca -0.15 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.06 3dyo n ASN 155 Cb 0.50 -2.87 0.00 0.00 -0.61 0.00 0.00 39.78 36.80 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 -1.10 1.70 3.89 7.41 0.00 -1.26 -5.02 105.19 110.82 3dyo n GLY 156 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.44 3.45 0.10 1.61 0.52 -0.07 -4.92 118.95 119.19 3dyo s ARG 157 Ca 0.00 -0.22 -0.31 0.00 -0.52 0.00 0.00 55.73 54.69 3dyo s ARG 157 Cb 0.00 -3.14 -0.07 0.00 0.52 0.00 0.00 34.95 32.26 3dyo s ARG 157 CO 0.00 0.73 1.25 -0.46 0.02 0.00 0.00 175.30 176.84 3dyo s TRP 158 N -1.17 3.38 -0.18 -0.53 -0.00 -1.26 -0.50 118.94 118.68 3dyo s TRP 158 Ca 0.21 1.23 -0.17 0.00 -0.00 0.00 0.00 56.10 57.38 3dyo s TRP 158 Cb -0.12 -3.49 -0.06 0.00 -0.00 0.00 0.00 33.47 29.80 3dyo s TRP 158 CO 0.11 -1.55 -0.33 0.28 -0.00 0.00 0.00 176.95 175.46 3dyo n VAL 159 N 3.63 1.49 -3.50 5.86 0.31 0.27 -4.91 118.33 121.48 3dyo n VAL 159 Ca 0.09 0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 3dyo n VAL 159 Cb 0.45 -2.35 0.00 0.00 -0.91 0.00 0.00 33.84 31.03 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 1.47 0.96 3.12 2.92 0.00 -0.98 -4.78 105.19 107.90 3dyo n GLY 160 Ca -0.14 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 44.96 3dyo n GLY 160 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dyo s TYR 161 N -3.61 0.07 0.05 1.61 5.04 -0.80 -0.20 117.35 119.51 3dyo s TYR 161 Ca 0.00 -0.21 -0.16 0.00 -2.44 0.00 0.00 57.07 54.26 3dyo s TYR 161 Cb 0.00 -0.06 0.03 0.00 0.35 0.00 0.00 41.96 42.28 3dyo s TYR 161 CO 0.00 -0.32 0.38 0.20 -1.34 0.00 0.00 175.55 174.47 3dyo s GLY 162 N -1.58 -0.23 0.44 8.97 0.00 -0.64 -1.32 107.32 112.95 3dyo s GLY 162 Ca -0.12 0.16 0.03 0.00 0.00 0.00 0.00 44.72 44.79 3dyo s GLY 162 CO 0.00 -0.08 0.11 1.20 0.00 0.00 0.00 173.10 174.32 3dyo s GLN 163 N -2.69 2.02 -0.02 2.90 -0.21 -0.20 -1.61 119.66 119.84 3dyo s GLN 163 Ca -0.04 -2.25 -0.01 0.00 0.02 0.00 0.00 55.36 53.08 3dyo s GLN 163 Cb -0.00 -0.79 0.00 0.00 1.00 0.00 0.00 33.01 33.22 3dyo s GLN 163 CO -0.04 -0.48 0.01 -3.47 -2.12 0.00 0.00 175.29 169.20 3dyo n ASP 164 N -1.36 -2.14 0.02 5.90 -0.08 -1.25 -4.89 116.55 112.74 3dyo n ASP 164 Ca -0.09 0.13 0.04 0.00 -1.51 0.00 0.00 54.79 53.36 3dyo n ASP 164 Cb 0.65 -1.41 0.18 0.00 2.34 0.00 0.00 41.12 42.89 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 0.12 0.07 -0.16 1.67 7.64 -1.26 -3.68 113.62 118.02 3dyo n SER 165 Ca -0.02 0.52 0.05 0.00 1.01 0.00 0.00 58.87 60.43 3dyo n SER 165 Cb 0.04 -0.54 0.07 0.00 -1.01 0.00 0.00 64.21 62.77 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 -1.58 1.13 -4.15 1.43 5.12 -1.26 -3.87 116.66 113.46 3dyo n ARG 166 Ca 0.01 -1.81 -0.17 0.00 -1.93 0.00 0.00 57.85 53.96 3dyo n ARG 166 Cb 0.08 -1.07 -0.12 0.00 -1.16 0.00 0.00 32.46 30.19 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 -1.56 2.28 0.40 0.55 1.43 -1.24 -4.49 118.68 116.04 3dyo s LEU 167 Ca 0.16 -0.62 -0.27 0.00 -1.03 0.00 0.00 54.13 52.37 3dyo s LEU 167 Cb 0.14 -0.44 -0.09 0.00 0.03 0.00 0.00 46.19 45.82 3dyo s LEU 167 CO 0.01 -0.11 1.37 -2.16 0.23 0.00 0.00 176.35 175.69 3dyo s PRO 168 N -1.80 3.98 -0.13 1.29 0.04 -1.16 -4.61 135.00 132.61 3dyo s PRO 168 Ca -0.03 2.32 0.03 0.00 0.04 0.00 0.00 61.00 63.36 3dyo s PRO 168 Cb -0.09 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.63 3dyo s PRO 168 CO 0.02 -0.54 -0.22 -1.12 0.04 0.00 0.00 177.00 175.18 3dyo s SER 169 N -0.52 3.16 0.00 6.66 0.01 -0.05 -4.94 113.70 118.01 3dyo s SER 169 Ca 0.56 -0.57 0.08 0.00 1.31 0.00 0.00 55.95 57.33 3dyo s SER 169 Cb -0.41 -1.44 -0.02 0.00 0.21 0.00 0.00 66.02 64.35 3dyo s SER 169 CO 0.54 0.11 -0.26 -1.61 0.41 0.00 0.00 173.24 172.44 3dyo s GLU 170 N 0.63 2.03 -0.01 12.44 2.02 -1.26 -1.54 118.70 133.00 3dyo s GLU 170 Ca -0.11 -0.98 0.02 0.00 0.02 0.00 0.00 54.97 53.91 3dyo s GLU 170 Cb -0.16 -2.03 -0.00 0.00 0.10 0.00 0.00 34.13 32.03 3dyo s GLU 170 CO 0.02 0.55 -0.05 -0.06 0.02 0.00 0.00 175.26 175.74 3dyo s PHE 171 N -0.68 0.49 -0.13 1.61 0.40 -1.01 -0.66 117.98 118.01 3dyo s PHE 171 Ca 0.11 -0.09 -0.28 0.00 -0.60 0.00 0.00 56.93 56.06 3dyo s PHE 171 Cb -0.10 -0.34 -0.01 0.00 0.51 0.00 0.00 43.02 43.08 3dyo s PHE 171 CO 0.00 -0.03 0.94 0.34 0.70 0.00 0.00 175.22 177.18 3dyo s ASP 172 N 0.01 7.13 0.00 1.36 -1.08 -1.26 -1.95 116.67 120.88 3dyo s ASP 172 Ca 0.00 1.39 0.14 0.00 -0.52 0.00 0.00 52.55 53.57 3dyo s ASP 172 Cb -0.04 -2.52 0.27 0.00 -1.46 0.00 0.00 42.92 39.18 3dyo s ASP 172 CO -0.00 -0.44 1.17 0.18 0.52 0.00 0.00 175.17 176.60 3dyo n LEU 173 N 5.13 2.76 -0.37 -1.34 4.77 0.43 -4.66 117.00 123.72 3dyo n LEU 173 Ca 0.07 -1.59 -0.02 0.00 -0.03 0.00 0.00 56.01 54.43 3dyo n LEU 173 Cb 0.49 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.42 3dyo n LEU 173 CO 0.51 0.63 0.54 -1.20 -1.33 0.00 0.00 177.39 176.54 3dyo n SER 174 N 0.79 -0.68 0.00 -1.43 7.64 -0.93 0.26 113.62 119.27 3dyo n SER 174 Ca 0.12 1.68 0.11 0.00 1.01 0.00 0.00 58.87 61.78 3dyo n SER 174 Cb 0.42 -0.36 0.51 0.00 -1.01 0.00 0.00 64.21 63.78 3dyo n SER 174 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dyo n ALA 175 N -3.46 2.07 -0.07 -0.43 0.00 -1.26 -3.38 120.51 113.98 3dyo n ALA 175 Ca 0.09 -0.09 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3dyo n ALA 175 Cb 0.36 -1.36 -0.15 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.40 0.45 -2.02 0.00 3.01 0.73 -4.99 117.46 113.23 3dyo n PHE 176 Ca 0.08 0.16 -0.29 0.00 1.01 0.00 0.00 57.45 58.41 3dyo n PHE 176 Cb 0.22 -1.08 0.06 0.00 -0.01 0.00 0.00 39.48 38.67 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 -5.82 2.84 0.02 4.37 1.43 0.04 -4.78 118.68 116.79 3dyo s LEU 177 Ca -0.09 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 3dyo s LEU 177 Cb 0.07 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.70 3dyo s LEU 177 CO 0.82 -1.48 -0.04 0.00 0.23 0.00 0.00 176.35 175.88 3dyo s ARG 178 N -5.34 0.35 0.77 1.70 1.70 -1.26 -5.02 118.95 111.85 3dyo s ARG 178 Ca 0.59 -0.65 -0.15 0.00 -0.47 0.00 0.00 55.73 55.05 3dyo s ARG 178 Cb -0.11 0.06 0.03 0.00 -0.57 0.00 0.00 34.95 34.35 3dyo s ARG 178 CO 0.49 -0.04 0.94 0.00 -1.08 0.00 0.00 175.30 175.61 3dyo n ALA 179 N 1.54 -0.52 -0.40 7.88 0.00 -1.26 -4.64 120.51 123.09 3dyo n ALA 179 Ca -0.24 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.93 3dyo n ALA 179 Cb 0.55 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.90 3dyo n ALA 179 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyo n GLY 180 N 1.04 1.43 3.75 0.00 0.00 -0.37 -4.86 105.19 106.17 3dyo n GLY 180 Ca 0.12 -0.68 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 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 4.45 0.07 1.61 0.41 -1.26 -0.38 118.70 123.60 3dyo s GLU 181 Ca 0.00 1.99 -0.00 0.00 -0.41 0.00 0.00 54.97 56.55 3dyo s GLU 181 Cb 0.00 -3.18 -0.04 0.00 -1.78 0.00 0.00 34.13 29.13 3dyo s GLU 181 CO 0.00 -0.12 -0.03 -0.80 -0.49 0.00 0.00 175.26 173.82 3dyo s ASN 182 N -0.06 0.62 -0.05 -0.19 0.01 0.44 -4.89 114.94 110.82 3dyo s ASN 182 Ca 0.52 -1.03 0.00 0.00 -0.71 0.00 0.00 52.86 51.65 3dyo s ASN 182 Cb -0.35 0.19 0.02 0.00 0.41 0.00 0.00 41.25 41.52 3dyo s ASN 182 CO 0.41 -0.59 -0.03 -0.60 -1.51 0.00 0.00 177.10 174.78 3dyo s ARG 183 N -3.92 0.80 0.08 -0.60 3.52 -1.26 0.79 118.95 118.37 3dyo s ARG 183 Ca 0.10 -0.06 0.02 0.00 -0.13 0.00 0.00 55.73 55.66 3dyo s ARG 183 Cb 0.07 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.52 3dyo s ARG 183 CO -0.07 -0.14 0.15 -0.51 -0.81 0.00 0.00 175.30 173.92 3dyo s LEU 184 N 1.20 4.06 -0.04 -0.88 1.43 0.28 -0.99 118.68 123.74 3dyo s LEU 184 Ca -0.07 0.11 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 3dyo s LEU 184 Cb -0.14 -2.70 0.02 0.00 0.03 0.00 0.00 46.19 43.41 3dyo s LEU 184 CO -0.02 0.15 -0.04 0.00 0.23 0.00 0.00 176.35 176.68 3dyo s ALA 185 N -1.49 0.60 -0.18 4.21 0.00 0.28 -2.40 121.76 122.78 3dyo s ALA 185 Ca 0.32 -0.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 3dyo s ALA 185 Cb -0.12 -0.39 0.04 0.00 0.00 0.00 0.00 23.12 22.65 3dyo s ALA 185 CO 0.25 -0.01 -0.06 0.08 0.00 0.00 0.00 175.76 176.02 3dyo s VAL 186 N 0.91 1.20 -0.42 0.00 1.01 0.12 -0.17 120.40 123.04 3dyo s VAL 186 Ca -0.11 -0.74 -0.17 0.00 0.00 0.00 0.00 61.98 60.96 3dyo s VAL 186 Cb -0.14 -1.38 0.02 0.00 0.00 0.00 0.00 36.38 34.88 3dyo s VAL 186 CO -0.00 0.10 0.44 -0.32 0.00 0.00 0.00 175.10 175.31 3dyo s MET 187 N 1.59 3.10 -0.22 2.72 1.75 -0.65 -1.40 119.30 126.18 3dyo s MET 187 Ca -0.00 -0.76 -0.10 0.00 -1.25 0.00 0.00 55.69 53.58 3dyo s MET 187 Cb -0.16 -3.97 -0.05 0.00 2.84 0.00 0.00 34.83 33.50 3dyo s MET 187 CO -0.08 -0.85 0.14 0.08 -0.65 0.00 0.00 175.02 173.66 3dyo s VAL 188 N 2.13 5.24 -0.21 10.11 1.01 0.10 -1.88 120.40 136.91 3dyo s VAL 188 Ca 0.12 0.13 -0.14 0.00 0.00 0.00 0.00 61.98 62.10 3dyo s VAL 188 Cb -0.17 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3dyo s VAL 188 CO 0.14 0.38 0.31 -0.76 0.00 0.00 0.00 175.10 175.16 3dyo s LEU 189 N 0.83 4.15 0.14 3.92 1.43 -0.34 -1.01 118.68 127.81 3dyo s LEU 189 Ca 0.07 0.38 -0.17 0.00 -1.03 0.00 0.00 54.13 53.37 3dyo s LEU 189 Cb -0.13 -2.36 0.02 0.00 0.03 0.00 0.00 46.19 43.76 3dyo s LEU 189 CO 0.02 -0.01 1.74 -0.09 0.23 0.00 0.00 176.35 178.25 3dyo h ARG 190 N 7.33 0.21 -6.71 1.70 2.43 -1.46 -1.97 114.38 115.91 3dyo h ARG 190 Ca -0.37 -0.01 -0.68 0.00 -0.81 0.00 0.00 59.98 58.10 3dyo h ARG 190 Cb 1.16 -0.05 -0.20 0.00 -0.42 0.00 0.00 29.97 30.46 3dyo h ARG 190 CO 0.70 0.14 -0.82 -1.58 -1.51 0.00 0.00 179.97 176.91 3dyo s TRP 191 N -6.17 2.50 0.30 2.20 0.52 -1.26 -3.96 118.94 113.07 3dyo s TRP 191 Ca -0.13 -0.28 -0.15 0.00 0.02 0.00 0.00 56.10 55.55 3dyo s TRP 191 Cb 0.11 -1.37 0.02 0.00 -1.15 0.00 0.00 33.47 31.08 3dyo s TRP 191 CO 0.70 0.33 0.63 -1.54 0.02 0.00 0.00 176.95 177.09 3dyo s SER 192 N -1.88 -0.00 0.46 2.95 1.04 -1.26 -4.91 113.70 110.10 3dyo s SER 192 Ca 0.16 -0.94 0.31 0.00 0.48 0.00 0.00 55.95 55.96 3dyo s SER 192 Cb -0.10 0.71 1.66 0.00 0.10 0.00 0.00 66.02 68.38 3dyo s SER 192 CO 0.08 -1.36 1.95 -2.24 0.98 0.00 0.00 173.24 172.65 3dyo h ASP 193 N 2.09 0.00 0.53 7.02 3.04 -1.31 0.34 116.42 128.13 3dyo h ASP 193 Ca -0.25 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.49 3dyo h ASP 193 Cb 1.25 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.53 3dyo h ASP 193 CO 0.33 0.00 -0.21 1.23 -2.04 0.00 0.00 179.24 178.55 3dyo h GLY 194 N 0.19 0.00 2.00 7.15 0.00 -1.90 -2.52 103.07 107.99 3dyo h GLY 194 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3dyo h GLY 194 CO 0.00 0.00 -0.24 1.76 0.00 0.00 0.00 176.54 178.06 3dyo h SER 195 N 0.00 0.00 -0.08 0.19 0.02 -0.66 -1.53 113.55 111.48 3dyo h SER 195 Ca -0.00 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3dyo h SER 195 Cb 0.52 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 3dyo h SER 195 CO 0.03 0.24 0.09 1.88 -1.14 0.00 0.00 176.83 177.93 3dyo h TYR 196 N 0.00 0.00 -0.56 3.45 -1.99 -1.57 0.12 116.97 116.43 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 0.43 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.16 3dyo h TYR 196 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 3dyo n LEU 197 N -3.86 3.65 -2.65 3.88 4.77 -0.59 -4.50 117.00 117.70 3dyo n LEU 197 Ca -0.01 -2.09 -0.21 0.00 -0.03 0.00 0.00 56.01 53.67 3dyo n LEU 197 Cb 0.19 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 3dyo n LEU 197 CO 0.28 0.86 0.06 -0.62 -1.33 0.00 0.00 177.39 176.63 3dyo n GLU 198 N 1.06 2.53 -0.70 3.23 1.02 0.44 -1.13 120.64 127.08 3dyo n GLU 198 Ca 0.20 -4.09 -0.14 0.00 -0.02 0.00 0.00 57.16 53.11 3dyo n GLU 198 Cb 0.59 -1.90 0.09 0.00 -0.02 0.00 0.00 31.44 30.19 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 -0.26 3.87 -4.76 1.62 2.03 0.39 -4.97 116.55 114.47 3dyo n ASP 199 Ca 0.28 -2.91 -0.39 0.00 0.52 0.00 0.00 54.79 52.30 3dyo n ASP 199 Cb 0.67 -0.74 0.02 0.00 -0.72 0.00 0.00 41.12 40.35 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 -1.81 3.57 -0.97 -0.67 1.11 -1.26 -4.59 119.66 115.03 3dyo s GLN 200 Ca 0.31 2.16 -0.24 0.00 0.01 0.00 0.00 55.36 57.61 3dyo s GLN 200 Cb 0.26 -2.49 -0.00 0.00 -1.01 0.00 0.00 33.01 29.77 3dyo s GLN 200 CO 0.05 -0.82 1.72 0.34 0.01 0.00 0.00 175.29 176.59 3dyo s ASP 201 N -0.89 5.77 0.16 5.90 2.15 -1.25 -4.83 116.67 123.68 3dyo s ASP 201 Ca 0.64 -1.08 -0.24 0.00 0.43 0.00 0.00 52.55 52.30 3dyo s ASP 201 Cb -0.38 -2.57 0.07 0.00 -0.30 0.00 0.00 42.92 39.75 3dyo s ASP 201 CO 0.47 -2.18 1.01 0.00 -0.17 0.00 0.00 175.17 174.31 3dyo s MET 202 N 6.04 1.21 0.36 4.34 0.23 -1.26 -5.02 119.30 125.20 3dyo s MET 202 Ca 0.59 -0.72 -0.28 0.00 -1.03 0.00 0.00 55.69 54.25 3dyo s MET 202 Cb -0.03 0.38 -0.11 0.00 -1.53 0.00 0.00 34.83 33.53 3dyo s MET 202 CO -0.04 -0.56 1.46 0.91 -2.03 0.00 0.00 175.02 174.76 3dyo n TRP 203 N -0.56 2.81 -3.24 3.16 7.02 -1.26 -4.36 117.44 121.01 3dyo n TRP 203 Ca -0.05 0.45 -0.42 0.00 -1.02 0.00 0.00 57.50 56.46 3dyo n TRP 203 Cb 0.60 -2.51 -0.08 0.00 -2.42 0.00 0.00 31.31 26.90 3dyo n TRP 203 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3dyo s ARG 204 N -1.83 3.44 0.15 -0.99 1.81 0.16 -4.94 118.95 116.75 3dyo s ARG 204 Ca 0.55 -0.34 0.01 0.00 -1.72 0.00 0.00 55.73 54.23 3dyo s ARG 204 Cb -0.50 -3.87 -0.00 0.00 -0.45 0.00 0.00 34.95 30.13 3dyo s ARG 204 CO 0.61 -0.75 0.03 -1.33 -0.68 0.00 0.00 175.30 173.18 3dyo n MET 205 N 5.79 1.12 -3.74 3.54 2.81 -1.26 -2.59 117.12 122.79 3dyo n MET 205 Ca -0.05 -1.21 -0.08 0.00 -1.81 0.00 0.00 57.70 54.55 3dyo n MET 205 Cb 0.48 0.52 -0.02 0.00 -0.71 0.00 0.00 33.22 33.49 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 -1.89 -0.33 0.00 7.83 1.04 -1.26 -4.81 113.70 114.28 3dyo s SER 206 Ca 0.04 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.04 3dyo s SER 206 Cb 0.00 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3dyo s SER 206 CO 0.03 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.65 3dyo n GLY 207 N -0.44 0.65 3.41 7.32 0.00 -0.40 -1.89 105.19 113.84 3dyo n GLY 207 Ca -0.07 -2.27 -0.45 0.00 0.00 0.00 0.00 46.02 43.23 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 -0.68 5.11 -1.83 -0.61 1.01 -1.11 -1.06 121.20 122.01 3dyo s ILE 208 Ca 0.00 -2.11 0.24 0.00 0.00 0.00 0.00 60.65 58.78 3dyo s ILE 208 Cb 0.00 -4.70 0.06 0.00 0.01 0.00 0.00 42.46 37.83 3dyo s ILE 208 CO 0.00 -1.37 1.24 2.22 0.00 0.00 0.00 174.94 177.02 3dyo n PHE 209 N 5.44 0.00 -4.48 3.97 1.16 -0.74 0.19 117.46 123.01 3dyo n PHE 209 Ca 0.23 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.58 3dyo n PHE 209 Cb 0.47 -0.05 -0.11 0.00 -1.61 0.00 0.00 39.48 38.19 3dyo n PHE 209 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3dyo s ARG 210 N -2.54 1.71 0.48 3.97 0.52 -1.06 -4.39 118.95 117.64 3dyo s ARG 210 Ca 0.19 -1.96 -0.19 0.00 -0.52 0.00 0.00 55.73 53.25 3dyo s ARG 210 Cb 0.18 -0.97 -0.14 0.00 0.52 0.00 0.00 34.95 34.55 3dyo s ARG 210 CO 0.58 -0.18 0.11 -0.25 0.02 0.00 0.00 175.30 175.59 3dyo n ASP 211 N -0.75 -2.71 -4.14 0.23 8.00 -1.26 -4.23 116.55 111.68 3dyo n ASP 211 Ca -0.03 0.74 -0.27 0.00 0.71 0.00 0.00 54.79 55.93 3dyo n ASP 211 Cb 0.67 -0.94 -0.16 0.00 -0.02 0.00 0.00 41.12 40.66 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 -1.82 1.55 0.22 2.53 1.01 -1.26 -0.44 120.40 122.20 3dyo s VAL 212 Ca 0.60 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 3dyo s VAL 212 Cb -0.54 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 3dyo s VAL 212 CO 0.62 0.45 0.36 -0.94 0.00 0.00 0.00 175.10 175.59 3dyo s SER 213 N 0.20 -0.01 -0.12 3.32 1.04 0.53 -0.35 113.70 118.30 3dyo s SER 213 Ca -0.09 -1.04 0.03 0.00 0.48 0.00 0.00 55.95 55.33 3dyo s SER 213 Cb -0.14 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.50 3dyo s SER 213 CO 0.04 -1.03 -0.20 -0.22 0.98 0.00 0.00 173.24 172.81 3dyo s LEU 214 N -3.05 1.97 -0.08 2.42 2.96 0.12 0.16 118.68 123.19 3dyo s LEU 214 Ca 0.26 -0.53 0.03 0.00 -0.22 0.00 0.00 54.13 53.67 3dyo s LEU 214 Cb 0.02 -1.31 0.01 0.00 0.50 0.00 0.00 46.19 45.41 3dyo s LEU 214 CO 0.09 0.08 -0.18 -0.22 -1.32 0.00 0.00 176.35 174.80 3dyo s LEU 215 N 0.75 1.86 -0.24 -0.68 2.96 0.52 -0.48 118.68 123.37 3dyo s LEU 215 Ca -0.10 -0.42 -0.09 0.00 -0.22 0.00 0.00 54.13 53.30 3dyo s LEU 215 Cb -0.16 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 3dyo s LEU 215 CO 0.01 0.10 0.11 -2.28 -1.32 0.00 0.00 176.35 172.96 3dyo s HIS 216 N 0.48 3.18 0.15 5.38 5.65 0.24 -0.85 115.29 129.51 3dyo s HIS 216 Ca -0.16 -0.10 0.10 0.00 0.25 0.00 0.00 55.06 55.15 3dyo s HIS 216 Cb -0.17 -2.24 -0.04 0.00 -1.18 0.00 0.00 32.58 28.96 3dyo s HIS 216 CO 0.06 -0.14 -0.22 0.15 -0.65 0.00 0.00 174.74 173.94 3dyo s LYS 217 N 1.28 1.61 0.73 2.88 -0.14 0.05 -4.74 119.74 121.41 3dyo s LYS 217 Ca 0.06 -1.34 -0.11 0.00 -1.36 0.00 0.00 55.97 53.22 3dyo s LYS 217 Cb -0.15 -1.97 0.03 0.00 -1.68 0.00 0.00 37.83 34.06 3dyo s LYS 217 CO 0.05 0.44 1.07 -2.14 -0.76 0.00 0.00 175.35 174.01 3dyo s PRO 218 N -2.33 2.66 0.31 -1.68 0.02 -1.26 0.20 135.00 132.92 3dyo s PRO 218 Ca 0.18 1.02 0.04 0.00 0.02 0.00 0.00 61.00 62.27 3dyo s PRO 218 Cb -0.09 -1.95 0.52 0.00 0.02 0.00 0.00 34.50 32.99 3dyo s PRO 218 CO 0.09 -1.31 1.79 1.15 -0.33 0.00 0.00 177.00 178.39 3dyo h THR 219 N -0.88 1.24 -3.75 0.99 2.02 -1.93 -3.35 112.91 107.25 3dyo h THR 219 Ca -0.44 -1.09 -0.67 0.00 0.77 0.00 0.00 66.41 64.99 3dyo h THR 219 Cb 1.22 1.25 -0.18 0.00 -1.74 0.00 0.00 68.15 68.70 3dyo h THR 219 CO 0.55 0.35 -0.46 -0.89 0.37 0.00 0.00 175.52 175.44 3dyo s THR 220 N -4.62 5.27 0.25 3.16 2.01 -1.26 -3.94 115.64 116.51 3dyo s THR 220 Ca -0.07 -0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.73 3dyo s THR 220 Cb 0.14 -3.69 -0.00 0.00 0.01 0.00 0.00 72.50 68.96 3dyo s THR 220 CO 0.77 0.04 0.49 0.00 -0.69 0.00 0.00 174.62 175.24 3dyo s GLN 221 N 1.78 1.58 -0.32 4.92 -2.07 -0.69 -4.90 119.66 119.95 3dyo s GLN 221 Ca 0.07 -1.27 -0.28 0.00 -1.82 0.00 0.00 55.36 52.07 3dyo s GLN 221 Cb -0.17 0.48 0.01 0.00 -1.09 0.00 0.00 33.01 32.24 3dyo s GLN 221 CO 0.11 -0.66 1.03 0.42 -1.32 0.00 0.00 175.29 174.86 3dyo s ILE 222 N -3.94 4.55 -0.65 3.63 1.01 -1.26 -1.97 121.20 122.55 3dyo s ILE 222 Ca 0.22 1.63 0.22 0.00 0.00 0.00 0.00 60.65 62.72 3dyo s ILE 222 Cb -0.01 -4.38 -0.23 0.00 0.01 0.00 0.00 42.46 37.85 3dyo s ILE 222 CO 0.09 -0.46 0.83 -1.54 0.00 0.00 0.00 174.94 173.87 3dyo n SER 223 N 6.78 0.63 -3.59 3.58 3.41 0.15 -4.93 113.62 119.65 3dyo n SER 223 Ca 0.11 -0.54 -0.06 0.00 -0.26 0.00 0.00 58.87 58.12 3dyo n SER 223 Cb 0.47 1.20 -0.03 0.00 -0.26 0.00 0.00 64.21 65.59 3dyo n SER 223 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dyo s ASP 224 N -3.61 -0.21 -0.25 4.04 2.15 -1.13 -4.92 116.67 112.74 3dyo s ASP 224 Ca 0.03 0.12 -0.24 0.00 0.43 0.00 0.00 52.55 52.89 3dyo s ASP 224 Cb 0.15 0.20 0.07 0.00 -0.30 0.00 0.00 42.92 43.03 3dyo s ASP 224 CO 0.86 -0.28 0.68 0.72 -0.17 0.00 0.00 175.17 176.98 3dyo s PHE 225 N -1.87 -0.74 -0.05 -5.34 -0.12 -1.26 -0.46 117.98 108.14 3dyo s PHE 225 Ca 0.06 1.80 0.04 0.00 -0.05 0.00 0.00 56.93 58.78 3dyo s PHE 225 Cb -0.01 0.26 -0.00 0.00 -0.63 0.00 0.00 43.02 42.64 3dyo s PHE 225 CO -0.04 -0.36 -0.19 -1.01 -0.05 0.00 0.00 175.22 173.57 3dyo s HIS 226 N 0.32 1.88 -0.10 3.49 3.76 0.71 -4.83 115.29 120.53 3dyo s HIS 226 Ca -0.00 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.34 3dyo s HIS 226 Cb -0.05 -1.26 -0.02 0.00 1.11 0.00 0.00 32.58 32.36 3dyo s HIS 226 CO 0.01 -0.20 -0.09 0.08 -0.85 0.00 0.00 174.74 173.69 3dyo s VAL 227 N 0.07 3.45 0.10 -0.90 1.01 -1.26 -1.54 120.40 121.32 3dyo s VAL 227 Ca -0.06 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.43 3dyo s VAL 227 Cb -0.13 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 3dyo s VAL 227 CO 0.03 0.56 -0.14 0.00 0.00 0.00 0.00 175.10 175.55 3dyo s ALA 228 N -0.24 1.30 -0.10 5.51 0.00 0.42 -4.86 121.76 123.78 3dyo s ALA 228 Ca 0.03 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 50.83 3dyo s ALA 228 Cb -0.13 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.95 3dyo s ALA 228 CO 0.03 0.11 -0.04 0.95 0.00 0.00 0.00 175.76 176.80 3dyo s THR 229 N -1.81 0.78 0.24 0.00 -4.23 -1.26 -0.68 115.64 108.68 3dyo s THR 229 Ca 0.04 -0.17 0.10 0.00 -1.18 0.00 0.00 61.69 60.48 3dyo s THR 229 Cb -0.07 -0.87 -0.04 0.00 1.34 0.00 0.00 72.50 72.86 3dyo s THR 229 CO 0.02 0.30 -0.09 0.00 -0.54 0.00 0.00 174.62 174.31 3dyo s ARG 230 N 1.81 2.03 0.25 3.99 1.70 -0.45 -4.81 118.95 123.48 3dyo s ARG 230 Ca 0.05 -1.45 0.01 0.00 -0.47 0.00 0.00 55.73 53.86 3dyo s ARG 230 Cb -0.13 -2.05 -0.05 0.00 -0.57 0.00 0.00 34.95 32.15 3dyo s ARG 230 CO -0.07 0.38 0.09 -0.06 -1.08 0.00 0.00 175.30 174.57 3dyo s PHE 231 N -2.12 1.51 0.46 5.89 0.40 -1.26 -1.92 117.98 120.94 3dyo s PHE 231 Ca 0.28 -1.18 -0.05 0.00 -0.60 0.00 0.00 56.93 55.38 3dyo s PHE 231 Cb -0.07 -0.88 0.10 0.00 0.51 0.00 0.00 43.02 42.68 3dyo s PHE 231 CO 0.17 -0.34 0.63 0.27 0.70 0.00 0.00 175.22 176.64 3dyo n ASN 232 N -0.45 0.34 -0.17 1.36 6.94 -0.80 -4.93 115.26 117.54 3dyo n ASN 232 Ca -0.00 -1.40 0.04 0.00 -0.02 0.00 0.00 54.58 53.20 3dyo n ASN 232 Cb 0.66 -0.45 0.33 0.00 -2.36 0.00 0.00 39.78 37.96 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 -0.66 0.69 -0.10 0.53 3.04 -2.02 -2.70 116.42 115.21 3dyo h ASP 233 Ca -0.20 -0.01 -0.03 0.00 -3.24 0.00 0.00 57.03 53.55 3dyo h ASP 233 Cb 0.63 -0.16 -0.02 0.00 -1.04 0.00 0.00 39.33 38.75 3dyo h ASP 233 CO 0.17 0.47 -0.16 -0.90 -2.04 0.00 0.00 179.24 176.79 3dyo n ASP 234 N -4.46 2.43 -1.51 4.15 5.75 -1.26 -4.96 116.55 116.69 3dyo n ASP 234 Ca 0.09 -3.43 -0.17 0.00 -0.01 0.00 0.00 54.79 51.27 3dyo n ASP 234 Cb 0.15 -0.51 -0.06 0.00 -1.03 0.00 0.00 41.12 39.67 3dyo n ASP 234 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3dyo n PHE 235 N -1.15 -0.21 1.29 2.11 3.01 -1.02 -4.85 117.46 116.64 3dyo n PHE 235 Ca 0.21 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.79 3dyo n PHE 235 Cb 0.76 -3.12 0.41 0.00 -0.01 0.00 0.00 39.48 37.51 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 -0.95 1.89 -3.84 4.37 3.41 -1.26 -4.60 113.62 112.64 3dyo n SER 236 Ca -0.18 -1.65 -0.12 0.00 -0.26 0.00 0.00 58.87 56.65 3dyo n SER 236 Cb 0.60 -0.04 -0.10 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 -1.93 0.49 0.08 4.33 0.52 -1.26 0.18 118.95 121.36 3dyo s ARG 237 Ca 0.35 -0.25 -0.11 0.00 -0.52 0.00 0.00 55.73 55.20 3dyo s ARG 237 Cb 0.20 0.21 0.01 0.00 0.52 0.00 0.00 34.95 35.89 3dyo s ARG 237 CO 0.31 -0.12 0.25 0.00 0.02 0.00 0.00 175.30 175.76 3dyo s ALA 238 N -1.15 -0.45 -0.14 2.13 0.00 0.21 -1.91 121.76 120.45 3dyo s ALA 238 Ca -0.12 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.48 3dyo s ALA 238 Cb -0.06 0.48 0.02 0.00 0.00 0.00 0.00 23.12 23.56 3dyo s ALA 238 CO 0.02 -0.51 -0.18 0.08 0.00 0.00 0.00 175.76 175.17 3dyo s VAL 239 N -3.52 1.79 -0.20 0.00 1.01 -0.81 0.90 120.40 119.57 3dyo s VAL 239 Ca 0.02 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.07 3dyo s VAL 239 Cb 0.03 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 3dyo s VAL 239 CO -0.09 0.50 0.27 -0.22 0.00 0.00 0.00 175.10 175.55 3dyo s LEU 240 N 1.11 4.17 -0.16 3.92 0.20 -0.07 -1.34 118.68 126.52 3dyo s LEU 240 Ca -0.02 0.36 0.00 0.00 0.69 0.00 0.00 54.13 55.16 3dyo s LEU 240 Cb -0.14 -2.30 -0.00 0.00 -0.43 0.00 0.00 46.19 43.31 3dyo s LEU 240 CO -0.06 0.04 -0.15 -1.61 -0.29 0.00 0.00 176.35 174.28 3dyo s GLU 241 N 0.91 3.20 -0.17 1.98 2.02 0.14 0.10 118.70 126.88 3dyo s GLU 241 Ca 0.14 -0.75 0.01 0.00 0.02 0.00 0.00 54.97 54.38 3dyo s GLU 241 Cb -0.13 -2.63 0.03 0.00 0.10 0.00 0.00 34.13 31.50 3dyo s GLU 241 CO 0.05 -0.00 -0.13 0.00 0.02 0.00 0.00 175.26 175.19 3dyo s ALA 242 N 0.86 1.94 -0.20 5.21 0.00 -0.11 -0.43 121.76 129.03 3dyo s ALA 242 Ca -0.04 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 50.77 3dyo s ALA 242 Cb -0.15 -1.14 -0.05 0.00 0.00 0.00 0.00 23.12 21.78 3dyo s ALA 242 CO -0.01 -0.53 0.19 -2.00 0.00 0.00 0.00 175.76 173.41 3dyo s GLU 243 N 1.44 4.19 -0.06 0.00 2.12 -0.59 -0.57 118.70 125.23 3dyo s GLU 243 Ca 0.03 -0.12 0.04 0.00 0.36 0.00 0.00 54.97 55.28 3dyo s GLU 243 Cb -0.14 -3.45 -0.00 0.00 0.26 0.00 0.00 34.13 30.80 3dyo s GLU 243 CO -0.10 0.22 -0.20 0.08 -0.54 0.00 0.00 175.26 174.73 3dyo s VAL 244 N 0.57 1.66 0.02 3.70 1.01 0.06 -0.21 120.40 127.21 3dyo s VAL 244 Ca 0.11 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.34 3dyo s VAL 244 Cb -0.12 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 3dyo s VAL 244 CO 0.01 0.47 -0.22 -1.10 0.00 0.00 0.00 175.10 174.26 3dyo s GLN 245 N 0.19 2.04 0.26 2.72 -0.21 0.40 -1.58 119.66 123.47 3dyo s GLN 245 Ca -0.10 -0.98 0.12 0.00 0.02 0.00 0.00 55.36 54.42 3dyo s GLN 245 Cb -0.14 -2.11 -0.05 0.00 1.00 0.00 0.00 33.01 31.70 3dyo s GLN 245 CO 0.04 0.54 -0.20 0.00 -2.12 0.00 0.00 175.29 173.56 3dyo s MET 246 N -1.14 1.67 0.14 2.91 0.23 -0.70 0.31 119.30 122.73 3dyo s MET 246 Ca 0.12 -1.71 0.08 0.00 -1.03 0.00 0.00 55.69 53.15 3dyo s MET 246 Cb -0.10 -1.80 -0.04 0.00 -1.53 0.00 0.00 34.83 31.36 3dyo s MET 246 CO 0.02 0.34 -0.18 0.00 -2.03 0.00 0.00 175.02 173.18 3dyo n GLY 248 N 0.50 -1.20 3.72 0.00 0.00 -1.25 -1.71 105.19 105.26 3dyo n GLY 248 Ca -0.15 -2.23 -0.42 0.00 0.00 0.00 0.00 46.02 43.22 3dyo n GLY 248 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyo s GLU 249 N -0.72 4.30 0.26 1.61 0.41 -1.26 -4.98 118.70 118.31 3dyo s GLU 249 Ca 0.00 2.17 -0.30 0.00 -0.41 0.00 0.00 54.97 56.43 3dyo s GLU 249 Cb 0.00 -3.20 -0.09 0.00 -1.78 0.00 0.00 34.13 29.06 3dyo s GLU 249 CO 0.00 -0.45 1.08 -0.51 -0.49 0.00 0.00 175.26 174.89 3dyo s LEU 250 N 0.78 4.55 -0.08 1.80 1.43 -1.26 -5.02 118.68 120.88 3dyo s LEU 250 Ca 0.64 2.20 -0.06 0.00 -1.03 0.00 0.00 54.13 55.88 3dyo s LEU 250 Cb -0.39 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.23 3dyo s LEU 250 CO 0.33 -0.13 0.20 -0.13 0.23 0.00 0.00 176.35 176.85 3dyo s ARG 251 N -1.21 0.21 0.54 1.70 1.81 -1.26 -5.04 118.95 115.71 3dyo s ARG 251 Ca 0.45 0.31 0.23 0.00 -1.72 0.00 0.00 55.73 55.00 3dyo s ARG 251 Cb -0.31 0.05 1.41 0.00 -0.45 0.00 0.00 34.95 35.65 3dyo s ARG 251 CO 0.39 -0.06 2.07 -0.44 -0.68 0.00 0.00 175.30 176.58 3dyo h ASP 252 N 6.15 0.00 0.88 0.23 3.32 -1.99 -1.48 116.42 123.53 3dyo h ASP 252 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3dyo h ASP 252 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3dyo h ASP 252 CO 0.39 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.91 3dyo n TYR 253 N -4.32 0.00 -2.35 4.55 0.18 -1.26 -4.87 117.16 109.09 3dyo n TYR 253 Ca 0.04 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.43 3dyo n TYR 253 Cb 0.37 -0.44 -0.03 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 -2.88 4.23 0.08 -3.48 1.43 -0.56 0.47 118.68 117.97 3dyo s LEU 254 Ca 0.18 2.29 -0.02 0.00 -1.03 0.00 0.00 54.13 55.55 3dyo s LEU 254 Cb 0.19 -4.00 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 3dyo s LEU 254 CO 0.51 -0.59 0.03 -0.13 0.23 0.00 0.00 176.35 176.40 3dyo s ARG 255 N -2.23 0.74 -0.02 1.70 1.81 0.81 -4.04 118.95 117.72 3dyo s ARG 255 Ca 0.56 -1.25 0.03 0.00 -1.72 0.00 0.00 55.73 53.35 3dyo s ARG 255 Cb -0.29 0.24 -0.00 0.00 -0.45 0.00 0.00 34.95 34.44 3dyo s ARG 255 CO 0.37 -0.18 -0.12 0.08 -0.68 0.00 0.00 175.30 174.77 3dyo s VAL 256 N -3.95 0.98 -0.11 3.52 1.01 -0.19 -1.71 120.40 119.96 3dyo s VAL 256 Ca 0.12 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.61 3dyo s VAL 256 Cb 0.07 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.63 3dyo s VAL 256 CO -0.07 0.29 -0.12 -0.89 0.00 0.00 0.00 175.10 174.31 3dyo s THR 257 N -0.06 1.28 -0.20 3.92 2.01 0.35 -1.20 115.64 121.75 3dyo s THR 257 Ca 0.00 -0.49 -0.03 0.00 0.31 0.00 0.00 61.69 61.48 3dyo s THR 257 Cb -0.07 -1.21 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 3dyo s THR 257 CO 0.00 0.40 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.58 3dyo s VAL 258 N 1.22 3.25 0.07 3.82 1.01 0.15 -0.20 120.40 129.70 3dyo s VAL 258 Ca -0.03 -0.55 0.10 0.00 0.00 0.00 0.00 61.98 61.50 3dyo s VAL 258 Cb -0.14 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 3dyo s VAL 258 CO -0.04 0.45 -0.26 -0.94 0.00 0.00 0.00 175.10 174.31 3dyo s SER 259 N 1.22 3.18 -0.11 3.32 1.04 -0.47 -0.84 113.70 121.04 3dyo s SER 259 Ca 0.02 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.84 3dyo s SER 259 Cb -0.14 -0.27 -0.01 0.00 0.10 0.00 0.00 66.02 65.70 3dyo s SER 259 CO -0.02 0.23 -0.16 -0.22 0.98 0.00 0.00 173.24 174.05 3dyo s LEU 260 N -1.46 2.55 0.04 2.42 2.96 0.15 -0.33 118.68 125.01 3dyo s LEU 260 Ca 0.12 -0.37 0.07 0.00 -0.22 0.00 0.00 54.13 53.73 3dyo s LEU 260 Cb -0.10 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.02 3dyo s LEU 260 CO 0.03 0.19 -0.21 0.26 -1.32 0.00 0.00 176.35 175.30 3dyo s TRP 261 N 0.20 1.83 -0.82 5.38 0.52 0.53 0.15 118.94 126.74 3dyo s TRP 261 Ca -0.10 -0.37 -0.04 0.00 0.02 0.00 0.00 56.10 55.61 3dyo s TRP 261 Cb -0.16 -1.10 0.21 0.00 -1.15 0.00 0.00 33.47 31.27 3dyo s TRP 261 CO 0.06 0.08 0.69 -1.14 0.02 0.00 0.00 176.95 176.66 3dyo s GLN 262 N -1.11 3.15 6.15 4.98 -0.44 0.39 -0.32 119.66 132.46 3dyo s GLN 262 Ca 0.08 -2.95 0.00 0.00 -2.50 0.00 0.00 55.36 49.99 3dyo s GLN 262 Cb -0.09 -3.98 0.00 0.00 -1.64 0.00 0.00 33.01 27.30 3dyo s GLN 262 CO 0.01 -1.24 0.00 0.41 0.50 0.00 0.00 175.29 174.98 3dyo n GLY 263 N 2.90 1.70 0.30 2.59 0.00 -1.26 -2.15 105.19 109.27 3dyo n GLY 263 Ca 0.16 -0.52 0.15 0.00 0.00 0.00 0.00 46.02 45.81 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 12.91 1.37 -3.64 1.61 1.02 -1.26 -4.81 120.64 127.84 3dyo n GLU 264 Ca 0.00 -0.59 -0.36 0.00 -0.02 0.00 0.00 57.16 56.19 3dyo n GLU 264 Cb 0.00 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 29.85 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 -2.04 5.35 -0.04 2.62 2.01 -0.92 -5.05 115.64 117.58 3dyo s THR 265 Ca 0.40 0.30 -0.29 0.00 0.31 0.00 0.00 61.69 62.41 3dyo s THR 265 Cb 0.21 -3.54 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 3dyo s THR 265 CO 0.36 0.38 0.97 -1.58 -0.69 0.00 0.00 174.62 174.06 3dyo s GLN 266 N 0.73 4.50 -0.02 4.92 0.74 -1.26 -0.46 119.66 128.81 3dyo s GLN 266 Ca 0.10 1.38 0.20 0.00 0.05 0.00 0.00 55.36 57.09 3dyo s GLN 266 Cb -0.13 -3.49 -0.30 0.00 1.10 0.00 0.00 33.01 30.20 3dyo s GLN 266 CO 0.02 -0.14 0.47 1.33 -0.55 0.00 0.00 175.29 176.43 3dyo n VAL 267 N 4.14 0.00 -3.49 1.34 0.24 0.40 -4.91 118.33 116.05 3dyo n VAL 267 Ca 0.07 -0.41 -0.13 0.00 -2.04 0.00 0.00 64.34 61.83 3dyo n VAL 267 Cb 0.50 0.15 -0.04 0.00 -1.47 0.00 0.00 33.84 32.99 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 -3.31 -1.74 -0.04 2.33 0.00 -1.17 -5.00 121.76 112.84 3dyo s ALA 268 Ca -0.06 1.01 -0.24 0.00 0.00 0.00 0.00 51.96 52.68 3dyo s ALA 268 Cb 0.13 0.29 0.05 0.00 0.00 0.00 0.00 23.12 23.59 3dyo s ALA 268 CO 0.82 -0.56 0.51 0.45 0.00 0.00 0.00 175.76 176.98 3dyo s SER 269 N -1.96 -0.45 -0.02 0.00 0.15 -1.26 -0.68 113.70 109.49 3dyo s SER 269 Ca -0.03 0.44 -0.02 0.00 0.70 0.00 0.00 55.95 57.04 3dyo s SER 269 Cb -0.01 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.75 3dyo s SER 269 CO -0.03 -0.53 0.05 -0.83 1.20 0.00 0.00 173.24 173.10 3dyo s GLY 270 N -1.23 -0.01 -0.00 9.45 0.00 -0.02 -4.98 107.32 110.53 3dyo s GLY 270 Ca -0.12 0.07 0.03 0.00 0.00 0.00 0.00 44.72 44.71 3dyo s GLY 270 CO 0.07 0.04 -0.11 -1.59 0.00 0.00 0.00 173.10 171.51 3dyo s THR 271 N -0.18 0.88 0.08 0.90 2.01 -1.26 -0.68 115.64 117.39 3dyo s THR 271 Ca -0.02 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.19 3dyo s THR 271 Cb -0.02 -0.75 0.08 0.00 0.01 0.00 0.00 72.50 71.83 3dyo s THR 271 CO 0.00 0.21 0.71 0.00 -0.69 0.00 0.00 174.62 174.85 3dyo s ALA 272 N -0.34 -1.70 0.51 7.40 0.00 -0.34 -4.98 121.76 122.32 3dyo s ALA 272 Ca 0.04 0.76 -0.07 0.00 0.00 0.00 0.00 51.96 52.69 3dyo s ALA 272 Cb -0.05 0.62 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 3dyo s ALA 272 CO -0.00 -0.70 0.84 -1.25 0.00 0.00 0.00 175.76 174.65 3dyo s PRO 273 N -3.28 3.56 0.66 0.00 0.04 -1.26 -1.02 135.00 133.71 3dyo s PRO 273 Ca 0.01 0.33 -0.16 0.00 0.04 0.00 0.00 61.00 61.22 3dyo s PRO 273 Cb -0.01 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3dyo s PRO 273 CO -0.10 -0.29 1.19 -0.06 0.04 0.00 0.00 177.00 177.79 3dyo s PHE 274 N -2.84 2.29 0.00 0.56 0.40 -1.26 -4.84 117.98 112.29 3dyo s PHE 274 Ca 0.49 1.56 0.00 0.00 -0.60 0.00 0.00 56.93 58.38 3dyo s PHE 274 Cb -0.10 -3.42 0.00 0.00 0.51 0.00 0.00 43.02 40.01 3dyo s PHE 274 CO 0.47 -2.28 0.00 0.41 0.70 0.00 0.00 175.22 174.52 3dyo n GLY 275 N 0.26 2.08 3.84 4.36 0.00 0.15 -4.95 105.19 110.92 3dyo n GLY 275 Ca 0.13 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 1.59 0.89 -0.02 0.00 0.31 -4.81 107.32 105.28 3dyo s GLY 276 Ca 0.00 -0.53 -0.10 0.00 0.00 0.00 0.00 44.72 44.08 3dyo s GLY 276 CO 0.00 -0.03 1.12 -1.83 0.00 0.00 0.00 173.10 172.36 3dyo s GLU 277 N -5.40 1.27 0.27 2.90 1.03 -1.26 -4.42 118.70 113.09 3dyo s GLU 277 Ca 0.62 1.37 -0.30 0.00 0.03 0.00 0.00 54.97 56.69 3dyo s GLU 277 Cb -0.13 -1.77 -0.10 0.00 -0.80 0.00 0.00 34.13 31.33 3dyo s GLU 277 CO 0.51 -2.39 1.44 0.42 -1.33 0.00 0.00 175.26 173.91 3dyo s ILE 278 N -2.73 2.60 -0.03 1.83 1.01 -1.26 -4.24 121.20 118.38 3dyo s ILE 278 Ca 0.65 0.52 0.04 0.00 0.00 0.00 0.00 60.65 61.86 3dyo s ILE 278 Cb -0.21 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 3dyo s ILE 278 CO 0.58 0.09 0.03 2.30 0.00 0.00 0.00 174.94 177.94 3dyo n ILE 279 N 2.06 0.23 -2.72 2.92 -5.35 0.42 -4.89 119.36 112.04 3dyo n ILE 279 Ca 0.06 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 3dyo n ILE 279 Cb 0.40 -0.67 0.00 0.00 -1.74 0.00 0.00 39.64 37.63 3dyo n ILE 279 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3dyo n ASP 280 N -2.07 0.00 0.31 7.28 5.68 -0.39 -4.99 116.55 122.37 3dyo n ASP 280 Ca -0.06 -0.47 0.18 0.00 -0.50 0.00 0.00 54.79 53.94 3dyo n ASP 280 Cb 0.55 0.00 1.01 0.00 -1.14 0.00 0.00 41.12 41.54 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 -0.35 0.11 3.07 -2.04 -1.65 114.58 113.71 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 0.01 0.00 0.54 -1.40 0.00 0.00 179.01 178.16 3dyo n ARG 282 N -3.56 2.29 0.00 2.33 5.12 -1.26 -5.07 116.66 116.51 3dyo n ARG 282 Ca -0.03 -1.96 0.00 0.00 -1.93 0.00 0.00 57.85 53.93 3dyo n ARG 282 Cb 0.09 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 29.91 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 1.40 0.09 0.27 -0.13 0.00 -0.62 -5.05 105.19 101.14 3dyo n GLY 283 Ca 0.18 -2.10 -0.02 0.00 0.00 0.00 0.00 46.02 44.08 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 4.08 3.55 -0.02 0.00 -1.26 -0.43 105.19 111.10 3dyo n GLY 284 Ca 0.00 -2.03 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 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 -1.48 3.19 -0.09 1.61 1.51 -1.26 -4.89 117.35 115.94 3dyo s TYR 285 Ca 0.01 0.06 0.21 0.00 -1.01 0.00 0.00 57.07 56.34 3dyo s TYR 285 Cb 0.00 -2.80 0.53 0.00 -0.11 0.00 0.00 41.96 39.58 3dyo s TYR 285 CO 0.01 -0.50 1.66 0.00 -1.11 0.00 0.00 175.55 175.61 3dyo h ALA 286 N 8.47 0.89 -0.41 3.71 0.00 -1.95 0.96 119.26 130.94 3dyo h ALA 286 Ca -0.29 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 3dyo h ALA 286 Cb 1.13 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 3dyo h ALA 286 CO 0.74 0.32 0.05 -0.40 0.00 0.00 0.00 179.25 179.96 3dyo n ASP 287 N -3.25 4.01 -4.13 0.00 5.75 -1.26 -3.32 116.55 114.34 3dyo n ASP 287 Ca 0.02 -2.66 -0.11 0.00 -0.01 0.00 0.00 54.79 52.02 3dyo n ASP 287 Cb 0.55 -0.63 -0.10 0.00 -1.03 0.00 0.00 41.12 39.90 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 -2.14 0.73 -0.06 0.11 0.52 -1.09 -1.72 118.95 115.29 3dyo s ARG 288 Ca 0.36 -1.15 -0.13 0.00 -0.52 0.00 0.00 55.73 54.29 3dyo s ARG 288 Cb 0.28 -0.22 0.03 0.00 0.52 0.00 0.00 34.95 35.55 3dyo s ARG 288 CO 0.10 0.00 0.31 0.54 0.02 0.00 0.00 175.30 176.27 3dyo s VAL 289 N -2.92 0.03 -0.17 3.52 0.11 -0.62 0.31 120.40 120.67 3dyo s VAL 289 Ca 0.05 -0.28 0.01 0.00 -2.93 0.00 0.00 61.98 58.83 3dyo s VAL 289 Cb 0.00 -0.54 0.01 0.00 -1.53 0.00 0.00 36.38 34.33 3dyo s VAL 289 CO -0.03 -0.15 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.52 3dyo s THR 290 N -0.67 2.34 -0.09 5.04 2.01 -1.26 -0.76 115.64 122.25 3dyo s THR 290 Ca -0.08 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 61.00 3dyo s THR 290 Cb -0.04 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.45 3dyo s THR 290 CO 0.02 0.52 0.15 -0.76 -0.69 0.00 0.00 174.62 173.87 3dyo s LEU 291 N 1.04 4.36 -0.10 4.42 2.01 0.27 -4.93 118.68 125.75 3dyo s LEU 291 Ca -0.01 0.43 -0.01 0.00 0.01 0.00 0.00 54.13 54.55 3dyo s LEU 291 Cb -0.14 -2.21 0.03 0.00 0.01 0.00 0.00 46.19 43.87 3dyo s LEU 291 CO -0.05 0.37 -0.04 -0.13 1.01 0.00 0.00 176.35 177.50 3dyo s ARG 292 N -1.28 1.15 -0.08 1.70 0.52 -1.26 -0.94 118.95 118.76 3dyo s ARG 292 Ca 0.18 -0.13 0.04 0.00 -0.52 0.00 0.00 55.73 55.30 3dyo s ARG 292 Cb -0.12 -1.39 -0.01 0.00 0.52 0.00 0.00 34.95 33.95 3dyo s ARG 292 CO 0.08 -0.30 -0.22 -0.51 0.02 0.00 0.00 175.30 174.37 3dyo s LEU 293 N 1.81 2.24 0.22 2.53 1.02 0.11 -4.91 118.68 121.71 3dyo s LEU 293 Ca 0.05 -0.47 -0.20 0.00 0.02 0.00 0.00 54.13 53.53 3dyo s LEU 293 Cb -0.13 -1.44 -0.08 0.00 0.02 0.00 0.00 46.19 44.56 3dyo s LEU 293 CO -0.07 0.22 0.73 0.20 0.02 0.00 0.00 176.35 177.45 3dyo s ASN 294 N 0.02 7.08 -0.10 2.29 0.01 -1.26 -0.89 114.94 122.08 3dyo s ASN 294 Ca -0.08 1.44 -0.02 0.00 -0.71 0.00 0.00 52.86 53.49 3dyo s ASN 294 Cb -0.15 -2.43 0.04 0.00 0.41 0.00 0.00 41.25 39.12 3dyo s ASN 294 CO 0.05 0.03 0.02 -0.69 -1.51 0.00 0.00 177.10 175.01 3dyo s VAL 295 N -1.52 0.33 0.08 1.60 1.01 0.26 -4.86 120.40 117.31 3dyo s VAL 295 Ca 0.43 -0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.16 3dyo s VAL 295 Cb -0.17 -0.62 -0.07 0.00 0.00 0.00 0.00 36.38 35.53 3dyo s VAL 295 CO 0.21 0.10 0.65 -1.61 0.00 0.00 0.00 175.10 174.46 3dyo s GLU 296 N 1.98 4.35 -1.29 2.72 0.41 -1.26 -0.62 118.70 124.98 3dyo s GLU 296 Ca 0.03 0.89 -0.16 0.00 -0.41 0.00 0.00 54.97 55.32 3dyo s GLU 296 Cb -0.14 -3.27 0.01 0.00 -1.78 0.00 0.00 34.13 28.95 3dyo s GLU 296 CO -0.06 0.54 0.54 0.09 -0.49 0.00 0.00 175.26 175.89 3dyo n ASN 297 N 1.95 -2.70 -4.75 -0.19 4.13 0.13 -4.88 115.26 108.95 3dyo n ASN 297 Ca -0.08 -1.14 -0.38 0.00 1.68 0.00 0.00 54.58 54.66 3dyo n ASN 297 Cb 0.50 -2.53 0.04 0.00 -1.54 0.00 0.00 39.78 36.25 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 -6.77 3.15 -0.21 3.52 0.04 -1.26 -4.94 135.00 128.54 3dyo s PRO 298 Ca 0.28 2.24 -0.29 0.00 0.04 0.00 0.00 61.00 63.28 3dyo s PRO 298 Cb -0.13 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.15 3dyo s PRO 298 CO 0.92 -1.18 1.07 0.15 0.04 0.00 0.00 177.00 178.00 3dyo s LYS 299 N -2.90 4.27 0.22 4.56 -0.14 -1.26 -4.99 119.74 119.50 3dyo s LYS 299 Ca 0.71 1.41 -0.19 0.00 -1.36 0.00 0.00 55.97 56.55 3dyo s LYS 299 Cb -0.41 -3.65 -0.08 0.00 -1.68 0.00 0.00 37.83 32.02 3dyo s LYS 299 CO 0.48 -0.61 0.71 -0.51 -0.76 0.00 0.00 175.35 174.66 3dyo s LEU 300 N 3.12 4.33 -0.01 3.17 1.43 -1.26 -4.45 118.68 125.00 3dyo s LEU 300 Ca 0.46 1.38 -0.18 0.00 -1.03 0.00 0.00 54.13 54.76 3dyo s LEU 300 Cb -0.16 -3.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.42 3dyo s LEU 300 CO 0.09 0.03 0.51 0.86 0.23 0.00 0.00 176.35 178.07 3dyo s TRP 301 N -1.54 3.69 0.27 0.29 -0.00 0.19 -3.88 118.94 117.97 3dyo s TRP 301 Ca 0.43 1.10 -0.14 0.00 -0.00 0.00 0.00 56.10 57.48 3dyo s TRP 301 Cb -0.16 -2.48 0.01 0.00 -0.00 0.00 0.00 33.47 30.84 3dyo s TRP 301 CO 0.21 0.45 0.56 -1.54 -0.00 0.00 0.00 176.95 176.63 3dyo s SER 302 N -0.50 -0.04 0.45 5.86 1.04 -0.85 -4.65 113.70 115.02 3dyo s SER 302 Ca 0.27 -0.92 0.25 0.00 0.48 0.00 0.00 55.95 56.03 3dyo s SER 302 Cb -0.17 0.64 1.01 0.00 0.10 0.00 0.00 66.02 67.60 3dyo s SER 302 CO 0.15 -1.24 1.87 0.00 0.98 0.00 0.00 173.24 175.00 3dyo h ALA 303 N 2.17 1.06 -0.14 5.32 0.00 -1.90 -2.28 119.26 123.48 3dyo h ALA 303 Ca -0.25 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.24 3dyo h ALA 303 Cb 1.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.02 3dyo h ALA 303 CO 0.33 0.26 -0.80 0.93 0.00 0.00 0.00 179.25 179.97 3dyo h GLU 304 N 0.00 0.77 -2.52 0.00 5.08 -1.94 -3.41 114.58 112.56 3dyo h GLU 304 Ca -0.00 -0.65 -0.49 0.00 -1.00 0.00 0.00 59.36 57.22 3dyo h GLU 304 Cb 0.68 0.14 -0.37 0.00 0.50 0.00 0.00 28.75 29.69 3dyo h GLU 304 CO 0.03 1.25 -0.76 0.42 -1.00 0.00 0.00 179.01 178.95 3dyo s ILE 305 N -3.71 -0.11 -1.22 3.13 1.01 -1.11 -4.98 121.20 114.22 3dyo s ILE 305 Ca -0.10 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 59.49 3dyo s ILE 305 Cb 0.09 -0.98 -0.12 0.00 0.01 0.00 0.00 42.46 41.45 3dyo s ILE 305 CO 0.90 -0.73 2.99 -0.81 0.00 0.00 0.00 174.94 177.29 3dyo n PRO 306 N 4.85 3.16 -1.70 2.79 -0.04 -0.88 -2.01 135.00 141.18 3dyo n PRO 306 Ca 0.01 -1.86 -0.44 0.00 -0.04 0.00 0.00 63.50 61.17 3dyo n PRO 306 Cb 0.42 -2.59 -0.03 0.00 -0.04 0.00 0.00 33.50 31.26 3dyo n PRO 306 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3dyo n ASN 307 N 3.42 3.52 -4.13 3.54 3.02 -1.25 -4.89 115.26 118.48 3dyo n ASN 307 Ca 0.67 1.09 -0.16 0.00 -0.03 0.00 0.00 54.58 56.16 3dyo n ASN 307 Cb 0.35 -1.51 -0.12 0.00 -0.61 0.00 0.00 39.78 37.90 3dyo n ASN 307 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dyo s LEU 308 N 0.70 2.28 0.35 3.41 1.43 -1.26 -4.05 118.68 121.54 3dyo s LEU 308 Ca 0.74 -0.61 0.09 0.00 -1.03 0.00 0.00 54.13 53.31 3dyo s LEU 308 Cb -0.58 -0.35 -0.05 0.00 0.03 0.00 0.00 46.19 45.23 3dyo s LEU 308 CO 0.39 -0.15 0.05 -0.31 0.23 0.00 0.00 176.35 176.56 3dyo s TYR 309 N -1.44 2.58 -0.14 0.29 1.51 0.86 -4.77 117.35 116.24 3dyo s TYR 309 Ca -0.04 -0.46 -0.00 0.00 -1.01 0.00 0.00 57.07 55.56 3dyo s TYR 309 Cb -0.09 -1.58 -0.01 0.00 -0.11 0.00 0.00 41.96 40.17 3dyo s TYR 309 CO 0.01 0.42 -0.13 0.50 -1.11 0.00 0.00 175.55 175.25 3dyo s ARG 310 N -3.76 3.35 -0.14 -0.62 6.06 0.56 0.60 118.95 125.01 3dyo s ARG 310 Ca 0.36 -0.69 -0.04 0.00 -2.50 0.00 0.00 55.73 52.86 3dyo s ARG 310 Cb 0.00 -2.66 -0.03 0.00 0.06 0.00 0.00 34.95 32.32 3dyo s ARG 310 CO 0.20 0.13 -0.01 0.00 -2.50 0.00 0.00 175.30 173.12 3dyo s ALA 311 N 0.55 3.14 -0.16 6.12 0.00 -0.82 -0.35 121.76 130.24 3dyo s ALA 311 Ca -0.08 -0.81 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 3dyo s ALA 311 Cb -0.16 -1.58 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 3dyo s ALA 311 CO 0.04 0.32 -0.08 0.08 0.00 0.00 0.00 175.76 176.12 3dyo s VAL 312 N -0.00 3.38 -0.40 0.00 1.01 0.55 -2.28 120.40 122.66 3dyo s VAL 312 Ca 0.02 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 3dyo s VAL 312 Cb -0.13 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.82 3dyo s VAL 312 CO 0.02 0.49 0.26 -0.69 0.00 0.00 0.00 175.10 175.18 3dyo s VAL 313 N 0.69 4.71 -0.15 2.92 1.01 0.51 -1.37 120.40 128.72 3dyo s VAL 313 Ca -0.04 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 60.92 3dyo s VAL 313 Cb -0.15 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 3dyo s VAL 313 CO 0.02 -0.35 0.01 -1.61 0.00 0.00 0.00 175.10 173.17 3dyo s GLU 314 N 1.56 3.61 -0.33 2.72 2.02 0.72 -1.12 118.70 127.87 3dyo s GLU 314 Ca 0.03 -0.41 -0.09 0.00 0.02 0.00 0.00 54.97 54.51 3dyo s GLU 314 Cb -0.21 -3.00 0.01 0.00 0.10 0.00 0.00 34.13 31.04 3dyo s GLU 314 CO 0.06 0.39 0.16 -1.17 0.02 0.00 0.00 175.26 174.72 3dyo s LEU 315 N 0.00 4.32 0.26 1.80 2.96 -0.42 -0.49 118.68 127.10 3dyo s LEU 315 Ca 0.03 -0.78 -0.08 0.00 -0.22 0.00 0.00 54.13 53.08 3dyo s LEU 315 Cb -0.13 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.57 3dyo s LEU 315 CO 0.02 -0.28 0.41 -1.38 -1.32 0.00 0.00 176.35 173.80 3dyo s HIS 316 N 1.56 0.68 0.60 5.38 -3.43 -0.70 0.12 115.29 119.49 3dyo s HIS 316 Ca 0.03 -0.98 -0.08 0.00 -0.80 0.00 0.00 55.06 53.23 3dyo s HIS 316 Cb -0.18 -0.01 -0.01 0.00 -1.43 0.00 0.00 32.58 30.95 3dyo s HIS 316 CO 0.06 -0.96 0.94 0.95 -2.00 0.00 0.00 174.74 173.72 3dyo s THR 317 N -3.81 4.05 0.48 -5.38 -4.23 -0.07 -0.14 115.64 106.55 3dyo s THR 317 Ca 0.27 0.28 0.17 0.00 -1.18 0.00 0.00 61.69 61.23 3dyo s THR 317 Cb 0.01 -3.61 0.32 0.00 1.34 0.00 0.00 72.50 70.56 3dyo s THR 317 CO 0.12 -0.69 2.04 0.00 -0.54 0.00 0.00 174.62 175.56 3dyo h ALA 318 N -0.21 2.11 -0.40 3.99 0.00 -0.29 0.66 119.26 125.12 3dyo h ALA 318 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3dyo h ALA 318 Cb 1.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3dyo h ALA 318 CO 0.62 -0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.27 3dyo n ASP 319 N -4.47 2.66 0.00 0.00 3.85 -1.26 -4.91 116.55 112.42 3dyo n ASP 319 Ca 0.05 -2.14 0.00 0.00 -0.71 0.00 0.00 54.79 51.99 3dyo n ASP 319 Cb 0.32 -0.37 0.00 0.00 -1.35 0.00 0.00 41.12 39.72 3dyo n ASP 319 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dyo n GLY 320 N 0.97 0.96 3.72 6.12 0.00 0.23 -5.06 105.19 112.12 3dyo n GLY 320 Ca 0.15 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3dyo n GLY 320 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyo s THR 321 N -2.00 5.05 0.12 2.61 2.01 -1.25 -4.79 115.64 117.38 3dyo s THR 321 Ca 0.00 1.42 -0.30 0.00 0.31 0.00 0.00 61.69 63.11 3dyo s THR 321 Cb 0.00 -4.03 -0.07 0.00 0.01 0.00 0.00 72.50 68.41 3dyo s THR 321 CO 0.00 0.26 1.20 -0.22 -0.69 0.00 0.00 174.62 175.17 3dyo s LEU 322 N 0.76 4.41 -0.21 4.42 2.96 -1.26 -0.89 118.68 128.86 3dyo s LEU 322 Ca 0.37 2.12 -0.16 0.00 -0.22 0.00 0.00 54.13 56.24 3dyo s LEU 322 Cb -0.18 -3.59 -0.12 0.00 0.50 0.00 0.00 46.19 42.80 3dyo s LEU 322 CO 0.18 -0.42 -0.12 -0.38 -1.32 0.00 0.00 176.35 174.28 3dyo n ILE 323 N 3.26 1.51 -3.59 6.68 5.41 0.31 -4.95 119.36 128.00 3dyo n ILE 323 Ca 0.07 -0.07 -0.07 0.00 1.00 0.00 0.00 62.75 63.68 3dyo n ILE 323 Cb 0.45 -2.10 -0.02 0.00 -0.71 0.00 0.00 39.64 37.26 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 -2.47 1.02 0.02 0.38 -1.05 -0.89 -4.88 118.70 110.83 3dyo s GLU 324 Ca -0.29 -0.46 0.02 0.00 -0.15 0.00 0.00 54.97 54.08 3dyo s GLU 324 Cb 0.08 0.42 -0.01 0.00 -0.44 0.00 0.00 34.13 34.17 3dyo s GLU 324 CO 0.47 -0.45 -0.06 0.00 0.95 0.00 0.00 175.26 176.17 3dyo s ALA 325 N -3.26 0.43 0.30 -0.84 0.00 -0.03 -1.31 121.76 117.05 3dyo s ALA 325 Ca 0.07 -0.46 0.06 0.00 0.00 0.00 0.00 51.96 51.64 3dyo s ALA 325 Cb -0.01 -0.02 -0.06 0.00 0.00 0.00 0.00 23.12 23.03 3dyo s ALA 325 CO -0.05 0.03 -0.03 -1.21 0.00 0.00 0.00 175.76 174.50 3dyo s GLU 326 N -0.81 1.61 0.21 0.00 0.41 -0.28 -2.09 118.70 117.75 3dyo s GLU 326 Ca -0.04 -1.84 -0.23 0.00 -0.41 0.00 0.00 54.97 52.44 3dyo s GLU 326 Cb -0.06 -1.14 0.04 0.00 -1.78 0.00 0.00 34.13 31.20 3dyo s GLU 326 CO 0.00 -0.02 0.78 0.00 -0.49 0.00 0.00 175.26 175.53 3dyo s ALA 327 N -3.05 -1.44 0.11 5.21 0.00 -1.26 -0.37 121.76 120.97 3dyo s ALA 327 Ca 0.32 0.01 -0.25 0.00 0.00 0.00 0.00 51.96 52.04 3dyo s ALA 327 Cb 0.05 0.77 0.08 0.00 0.00 0.00 0.00 23.12 24.02 3dyo s ALA 327 CO 0.13 -0.98 0.67 0.00 0.00 0.00 0.00 175.76 175.58 3dyo s ASP 329 N -2.56 7.29 -0.07 0.00 1.01 -1.26 -1.95 116.67 119.13 3dyo s ASP 329 Ca 0.01 1.78 0.05 0.00 0.71 0.00 0.00 52.55 55.11 3dyo s ASP 329 Cb -0.01 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.35 3dyo s ASP 329 CO -0.10 -0.07 -0.23 -0.69 0.21 0.00 0.00 175.17 174.28 3dyo s VAL 330 N -1.63 2.18 -0.22 -1.27 1.01 0.20 -4.70 120.40 115.98 3dyo s VAL 330 Ca 0.50 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 3dyo s VAL 330 Cb -0.18 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.41 3dyo s VAL 330 CO 0.23 0.57 -0.10 -0.83 0.00 0.00 0.00 175.10 174.97 3dyo s GLY 331 N -0.11 1.55 -0.40 4.51 0.00 -1.26 -0.10 107.32 111.50 3dyo s GLY 331 Ca -0.05 -1.30 -0.29 0.00 0.00 0.00 0.00 44.72 43.09 3dyo s GLY 331 CO 0.04 0.42 1.26 -1.36 0.00 0.00 0.00 173.10 173.46 3dyo s PHE 332 N 1.36 2.67 -0.10 1.90 0.40 -1.26 -4.81 117.98 118.14 3dyo s PHE 332 Ca 0.03 0.78 -0.30 0.00 -0.60 0.00 0.00 56.93 56.84 3dyo s PHE 332 Cb -0.15 -4.21 0.08 0.00 0.51 0.00 0.00 43.02 39.26 3dyo s PHE 332 CO -0.07 -1.57 0.77 -0.98 0.70 0.00 0.00 175.22 174.07 3dyo s ARG 333 N 4.49 0.91 -0.12 0.44 3.03 -1.26 -0.64 118.95 125.81 3dyo s ARG 333 Ca 0.54 0.32 -0.01 0.00 2.03 0.00 0.00 55.73 58.61 3dyo s ARG 333 Cb -0.12 0.43 -0.02 0.00 -1.03 0.00 0.00 34.95 34.21 3dyo s ARG 333 CO 0.29 -0.27 -0.09 -2.00 -1.13 0.00 0.00 175.30 172.10 3dyo s GLU 334 N -0.96 3.25 -0.18 3.89 2.12 -1.26 -4.87 118.70 120.68 3dyo s GLU 334 Ca -0.07 -0.60 -0.01 0.00 0.36 0.00 0.00 54.97 54.65 3dyo s GLU 334 Cb -0.01 -2.69 0.00 0.00 0.26 0.00 0.00 34.13 31.69 3dyo s GLU 334 CO 0.07 0.37 -0.13 0.08 -0.54 0.00 0.00 175.26 175.11 3dyo s VAL 335 N -0.02 2.73 -0.02 3.70 1.01 -1.26 -0.50 120.40 126.04 3dyo s VAL 335 Ca -0.01 -0.72 -0.21 0.00 0.00 0.00 0.00 61.98 61.03 3dyo s VAL 335 Cb -0.14 -2.19 0.04 0.00 0.00 0.00 0.00 36.38 34.10 3dyo s VAL 335 CO 0.03 0.49 0.45 0.00 0.00 0.00 0.00 175.10 176.07 3dyo s ARG 336 N 1.18 0.83 -0.24 2.72 1.70 -0.46 -4.59 118.95 120.09 3dyo s ARG 336 Ca 0.02 -0.05 -0.08 0.00 -0.47 0.00 0.00 55.73 55.15 3dyo s ARG 336 Cb -0.14 0.38 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 3dyo s ARG 336 CO -0.05 -0.25 0.09 0.42 -1.08 0.00 0.00 175.30 174.43 3dyo s ILE 337 N -1.39 4.60 -0.02 4.99 1.01 -1.26 -0.31 121.20 128.83 3dyo s ILE 337 Ca -0.12 -0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.45 3dyo s ILE 337 Cb -0.03 -3.14 0.03 0.00 0.01 0.00 0.00 42.46 39.33 3dyo s ILE 337 CO 0.06 0.35 0.02 -0.70 0.00 0.00 0.00 174.94 174.67 3dyo s GLU 338 N 1.34 0.03 -1.57 2.79 2.12 0.37 -4.84 118.70 118.94 3dyo s GLU 338 Ca 0.05 0.17 -0.02 0.00 0.36 0.00 0.00 54.97 55.53 3dyo s GLU 338 Cb -0.15 -0.31 0.01 0.00 0.26 0.00 0.00 34.13 33.94 3dyo s GLU 338 CO 0.04 -0.17 0.27 -1.71 -0.54 0.00 0.00 175.26 173.16 3dyo n ASN 339 N 4.21 -5.59 0.00 -1.70 5.15 -1.26 -1.96 115.26 114.10 3dyo n ASN 339 Ca -0.27 -0.12 0.00 0.00 -0.60 0.00 0.00 54.58 53.59 3dyo n ASN 339 Cb 0.50 -4.61 0.00 0.00 -0.53 0.00 0.00 39.78 35.15 3dyo n ASN 339 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dyo n GLY 340 N -1.20 0.84 3.39 8.20 0.00 -1.26 -5.05 105.19 110.12 3dyo n GLY 340 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 2.46 -0.25 0.99 1.43 -0.83 -2.44 118.68 120.04 3dyo s LEU 341 Ca 0.00 -0.33 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 3dyo s LEU 341 Cb 0.00 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 44.73 3dyo s LEU 341 CO 0.00 0.30 0.79 -0.22 0.23 0.00 0.00 176.35 177.45 3dyo s LEU 342 N -0.49 4.08 -0.00 1.79 2.96 -1.26 -0.48 118.68 125.27 3dyo s LEU 342 Ca 0.06 0.92 0.04 0.00 -0.22 0.00 0.00 54.13 54.93 3dyo s LEU 342 Cb -0.12 -3.11 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 3dyo s LEU 342 CO 0.01 -0.51 -0.11 -0.76 -1.32 0.00 0.00 176.35 173.66 3dyo s LEU 343 N 2.81 2.93 -0.17 -0.68 1.43 0.58 -2.35 118.68 123.22 3dyo s LEU 343 Ca 0.33 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.22 3dyo s LEU 343 Cb -0.15 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.42 3dyo s LEU 343 CO 0.08 0.30 -0.18 -0.22 0.23 0.00 0.00 176.35 176.56 3dyo s LEU 344 N -1.23 2.04 -1.40 1.79 0.20 0.17 -1.36 118.68 118.89 3dyo s LEU 344 Ca 0.15 -0.62 -0.08 0.00 0.69 0.00 0.00 54.13 54.26 3dyo s LEU 344 Cb -0.11 -1.40 0.05 0.00 -0.43 0.00 0.00 46.19 44.30 3dyo s LEU 344 CO 0.05 -0.02 0.58 0.59 -0.29 0.00 0.00 176.35 177.25 3dyo n ASN 345 N 4.66 -4.71 0.00 3.68 3.02 0.35 -0.65 115.26 121.61 3dyo n ASN 345 Ca -0.20 -0.38 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 3dyo n ASN 345 Cb 0.50 -3.84 0.00 0.00 -0.61 0.00 0.00 39.78 35.83 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 1.10 3.40 7.41 0.00 -1.26 -5.01 105.19 109.48 3dyo n GLY 346 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.16 2.09 -0.21 1.61 -0.14 0.18 -4.99 119.74 118.13 3dyo s LYS 347 Ca 0.00 -0.95 -0.29 0.00 -1.36 0.00 0.00 55.97 53.37 3dyo s LYS 347 Cb 0.00 -2.13 -0.01 0.00 -1.68 0.00 0.00 37.83 34.01 3dyo s LYS 347 CO 0.00 0.55 1.24 -1.25 -0.76 0.00 0.00 175.35 175.13 3dyo s PRO 348 N -1.06 4.16 0.70 -1.68 0.04 -1.26 0.42 135.00 136.31 3dyo s PRO 348 Ca 0.12 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.56 3dyo s PRO 348 Cb -0.10 -3.77 0.01 0.00 0.04 0.00 0.00 34.50 30.68 3dyo s PRO 348 CO 0.02 -0.80 1.07 -0.51 0.04 0.00 0.00 177.00 176.82 3dyo s LEU 349 N 3.66 3.16 -0.28 -3.56 1.43 -0.99 -4.95 118.68 117.15 3dyo s LEU 349 Ca 0.53 1.70 -0.01 0.00 -1.03 0.00 0.00 54.13 55.32 3dyo s LEU 349 Cb -0.19 -4.51 0.09 0.00 0.03 0.00 0.00 46.19 41.61 3dyo s LEU 349 CO 0.15 -1.55 0.06 -0.22 0.23 0.00 0.00 176.35 175.03 3dyo s LEU 350 N -5.49 2.23 -0.41 1.79 2.96 -1.26 -4.79 118.68 113.71 3dyo s LEU 350 Ca 0.60 -1.46 -0.29 0.00 -0.22 0.00 0.00 54.13 52.76 3dyo s LEU 350 Cb -0.15 -0.90 0.02 0.00 0.50 0.00 0.00 46.19 45.66 3dyo s LEU 350 CO 0.53 -0.37 1.25 -0.63 -1.32 0.00 0.00 176.35 175.81 3dyo s ILE 351 N 1.59 4.12 -1.05 6.68 -1.09 0.11 -4.94 121.20 126.62 3dyo s ILE 351 Ca 0.06 1.18 -0.05 0.00 -2.23 0.00 0.00 60.65 59.61 3dyo s ILE 351 Cb -0.17 -4.38 0.28 0.00 -1.58 0.00 0.00 42.46 36.61 3dyo s ILE 351 CO -0.19 -0.79 1.22 0.54 -1.23 0.00 0.00 174.94 174.50 3dyo n ARG 352 N 7.74 3.81 -3.60 2.79 1.74 -1.26 -1.73 116.66 126.14 3dyo n ARG 352 Ca 0.14 -4.52 -0.21 0.00 -0.77 0.00 0.00 57.85 52.49 3dyo n ARG 352 Cb 0.48 -2.50 -0.03 0.00 -1.02 0.00 0.00 32.46 29.39 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 -0.41 2.16 -0.08 -0.13 0.00 0.28 -1.11 107.32 108.02 3dyo s GLY 353 Ca 0.31 -1.86 -0.09 0.00 0.00 0.00 0.00 44.72 43.09 3dyo s GLY 353 CO 0.00 -1.73 0.24 0.54 0.00 0.00 0.00 173.10 172.16 3dyo s VAL 354 N -2.51 0.01 0.01 1.40 0.11 -0.41 -1.16 120.40 117.85 3dyo s VAL 354 Ca 0.47 -0.06 -0.24 0.00 -2.93 0.00 0.00 61.98 59.22 3dyo s VAL 354 Cb -0.03 -0.37 -0.05 0.00 -1.53 0.00 0.00 36.38 34.40 3dyo s VAL 354 CO 0.27 -0.03 0.72 0.20 -3.33 0.00 0.00 175.10 172.93 3dyo s ASN 355 N -0.03 7.11 -0.09 3.54 0.01 0.02 -1.11 114.94 124.40 3dyo s ASN 355 Ca -0.02 1.33 0.01 0.00 -0.71 0.00 0.00 52.86 53.48 3dyo s ASN 355 Cb -0.02 -2.44 0.02 0.00 0.41 0.00 0.00 41.25 39.22 3dyo s ASN 355 CO 0.01 -0.00 -0.10 -0.60 -1.51 0.00 0.00 177.10 174.90 3dyo s ARG 356 N 0.14 1.58 0.51 -0.60 3.52 -0.51 -0.74 118.95 122.85 3dyo s ARG 356 Ca 0.37 -0.32 -0.04 0.00 -0.13 0.00 0.00 55.73 55.61 3dyo s ARG 356 Cb -0.19 -1.48 -0.02 0.00 -1.56 0.00 0.00 34.95 31.70 3dyo s ARG 356 CO 0.21 -0.13 0.80 -1.01 -0.81 0.00 0.00 175.30 174.36 3dyo s HIS 357 N 1.21 3.40 -0.60 5.12 3.76 -1.26 -3.66 115.29 123.26 3dyo s HIS 357 Ca -0.04 0.65 -0.21 0.00 -0.15 0.00 0.00 55.06 55.31 3dyo s HIS 357 Cb -0.14 -2.44 0.08 0.00 1.11 0.00 0.00 32.58 31.19 3dyo s HIS 357 CO -0.03 -0.47 0.80 -1.21 -0.85 0.00 0.00 174.74 172.98 3dyo s GLU 358 N -4.79 3.10 -0.04 1.40 2.02 -1.26 -4.95 118.70 114.18 3dyo s GLU 358 Ca 0.50 -1.01 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 3dyo s GLU 358 Cb -0.10 -4.21 0.03 0.00 0.10 0.00 0.00 34.13 29.94 3dyo s GLU 358 CO 0.44 -1.59 0.08 -1.58 0.02 0.00 0.00 175.26 172.63 3dyo s HIS 359 N 3.24 -0.07 -0.06 1.61 2.46 -1.26 -4.50 115.29 116.71 3dyo s HIS 359 Ca 0.17 0.27 -0.00 0.00 0.47 0.00 0.00 55.06 55.96 3dyo s HIS 359 Cb -0.20 -0.11 0.03 0.00 -0.13 0.00 0.00 32.58 32.17 3dyo s HIS 359 CO 0.09 -0.10 -0.02 -1.58 -2.47 0.00 0.00 174.74 170.66 3dyo s HIS 360 N 0.80 0.78 0.13 3.88 2.46 0.12 -4.99 115.29 118.47 3dyo s HIS 360 Ca -0.06 -0.24 0.33 0.00 0.47 0.00 0.00 55.06 55.55 3dyo s HIS 360 Cb -0.09 -0.79 1.64 0.00 -0.13 0.00 0.00 32.58 33.21 3dyo s HIS 360 CO -0.03 -0.29 2.00 -1.00 -2.47 0.00 0.00 174.74 172.94 3dyo h PRO 361 N 7.86 0.00 0.00 2.88 0.13 -1.80 0.39 132.00 141.46 3dyo h PRO 361 Ca -0.28 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.52 3dyo h PRO 361 Cb 1.14 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 3dyo h PRO 361 CO 0.36 0.00 -2.15 1.28 -0.23 0.00 0.00 178.00 177.26 3dyo n LEU 362 N -2.73 2.02 -0.16 1.56 4.77 -1.26 -1.80 117.00 119.39 3dyo n LEU 362 Ca -0.01 0.13 0.13 0.00 -0.03 0.00 0.00 56.01 56.23 3dyo n LEU 362 Cb 0.14 -0.64 0.39 0.00 -2.33 0.00 0.00 43.42 40.98 3dyo n LEU 362 CO 0.19 0.58 0.65 1.41 -1.33 0.00 0.00 177.39 178.88 3dyo n HIS 363 N -3.63 0.00 0.00 -1.77 8.25 -1.19 -4.96 115.22 111.92 3dyo n HIS 363 Ca -0.39 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.07 3dyo n HIS 363 Cb 0.82 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.76 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 1.37 1.77 1.28 -1.41 0.00 0.14 -3.41 105.19 104.93 3dyo n GLY 364 Ca 0.11 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.59 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 9.94 3.51 -3.05 1.61 6.02 -1.26 0.10 117.38 134.26 3dyo n GLN 365 Ca 0.00 -2.76 -0.40 0.00 -0.01 0.00 0.00 57.00 53.83 3dyo n GLN 365 Cb 0.00 -1.81 -0.05 0.00 1.02 0.00 0.00 30.24 29.40 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 -2.03 5.03 0.07 5.09 1.01 -1.22 -4.85 120.40 123.49 3dyo s VAL 366 Ca 0.44 1.42 0.02 0.00 0.00 0.00 0.00 61.98 63.86 3dyo s VAL 366 Cb 0.30 -4.03 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3dyo s VAL 366 CO 0.18 0.21 0.13 -0.04 0.00 0.00 0.00 175.10 175.58 3dyo s MET 367 N 1.08 3.10 0.06 2.72 -1.94 -1.26 -4.70 119.30 118.36 3dyo s MET 367 Ca 0.36 -0.59 0.01 0.00 -1.71 0.00 0.00 55.69 53.76 3dyo s MET 367 Cb -0.17 -2.85 -0.03 0.00 2.01 0.00 0.00 34.83 33.78 3dyo s MET 367 CO 0.16 0.59 -0.06 0.16 -0.01 0.00 0.00 175.02 175.86 3dyo s ASP 368 N -2.41 0.83 0.21 3.03 1.47 -1.26 -5.02 116.67 113.52 3dyo s ASP 368 Ca 0.31 -0.83 -0.10 0.00 1.18 0.00 0.00 52.55 53.11 3dyo s ASP 368 Cb -0.12 0.10 0.15 0.00 -0.34 0.00 0.00 42.92 42.70 3dyo s ASP 368 CO 0.24 -0.41 1.86 -0.08 0.68 0.00 0.00 175.17 177.46 3dyo h GLU 369 N 3.59 0.99 -0.40 2.11 4.81 -1.99 -0.55 114.58 123.14 3dyo h GLU 369 Ca -0.35 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 58.83 3dyo h GLU 369 Cb 1.17 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.31 3dyo h GLU 369 CO 0.56 0.69 0.20 1.96 -0.73 0.00 0.00 179.01 181.69 3dyo h GLN 370 N 1.01 0.40 -0.55 1.92 4.20 -1.99 0.33 115.11 120.43 3dyo h GLN 370 Ca 0.27 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.91 3dyo h GLN 370 Cb -0.07 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 3dyo h GLN 370 CO -0.05 0.27 0.17 1.15 -0.67 0.00 0.00 178.83 179.69 3dyo h THR 371 N 0.42 1.24 -0.54 -0.54 2.02 -1.93 0.31 112.91 113.88 3dyo h THR 371 Ca 0.17 -0.81 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 3dyo h THR 371 Cb 0.06 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 3dyo h THR 371 CO -0.11 0.30 0.33 0.24 0.37 0.00 0.00 175.52 176.66 3dyo h MET 372 N 0.78 0.73 -0.64 6.66 2.86 -0.46 -0.26 114.93 124.60 3dyo h MET 372 Ca 0.18 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 3dyo h MET 372 Cb 0.29 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.77 3dyo h MET 372 CO -0.00 0.52 0.12 0.28 1.06 0.00 0.00 176.91 178.88 3dyo h VAL 373 N 0.73 1.26 -0.56 -2.22 2.07 -0.05 -1.41 116.25 116.07 3dyo h VAL 373 Ca 0.20 -1.00 0.04 0.00 0.82 0.00 0.00 66.70 66.76 3dyo h VAL 373 Cb -0.03 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 3dyo h VAL 373 CO -0.04 0.37 0.30 -0.61 0.02 0.00 0.00 177.57 177.62 3dyo h GLN 374 N 0.96 0.57 -0.08 1.57 4.15 0.06 -0.91 115.11 121.44 3dyo h GLN 374 Ca 0.19 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.58 3dyo h GLN 374 Cb 0.42 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.97 3dyo h GLN 374 CO 0.01 0.38 0.05 -0.44 -1.93 0.00 0.00 178.83 176.89 3dyo h ASP 375 N 0.59 0.10 -0.55 -0.69 3.32 -0.60 -2.21 116.42 116.37 3dyo h ASP 375 Ca 0.24 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 3dyo h ASP 375 Cb 0.12 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 3dyo h ASP 375 CO -0.15 0.13 0.32 0.40 -1.72 0.00 0.00 179.24 178.22 3dyo h ILE 376 N 0.06 1.17 -0.43 0.35 2.04 -0.92 -0.77 117.51 119.00 3dyo h ILE 376 Ca 0.03 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.49 3dyo h ILE 376 Cb 0.05 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 3dyo h ILE 376 CO -0.00 0.18 0.29 -0.07 0.00 0.00 0.00 178.15 178.54 3dyo h LEU 377 N 0.74 0.50 -0.98 1.44 3.38 -1.08 -0.60 115.31 118.70 3dyo h LEU 377 Ca 0.20 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 3dyo h LEU 377 Cb 0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3dyo h LEU 377 CO -0.03 0.36 -0.26 -0.07 0.09 0.00 0.00 178.44 178.53 3dyo h LEU 378 N 0.59 0.43 0.29 1.67 3.38 -1.18 0.23 115.31 120.72 3dyo h LEU 378 Ca 0.16 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3dyo h LEU 378 Cb -0.07 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3dyo h LEU 378 CO -0.03 0.69 -0.14 0.24 0.09 0.00 0.00 178.44 179.29 3dyo h MET 379 N 0.38 -0.37 -0.75 1.13 2.86 -0.82 -0.76 114.93 116.60 3dyo h MET 379 Ca 0.06 0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 3dyo h MET 379 Cb 0.66 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.37 3dyo h MET 379 CO 0.05 -0.18 0.36 0.87 1.06 0.00 0.00 176.91 179.07 3dyo h LYS 380 N -0.49 1.07 0.00 1.72 1.57 -0.87 0.34 116.57 119.92 3dyo h LYS 380 Ca -0.04 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3dyo h LYS 380 Cb 0.36 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3dyo h LYS 380 CO 0.06 0.82 0.00 1.96 -0.57 0.00 0.00 179.45 181.72 3dyo h GLN 381 N 1.06 0.00 -0.40 3.15 4.20 -0.38 -2.37 115.11 120.38 3dyo h GLN 381 Ca 0.26 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.85 3dyo h GLN 381 Cb 0.10 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.81 3dyo h GLN 381 CO -0.03 0.00 0.04 0.09 -0.67 0.00 0.00 178.83 178.26 3dyo n ASN 382 N -2.89 3.50 -1.37 1.46 3.02 0.03 -4.96 115.26 114.05 3dyo n ASN 382 Ca -0.01 -3.35 -0.14 0.00 -0.03 0.00 0.00 54.58 51.05 3dyo n ASN 382 Cb 0.16 -0.62 -0.04 0.00 -0.61 0.00 0.00 39.78 38.67 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 -0.72 -4.58 -4.82 6.41 3.02 -0.89 -3.94 115.26 109.73 3dyo n ASN 383 Ca 0.30 0.18 -0.37 0.00 -0.03 0.00 0.00 54.58 54.66 3dyo n ASN 383 Cb 1.05 -3.54 -0.06 0.00 -0.61 0.00 0.00 39.78 36.63 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 -2.62 3.70 0.00 3.10 0.40 -0.73 -4.84 117.98 116.99 3dyo s PHE 384 Ca 0.00 1.21 0.00 0.00 -0.60 0.00 0.00 56.93 57.54 3dyo s PHE 384 Cb 0.00 -2.46 0.00 0.00 0.51 0.00 0.00 43.02 41.07 3dyo s PHE 384 CO 0.00 0.48 0.56 0.27 0.70 0.00 0.00 175.22 177.23 3dyo n ASN 385 N 1.17 1.05 -3.69 1.36 0.23 -0.27 -4.27 115.26 110.84 3dyo n ASN 385 Ca -0.07 -1.25 -0.15 0.00 -0.53 0.00 0.00 54.58 52.58 3dyo n ASN 385 Cb 0.51 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.13 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 -0.25 -1.07 0.01 -2.53 0.00 -1.13 0.14 121.76 116.92 3dyo s ALA 386 Ca 0.00 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.65 3dyo s ALA 386 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 3dyo s ALA 386 CO 0.00 -0.28 -0.04 0.54 0.00 0.00 0.00 175.76 175.98 3dyo s VAL 387 N -1.13 0.24 -0.15 0.00 0.11 0.21 -1.29 120.40 118.40 3dyo s VAL 387 Ca -0.12 -0.45 -0.02 0.00 -2.93 0.00 0.00 61.98 58.47 3dyo s VAL 387 Cb -0.04 -0.27 -0.02 0.00 -1.53 0.00 0.00 36.38 34.52 3dyo s VAL 387 CO 0.05 -0.14 -0.09 -0.60 -3.33 0.00 0.00 175.10 170.99 3dyo s ARG 388 N -0.63 3.48 -0.98 1.54 3.52 -0.27 -1.19 118.95 124.42 3dyo s ARG 388 Ca -0.05 -0.62 -0.13 0.00 -0.13 0.00 0.00 55.73 54.80 3dyo s ARG 388 Cb -0.04 -2.77 -0.08 0.00 -1.56 0.00 0.00 34.95 30.50 3dyo s ARG 388 CO -0.00 0.18 2.13 0.00 -0.81 0.00 0.00 175.30 176.80 3dyo s SER 390 N 3.84 6.69 -0.46 0.00 1.04 -1.24 -1.13 113.70 122.44 3dyo s SER 390 Ca 0.49 2.02 0.08 0.00 0.48 0.00 0.00 55.95 59.03 3dyo s SER 390 Cb 0.13 -2.53 0.30 0.00 0.10 0.00 0.00 66.02 64.01 3dyo s SER 390 CO 0.01 -0.93 0.71 1.41 0.98 0.00 0.00 173.24 175.42 3dyo n HIS 391 N 7.19 1.40 0.00 5.02 -0.00 -1.26 -4.21 115.22 123.37 3dyo n HIS 391 Ca 0.17 -3.84 0.00 0.00 -0.00 0.00 0.00 57.72 54.05 3dyo n HIS 391 Cb 0.44 -0.44 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 3dyo n HIS 391 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.34 178.82 3dyo n TYR 392 N 0.61 0.00 -1.96 4.41 0.18 -0.28 -4.29 117.16 115.83 3dyo n TYR 392 Ca 0.26 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.63 3dyo n TYR 392 Cb 0.52 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.47 3dyo n TYR 392 CO 0.00 0.00 0.00 -2.14 -2.08 0.00 0.00 176.86 172.64 3dyo s PRO 393 N -2.00 4.23 0.56 -3.48 0.02 -0.92 -4.59 135.00 128.81 3dyo s PRO 393 Ca 0.00 2.39 0.01 0.00 0.02 0.00 0.00 61.00 63.41 3dyo s PRO 393 Cb 0.00 -3.04 0.03 0.00 0.02 0.00 0.00 34.50 31.51 3dyo s PRO 393 CO 0.00 -0.40 0.79 -0.80 -0.33 0.00 0.00 177.00 176.26 3dyo s ASN 394 N -0.09 5.28 0.23 2.53 0.02 -1.26 -4.83 114.94 116.82 3dyo s ASN 394 Ca 0.54 0.05 -0.31 0.00 -1.02 0.00 0.00 52.86 52.12 3dyo s ASN 394 Cb -0.43 -0.94 -0.14 0.00 0.02 0.00 0.00 41.25 39.76 3dyo s ASN 394 CO 0.54 -1.15 1.28 1.57 0.02 0.00 0.00 177.10 179.35 3dyo n HIS 395 N -2.37 1.79 0.08 2.20 -0.00 -1.26 -4.82 115.22 110.83 3dyo n HIS 395 Ca 0.08 0.55 0.20 0.00 -0.00 0.00 0.00 57.72 58.54 3dyo n HIS 395 Cb 0.60 -2.37 0.75 0.00 -0.00 0.00 0.00 29.99 28.96 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 3.60 0.00 0.00 1.57 0.13 -1.97 -0.95 132.00 134.39 3dyo h PRO 396 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 3dyo h PRO 396 Cb 1.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.43 3dyo h PRO 396 CO 0.71 0.00 -0.15 1.25 -0.23 0.00 0.00 178.00 179.58 3dyo h LEU 397 N 0.00 0.00 -0.62 1.56 5.85 -2.01 -3.14 115.31 116.95 3dyo h LEU 397 Ca 0.20 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.00 3dyo h LEU 397 Cb 0.95 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.92 3dyo h LEU 397 CO -0.00 0.15 0.27 -0.25 -0.34 0.00 0.00 178.44 178.27 3dyo h TRP 398 N 0.00 0.48 -0.62 1.25 2.91 -1.51 -0.45 115.95 118.02 3dyo h TRP 398 Ca -0.00 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 59.97 3dyo h TRP 398 Cb 0.63 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.13 3dyo h TRP 398 CO 0.00 0.17 0.10 1.88 -1.03 0.00 0.00 178.44 179.55 3dyo h TYR 399 N 0.49 1.07 -0.52 2.65 -1.99 -1.73 0.28 116.97 117.22 3dyo h TYR 399 Ca 0.30 -0.14 -0.04 0.00 2.00 0.00 0.00 58.73 60.85 3dyo h TYR 399 Cb 0.32 -0.30 -0.02 0.00 2.00 0.00 0.00 36.73 38.73 3dyo h TYR 399 CO -0.14 0.90 0.16 1.15 -0.00 0.00 0.00 178.16 180.24 3dyo h THR 400 N 0.95 1.23 -0.55 -2.88 2.02 -1.39 -0.06 112.91 112.24 3dyo h THR 400 Ca 0.19 -0.79 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 3dyo h THR 400 Cb 0.42 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 3dyo h THR 400 CO 0.01 0.29 -0.06 -0.07 0.37 0.00 0.00 175.52 176.07 3dyo h LEU 401 N 0.72 0.97 -1.09 2.58 3.38 -0.64 -1.52 115.31 119.71 3dyo h LEU 401 Ca 0.17 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 3dyo h LEU 401 Cb 0.28 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3dyo h LEU 401 CO -0.00 1.06 0.02 0.00 0.09 0.00 0.00 178.44 179.60 3dyo h ASP 403 N 0.63 0.91 0.24 0.00 3.32 -0.71 -0.70 116.42 120.11 3dyo h ASP 403 Ca 0.13 -0.13 -0.31 0.00 0.02 0.00 0.00 57.03 56.74 3dyo h ASP 403 Cb 0.36 -0.23 0.04 0.00 0.22 0.00 0.00 39.33 39.72 3dyo h ASP 403 CO 0.01 0.78 -1.39 0.03 -1.72 0.00 0.00 179.24 176.95 3dyo h ARG 404 N 0.97 0.50 0.00 3.56 3.08 -0.69 -3.34 114.38 118.46 3dyo h ARG 404 Ca 0.24 -0.85 -0.18 0.00 0.07 0.00 0.00 59.98 59.26 3dyo h ARG 404 Cb 0.11 0.32 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 3dyo h ARG 404 CO -0.03 1.41 -1.15 1.88 -1.07 0.00 0.00 179.97 181.00 3dyo h TYR 405 N 0.06 0.00 -0.82 3.04 -1.99 -0.76 -3.45 116.97 113.05 3dyo h TYR 405 Ca -0.25 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.48 3dyo h TYR 405 Cb 2.09 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.82 3dyo h TYR 405 CO 0.14 0.70 0.00 0.41 -0.00 0.00 0.00 178.16 179.41 3dyo n GLY 406 N 1.37 0.05 2.92 3.88 0.00 -0.31 -4.80 105.19 108.30 3dyo n GLY 406 Ca -0.06 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.21 1.73 0.24 0.99 1.43 -0.93 -4.62 118.68 117.31 3dyo s LEU 407 Ca 0.00 -0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 52.71 3dyo s LEU 407 Cb 0.00 -0.31 -0.09 0.00 0.03 0.00 0.00 46.19 45.82 3dyo s LEU 407 CO 0.00 0.01 1.25 -0.31 0.23 0.00 0.00 176.35 177.54 3dyo s TYR 408 N 0.28 3.29 -0.01 0.29 4.12 0.12 -4.74 117.35 120.71 3dyo s TYR 408 Ca -0.03 1.38 0.07 0.00 0.02 0.00 0.00 57.07 58.51 3dyo s TYR 408 Cb -0.07 -3.54 -0.02 0.00 -1.52 0.00 0.00 41.96 36.82 3dyo s TYR 408 CO -0.00 -1.53 -0.23 0.08 0.02 0.00 0.00 175.55 173.88 3dyo s VAL 409 N -0.42 1.80 -0.40 0.71 1.01 0.51 -0.62 120.40 122.99 3dyo s VAL 409 Ca 0.52 -1.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 3dyo s VAL 409 Cb -0.36 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.55 3dyo s VAL 409 CO 0.42 0.46 0.25 -0.69 0.00 0.00 0.00 175.10 175.54 3dyo s VAL 410 N -0.58 4.80 -0.21 2.92 1.01 -0.34 -0.70 120.40 127.31 3dyo s VAL 410 Ca 0.09 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 61.03 3dyo s VAL 410 Cb -0.09 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 3dyo s VAL 410 CO -0.00 -0.30 0.53 -0.62 0.00 0.00 0.00 175.10 174.70 3dyo s ASP 411 N 1.70 6.55 -0.11 3.32 2.15 -0.48 -1.94 116.67 127.86 3dyo s ASP 411 Ca 0.03 0.66 0.02 0.00 0.43 0.00 0.00 52.55 53.68 3dyo s ASP 411 Cb -0.20 -2.29 -0.01 0.00 -0.30 0.00 0.00 42.92 40.11 3dyo s ASP 411 CO 0.07 -0.21 -0.16 -0.70 -0.17 0.00 0.00 175.17 174.00 3dyo s GLU 412 N 1.79 3.13 0.58 4.34 2.12 -1.26 -0.38 118.70 129.02 3dyo s GLU 412 Ca 0.24 -0.74 -0.19 0.00 0.36 0.00 0.00 54.97 54.64 3dyo s GLU 412 Cb -0.15 -2.50 -0.04 0.00 0.26 0.00 0.00 34.13 31.69 3dyo s GLU 412 CO 0.09 0.29 1.19 0.00 -0.54 0.00 0.00 175.26 176.29 3dyo s ALA 413 N 0.14 2.59 -1.42 6.30 0.00 -0.33 -2.17 121.76 126.87 3dyo s ALA 413 Ca -0.08 0.97 -0.15 0.00 0.00 0.00 0.00 51.96 52.70 3dyo s ALA 413 Cb -0.15 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.57 3dyo s ALA 413 CO 0.05 -1.06 2.19 -1.71 0.00 0.00 0.00 175.76 175.23 3dyo n ASN 414 N -1.50 3.84 -3.68 0.00 5.15 -1.26 -4.04 115.26 113.78 3dyo n ASN 414 Ca 0.13 -2.83 -0.26 0.00 -0.60 0.00 0.00 54.58 51.01 3dyo n ASN 414 Cb 0.50 -1.64 -0.17 0.00 -0.53 0.00 0.00 39.78 37.94 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 3.35 0.21 -0.11 -1.44 1.01 -1.26 -4.80 121.20 118.16 3dyo s ILE 415 Ca 0.48 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.79 3dyo s ILE 415 Cb 0.14 -0.76 0.06 0.00 0.01 0.00 0.00 42.46 41.90 3dyo s ILE 415 CO -0.07 -0.20 0.21 -0.70 0.00 0.00 0.00 174.94 174.17 3dyo s GLU 416 N 2.01 0.09 -0.25 2.79 2.12 -0.29 -0.59 118.70 124.58 3dyo s GLU 416 Ca 0.01 0.64 0.11 0.00 0.36 0.00 0.00 54.97 56.09 3dyo s GLU 416 Cb -0.16 -0.19 0.46 0.00 0.26 0.00 0.00 34.13 34.50 3dyo s GLU 416 CO -0.08 -0.31 1.19 0.25 -0.54 0.00 0.00 175.26 175.77 3dyo n THR 417 N 5.34 2.16 -0.32 -1.70 -2.24 -1.05 -0.46 114.28 116.01 3dyo n THR 417 Ca -0.05 -3.65 0.16 0.00 -2.27 0.00 0.00 64.05 58.24 3dyo n THR 417 Cb 0.50 -0.50 0.35 0.00 -2.10 0.00 0.00 70.33 68.58 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 1.89 0.40 0.67 3.42 -0.00 -1.29 -2.15 115.58 118.52 3dyo h ASN 418 Ca 0.18 0.16 0.00 0.00 -0.00 0.00 0.00 56.30 56.64 3dyo h ASN 418 Cb 1.39 0.13 0.00 0.00 -0.00 0.00 0.00 38.32 39.84 3dyo h ASN 418 CO 0.47 -0.02 0.00 0.61 -0.00 0.00 0.00 177.43 178.49 3dyo n GLY 419 N -1.33 -1.18 3.73 1.57 0.00 -1.19 -4.82 105.19 101.97 3dyo n GLY 419 Ca 0.25 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.95 1.36 -0.09 1.61 -1.94 -0.81 -4.78 119.30 111.70 3dyo s MET 420 Ca 0.11 0.75 -0.01 0.00 -1.71 0.00 0.00 55.69 54.83 3dyo s MET 420 Cb 0.14 -1.83 0.03 0.00 2.01 0.00 0.00 34.83 35.18 3dyo s MET 420 CO 0.37 -2.15 -0.00 0.08 -0.01 0.00 0.00 175.02 173.31 3dyo s VAL 421 N -2.99 0.45 1.18 -6.03 1.01 -1.26 -3.60 120.40 109.17 3dyo s VAL 421 Ca 0.63 0.00 -0.17 0.00 0.00 0.00 0.00 61.98 62.44 3dyo s VAL 421 Cb -0.17 -0.64 0.27 0.00 0.00 0.00 0.00 36.38 35.84 3dyo s VAL 421 CO 0.56 0.21 1.07 -2.16 0.00 0.00 0.00 175.10 174.78 3dyo s PRO 422 N 1.94 -1.02 0.52 2.72 0.04 -1.26 -4.83 135.00 133.11 3dyo s PRO 422 Ca 0.04 0.24 0.22 0.00 0.04 0.00 0.00 61.00 61.55 3dyo s PRO 422 Cb -0.13 -1.59 1.40 0.00 0.04 0.00 0.00 34.50 34.22 3dyo s PRO 422 CO -0.06 -3.64 2.11 1.98 0.04 0.00 0.00 177.00 177.43 3dyo h MET 423 N -2.54 0.00 -0.77 4.56 4.05 -1.88 -2.54 114.93 115.82 3dyo h MET 423 Ca -0.50 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 58.92 3dyo h MET 423 Cb 1.32 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.12 3dyo h MET 423 CO 0.43 0.09 0.00 0.27 0.23 0.00 0.00 176.91 177.92 3dyo n ASN 424 N -4.04 3.68 -0.29 1.39 6.94 -1.26 -3.77 115.26 117.91 3dyo n ASN 424 Ca -0.03 -2.53 0.00 0.00 -0.02 0.00 0.00 54.58 52.01 3dyo n ASN 424 Cb 0.17 -0.61 0.13 0.00 -2.36 0.00 0.00 39.78 37.12 3dyo n ASN 424 CO 0.00 0.00 0.00 -0.09 -1.03 0.00 0.00 177.26 176.14 3dyo h ARG 425 N 2.24 0.85 0.13 -3.83 2.43 -1.77 -0.33 114.38 114.10 3dyo h ARG 425 Ca 0.00 -0.05 -0.24 0.00 -0.81 0.00 0.00 59.98 58.88 3dyo h ARG 425 Cb 1.34 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 30.71 3dyo h ARG 425 CO 0.28 0.56 -1.18 -0.07 -1.51 0.00 0.00 179.97 178.05 3dyo h LEU 426 N 0.87 0.42 -1.37 3.80 3.38 -1.87 -3.33 115.31 117.22 3dyo h LEU 426 Ca 0.36 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3dyo h LEU 426 Cb 0.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3dyo h LEU 426 CO -0.18 1.53 0.00 0.71 0.09 0.00 0.00 178.44 180.59 3dyo h THR 427 N -0.33 0.00 -0.02 0.22 1.35 -1.79 -0.91 112.91 111.42 3dyo h THR 427 Ca -0.24 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 3dyo h THR 427 Cb 1.72 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3dyo h THR 427 CO 0.10 0.00 -0.15 -0.67 -0.25 0.00 0.00 175.52 174.54 3dyo n ASP 428 N -2.49 2.25 -4.52 5.36 2.03 -0.15 -2.24 116.55 116.78 3dyo n ASP 428 Ca 0.00 -1.66 -0.41 0.00 0.52 0.00 0.00 54.79 53.24 3dyo n ASP 428 Cb 0.16 0.14 -0.10 0.00 -0.72 0.00 0.00 41.12 40.59 3dyo n ASP 428 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3dyo s ASP 429 N -2.18 6.11 0.61 1.67 -1.08 -0.35 -4.62 116.67 116.84 3dyo s ASP 429 Ca 0.27 -0.44 0.33 0.00 -0.52 0.00 0.00 52.55 52.19 3dyo s ASP 429 Cb 0.20 -2.17 1.88 0.00 -1.46 0.00 0.00 42.92 41.37 3dyo s ASP 429 CO 0.40 -0.32 2.19 1.55 0.52 0.00 0.00 175.17 179.51 3dyo h PRO 430 N 8.52 0.00 0.00 4.34 0.13 -1.90 0.20 132.00 143.29 3dyo h PRO 430 Ca -0.30 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.81 3dyo h PRO 430 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 3dyo h PRO 430 CO 0.68 0.00 -0.10 0.00 -0.23 0.00 0.00 178.00 178.34 3dyo h ARG 431 N 0.00 0.00 -0.02 0.86 2.47 -1.93 -1.79 114.38 113.98 3dyo h ARG 431 Ca 0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 3dyo h ARG 431 Cb 0.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.57 3dyo h ARG 431 CO -0.00 0.10 -0.12 0.91 0.56 0.00 0.00 179.97 181.42 3dyo n TRP 432 N -3.42 0.00 -0.22 3.04 7.02 0.69 -4.39 117.44 120.17 3dyo n TRP 432 Ca -0.01 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.42 3dyo n TRP 432 Cb 0.27 -0.01 0.06 0.00 -2.42 0.00 0.00 31.31 29.20 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 3.27 0.64 -0.11 -0.99 5.85 -1.22 -2.36 115.31 120.39 3dyo h LEU 433 Ca 0.00 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.74 3dyo h LEU 433 Cb 0.77 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3dyo h LEU 433 CO 0.00 0.45 0.00 -0.65 -0.34 0.00 0.00 178.44 177.90 3dyo h PRO 434 N 0.77 0.04 -0.62 5.25 0.11 -1.77 0.71 132.00 136.49 3dyo h PRO 434 Ca 0.25 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.30 3dyo h PRO 434 Cb -0.00 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 3dyo h PRO 434 CO -0.09 0.03 0.19 0.00 -0.21 0.00 0.00 178.00 177.91 3dyo h ALA 435 N 1.09 1.17 -0.19 -0.75 0.00 -1.73 -2.06 119.26 116.79 3dyo h ALA 435 Ca 0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3dyo h ALA 435 Cb 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3dyo h ALA 435 CO -0.09 0.58 0.03 0.52 0.00 0.00 0.00 179.25 180.29 3dyo h MET 436 N 0.91 0.31 -0.97 0.00 2.86 -1.01 -2.99 114.93 114.04 3dyo h MET 436 Ca 0.20 -0.08 0.14 0.00 -2.06 0.00 0.00 59.70 57.90 3dyo h MET 436 Cb 0.27 -0.04 -0.08 0.00 0.06 0.00 0.00 31.60 31.81 3dyo h MET 436 CO -0.01 0.47 0.61 0.66 1.06 0.00 0.00 176.91 179.71 3dyo h SER 437 N 0.10 0.82 0.96 1.22 4.64 0.82 0.33 113.55 122.44 3dyo h SER 437 Ca 0.06 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.38 3dyo h SER 437 Cb 0.31 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3dyo h SER 437 CO 0.00 0.41 -0.22 -0.33 -0.87 0.00 0.00 176.83 175.83 3dyo h GLU 438 N 0.87 0.00 0.00 4.77 5.08 -1.25 0.12 114.58 124.17 3dyo h GLU 438 Ca 0.50 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.82 3dyo h GLU 438 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 3dyo h GLU 438 CO -0.26 0.22 -0.16 0.00 -1.00 0.00 0.00 179.01 177.80 3dyo h ARG 439 N 0.00 0.00 0.00 2.33 3.08 -0.24 -2.14 114.38 117.41 3dyo h ARG 439 Ca -0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 3dyo h ARG 439 Cb 0.75 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 3dyo h ARG 439 CO 0.03 0.16 -1.03 0.28 -1.07 0.00 0.00 179.97 178.33 3dyo h VAL 440 N 0.00 0.82 -0.93 2.04 2.07 -1.08 -3.32 116.25 115.85 3dyo h VAL 440 Ca -0.00 -1.99 -0.01 0.00 0.82 0.00 0.00 66.70 65.53 3dyo h VAL 440 Cb 0.72 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 32.37 3dyo h VAL 440 CO 0.02 0.28 0.56 0.71 0.02 0.00 0.00 177.57 179.15 3dyo h THR 441 N -1.00 1.25 0.00 2.57 1.35 -1.03 -1.72 112.91 114.33 3dyo h THR 441 Ca -0.27 -0.55 -0.05 0.00 -0.55 0.00 0.00 66.41 64.99 3dyo h THR 441 Cb 1.14 -0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 67.50 3dyo h THR 441 CO -0.16 0.27 -0.24 0.03 -0.25 0.00 0.00 175.52 175.17 3dyo h ARG 442 N 1.28 0.00 -0.04 4.72 3.08 -1.59 -1.09 114.38 120.73 3dyo h ARG 442 Ca 0.33 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.32 3dyo h ARG 442 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3dyo h ARG 442 CO -0.06 0.24 -0.23 1.98 -1.07 0.00 0.00 179.97 180.82 3dyo h MET 443 N 0.00 0.24 -0.59 0.04 4.05 -1.47 -2.77 114.93 114.42 3dyo h MET 443 Ca -0.00 -0.20 0.06 0.00 -0.28 0.00 0.00 59.70 59.28 3dyo h MET 443 Cb 0.88 0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.67 3dyo h MET 443 CO 0.03 0.85 0.31 0.28 0.23 0.00 0.00 176.91 178.61 3dyo h VAL 444 N -0.32 0.95 -0.56 -5.77 2.07 -1.10 -0.45 116.25 111.06 3dyo h VAL 444 Ca -0.02 -0.20 0.07 0.00 0.82 0.00 0.00 66.70 67.38 3dyo h VAL 444 Cb 0.90 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3dyo h VAL 444 CO 0.05 0.11 0.38 1.56 0.02 0.00 0.00 177.57 179.68 3dyo h GLN 445 N 0.58 0.45 0.16 1.57 4.20 -1.27 -1.33 115.11 119.47 3dyo h GLN 445 Ca 0.27 -0.03 -0.23 0.00 0.06 0.00 0.00 58.65 58.72 3dyo h GLN 445 Cb 0.18 -0.10 0.02 0.00 0.30 0.00 0.00 27.48 27.88 3dyo h GLN 445 CO -0.18 0.30 -1.06 -0.09 -0.67 0.00 0.00 178.83 177.13 3dyo h ARG 446 N 0.46 0.33 -0.02 1.46 2.43 -1.07 -2.94 114.38 115.03 3dyo h ARG 446 Ca 0.25 -0.57 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 3dyo h ARG 446 Cb 0.39 0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 3dyo h ARG 446 CO -0.07 1.27 -0.14 -0.25 -1.51 0.00 0.00 179.97 179.27 3dyo n ASP 447 N -4.01 2.39 0.27 -3.80 8.00 -0.25 -4.23 116.55 114.93 3dyo n ASP 447 Ca -0.17 -1.70 0.17 0.00 0.71 0.00 0.00 54.79 53.80 3dyo n ASP 447 Cb 0.89 0.17 0.90 0.00 -0.02 0.00 0.00 41.12 43.06 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 3.34 0.00 -0.02 -1.24 0.11 -1.46 -2.10 114.38 113.01 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 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 3dyo h ARG 448 CO 0.00 0.00 -0.09 0.09 0.10 0.00 0.00 179.97 180.07 3dyo n ASN 449 N -2.71 2.14 -4.65 0.08 3.02 -1.26 -4.84 115.26 107.04 3dyo n ASN 449 Ca -0.02 -1.65 -0.43 0.00 -0.03 0.00 0.00 54.58 52.46 3dyo n ASN 449 Cb 0.13 0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.34 3dyo n ASN 449 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3dyo s HIS 450 N -2.11 3.29 0.44 3.10 3.76 -0.79 -4.87 115.29 118.10 3dyo s HIS 450 Ca 0.30 1.32 0.19 0.00 -0.15 0.00 0.00 55.06 56.71 3dyo s HIS 450 Cb 0.20 -3.31 1.14 0.00 1.11 0.00 0.00 32.58 31.72 3dyo s HIS 450 CO 0.37 -0.53 2.01 -1.00 -0.85 0.00 0.00 174.74 174.75 3dyo h PRO 451 N 7.66 0.00 0.00 8.40 0.13 -1.88 -2.93 132.00 143.38 3dyo h PRO 451 Ca -0.20 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.90 3dyo h PRO 451 Cb 1.07 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 3dyo h PRO 451 CO 0.96 0.17 -0.13 0.66 -0.23 0.00 0.00 178.00 179.44 3dyo h SER 452 N 0.00 0.00 -3.30 1.44 4.64 -1.87 -3.39 113.55 111.07 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 0.34 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.38 3dyo h SER 452 CO 0.02 0.13 1.02 -0.69 -0.87 0.00 0.00 176.83 176.44 3dyo s VAL 453 N -4.46 4.03 -0.03 0.95 1.01 -1.11 0.19 120.40 120.99 3dyo s VAL 453 Ca -0.04 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.19 3dyo s VAL 453 Cb 0.15 -4.25 -0.24 0.00 0.00 0.00 0.00 36.38 32.04 3dyo s VAL 453 CO 0.63 -0.70 0.32 2.30 0.00 0.00 0.00 175.10 177.65 3dyo n ILE 454 N 6.75 0.08 -3.85 2.22 -5.35 0.13 -4.88 119.36 114.46 3dyo n ILE 454 Ca 0.15 -0.37 -0.12 0.00 -0.27 0.00 0.00 62.75 62.14 3dyo n ILE 454 Cb 0.48 0.08 -0.12 0.00 -1.74 0.00 0.00 39.64 38.34 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 -3.02 0.02 -0.04 7.28 1.01 -1.18 -3.95 121.20 121.32 3dyo s ILE 455 Ca -0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 60.65 60.39 3dyo s ILE 455 Cb 0.09 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.30 3dyo s ILE 455 CO 0.64 -0.09 0.15 0.26 0.00 0.00 0.00 174.94 175.90 3dyo s TRP 456 N -0.27 3.52 -0.02 3.97 0.52 -0.86 -1.38 118.94 124.43 3dyo s TRP 456 Ca -0.03 0.38 0.06 0.00 0.02 0.00 0.00 56.10 56.53 3dyo s TRP 456 Cb -0.03 -1.85 -0.01 0.00 -1.15 0.00 0.00 33.47 30.43 3dyo s TRP 456 CO 0.00 0.66 -0.19 0.45 0.02 0.00 0.00 176.95 177.89 3dyo s SER 457 N -1.64 2.27 0.00 2.95 0.15 0.48 -0.33 113.70 117.59 3dyo s SER 457 Ca 0.23 -0.35 0.25 0.00 0.70 0.00 0.00 55.95 56.78 3dyo s SER 457 Cb -0.12 -0.26 1.47 0.00 -1.71 0.00 0.00 66.02 65.40 3dyo s SER 457 CO 0.14 0.24 1.89 0.18 1.20 0.00 0.00 173.24 176.88 3dyo n LEU 458 N 2.62 0.00 0.00 3.45 4.77 -1.06 -1.18 117.00 125.60 3dyo n LEU 458 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 3dyo n LEU 458 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 3dyo n LEU 458 CO 0.24 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 3dyo n GLY 459 N 0.73 0.65 3.24 -0.72 0.00 -1.26 -4.63 105.19 103.20 3dyo n GLY 459 Ca 0.19 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.25 -0.77 1.61 2.47 0.24 -4.74 114.94 109.52 3dyo s ASN 460 Ca 0.00 0.29 -0.17 0.00 0.42 0.00 0.00 52.86 53.40 3dyo s ASN 460 Cb 0.00 0.44 0.02 0.00 -1.45 0.00 0.00 41.25 40.27 3dyo s ASN 460 CO 0.00 -0.34 0.46 -0.62 -3.72 0.00 0.00 177.10 172.88 3dyo n GLU 461 N 1.81 -0.66 -1.43 0.43 1.02 -1.26 -3.90 120.64 116.65 3dyo n GLU 461 Ca -0.19 0.09 0.01 0.00 -0.02 0.00 0.00 57.16 57.05 3dyo n GLU 461 Cb 0.57 -1.46 0.09 0.00 -0.02 0.00 0.00 31.44 30.61 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 -1.37 1.72 0.00 1.62 7.64 -1.26 -0.95 113.62 121.01 3dyo n SER 462 Ca -0.13 -2.83 0.00 0.00 1.01 0.00 0.00 58.87 56.93 3dyo n SER 462 Cb 0.42 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 -0.31 0.92 2.92 0.23 0.00 -1.25 -3.99 105.19 103.70 3dyo n GLY 463 Ca 0.14 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 45.09 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 2.06 0.39 1.61 2.46 -1.26 -3.50 115.29 117.05 3dyo s HIS 464 Ca 0.00 -1.44 0.05 0.00 0.47 0.00 0.00 55.06 54.15 3dyo s HIS 464 Cb 0.00 -1.46 -0.07 0.00 -0.13 0.00 0.00 32.58 30.92 3dyo s HIS 464 CO 0.00 -0.71 0.03 0.20 -2.47 0.00 0.00 174.74 171.80 3dyo s GLY 465 N 1.51 2.41 0.43 1.59 0.00 -1.26 -4.84 107.32 107.16 3dyo s GLY 465 Ca -0.02 -2.01 0.15 0.00 0.00 0.00 0.00 44.72 42.83 3dyo s GLY 465 CO -0.07 -2.00 1.93 0.00 0.00 0.00 0.00 173.10 172.95 3dyo h ALA 466 N 1.85 2.09 -0.40 3.20 0.00 -1.81 0.17 119.26 124.35 3dyo h ALA 466 Ca -0.43 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 3dyo h ALA 466 Cb 1.25 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3dyo h ALA 466 CO 0.76 -0.28 0.19 -0.91 0.00 0.00 0.00 179.25 179.00 3dyo h ASN 467 N 0.42 0.49 -0.66 0.00 2.35 -1.76 -0.42 115.58 115.99 3dyo h ASN 467 Ca 0.36 -0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.99 3dyo h ASN 467 Cb 0.79 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.01 3dyo h ASN 467 CO -0.11 0.42 0.10 0.45 -1.65 0.00 0.00 177.43 176.63 3dyo h HIS 468 N 0.55 1.18 -0.63 1.19 3.86 -0.84 -1.45 115.15 119.01 3dyo h HIS 468 Ca 0.14 -0.17 -0.06 0.00 -1.16 0.00 0.00 60.37 59.12 3dyo h HIS 468 Cb 0.06 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 28.18 3dyo h HIS 468 CO 0.00 0.99 0.16 -0.44 0.86 0.00 0.00 177.93 179.51 3dyo h ASP 469 N 1.04 0.95 -0.41 2.45 3.32 -1.04 -0.27 116.42 122.46 3dyo h ASP 469 Ca 0.20 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 3dyo h ASP 469 Cb 0.46 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 3dyo h ASP 469 CO 0.02 0.93 0.14 0.00 -1.72 0.00 0.00 179.24 178.61 3dyo h ALA 470 N 1.06 0.54 -0.24 3.45 0.00 -1.04 -2.50 119.26 120.53 3dyo h ALA 470 Ca 0.20 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3dyo h ALA 470 Cb 0.34 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3dyo h ALA 470 CO 0.00 0.18 -0.32 -0.07 0.00 0.00 0.00 179.25 179.04 3dyo h LEU 471 N 0.53 0.50 -0.02 0.00 3.38 -0.95 -0.76 115.31 117.99 3dyo h LEU 471 Ca 0.14 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3dyo h LEU 471 Cb 0.24 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3dyo h LEU 471 CO -0.01 0.79 -0.04 0.22 0.09 0.00 0.00 178.44 179.50 3dyo h TYR 472 N 0.42 -0.09 -0.72 1.13 3.20 -0.97 -2.04 116.97 117.89 3dyo h TYR 472 Ca 0.05 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 3dyo h TYR 472 Cb 0.76 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.04 3dyo h TYR 472 CO 0.03 -0.06 0.29 -0.09 -1.64 0.00 0.00 178.16 176.69 3dyo h ARG 473 N -0.06 1.08 -0.41 1.82 9.65 -1.17 -1.60 114.38 123.70 3dyo h ARG 473 Ca 0.02 -0.20 0.06 0.00 -1.10 0.00 0.00 59.98 58.76 3dyo h ARG 473 Cb 0.09 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 28.44 3dyo h ARG 473 CO -0.05 0.89 0.12 2.35 2.80 0.00 0.00 179.97 186.07 3dyo h TRP 474 N 1.04 0.20 -0.68 2.20 7.01 -0.85 -0.85 115.95 124.02 3dyo h TRP 474 Ca 0.24 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.21 3dyo h TRP 474 Cb 0.21 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.21 3dyo h TRP 474 CO 0.02 0.06 0.21 0.82 -2.79 0.00 0.00 178.44 176.75 3dyo h ILE 475 N 0.26 1.25 -0.41 2.65 2.04 -1.06 -0.27 117.51 121.97 3dyo h ILE 475 Ca 0.19 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.18 3dyo h ILE 475 Cb 0.21 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3dyo h ILE 475 CO -0.22 0.34 0.28 0.11 0.00 0.00 0.00 178.15 178.65 3dyo h LYS 476 N 0.99 0.52 -0.00 2.37 1.79 -0.64 0.24 116.57 121.83 3dyo h LYS 476 Ca 0.22 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.65 3dyo h LYS 476 Cb 0.31 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 3dyo h LYS 476 CO -0.01 0.34 -0.02 0.77 -1.08 0.00 0.00 179.45 179.45 3dyo h SER 477 N 0.53 0.02 0.58 0.86 0.02 -0.78 -3.26 113.55 111.52 3dyo h SER 477 Ca 0.16 -0.77 -0.16 0.00 -0.84 0.00 0.00 61.79 60.17 3dyo h SER 477 Cb -0.02 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3dyo h SER 477 CO -0.04 0.79 -0.71 -0.37 -1.14 0.00 0.00 176.83 175.36 3dyo h VAL 478 N -0.75 1.47 -2.09 2.27 -1.51 -0.74 -3.40 116.25 111.49 3dyo h VAL 478 Ca -0.00 -2.33 -0.50 0.00 -1.23 0.00 0.00 66.70 62.64 3dyo h VAL 478 Cb 0.80 2.25 -0.34 0.00 -2.13 0.00 0.00 31.29 31.87 3dyo h VAL 478 CO 0.00 0.67 -0.88 -0.62 -1.23 0.00 0.00 177.57 175.52 3dyo s ASP 479 N -6.86 0.86 0.00 4.19 2.15 0.80 -4.96 116.67 112.84 3dyo s ASP 479 Ca -0.02 -2.77 0.13 0.00 0.43 0.00 0.00 52.55 50.32 3dyo s ASP 479 Cb 0.12 0.04 0.77 0.00 -0.30 0.00 0.00 42.92 43.54 3dyo s ASP 479 CO 0.79 -0.15 1.21 -2.65 -0.17 0.00 0.00 175.17 174.20 3dyo n PRO 480 N 2.90 0.39 0.00 4.34 -0.02 -1.23 -3.57 135.00 137.82 3dyo n PRO 480 Ca 0.27 0.01 0.13 0.00 -2.02 0.00 0.00 63.50 61.89 3dyo n PRO 480 Cb 0.49 -1.50 0.49 0.00 -0.02 0.00 0.00 33.50 32.97 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 -1.02 0.23 -4.00 2.55 3.41 -1.26 -4.79 113.62 108.74 3dyo n SER 481 Ca 0.10 0.11 -0.20 0.00 -0.26 0.00 0.00 58.87 58.61 3dyo n SER 481 Cb 0.05 -0.19 -0.15 0.00 -0.26 0.00 0.00 64.21 63.66 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 -2.93 0.93 0.74 4.33 0.52 -1.23 -4.22 118.95 117.08 3dyo s ARG 482 Ca 0.15 -0.30 -0.15 0.00 -0.52 0.00 0.00 55.73 54.91 3dyo s ARG 482 Cb 0.19 -0.87 0.05 0.00 0.52 0.00 0.00 34.95 34.83 3dyo s ARG 482 CO 0.58 0.11 1.21 -2.14 0.02 0.00 0.00 175.30 175.08 3dyo s PRO 483 N 0.18 2.06 -0.08 3.54 0.02 -1.25 -4.75 135.00 134.70 3dyo s PRO 483 Ca -0.03 1.76 0.02 0.00 0.02 0.00 0.00 61.00 62.77 3dyo s PRO 483 Cb -0.08 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 32.59 3dyo s PRO 483 CO 0.00 -1.90 -0.13 0.08 -0.33 0.00 0.00 177.00 174.72 3dyo s VAL 484 N -2.02 3.12 0.18 3.83 1.01 -1.26 -2.02 120.40 123.24 3dyo s VAL 484 Ca 0.74 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 62.09 3dyo s VAL 484 Cb -0.29 -2.26 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 3dyo s VAL 484 CO 0.46 0.56 -0.07 0.00 0.00 0.00 0.00 175.10 176.06 3dyo s GLN 485 N -0.30 1.18 -0.29 2.72 -2.07 0.55 -0.37 119.66 121.07 3dyo s GLN 485 Ca 0.03 -1.54 -0.15 0.00 -1.82 0.00 0.00 55.36 51.87 3dyo s GLN 485 Cb -0.13 -0.64 0.13 0.00 -1.09 0.00 0.00 33.01 31.28 3dyo s GLN 485 CO 0.03 0.02 0.88 -0.47 -1.32 0.00 0.00 175.29 174.42 3dyo s TYR 486 N -3.35 -0.78 -0.08 9.60 5.04 -1.26 -2.55 117.35 123.97 3dyo s TYR 486 Ca 0.21 1.50 0.14 0.00 -2.44 0.00 0.00 57.07 56.48 3dyo s TYR 486 Cb 0.04 0.47 -0.09 0.00 0.35 0.00 0.00 41.96 42.73 3dyo s TYR 486 CO 0.04 -0.39 1.12 1.49 -1.34 0.00 0.00 175.55 176.47 3dyo h GLU 487 N 6.72 0.00 -6.81 4.97 4.22 -1.85 -3.43 114.58 118.40 3dyo h GLU 487 Ca -0.25 0.00 -0.57 0.00 0.08 0.00 0.00 59.36 58.62 3dyo h GLU 487 Cb 1.18 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.59 3dyo h GLU 487 CO 0.16 0.52 0.16 0.41 -2.18 0.00 0.00 179.01 178.07 3dyo n GLY 488 N 1.34 -0.25 2.15 1.92 0.00 -1.26 0.61 105.19 109.70 3dyo n GLY 488 Ca -0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 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 1.24 0.28 0.00 -0.02 0.00 -1.23 -3.84 105.19 101.62 3dyo n GLY 489 Ca 0.13 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.27 0.93 3.55 -0.02 0.00 -1.18 -4.73 105.19 102.47 3dyo n GLY 490 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.49 0.00 -2.53 4.61 0.00 0.20 -4.68 120.51 117.63 3dyo n ALA 491 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 3dyo n ALA 491 Cb 0.00 -0.98 0.02 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.25 0.92 -3.65 0.00 5.68 -1.26 -1.95 116.55 116.04 3dyo n ASP 492 Ca 0.00 -2.01 -0.28 0.00 -0.50 0.00 0.00 54.79 52.01 3dyo n ASP 492 Cb 0.13 -0.27 0.21 0.00 -1.14 0.00 0.00 41.12 40.04 3dyo n ASP 492 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3dyo n THR 493 N 0.25 0.00 1.73 2.12 -2.24 -1.26 -4.90 114.28 109.98 3dyo n THR 493 Ca 0.03 -0.71 0.13 0.00 -2.27 0.00 0.00 64.05 61.23 3dyo n THR 493 Cb 1.06 -1.40 0.75 0.00 -2.10 0.00 0.00 70.33 68.64 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 -4.16 0.00 -0.71 4.28 -2.24 -1.26 -2.52 114.28 107.66 3dyo n THR 494 Ca 0.15 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.02 3dyo n THR 494 Cb 0.54 -0.52 0.37 0.00 -2.10 0.00 0.00 70.33 68.62 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 -0.96 3.33 -3.03 6.98 0.00 -1.26 -4.95 120.51 120.61 3dyo n ALA 495 Ca 0.19 -1.71 -0.12 0.00 0.00 0.00 0.00 53.44 51.80 3dyo n ALA 495 Cb 0.09 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.37 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 -2.13 0.03 -1.01 0.00 -1.32 -1.05 -4.11 115.64 106.06 3dyo s THR 496 Ca 0.53 -0.28 0.24 0.00 -1.21 0.00 0.00 61.69 60.96 3dyo s THR 496 Cb 0.36 -0.26 -0.07 0.00 -1.51 0.00 0.00 72.50 71.02 3dyo s THR 496 CO 0.22 -0.16 1.25 0.47 -2.21 0.00 0.00 174.62 174.20 3dyo n ASP 497 N 2.43 0.67 -4.05 8.08 8.00 0.50 -4.83 116.55 127.34 3dyo n ASP 497 Ca -0.16 -0.49 -0.22 0.00 0.71 0.00 0.00 54.79 54.62 3dyo n ASP 497 Cb 0.58 0.48 -0.16 0.00 -0.02 0.00 0.00 41.12 42.00 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 -2.99 1.01 -0.32 0.53 1.01 -1.26 -4.54 121.20 114.63 3dyo s ILE 498 Ca 0.10 -0.49 -0.29 0.00 0.00 0.00 0.00 60.65 59.98 3dyo s ILE 498 Cb 0.17 -0.88 -0.01 0.00 0.01 0.00 0.00 42.46 41.75 3dyo s ILE 498 CO 0.75 0.30 1.52 -0.63 0.00 0.00 0.00 174.94 176.88 3dyo s ILE 499 N 0.11 3.81 -0.49 2.92 1.01 0.56 -4.68 121.20 124.44 3dyo s ILE 499 Ca -0.03 0.87 0.08 0.00 0.00 0.00 0.00 60.65 61.58 3dyo s ILE 499 Cb -0.09 -3.96 0.31 0.00 0.01 0.00 0.00 42.46 38.73 3dyo s ILE 499 CO 0.01 -0.51 0.76 0.00 0.00 0.00 0.00 174.94 175.20 3dyo s PRO 501 N -2.51 1.79 -0.21 0.00 0.04 -1.26 -3.54 135.00 129.31 3dyo s PRO 501 Ca 0.42 1.06 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 3dyo s PRO 501 Cb 0.25 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.94 3dyo s PRO 501 CO -0.09 -1.94 -0.07 0.00 0.04 0.00 0.00 177.00 174.94 3dyo s MET 502 N -4.90 3.34 -1.31 4.56 0.23 -1.26 -1.20 119.30 118.76 3dyo s MET 502 Ca 0.62 -0.65 0.00 0.00 -1.03 0.00 0.00 55.69 54.63 3dyo s MET 502 Cb -0.18 -2.92 0.00 0.00 -1.53 0.00 0.00 34.83 30.20 3dyo s MET 502 CO 0.57 -0.15 0.00 0.66 -2.03 0.00 0.00 175.02 174.07 3dyo n TYR 503 N 4.62 -0.12 -2.41 3.16 4.02 0.14 -4.97 117.16 121.60 3dyo n TYR 503 Ca -0.18 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.31 3dyo n TYR 503 Cb 0.51 -2.43 -0.03 0.00 -0.02 0.00 0.00 39.34 37.36 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 -2.51 3.30 0.63 -0.72 0.00 -1.26 -4.90 121.76 116.29 3dyo s ALA 504 Ca 0.00 0.91 -0.06 0.00 0.00 0.00 0.00 51.96 52.82 3dyo s ALA 504 Cb 0.00 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.81 3dyo s ALA 504 CO 0.00 -0.30 0.94 1.03 0.00 0.00 0.00 175.76 177.42 3dyo s ARG 505 N -1.87 2.63 -0.03 0.00 0.52 -1.26 -4.83 118.95 114.11 3dyo s ARG 505 Ca 0.50 -0.14 -0.20 0.00 -0.52 0.00 0.00 55.73 55.37 3dyo s ARG 505 Cb -0.31 -2.25 -0.13 0.00 0.52 0.00 0.00 34.95 32.78 3dyo s ARG 505 CO 0.39 -0.90 0.89 0.28 0.02 0.00 0.00 175.30 175.98 3dyo h VAL 506 N -0.32 0.47 0.00 3.52 2.07 -1.94 -0.64 116.25 119.41 3dyo h VAL 506 Ca -0.45 -0.77 -0.11 0.00 0.82 0.00 0.00 66.70 66.19 3dyo h VAL 506 Cb 1.28 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3dyo h VAL 506 CO 0.60 0.11 -1.65 0.47 0.02 0.00 0.00 177.57 177.11 3dyo n ASP 507 N -5.08 2.29 -4.64 0.57 8.00 -1.26 -3.04 116.55 113.39 3dyo n ASP 507 Ca -0.08 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.01 3dyo n ASP 507 Cb 0.26 1.13 -0.06 0.00 -0.02 0.00 0.00 41.12 42.43 3dyo n ASP 507 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3dyo s GLU 508 N -2.53 4.17 0.46 -1.24 2.12 -1.26 -4.72 118.70 115.70 3dyo s GLU 508 Ca -0.05 0.64 -0.20 0.00 0.36 0.00 0.00 54.97 55.71 3dyo s GLU 508 Cb 0.05 -3.61 -0.10 0.00 0.26 0.00 0.00 34.13 30.73 3dyo s GLU 508 CO 0.47 -0.34 0.99 -0.51 -0.54 0.00 0.00 175.26 175.33 3dyo s ASP 509 N 1.32 6.67 -0.45 -1.70 1.01 -1.26 -3.72 116.67 118.54 3dyo s ASP 509 Ca 0.29 1.78 0.02 0.00 0.71 0.00 0.00 52.55 55.35 3dyo s ASP 509 Cb -0.16 -2.55 0.15 0.00 1.01 0.00 0.00 42.92 41.37 3dyo s ASP 509 CO 0.09 -0.55 0.28 -1.10 0.21 0.00 0.00 175.17 174.11 3dyo s GLN 510 N -3.24 1.27 -1.28 8.23 -0.21 0.04 -4.88 119.66 119.58 3dyo s GLN 510 Ca 0.64 -2.09 -0.09 0.00 0.02 0.00 0.00 55.36 53.84 3dyo s GLN 510 Cb -0.12 -2.18 -0.11 0.00 1.00 0.00 0.00 33.01 31.60 3dyo s GLN 510 CO 0.17 -1.22 2.89 -0.35 -2.12 0.00 0.00 175.29 174.65 3dyo n PRO 511 N 3.31 3.18 -1.74 2.91 -0.04 -1.26 -0.21 135.00 141.14 3dyo n PRO 511 Ca 0.14 -1.89 -0.38 0.00 -0.04 0.00 0.00 63.50 61.32 3dyo n PRO 511 Cb 0.37 -2.62 0.05 0.00 -0.04 0.00 0.00 33.50 31.26 3dyo n PRO 511 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3dyo n PHE 512 N 3.53 2.26 -2.07 0.54 3.01 -1.26 -4.84 117.46 118.63 3dyo n PHE 512 Ca 0.68 0.43 -0.38 0.00 1.01 0.00 0.00 57.45 59.18 3dyo n PHE 512 Cb 0.30 -2.35 0.00 0.00 -0.01 0.00 0.00 39.48 37.42 3dyo n PHE 512 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3dyo s PRO 513 N -2.98 3.74 0.00 -1.08 0.04 -1.26 -2.31 135.00 131.15 3dyo s PRO 513 Ca 0.74 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.82 3dyo s PRO 513 Cb -0.41 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.58 3dyo s PRO 513 CO 0.47 -0.64 0.00 0.00 0.04 0.00 0.00 177.00 176.87 3dyo n ALA 514 N -0.29 0.00 -3.17 8.56 0.00 -1.26 -4.52 120.51 119.83 3dyo n ALA 514 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.29 3dyo n ALA 514 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.86 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 0.30 -1.67 0.00 0.24 -1.22 -4.82 118.33 111.16 3dyo n VAL 515 Ca 0.00 -4.62 -0.35 0.00 -2.04 0.00 0.00 64.34 57.33 3dyo n VAL 515 Cb 0.00 -0.97 0.07 0.00 -1.47 0.00 0.00 33.84 31.47 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 -2.25 2.48 -0.65 7.34 0.04 -0.98 -4.54 135.00 136.43 3dyo s PRO 516 Ca 0.40 1.83 -0.02 0.00 0.04 0.00 0.00 61.00 63.25 3dyo s PRO 516 Cb 0.28 -1.87 0.17 0.00 0.04 0.00 0.00 34.50 33.12 3dyo s PRO 516 CO -0.09 -1.59 0.47 0.15 0.04 0.00 0.00 177.00 175.97 3dyo s LYS 517 N -3.64 2.60 0.66 4.56 1.02 0.71 -4.86 119.74 120.79 3dyo s LYS 517 Ca 0.77 -2.66 -0.14 0.00 0.02 0.00 0.00 55.97 53.95 3dyo s LYS 517 Cb -0.31 -3.71 -0.00 0.00 -0.52 0.00 0.00 37.83 33.28 3dyo s LYS 517 CO 0.41 -1.18 1.09 -1.58 -0.92 0.00 0.00 175.35 173.16 3dyo s TRP 518 N -0.30 2.75 0.18 3.18 0.52 -1.26 -0.78 118.94 123.23 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 -0.19 -3.09 -0.16 0.00 -1.15 0.00 0.00 33.47 28.88 3dyo s TRP 518 CO -0.04 -1.52 0.90 0.45 0.02 0.00 0.00 176.95 176.76 3dyo n SER 519 N -2.53 0.26 0.03 2.95 2.88 -1.24 -4.44 113.62 111.53 3dyo n SER 519 Ca 0.10 1.15 0.02 0.00 -1.33 0.00 0.00 58.87 58.80 3dyo n SER 519 Cb 0.52 -1.10 0.36 0.00 -0.75 0.00 0.00 64.21 63.24 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 2.02 1.17 -0.49 2.46 3.07 -1.02 -0.39 117.51 124.33 3dyo h ILE 520 Ca -0.39 -0.62 -0.09 0.00 1.55 0.00 0.00 64.86 65.32 3dyo h ILE 520 Cb 1.39 0.89 -0.02 0.00 -0.27 0.00 0.00 36.82 38.81 3dyo h ILE 520 CO 0.63 0.22 -0.05 0.11 -1.05 0.00 0.00 178.15 178.01 3dyo h LYS 521 N 0.44 0.85 0.10 0.16 1.57 -1.84 -3.03 116.57 114.82 3dyo h LYS 521 Ca 0.10 -0.26 -0.27 0.00 -1.87 0.00 0.00 60.65 58.35 3dyo h LYS 521 Cb 0.24 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.47 3dyo h LYS 521 CO 0.00 0.88 -1.17 -0.22 -0.57 0.00 0.00 179.45 178.38 3dyo h LYS 522 N 0.78 0.38 -0.56 3.15 3.64 -1.73 -3.32 116.57 118.92 3dyo h LYS 522 Ca 0.14 -0.55 0.08 0.00 -1.27 0.00 0.00 60.65 59.05 3dyo h LYS 522 Cb 0.54 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.48 3dyo h LYS 522 CO 0.03 1.22 0.20 2.35 -2.27 0.00 0.00 179.45 180.99 3dyo h TRP 523 N 0.16 0.36 -0.87 1.91 2.91 -0.97 -2.47 115.95 116.97 3dyo h TRP 523 Ca -0.13 0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.04 3dyo h TRP 523 Cb 1.86 -0.08 -0.07 0.00 -0.51 0.00 0.00 29.16 30.36 3dyo h TRP 523 CO 0.07 0.10 0.56 -0.07 -1.03 0.00 0.00 178.44 178.08 3dyo h LEU 524 N 0.38 0.68 -2.74 0.65 3.38 -1.63 -2.64 115.31 113.40 3dyo h LEU 524 Ca 0.27 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3dyo h LEU 524 Cb 0.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3dyo h LEU 524 CO -0.27 0.36 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 3dyo n SER 525 N -4.55 4.19 -4.76 -0.43 3.41 -0.94 -4.62 113.62 105.94 3dyo n SER 525 Ca 0.16 -2.41 -0.36 0.00 -0.26 0.00 0.00 58.87 56.00 3dyo n SER 525 Cb 0.42 -0.54 0.03 0.00 -0.26 0.00 0.00 64.21 63.85 3dyo n SER 525 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dyo s LEU 526 N -1.68 3.73 -0.03 1.04 1.43 -1.00 -4.79 118.68 117.38 3dyo s LEU 526 Ca 0.44 2.41 -0.38 0.00 -1.03 0.00 0.00 54.13 55.58 3dyo s LEU 526 Cb 0.29 -4.52 -0.16 0.00 0.03 0.00 0.00 46.19 41.83 3dyo s LEU 526 CO 0.21 -1.49 1.48 -2.65 0.23 0.00 0.00 176.35 174.12 3dyo n PRO 527 N -1.37 1.17 0.00 1.29 -0.02 -1.26 -0.38 135.00 134.42 3dyo n PRO 527 Ca 0.12 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3dyo n PRO 527 Cb 0.49 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 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 3.09 2.88 3.72 -1.23 0.00 -1.26 -5.02 105.19 107.37 3dyo n GLY 528 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.05 4.41 0.00 1.61 2.56 0.49 -4.92 118.70 122.80 3dyo s GLU 529 Ca 0.00 1.92 0.00 0.00 0.00 0.00 0.00 54.97 56.89 3dyo s GLU 529 Cb 0.00 -3.27 0.00 0.00 2.00 0.00 0.00 34.13 32.86 3dyo s GLU 529 CO 0.00 -0.26 0.00 0.25 -0.56 0.00 0.00 175.26 174.69 3dyo n THR 530 N 3.35 0.00 -1.34 -1.70 -2.24 -1.26 -4.81 114.28 106.28 3dyo n THR 530 Ca 0.08 -0.10 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 3dyo n THR 530 Cb 0.44 0.53 0.11 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.11 1.83 0.60 -0.78 0.52 -1.26 -4.04 118.95 114.71 3dyo s ARG 531 Ca 0.00 0.86 -0.14 0.00 -0.52 0.00 0.00 55.73 55.93 3dyo s ARG 531 Cb 0.00 -1.87 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 3dyo s ARG 531 CO 0.00 -1.85 1.04 -1.25 0.02 0.00 0.00 175.30 173.25 3dyo s PRO 532 N -5.00 3.42 -0.16 3.54 0.04 -1.02 -4.79 135.00 131.04 3dyo s PRO 532 Ca 0.62 1.03 0.01 0.00 0.04 0.00 0.00 61.00 62.70 3dyo s PRO 532 Cb -0.16 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.34 3dyo s PRO 532 CO 0.56 -0.71 -0.20 -1.17 0.04 0.00 0.00 177.00 175.52 3dyo s LEU 533 N -4.72 2.04 -0.14 -3.56 0.20 -0.23 -0.32 118.68 111.95 3dyo s LEU 533 Ca 0.60 -0.60 -0.02 0.00 0.69 0.00 0.00 54.13 54.79 3dyo s LEU 533 Cb -0.13 -1.41 0.05 0.00 -0.43 0.00 0.00 46.19 44.27 3dyo s LEU 533 CO 0.42 0.02 0.03 -0.63 -0.29 0.00 0.00 176.35 175.89 3dyo s ILE 534 N 1.15 0.41 0.18 6.68 1.01 -0.61 -0.65 121.20 129.37 3dyo s ILE 534 Ca 0.01 -0.25 -0.31 0.00 0.00 0.00 0.00 60.65 60.10 3dyo s ILE 534 Cb -0.14 -0.79 -0.09 0.00 0.01 0.00 0.00 42.46 41.45 3dyo s ILE 534 CO -0.09 -0.03 1.46 -0.76 0.00 0.00 0.00 174.94 175.53 3dyo s LEU 535 N 1.93 4.38 0.43 2.97 1.02 -0.39 -4.17 118.68 124.85 3dyo s LEU 535 Ca 0.02 2.53 0.24 0.00 0.02 0.00 0.00 54.13 56.93 3dyo s LEU 535 Cb -0.15 -3.60 0.73 0.00 0.02 0.00 0.00 46.19 43.19 3dyo s LEU 535 CO -0.07 -0.72 1.74 0.00 0.02 0.00 0.00 176.35 177.33 3dyo s GLU 537 N -3.45 0.58 0.29 0.00 2.02 -1.23 -4.40 118.70 112.52 3dyo s GLU 537 Ca 0.02 0.79 -0.20 0.00 0.02 0.00 0.00 54.97 55.60 3dyo s GLU 537 Cb 0.09 0.22 0.03 0.00 0.10 0.00 0.00 34.13 34.57 3dyo s GLU 537 CO 0.65 -0.10 0.75 1.52 0.02 0.00 0.00 175.26 178.10 3dyo s TYR 538 N 0.63 -0.13 -1.11 1.61 -0.85 -0.71 0.24 117.35 117.03 3dyo s TYR 538 Ca -0.03 -0.35 -0.10 0.00 -0.52 0.00 0.00 57.07 56.07 3dyo s TYR 538 Cb -0.05 0.73 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 3dyo s TYR 538 CO -0.04 -1.27 0.86 0.00 -1.52 0.00 0.00 175.55 173.58 3dyo n ALA 539 N -0.47 -2.43 -1.57 9.51 0.00 -1.26 -1.17 120.51 123.11 3dyo n ALA 539 Ca -0.05 -0.03 -0.40 0.00 0.00 0.00 0.00 53.44 52.96 3dyo n ALA 539 Cb 0.59 -4.67 -0.03 0.00 0.00 0.00 0.00 19.45 15.34 3dyo n ALA 539 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3dyo n HIS 540 N -3.71 1.68 -0.76 0.00 -0.00 -0.67 -3.92 115.22 107.84 3dyo n HIS 540 Ca -0.11 0.01 -0.11 0.00 0.46 0.00 0.00 57.72 57.97 3dyo n HIS 540 Cb 0.62 -2.67 0.02 0.00 -0.12 0.00 0.00 29.99 27.84 3dyo n HIS 540 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3dyo n ALA 541 N 13.57 4.73 -2.36 1.57 0.00 0.44 -4.40 120.51 134.06 3dyo n ALA 541 Ca 0.34 -1.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.28 3dyo n ALA 541 Cb 0.48 -1.24 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 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 -1.17 3.47 4.36 0.00 0.00 -1.26 -3.77 119.30 120.93 3dyo s MET 542 Ca 0.20 0.77 0.00 0.00 0.00 0.00 0.00 55.69 56.66 3dyo s MET 542 Cb 0.16 -4.06 0.00 0.00 0.00 0.00 0.00 34.83 30.93 3dyo s MET 542 CO -0.00 -1.71 0.00 0.41 0.00 0.00 0.00 175.02 173.72 3dyo n GLY 543 N 5.15 1.16 3.56 2.11 0.00 -1.26 -4.20 105.19 111.71 3dyo n GLY 543 Ca 0.15 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.10 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 5.95 0.00 1.61 3.84 -1.26 -4.87 114.94 116.21 3dyo s ASN 544 Ca 0.00 -0.88 0.00 0.00 0.21 0.00 0.00 52.86 52.19 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 -1.99 0.00 -0.24 -2.79 0.00 0.00 177.10 172.08 3dyo n SER 545 N 10.73 0.09 0.00 -4.21 2.88 -1.26 -4.74 113.62 117.11 3dyo n SER 545 Ca 0.28 -0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 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 -4.70 2.46 4.32 -1.19 -4.79 117.00 113.10 3dyo n LEU 546 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.57 3dyo n LEU 546 Cb 0.00 -0.24 -0.03 0.00 -1.62 0.00 0.00 43.42 41.53 3dyo n LEU 546 CO 0.00 0.00 1.35 -0.83 -1.22 0.00 0.00 177.39 176.69 3dyo s GLY 547 N -1.92 1.43 0.00 -0.72 0.00 0.29 -1.86 107.32 104.54 3dyo s GLY 547 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 44.72 46.11 3dyo s GLY 547 CO 0.00 2.88 0.00 0.61 0.00 0.00 0.00 173.10 176.59 3dyo n GLY 548 N 3.99 0.72 0.31 0.20 0.00 0.89 -3.98 105.19 107.32 3dyo n GLY 548 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.21 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 0.89 -0.27 1.61 3.57 -1.56 -1.73 116.94 119.46 3dyo h PHE 549 Ca 0.00 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.58 3dyo h PHE 549 Cb 0.00 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 3dyo h PHE 549 CO 0.00 0.36 0.19 0.00 -2.23 0.00 0.00 178.31 176.62 3dyo h ALA 550 N 1.47 2.09 -0.46 2.41 0.00 -1.86 -1.88 119.26 121.03 3dyo h ALA 550 Ca 0.41 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 3dyo h ALA 550 Cb 0.39 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3dyo h ALA 550 CO -0.25 -0.15 0.05 -0.22 0.00 0.00 0.00 179.25 178.68 3dyo h LYS 551 N 0.13 0.73 -0.11 0.00 3.64 -1.71 -0.46 116.57 118.79 3dyo h LYS 551 Ca 0.12 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 3dyo h LYS 551 Cb 0.32 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3dyo h LYS 551 CO -0.02 0.71 -0.02 1.88 -2.27 0.00 0.00 179.45 179.74 3dyo h TYR 552 N 0.69 0.22 -0.97 1.91 -1.99 -1.40 -2.63 116.97 112.80 3dyo h TYR 552 Ca 0.15 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.83 3dyo h TYR 552 Cb 0.35 -0.06 -0.05 0.00 2.00 0.00 0.00 36.73 38.98 3dyo h TYR 552 CO 0.02 0.48 0.61 -1.49 -0.00 0.00 0.00 178.16 177.78 3dyo h TRP 553 N -0.10 1.26 -0.72 4.88 4.06 -1.38 0.56 115.95 124.50 3dyo h TRP 553 Ca 0.03 0.01 -0.05 0.00 2.06 0.00 0.00 58.89 60.94 3dyo h TRP 553 Cb 0.41 -0.42 -0.03 0.00 -1.00 0.00 0.00 29.16 28.12 3dyo h TRP 553 CO 0.05 0.81 0.27 0.37 -3.56 0.00 0.00 178.44 176.38 3dyo h GLN 554 N 1.33 1.08 -0.28 0.49 4.15 -1.04 -1.18 115.11 119.65 3dyo h GLN 554 Ca 0.35 -0.20 -0.06 0.00 0.77 0.00 0.00 58.65 59.52 3dyo h GLN 554 Cb -0.10 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.41 3dyo h GLN 554 CO -0.07 0.89 -0.04 0.00 -1.93 0.00 0.00 178.83 177.68 3dyo h ALA 555 N 1.24 0.38 -0.92 3.38 0.00 -0.72 -2.41 119.26 120.21 3dyo h ALA 555 Ca 0.24 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.94 3dyo h ALA 555 Cb 0.23 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 3dyo h ALA 555 CO -0.02 0.17 0.60 0.74 0.00 0.00 0.00 179.25 180.74 3dyo h PHE 556 N 0.29 1.10 -0.05 0.00 0.05 0.39 -2.04 116.94 116.68 3dyo h PHE 556 Ca 0.07 0.03 -0.15 0.00 3.82 0.00 0.00 57.97 61.75 3dyo h PHE 556 Cb 0.50 -0.36 -0.01 0.00 2.00 0.00 0.00 35.95 38.07 3dyo h PHE 556 CO 0.05 0.61 -0.63 0.00 -0.18 0.00 0.00 178.31 178.16 3dyo h ARG 557 N 1.11 0.17 0.02 1.51 3.08 -1.15 -3.27 114.38 115.87 3dyo h ARG 557 Ca 0.37 -0.13 -0.22 0.00 0.07 0.00 0.00 59.98 60.08 3dyo h ARG 557 Cb 0.08 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3dyo h ARG 557 CO -0.12 0.74 -1.02 0.37 -1.07 0.00 0.00 179.97 178.87 3dyo h GLN 558 N 0.13 0.07 -4.72 0.04 4.15 -0.90 -3.44 115.11 110.44 3dyo h GLN 558 Ca -0.01 -0.10 -0.69 0.00 0.77 0.00 0.00 58.65 58.62 3dyo h GLN 558 Cb 1.13 0.04 -0.26 0.00 0.21 0.00 0.00 27.48 28.60 3dyo h GLN 558 CO 0.09 1.02 -0.58 0.71 -1.93 0.00 0.00 178.83 178.14 3dyo s TYR 559 N -2.79 3.20 0.21 3.99 1.51 -0.82 -4.99 117.35 117.66 3dyo s TYR 559 Ca -0.00 -1.02 -0.11 0.00 -1.01 0.00 0.00 57.07 54.93 3dyo s TYR 559 Cb 0.10 -2.32 0.30 0.00 -0.11 0.00 0.00 41.96 39.92 3dyo s TYR 559 CO 0.83 -0.61 1.66 -1.35 -1.11 0.00 0.00 175.55 174.97 3dyo h PRO 560 N 8.30 0.12 0.00 -1.71 0.11 -1.86 -0.90 132.00 136.06 3dyo h PRO 560 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3dyo h PRO 560 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3dyo h PRO 560 CO 0.62 0.08 0.00 0.54 -0.21 0.00 0.00 178.00 179.03 3dyo n ARG 561 N -5.27 0.07 -2.77 1.05 1.74 -1.26 -4.34 116.66 105.87 3dyo n ARG 561 Ca 0.09 0.21 -0.43 0.00 -0.77 0.00 0.00 57.85 56.95 3dyo n ARG 561 Cb 0.35 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 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 -3.48 3.99 -0.26 0.55 1.43 -0.34 -1.06 118.68 119.50 3dyo s LEU 562 Ca 0.09 -0.57 0.13 0.00 -1.03 0.00 0.00 54.13 52.75 3dyo s LEU 562 Cb 0.12 -2.66 0.72 0.00 0.03 0.00 0.00 46.19 44.40 3dyo s LEU 562 CO 0.41 -1.43 1.69 0.00 0.23 0.00 0.00 176.35 177.24 3dyo n GLN 563 N 7.97 3.85 0.00 1.70 6.02 0.17 -4.69 117.38 132.39 3dyo n GLN 563 Ca 0.00 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 53.92 3dyo n GLN 563 Cb 0.47 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.59 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 -0.04 0.23 0.00 1.08 0.00 -1.26 0.06 105.19 105.27 3dyo n GLY 564 Ca 0.32 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.48 3dyo n GLY 564 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLY 565 N 0.00 -0.54 3.17 -0.02 0.00 -0.71 -1.26 105.19 105.83 3dyo n GLY 565 Ca 0.00 -1.01 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 3dyo n GLY 565 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dyo s PHE 566 N -2.00 3.01 0.58 1.61 0.40 -0.23 -0.56 117.98 120.79 3dyo s PHE 566 Ca 0.00 -1.63 -0.19 0.00 -0.60 0.00 0.00 56.93 54.51 3dyo s PHE 566 Cb 0.00 -2.01 -0.04 0.00 0.51 0.00 0.00 43.02 41.48 3dyo s PHE 566 CO 0.00 -0.76 1.20 0.08 0.70 0.00 0.00 175.22 176.45 3dyo s VAL 567 N 1.30 2.67 -0.38 -0.44 1.01 -0.31 -1.74 120.40 122.50 3dyo s VAL 567 Ca 0.01 0.42 -0.02 0.00 0.00 0.00 0.00 61.98 62.39 3dyo s VAL 567 Cb -0.16 -3.17 0.10 0.00 0.00 0.00 0.00 36.38 33.15 3dyo s VAL 567 CO -0.07 -0.08 0.15 0.86 0.00 0.00 0.00 175.10 175.96 3dyo s TRP 568 N -1.59 3.58 0.00 5.22 -0.11 -0.32 -0.80 118.94 124.92 3dyo s TRP 568 Ca 0.77 -2.43 0.00 0.00 1.22 0.00 0.00 56.10 55.65 3dyo s TRP 568 Cb -0.30 -3.04 0.00 0.00 -1.50 0.00 0.00 33.47 28.63 3dyo s TRP 568 CO 0.33 -0.95 0.00 -0.40 -4.62 0.00 0.00 176.95 171.31 3dyo n ASP 569 N 4.55 0.00 0.26 5.86 5.75 -0.62 -0.42 116.55 131.92 3dyo n ASP 569 Ca -0.03 -0.80 -0.11 0.00 -0.01 0.00 0.00 54.79 53.85 3dyo n ASP 569 Cb 0.42 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.46 3dyo n ASP 569 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 3dyo h TRP 570 N 0.80 -0.65 -3.70 2.11 2.91 -1.18 -0.15 115.95 116.09 3dyo h TRP 570 Ca 0.00 -0.02 -0.43 0.00 1.13 0.00 0.00 58.89 59.57 3dyo h TRP 570 Cb 0.00 0.22 -0.32 0.00 -0.51 0.00 0.00 29.16 28.55 3dyo h TRP 570 CO 0.00 -0.41 -0.79 0.54 -1.03 0.00 0.00 178.44 176.76 3dyo s VAL 571 N -3.96 0.77 0.07 2.65 0.11 -1.26 -1.46 120.40 117.32 3dyo s VAL 571 Ca -0.10 -0.33 -0.36 0.00 -2.93 0.00 0.00 61.98 58.26 3dyo s VAL 571 Cb 0.01 -0.71 -0.15 0.00 -1.53 0.00 0.00 36.38 34.00 3dyo s VAL 571 CO 0.31 0.25 1.53 0.47 -3.33 0.00 0.00 175.10 174.33 3dyo n ASP 572 N 3.49 2.49 -3.58 3.54 8.00 -0.58 -4.41 116.55 125.50 3dyo n ASP 572 Ca -0.20 1.09 -0.41 0.00 0.71 0.00 0.00 54.79 55.98 3dyo n ASP 572 Cb 0.53 -1.30 -0.01 0.00 -0.02 0.00 0.00 41.12 40.33 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 3.56 4.06 -3.43 -1.24 6.02 -0.54 -4.02 117.38 121.78 3dyo n GLN 573 Ca 0.19 -3.21 -0.27 0.00 -0.01 0.00 0.00 57.00 53.70 3dyo n GLN 573 Cb 0.24 -2.79 -0.03 0.00 1.02 0.00 0.00 30.24 28.68 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 1.00 6.40 0.07 1.08 1.04 -1.26 -4.72 113.70 117.31 3dyo s SER 574 Ca 0.52 0.58 0.08 0.00 0.48 0.00 0.00 55.95 57.62 3dyo s SER 574 Cb 0.16 -2.09 -0.03 0.00 0.10 0.00 0.00 66.02 64.16 3dyo s SER 574 CO -0.06 -0.18 -0.22 -0.76 0.98 0.00 0.00 173.24 173.00 3dyo s LEU 575 N -3.64 2.21 0.18 2.42 1.43 -0.82 -4.28 118.68 116.19 3dyo s LEU 575 Ca 0.42 -0.59 -0.26 0.00 -1.03 0.00 0.00 54.13 52.67 3dyo s LEU 575 Cb -0.11 -1.01 -0.08 0.00 0.03 0.00 0.00 46.19 45.03 3dyo s LEU 575 CO 0.31 0.15 0.80 -0.63 0.23 0.00 0.00 176.35 177.20 3dyo s ILE 576 N -0.91 4.34 0.24 -0.59 -1.09 -0.74 -0.38 121.20 122.06 3dyo s ILE 576 Ca 0.08 1.73 0.05 0.00 -2.23 0.00 0.00 60.65 60.28 3dyo s ILE 576 Cb -0.09 -4.15 -0.05 0.00 -1.58 0.00 0.00 42.46 36.59 3dyo s ILE 576 CO 0.03 0.50 -0.03 -0.54 -1.23 0.00 0.00 174.94 173.67 3dyo s LYS 577 N -1.20 1.39 -0.05 2.79 1.02 -0.20 -4.92 119.74 118.58 3dyo s LYS 577 Ca 0.37 -1.70 0.07 0.00 0.02 0.00 0.00 55.97 54.73 3dyo s LYS 577 Cb -0.23 -0.81 -0.01 0.00 -0.52 0.00 0.00 37.83 36.25 3dyo s LYS 577 CO 0.27 -0.03 -0.25 0.71 -0.92 0.00 0.00 175.35 175.12 3dyo s TYR 578 N -3.26 2.40 0.72 3.18 1.51 -1.26 0.14 117.35 120.77 3dyo s TYR 578 Ca 0.28 -0.64 -0.10 0.00 -1.01 0.00 0.00 57.07 55.60 3dyo s TYR 578 Cb 0.05 -1.56 0.04 0.00 -0.11 0.00 0.00 41.96 40.37 3dyo s TYR 578 CO 0.09 -0.17 1.09 0.16 -1.11 0.00 0.00 175.55 175.61 3dyo s ASP 579 N -0.29 5.12 0.28 2.29 1.47 0.47 -4.84 116.67 121.16 3dyo s ASP 579 Ca 0.00 0.89 -0.00 0.00 1.18 0.00 0.00 52.55 54.62 3dyo s ASP 579 Cb -0.13 -1.61 0.63 0.00 -0.34 0.00 0.00 42.92 41.48 3dyo s ASP 579 CO 0.02 -1.50 1.43 1.21 0.68 0.00 0.00 175.17 177.01 3dyo n GLU 580 N -3.03 -0.08 -0.41 2.11 0.00 -1.26 0.42 120.64 118.39 3dyo n GLU 580 Ca 0.07 1.38 0.04 0.00 0.00 0.00 0.00 57.16 58.65 3dyo n GLU 580 Cb 0.59 -2.17 0.19 0.00 0.00 0.00 0.00 31.44 30.05 3dyo n GLU 580 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3dyo n ASN 581 N -5.38 3.13 -0.76 4.31 3.02 -1.26 -4.85 115.26 113.47 3dyo n ASN 581 Ca 0.20 -2.40 -0.10 0.00 -0.03 0.00 0.00 54.58 52.25 3dyo n ASN 581 Cb 0.65 -0.55 -0.04 0.00 -0.61 0.00 0.00 39.78 39.22 3dyo n ASN 581 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyo n GLY 582 N 0.38 1.14 3.78 7.41 0.00 1.41 -5.01 105.19 114.29 3dyo n GLY 582 Ca 0.13 -0.48 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.81 7.27 0.37 1.61 0.01 -1.21 -4.55 114.94 115.63 3dyo s ASN 583 Ca 0.00 1.51 -0.25 0.00 -0.71 0.00 0.00 52.86 53.41 3dyo s ASN 583 Cb 0.00 -2.46 -0.10 0.00 0.41 0.00 0.00 41.25 39.10 3dyo s ASN 583 CO 0.00 0.19 0.98 -2.16 -1.51 0.00 0.00 177.10 174.60 3dyo s PRO 584 N -0.91 4.38 0.04 -0.60 0.04 -1.26 0.18 135.00 136.87 3dyo s PRO 584 Ca 0.34 1.36 -0.14 0.00 0.04 0.00 0.00 61.00 62.61 3dyo s PRO 584 Cb -0.22 -2.61 0.02 0.00 0.04 0.00 0.00 34.50 31.73 3dyo s PRO 584 CO 0.24 0.08 0.30 1.67 0.04 0.00 0.00 177.00 179.33 3dyo s TRP 585 N -1.72 -0.11 -0.10 0.56 1.48 0.12 -4.90 118.94 114.27 3dyo s TRP 585 Ca 0.55 -0.00 -0.29 0.00 -1.06 0.00 0.00 56.10 55.30 3dyo s TRP 585 Cb -0.18 0.10 -0.02 0.00 -1.16 0.00 0.00 33.47 32.21 3dyo s TRP 585 CO 0.23 -0.49 0.96 -1.12 -4.06 0.00 0.00 176.95 172.47 3dyo s SER 586 N -1.99 7.20 0.19 -2.66 0.01 -1.26 -1.03 113.70 114.16 3dyo s SER 586 Ca -0.06 1.47 0.10 0.00 1.31 0.00 0.00 55.95 58.77 3dyo s SER 586 Cb -0.01 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3dyo s SER 586 CO -0.03 -0.40 -0.15 0.00 0.41 0.00 0.00 173.24 173.08 3dyo s ALA 587 N 1.84 2.79 0.00 1.44 0.00 0.49 -4.92 121.76 123.39 3dyo s ALA 587 Ca 0.46 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.87 3dyo s ALA 587 Cb -0.18 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.37 3dyo s ALA 587 CO 0.18 0.44 0.00 2.48 0.00 0.00 0.00 175.76 178.86 3dyo n TYR 588 N 0.08 0.00 -1.69 0.00 0.18 -1.26 -1.95 117.16 112.52 3dyo n TYR 588 Ca -0.11 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.27 3dyo n TYR 588 Cb 0.56 0.00 0.03 0.00 -0.38 0.00 0.00 39.34 39.54 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 2.19 0.42 2.49 -7.48 0.00 -0.43 -1.88 105.19 100.49 3dyo n GLY 589 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 0.90 2.96 0.00 -0.02 0.00 -1.26 -4.03 105.19 103.74 3dyo n GLY 590 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.16 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 0.28 0.00 -0.48 1.61 8.00 -0.79 -1.94 116.55 123.23 3dyo n ASP 591 Ca 0.00 0.23 0.07 0.00 0.71 0.00 0.00 54.79 55.80 3dyo n ASP 591 Cb 0.00 -0.34 0.16 0.00 -0.02 0.00 0.00 41.12 40.92 3dyo n ASP 591 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dyo n PHE 592 N -1.34 0.44 -0.77 1.24 3.01 -1.26 -4.90 117.46 113.88 3dyo n PHE 592 Ca 0.04 -0.75 0.00 0.00 1.01 0.00 0.00 57.45 57.75 3dyo n PHE 592 Cb 0.10 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 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 -0.49 0.92 3.75 1.37 0.00 -0.82 -4.86 105.19 105.06 3dyo n GLY 593 Ca 0.14 0.00 -0.41 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 -3.01 6.72 -0.28 1.61 -4.77 -1.26 -4.99 116.67 110.69 3dyo s ASP 594 Ca 0.00 2.64 -0.23 0.00 -3.30 0.00 0.00 52.55 51.66 3dyo s ASP 594 Cb 0.00 -2.63 0.11 0.00 -1.09 0.00 0.00 42.92 39.31 3dyo s ASP 594 CO 0.00 -0.63 0.94 0.28 0.70 0.00 0.00 175.17 176.46 3dyo s THR 595 N -0.31 0.00 1.03 2.11 -1.32 -1.26 -3.99 115.64 111.89 3dyo s THR 595 Ca 0.56 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.92 3dyo s THR 595 Cb -0.41 -1.00 0.21 0.00 -1.51 0.00 0.00 72.50 69.79 3dyo s THR 595 CO 0.45 0.00 1.08 -2.84 -2.21 0.00 0.00 174.62 171.11 3dyo s PRO 596 N 0.56 0.17 0.22 7.08 0.02 -1.26 -5.15 135.00 136.63 3dyo s PRO 596 Ca -0.01 1.09 -0.13 0.00 0.02 0.00 0.00 61.00 61.98 3dyo s PRO 596 Cb -0.05 -1.66 0.00 0.00 0.02 0.00 0.00 34.50 32.81 3dyo s PRO 596 CO -0.08 -3.07 0.43 0.54 -0.33 0.00 0.00 177.00 174.50 3dyo s ASN 597 N -2.74 -0.09 -0.29 2.53 2.20 -1.26 -4.73 114.94 110.55 3dyo s ASN 597 Ca 0.67 -0.83 0.09 0.00 -0.94 0.00 0.00 52.86 51.85 3dyo s ASN 597 Cb -0.23 0.54 0.50 0.00 -2.00 0.00 0.00 41.25 40.07 3dyo s ASN 597 CO 0.61 -1.06 1.46 0.47 -2.94 0.00 0.00 177.10 175.64 3dyo n ASP 598 N -0.33 2.41 0.00 3.54 8.00 -0.05 -4.94 116.55 125.18 3dyo n ASP 598 Ca -0.05 -3.81 0.00 0.00 0.71 0.00 0.00 54.79 51.65 3dyo n ASP 598 Cb 0.62 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 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 -1.13 0.00 0.00 -1.24 1.85 -1.26 -1.28 116.66 113.60 3dyo n ARG 599 Ca 0.33 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 57.26 3dyo n ARG 599 Cb 1.03 0.00 0.49 0.00 -1.05 0.00 0.00 32.46 32.93 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 0.81 0.00 2.89 0.00 -1.26 -1.32 117.38 132.50 3dyo n GLN 600 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 57.00 57.02 3dyo n GLN 600 Cb 0.00 -1.32 0.11 0.00 0.00 0.00 0.00 30.24 29.03 3dyo n GLN 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 3dyo n PHE 601 N -0.82 0.00 1.34 2.61 3.01 -0.41 -1.04 117.46 122.16 3dyo n PHE 601 Ca 0.12 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.73 3dyo n PHE 601 Cb 0.06 -0.45 0.68 0.00 -0.01 0.00 0.00 39.48 39.77 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 -2.63 2.10 -0.03 0.00 -1.94 -0.21 -1.46 119.30 115.13 3dyo s MET 603 Ca 0.26 -1.68 0.14 0.00 -1.71 0.00 0.00 55.69 52.69 3dyo s MET 603 Cb 0.20 -3.50 0.25 0.00 2.01 0.00 0.00 34.83 33.79 3dyo s MET 603 CO 0.49 -0.96 1.11 0.09 -0.01 0.00 0.00 175.02 175.73 3dyo n ASN 604 N 4.60 0.78 -4.96 3.03 5.03 -1.26 -4.22 115.26 118.26 3dyo n ASN 604 Ca -0.05 -2.26 -0.22 0.00 0.87 0.00 0.00 54.58 52.92 3dyo n ASN 604 Cb 0.42 -0.29 0.01 0.00 -1.02 0.00 0.00 39.78 38.90 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 -1.79 1.58 0.45 7.41 0.00 -1.25 -1.59 107.32 112.13 3dyo s GLY 605 Ca 0.21 -1.12 0.25 0.00 0.00 0.00 0.00 44.72 44.05 3dyo s GLY 605 CO -0.08 -0.96 1.84 1.41 0.00 0.00 0.00 173.10 175.31 3dyo h LEU 606 N 0.47 0.00 -8.71 0.66 3.38 0.13 -3.43 115.31 107.80 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 1.25 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.80 3dyo h LEU 606 CO 0.57 0.21 -0.80 0.68 0.09 0.00 0.00 178.44 179.18 3dyo s VAL 607 N -3.67 1.69 0.85 1.22 -7.23 -0.53 -0.46 120.40 112.27 3dyo s VAL 607 Ca 0.00 -1.68 -0.11 0.00 -1.81 0.00 0.00 61.98 58.38 3dyo s VAL 607 Cb 0.10 -1.63 0.10 0.00 0.56 0.00 0.00 36.38 35.51 3dyo s VAL 607 CO 0.63 -0.19 1.09 -0.36 -0.31 0.00 0.00 175.10 175.96 3dyo s PHE 608 N -1.57 2.36 0.56 2.82 0.40 0.21 -1.53 117.98 121.22 3dyo s PHE 608 Ca 0.10 1.40 0.28 0.00 -0.60 0.00 0.00 56.93 58.11 3dyo s PHE 608 Cb -0.08 -3.12 1.47 0.00 0.51 0.00 0.00 43.02 41.80 3dyo s PHE 608 CO 0.05 -2.22 1.96 0.00 0.70 0.00 0.00 175.22 175.71 3dyo h ALA 609 N -1.43 2.34 -0.29 5.36 0.00 -1.88 0.66 119.26 124.01 3dyo h ALA 609 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3dyo h ALA 609 Cb 1.26 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3dyo h ALA 609 CO 0.52 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.68 3dyo n ASP 610 N -4.04 1.73 0.00 0.00 5.75 -1.26 -4.56 116.55 114.17 3dyo n ASP 610 Ca 0.09 -1.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 3dyo n ASP 610 Cb 0.64 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 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 0.42 0.00 -2.32 0.11 3.00 0.23 -5.00 116.66 113.10 3dyo n ARG 611 Ca 0.12 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.55 3dyo n ARG 611 Cb 0.29 -2.44 -0.03 0.00 0.00 0.00 0.00 32.46 30.28 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 -3.53 3.32 0.57 0.55 2.01 -1.25 -4.69 115.64 112.62 3dyo s THR 612 Ca 0.00 1.18 -0.17 0.00 0.31 0.00 0.00 61.69 63.01 3dyo s THR 612 Cb 0.00 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.71 3dyo s THR 612 CO 0.00 0.22 1.07 -2.84 -0.69 0.00 0.00 174.62 172.38 3dyo s PRO 613 N -0.73 3.39 0.53 4.92 0.02 -1.26 0.65 135.00 142.52 3dyo s PRO 613 Ca 0.51 1.31 -0.06 0.00 0.02 0.00 0.00 61.00 62.78 3dyo s PRO 613 Cb -0.35 -2.04 -0.02 0.00 0.02 0.00 0.00 34.50 32.11 3dyo s PRO 613 CO 0.41 -0.77 0.84 -1.01 -0.33 0.00 0.00 177.00 176.14 3dyo s HIS 614 N -2.24 3.48 0.47 6.54 3.76 0.40 -4.75 115.29 122.94 3dyo s HIS 614 Ca 0.66 0.81 0.21 0.00 -0.15 0.00 0.00 55.06 56.58 3dyo s HIS 614 Cb -0.17 -2.46 1.20 0.00 1.11 0.00 0.00 32.58 32.26 3dyo s HIS 614 CO 0.32 -0.47 1.93 -1.35 -0.85 0.00 0.00 174.74 174.31 3dyo h PRO 615 N 0.06 0.24 0.00 8.40 0.11 -1.92 -1.72 132.00 137.17 3dyo h PRO 615 Ca -0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3dyo h PRO 615 Cb 1.22 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3dyo h PRO 615 CO 0.61 0.16 -0.03 0.00 -0.21 0.00 0.00 178.00 178.54 3dyo h ALA 616 N 1.65 1.30 -0.95 -0.75 0.00 -1.87 -2.62 119.26 116.04 3dyo h ALA 616 Ca 0.36 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.30 3dyo h ALA 616 Cb 1.05 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3dyo h ALA 616 CO -0.08 0.03 0.61 1.25 0.00 0.00 0.00 179.25 181.06 3dyo h LEU 617 N 0.00 0.99 -1.01 0.00 5.85 -1.50 -1.35 115.31 118.29 3dyo h LEU 617 Ca -0.00 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 3dyo h LEU 617 Cb 0.10 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3dyo h LEU 617 CO 0.00 0.65 -0.47 0.00 -0.34 0.00 0.00 178.44 178.28 3dyo h THR 618 N 1.14 1.34 -0.44 1.05 1.03 -1.67 -0.45 112.91 114.92 3dyo h THR 618 Ca 0.40 -1.64 -0.04 0.00 -0.01 0.00 0.00 66.41 65.12 3dyo h THR 618 Cb 0.10 1.86 -0.02 0.00 -1.07 0.00 0.00 68.15 69.02 3dyo h THR 618 CO -0.15 0.47 0.12 -0.08 -0.01 0.00 0.00 175.52 175.87 3dyo h GLU 619 N 0.03 0.70 -0.44 0.00 4.57 -1.40 -1.56 114.58 116.49 3dyo h GLU 619 Ca -0.00 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.00 3dyo h GLU 619 Cb 0.85 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.33 3dyo h GLU 619 CO 0.06 0.69 0.22 0.00 -1.18 0.00 0.00 179.01 178.80 3dyo h ALA 620 N 0.98 0.57 -0.24 2.92 0.00 -0.57 -1.45 119.26 121.47 3dyo h ALA 620 Ca 0.14 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3dyo h ALA 620 Cb 0.30 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3dyo h ALA 620 CO -0.00 0.12 0.05 -0.22 0.00 0.00 0.00 179.25 179.20 3dyo h LYS 621 N 0.57 0.13 -0.47 0.00 3.64 -0.93 -1.32 116.57 118.18 3dyo h LYS 621 Ca 0.15 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3dyo h LYS 621 Cb 0.11 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 3dyo h LYS 621 CO -0.02 0.09 0.15 1.25 -2.27 0.00 0.00 179.45 178.65 3dyo h HIS 622 N 0.14 0.76 0.00 1.91 2.76 -1.12 -2.61 115.15 116.99 3dyo h HIS 622 Ca 0.11 -0.08 -0.06 0.00 -2.20 0.00 0.00 60.37 58.14 3dyo h HIS 622 Cb 0.11 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.84 3dyo h HIS 622 CO -0.15 0.67 -0.28 1.96 -1.30 0.00 0.00 177.93 178.83 3dyo h GLN 623 N 0.63 0.00 -0.34 5.26 1.08 -1.07 -2.57 115.11 118.10 3dyo h GLN 623 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 3dyo h GLN 623 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 3dyo h GLN 623 CO -0.01 0.28 0.00 1.04 -0.95 0.00 0.00 178.83 179.19 3dyo n GLN 624 N -3.88 1.89 -1.02 1.46 6.02 -0.52 -4.97 117.38 116.37 3dyo n GLN 624 Ca -0.02 -1.37 -0.34 0.00 -0.01 0.00 0.00 57.00 55.26 3dyo n GLN 624 Cb 0.36 -1.34 0.10 0.00 1.02 0.00 0.00 30.24 30.39 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 0.60 0.01 0.00 -1.09 6.02 -0.97 -4.87 117.38 117.08 3dyo n GLN 625 Ca 0.14 0.06 0.10 0.00 -0.01 0.00 0.00 57.00 57.29 3dyo n GLN 625 Cb 0.34 -1.94 -0.03 0.00 1.02 0.00 0.00 30.24 29.63 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 -3.09 0.00 -5.20 1.08 3.01 -1.26 -4.88 117.46 107.12 3dyo n PHE 626 Ca 0.09 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.24 3dyo n PHE 626 Cb 0.52 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.82 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 -2.45 2.32 0.13 1.38 0.40 -1.26 0.21 117.98 118.71 3dyo s PHE 627 Ca 0.15 -0.68 0.07 0.00 -0.60 0.00 0.00 56.93 55.86 3dyo s PHE 627 Cb 0.17 -1.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.13 3dyo s PHE 627 CO 0.59 -0.21 -0.04 -0.65 0.70 0.00 0.00 175.22 175.62 3dyo s GLN 628 N -0.14 2.34 0.05 0.44 -1.52 0.03 -4.94 119.66 115.93 3dyo s GLN 628 Ca -0.03 -1.01 0.03 0.00 -1.95 0.00 0.00 55.36 52.40 3dyo s GLN 628 Cb -0.13 -2.39 -0.03 0.00 -0.22 0.00 0.00 33.01 30.24 3dyo s GLN 628 CO 0.03 0.50 -0.10 -0.06 -0.25 0.00 0.00 175.29 175.41 3dyo s PHE 629 N -1.44 0.89 0.02 0.91 0.40 -1.26 -0.91 117.98 116.60 3dyo s PHE 629 Ca 0.25 -0.49 0.00 0.00 -0.60 0.00 0.00 56.93 56.10 3dyo s PHE 629 Cb -0.11 -0.52 -0.01 0.00 0.51 0.00 0.00 43.02 42.89 3dyo s PHE 629 CO 0.17 -0.03 -0.03 1.03 0.70 0.00 0.00 175.22 177.07 3dyo s ARG 630 N -1.66 0.24 -0.04 0.44 0.52 -0.73 -4.98 118.95 112.74 3dyo s ARG 630 Ca -0.07 -0.43 0.05 0.00 -0.52 0.00 0.00 55.73 54.76 3dyo s ARG 630 Cb -0.10 0.02 -0.01 0.00 0.52 0.00 0.00 34.95 35.39 3dyo s ARG 630 CO 0.01 -0.02 -0.20 -1.17 0.02 0.00 0.00 175.30 173.95 3dyo s LEU 631 N -1.00 1.97 -0.26 2.53 2.96 -1.26 -0.46 118.68 123.17 3dyo s LEU 631 Ca -0.10 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.39 3dyo s LEU 631 Cb -0.07 -1.08 0.11 0.00 0.50 0.00 0.00 46.19 45.66 3dyo s LEU 631 CO -0.01 0.19 0.25 -0.55 -1.32 0.00 0.00 176.35 174.91 3dyo s SER 632 N -0.08 1.77 1.40 3.68 0.15 -0.19 -5.02 113.70 115.41 3dyo s SER 632 Ca -0.02 -0.59 0.00 0.00 0.70 0.00 0.00 55.95 56.03 3dyo s SER 632 Cb -0.12 0.36 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 3dyo s SER 632 CO 0.02 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.70 3dyo n GLY 633 N 5.31 3.07 0.52 9.45 0.00 -1.26 -2.06 105.19 120.22 3dyo n GLY 633 Ca -0.04 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.85 3dyo n GLY 633 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyo n GLN 634 N 12.80 2.19 -3.71 1.61 0.00 -1.26 -4.96 117.38 124.06 3dyo n GLN 634 Ca 0.00 -2.71 -0.36 0.00 0.00 0.00 0.00 57.00 53.93 3dyo n GLN 634 Cb 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 30.24 28.46 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 -2.81 5.12 -0.19 -0.39 2.01 -0.87 0.23 115.64 118.73 3dyo s THR 635 Ca 0.37 0.10 -0.11 0.00 0.31 0.00 0.00 61.69 62.36 3dyo s THR 635 Cb 0.31 -3.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.38 3dyo s THR 635 CO 0.06 0.35 0.16 -0.63 -0.69 0.00 0.00 174.62 173.87 3dyo s ILE 636 N 1.15 5.39 -0.24 1.82 1.01 0.22 -1.02 121.20 129.53 3dyo s ILE 636 Ca 0.07 0.25 -0.07 0.00 0.00 0.00 0.00 60.65 60.89 3dyo s ILE 636 Cb -0.14 -3.50 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3dyo s ILE 636 CO 0.05 0.43 0.07 -0.70 0.00 0.00 0.00 174.94 174.79 3dyo s GLU 637 N 0.39 3.70 -0.15 2.79 2.12 0.39 -0.22 118.70 127.73 3dyo s GLU 637 Ca 0.09 -0.46 -0.04 0.00 0.36 0.00 0.00 54.97 54.93 3dyo s GLU 637 Cb -0.11 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 3dyo s GLU 637 CO -0.01 -0.12 -0.04 0.08 -0.54 0.00 0.00 175.26 174.63 3dyo s VAL 638 N 1.44 3.89 -0.09 3.70 1.01 0.11 -1.77 120.40 128.69 3dyo s VAL 638 Ca 0.05 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.71 3dyo s VAL 638 Cb -0.15 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 3dyo s VAL 638 CO 0.04 0.50 -0.20 -0.89 0.00 0.00 0.00 175.10 174.54 3dyo s THR 639 N 0.30 2.44 0.03 3.92 2.01 -0.08 -0.52 115.64 123.74 3dyo s THR 639 Ca -0.04 -0.91 -0.26 0.00 0.31 0.00 0.00 61.69 60.79 3dyo s THR 639 Cb -0.14 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.38 3dyo s THR 639 CO 0.03 0.56 0.82 -0.55 -0.69 0.00 0.00 174.62 174.79 3dyo s SER 640 N 0.04 7.24 -0.01 3.53 0.15 -0.39 -0.79 113.70 123.47 3dyo s SER 640 Ca -0.08 1.49 0.19 0.00 0.70 0.00 0.00 55.95 58.24 3dyo s SER 640 Cb -0.15 -2.49 0.55 0.00 -1.71 0.00 0.00 66.02 62.22 3dyo s SER 640 CO 0.05 -0.07 1.46 -0.62 1.20 0.00 0.00 173.24 175.26 3dyo n GLU 641 N 3.19 2.87 -2.67 5.44 1.02 0.13 -2.69 120.64 127.93 3dyo n GLU 641 Ca -0.00 -2.51 -0.38 0.00 -0.02 0.00 0.00 57.16 54.24 3dyo n GLU 641 Cb 0.50 -1.52 -0.06 0.00 -0.02 0.00 0.00 31.44 30.35 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 -1.11 3.69 -0.13 -0.32 1.51 -1.26 -4.86 117.35 114.87 3dyo s TYR 642 Ca 0.42 1.79 0.18 0.00 -1.01 0.00 0.00 57.07 58.44 3dyo s TYR 642 Cb 0.22 -3.04 -0.24 0.00 -0.11 0.00 0.00 41.96 38.79 3dyo s TYR 642 CO 0.27 0.01 0.37 1.28 -1.11 0.00 0.00 175.55 176.36 3dyo n LEU 643 N 0.87 0.30 -0.04 -1.29 4.77 -1.26 -1.58 117.00 118.76 3dyo n LEU 643 Ca 0.01 0.14 -0.06 0.00 -0.03 0.00 0.00 56.01 56.06 3dyo n LEU 643 Cb 0.48 0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 41.83 3dyo n LEU 643 CO 0.48 0.34 -0.74 0.49 -1.33 0.00 0.00 177.39 176.63 3dyo n PHE 644 N -2.74 0.00 -3.41 -1.77 3.01 -1.26 -4.84 117.46 106.45 3dyo n PHE 644 Ca -0.22 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.00 3dyo n PHE 644 Cb 0.99 -0.28 -0.01 0.00 -0.01 0.00 0.00 39.48 40.17 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 -2.14 3.49 0.39 -1.08 1.70 -1.26 -4.77 118.95 115.27 3dyo s ARG 645 Ca -0.10 -0.33 -0.04 0.00 -0.47 0.00 0.00 55.73 54.79 3dyo s ARG 645 Cb 0.03 -2.68 -0.04 0.00 -0.57 0.00 0.00 34.95 31.69 3dyo s ARG 645 CO 0.16 0.17 0.66 -1.58 -1.08 0.00 0.00 175.30 173.63 3dyo s HIS 646 N -2.28 3.51 -1.19 5.89 5.65 -1.26 -3.10 115.29 122.51 3dyo s HIS 646 Ca 0.40 0.66 -0.16 0.00 0.25 0.00 0.00 55.06 56.21 3dyo s HIS 646 Cb -0.10 -2.15 -0.05 0.00 -1.18 0.00 0.00 32.58 29.11 3dyo s HIS 646 CO 0.35 -0.03 2.17 -1.13 -0.65 0.00 0.00 174.74 175.45 3dyo n SER 647 N -1.68 3.82 0.00 9.88 3.41 -0.32 -4.69 113.62 124.04 3dyo n SER 647 Ca -0.01 -2.73 0.12 0.00 -0.26 0.00 0.00 58.87 55.98 3dyo n SER 647 Cb 0.55 -1.42 0.59 0.00 -0.26 0.00 0.00 64.21 63.68 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 6.28 0.00 -3.04 4.04 5.68 -1.26 -4.02 116.55 124.23 3dyo n ASP 648 Ca 0.53 -0.03 -0.15 0.00 -0.50 0.00 0.00 54.79 54.64 3dyo n ASP 648 Cb 0.37 -0.29 0.01 0.00 -1.14 0.00 0.00 41.12 40.06 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 -1.29 -0.21 -3.71 -1.12 5.15 -1.26 -5.07 115.26 107.74 3dyo n ASN 649 Ca 0.11 -3.24 -0.12 0.00 -0.60 0.00 0.00 54.58 50.73 3dyo n ASN 649 Cb 0.19 0.22 -0.10 0.00 -0.53 0.00 0.00 39.78 39.56 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 -1.54 0.52 0.02 1.20 8.01 -1.26 -4.16 118.70 121.50 3dyo s GLU 650 Ca 0.34 0.70 0.05 0.00 0.01 0.00 0.00 54.97 56.08 3dyo s GLU 650 Cb 0.33 0.20 -0.02 0.00 -4.31 0.00 0.00 34.13 30.34 3dyo s GLU 650 CO -0.07 -0.09 -0.15 -0.48 0.01 0.00 0.00 175.26 174.48 3dyo s LEU 651 N 0.53 2.12 -0.23 1.80 0.05 0.12 -1.79 118.68 121.28 3dyo s LEU 651 Ca -0.02 -0.39 -0.14 0.00 0.05 0.00 0.00 54.13 53.63 3dyo s LEU 651 Cb -0.04 -0.72 -0.04 0.00 -2.05 0.00 0.00 46.19 43.34 3dyo s LEU 651 CO -0.03 0.11 0.30 -0.22 -0.55 0.00 0.00 176.35 175.96 3dyo s LEU 652 N -0.84 4.12 -0.10 1.48 0.20 0.32 -0.72 118.68 123.14 3dyo s LEU 652 Ca 0.04 0.32 -0.02 0.00 0.69 0.00 0.00 54.13 55.16 3dyo s LEU 652 Cb -0.07 -2.34 -0.03 0.00 -0.43 0.00 0.00 46.19 43.31 3dyo s LEU 652 CO 0.01 -0.04 -0.02 -2.28 -0.29 0.00 0.00 176.35 173.72 3dyo s HIS 653 N 1.36 3.08 0.09 5.38 5.65 0.73 0.19 115.29 131.77 3dyo s HIS 653 Ca 0.14 0.03 0.04 0.00 0.25 0.00 0.00 55.06 55.51 3dyo s HIS 653 Cb -0.15 -1.83 -0.03 0.00 -1.18 0.00 0.00 32.58 29.39 3dyo s HIS 653 CO 0.07 0.30 -0.10 1.67 -0.65 0.00 0.00 174.74 176.03 3dyo s TRP 654 N -0.50 1.06 -0.13 3.88 1.48 0.14 -0.87 118.94 124.00 3dyo s TRP 654 Ca 0.08 -0.64 -0.19 0.00 -1.06 0.00 0.00 56.10 54.30 3dyo s TRP 654 Cb -0.12 -0.58 0.05 0.00 -1.16 0.00 0.00 33.47 31.66 3dyo s TRP 654 CO 0.02 0.00 0.48 1.41 -4.06 0.00 0.00 176.95 174.80 3dyo s MET 655 N -2.69 0.67 -0.10 3.25 1.75 -0.14 -1.34 119.30 120.70 3dyo s MET 655 Ca 0.04 0.43 0.03 0.00 -1.25 0.00 0.00 55.69 54.95 3dyo s MET 655 Cb -0.04 0.32 -0.01 0.00 2.84 0.00 0.00 34.83 37.95 3dyo s MET 655 CO 0.00 -0.13 -0.21 0.08 -0.65 0.00 0.00 175.02 174.11 3dyo s VAL 656 N -0.30 2.34 0.06 10.11 1.01 -0.05 -0.86 120.40 132.71 3dyo s VAL 656 Ca -0.05 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.03 3dyo s VAL 656 Cb -0.03 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 3dyo s VAL 656 CO 0.03 0.55 -0.08 0.00 0.00 0.00 0.00 175.10 175.60 3dyo s ALA 657 N 0.26 0.72 -0.37 5.51 0.00 -0.27 -1.09 121.76 126.53 3dyo s ALA 657 Ca -0.15 -0.92 -0.08 0.00 0.00 0.00 0.00 51.96 50.81 3dyo s ALA 657 Cb -0.17 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.06 3dyo s ALA 657 CO 0.07 -0.05 0.16 -1.17 0.00 0.00 0.00 175.76 174.77 3dyo s LEU 658 N -1.93 4.61 -1.28 0.00 2.96 0.18 -1.00 118.68 122.22 3dyo s LEU 658 Ca -0.04 -1.21 -0.14 0.00 -0.22 0.00 0.00 54.13 52.51 3dyo s LEU 658 Cb -0.07 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.70 3dyo s LEU 658 CO -0.01 -0.39 0.58 0.47 -1.32 0.00 0.00 176.35 175.68 3dyo n ASP 659 N 4.87 -2.82 0.00 3.68 8.00 -0.85 -0.81 116.55 128.62 3dyo n ASP 659 Ca -0.11 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.30 3dyo n ASP 659 Cb 0.44 -2.81 0.00 0.00 -0.02 0.00 0.00 41.12 38.73 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 -1.94 2.56 3.52 0.44 0.00 -1.26 -4.86 105.19 103.64 3dyo n GLY 660 Ca -0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.17 3.43 0.38 1.61 1.02 0.01 -4.67 119.74 121.35 3dyo s LYS 661 Ca 0.00 -0.69 -0.27 0.00 0.02 0.00 0.00 55.97 55.03 3dyo s LYS 661 Cb 0.00 -3.81 -0.11 0.00 -0.52 0.00 0.00 37.83 33.39 3dyo s LYS 661 CO 0.00 -0.47 1.30 -2.30 -0.92 0.00 0.00 175.35 172.95 3dyo n PRO 662 N 5.10 2.08 0.00 -1.68 -0.02 -1.26 0.51 135.00 139.74 3dyo n PRO 662 Ca -0.13 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 3dyo n PRO 662 Cb 0.49 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3dyo n PRO 662 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dyo n LEU 663 N 0.50 1.64 -3.59 2.45 4.77 -0.25 -4.78 117.00 117.75 3dyo n LEU 663 Ca 0.05 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 3dyo n LEU 663 Cb 0.38 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.43 3dyo n LEU 663 CO 0.61 0.25 0.22 0.00 -1.33 0.00 0.00 177.39 177.13 3dyo s ALA 664 N -1.71 -1.08 0.14 -1.18 0.00 -1.07 -4.98 121.76 111.87 3dyo s ALA 664 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 51.96 51.77 3dyo s ALA 664 Cb 0.00 0.75 0.07 0.00 0.00 0.00 0.00 23.12 23.94 3dyo s ALA 664 CO 0.00 -0.68 1.02 -1.54 0.00 0.00 0.00 175.76 174.56 3dyo s SER 665 N -2.80 -0.12 0.00 0.00 1.04 -1.26 -0.87 113.70 109.69 3dyo s SER 665 Ca 0.03 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.04 3dyo s SER 665 Cb 0.01 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.57 3dyo s SER 665 CO -0.12 -0.83 0.00 0.61 0.98 0.00 0.00 173.24 173.88 3dyo n GLY 666 N -0.52 -0.27 3.07 7.32 0.00 -0.45 -4.99 105.19 109.34 3dyo n GLY 666 Ca -0.06 -0.99 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 3dyo n GLY 666 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dyo s GLU 667 N -2.00 0.57 -0.11 1.61 2.02 -1.26 0.26 118.70 119.80 3dyo s GLU 667 Ca 0.00 -0.70 -0.07 0.00 0.02 0.00 0.00 54.97 54.22 3dyo s GLU 667 Cb 0.00 -0.41 0.04 0.00 0.10 0.00 0.00 34.13 33.86 3dyo s GLU 667 CO 0.00 0.08 0.26 0.08 0.02 0.00 0.00 175.26 175.70 3dyo s VAL 668 N -1.16 -0.03 0.43 2.63 1.01 0.13 -4.96 120.40 118.45 3dyo s VAL 668 Ca -0.07 0.10 -0.23 0.00 0.00 0.00 0.00 61.98 61.77 3dyo s VAL 668 Cb -0.09 -0.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.82 3dyo s VAL 668 CO 0.01 0.04 1.11 -2.84 0.00 0.00 0.00 175.10 173.41 3dyo s PRO 669 N 0.90 3.95 0.11 2.72 0.02 -1.26 0.12 135.00 141.55 3dyo s PRO 669 Ca -0.06 1.65 -0.22 0.00 0.02 0.00 0.00 61.00 62.38 3dyo s PRO 669 Cb -0.07 -2.46 -0.07 0.00 0.02 0.00 0.00 34.50 31.91 3dyo s PRO 669 CO -0.06 -0.36 0.67 -0.51 -0.33 0.00 0.00 177.00 176.42 3dyo s LEU 670 N -2.86 4.55 -0.43 -5.54 1.43 -0.74 -4.74 118.68 110.35 3dyo s LEU 670 Ca 0.61 1.44 0.05 0.00 -1.03 0.00 0.00 54.13 55.20 3dyo s LEU 670 Cb -0.25 -3.10 0.20 0.00 0.03 0.00 0.00 46.19 43.07 3dyo s LEU 670 CO 0.31 0.22 0.41 -0.67 0.23 0.00 0.00 176.35 176.85 3dyo n ASP 671 N 1.81 0.01 -4.04 2.29 2.03 -1.26 -4.75 116.55 112.64 3dyo n ASP 671 Ca -0.08 -2.54 -0.25 0.00 0.52 0.00 0.00 54.79 52.44 3dyo n ASP 671 Cb 0.50 -0.59 -0.17 0.00 -0.72 0.00 0.00 41.12 40.14 3dyo n ASP 671 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3dyo s VAL 672 N -0.46 1.22 0.60 5.18 1.01 -1.26 -4.85 120.40 121.84 3dyo s VAL 672 Ca 0.33 -0.53 -0.17 0.00 0.00 0.00 0.00 61.98 61.61 3dyo s VAL 672 Cb 0.08 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3dyo s VAL 672 CO -0.17 0.37 1.13 0.00 0.00 0.00 0.00 175.10 176.43 3dyo s ALA 673 N 0.66 2.58 0.07 5.51 0.00 -1.26 -1.17 121.76 128.15 3dyo s ALA 673 Ca -0.15 0.72 -0.37 0.00 0.00 0.00 0.00 51.96 52.16 3dyo s ALA 673 Cb -0.16 -3.35 -0.17 0.00 0.00 0.00 0.00 23.12 19.44 3dyo s ALA 673 CO 0.04 -1.03 1.31 -0.35 0.00 0.00 0.00 175.76 175.73 3dyo n PRO 674 N -1.82 1.00 -0.94 0.00 -0.04 -1.18 0.76 135.00 132.78 3dyo n PRO 674 Ca 0.11 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 3dyo n PRO 674 Cb 0.51 -1.98 0.00 0.00 -0.04 0.00 0.00 33.50 31.99 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 2.44 -1.21 -1.18 0.54 6.02 -0.62 -4.95 117.38 118.42 3dyo n GLN 675 Ca 0.19 0.30 -0.07 0.00 -0.01 0.00 0.00 57.00 57.41 3dyo n GLN 675 Cb 0.17 -4.37 0.04 0.00 1.02 0.00 0.00 30.24 27.11 3dyo n GLN 675 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dyo n GLY 676 N -0.42 0.59 3.02 1.08 0.00 0.23 -4.73 105.19 104.97 3dyo n GLY 676 Ca 0.00 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 3dyo n GLY 676 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyo s LYS 677 N -3.28 0.43 -0.03 1.61 1.02 -1.26 -1.26 119.74 116.98 3dyo s LYS 677 Ca 0.21 -0.64 0.02 0.00 0.02 0.00 0.00 55.97 55.58 3dyo s LYS 677 Cb -0.01 -0.17 0.01 0.00 -0.52 0.00 0.00 37.83 37.14 3dyo s LYS 677 CO 0.14 0.02 -0.06 -1.14 -0.92 0.00 0.00 175.35 173.39 3dyo s GLN 678 N -1.36 0.79 -0.12 1.68 0.74 0.33 -4.93 119.66 116.80 3dyo s GLN 678 Ca -0.10 -0.19 -0.03 0.00 0.05 0.00 0.00 55.36 55.09 3dyo s GLN 678 Cb -0.09 -0.77 -0.03 0.00 1.10 0.00 0.00 33.01 33.22 3dyo s GLN 678 CO -0.00 0.02 -0.02 -0.51 -0.55 0.00 0.00 175.29 174.24 3dyo s LEU 679 N 0.46 3.42 -0.13 3.68 1.43 -1.26 0.05 118.68 126.33 3dyo s LEU 679 Ca -0.06 0.02 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 3dyo s LEU 679 Cb -0.10 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.35 3dyo s LEU 679 CO 0.00 0.28 -0.09 -0.63 0.23 0.00 0.00 176.35 176.14 3dyo s ILE 680 N -0.32 1.20 -0.24 -0.59 1.01 0.70 -4.98 121.20 117.98 3dyo s ILE 680 Ca 0.06 -0.43 -0.15 0.00 0.00 0.00 0.00 60.65 60.13 3dyo s ILE 680 Cb -0.12 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 3dyo s ILE 680 CO 0.02 0.37 0.36 -1.61 0.00 0.00 0.00 174.94 174.08 3dyo s GLU 681 N 1.63 4.08 0.39 2.79 8.01 -1.26 0.71 118.70 135.05 3dyo s GLU 681 Ca 0.04 0.07 -0.23 0.00 0.01 0.00 0.00 54.97 54.86 3dyo s GLU 681 Cb -0.13 -3.60 -0.10 0.00 -4.31 0.00 0.00 34.13 25.98 3dyo s GLU 681 CO -0.09 -0.16 0.95 -0.51 0.01 0.00 0.00 175.26 175.46 3dyo s LEU 682 N 1.71 4.11 0.00 1.80 1.43 0.63 -4.97 118.68 123.39 3dyo s LEU 682 Ca 0.16 1.77 -0.14 0.00 -1.03 0.00 0.00 54.13 54.88 3dyo s LEU 682 Cb -0.15 -4.32 0.22 0.00 0.03 0.00 0.00 46.19 41.97 3dyo s LEU 682 CO 0.09 -0.25 0.72 -0.81 0.23 0.00 0.00 176.35 176.32 3dyo n PRO 683 N -0.14 -2.68 -1.58 1.29 -0.04 -1.26 -4.83 135.00 125.75 3dyo n PRO 683 Ca 0.05 -1.16 -0.46 0.00 -0.04 0.00 0.00 63.50 61.89 3dyo n PRO 683 Cb 0.52 -1.14 -0.04 0.00 -0.04 0.00 0.00 33.50 32.80 3dyo n PRO 683 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3dyo n GLU 684 N -3.89 1.86 -3.06 0.54 2.13 -1.26 -4.91 120.64 112.05 3dyo n GLU 684 Ca 0.10 0.57 -0.40 0.00 0.66 0.00 0.00 57.16 58.09 3dyo n GLU 684 Cb 0.40 -2.91 -0.05 0.00 0.27 0.00 0.00 31.44 29.15 3dyo n GLU 684 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3dyo s LEU 685 N 6.91 4.23 0.47 4.31 1.43 -1.26 -4.99 118.68 129.79 3dyo s LEU 685 Ca 1.01 1.05 -0.23 0.00 -1.03 0.00 0.00 54.13 54.92 3dyo s LEU 685 Cb -0.55 -3.02 -0.07 0.00 0.03 0.00 0.00 46.19 42.58 3dyo s LEU 685 CO 0.43 -0.21 1.24 -2.84 0.23 0.00 0.00 176.35 175.19 3dyo s PRO 686 N 1.40 3.65 -0.06 1.29 0.02 -1.26 -5.02 135.00 135.02 3dyo s PRO 686 Ca 0.34 1.97 -0.11 0.00 0.02 0.00 0.00 61.00 63.22 3dyo s PRO 686 Cb -0.17 -2.45 -0.05 0.00 0.02 0.00 0.00 34.50 31.86 3dyo s PRO 686 CO 0.14 -0.70 0.28 -0.65 -0.33 0.00 0.00 177.00 175.74 3dyo s GLN 687 N -2.65 3.72 -0.20 5.54 1.11 -1.26 -5.06 119.66 120.86 3dyo s GLN 687 Ca 0.64 0.15 -0.02 0.00 0.01 0.00 0.00 55.36 56.14 3dyo s GLN 687 Cb -0.34 -3.22 0.00 0.00 -1.01 0.00 0.00 33.01 28.45 3dyo s GLN 687 CO 0.41 0.71 -0.11 -1.25 0.01 0.00 0.00 175.29 175.06 3dyo s PRO 688 N -0.98 3.22 0.00 2.91 0.04 -1.26 -4.94 135.00 133.99 3dyo s PRO 688 Ca 0.19 -0.71 0.27 0.00 0.04 0.00 0.00 61.00 60.79 3dyo s PRO 688 Cb -0.14 -2.80 0.98 0.00 0.04 0.00 0.00 34.50 32.57 3dyo s PRO 688 CO 0.09 -0.17 1.71 -0.85 0.04 0.00 0.00 177.00 177.81 3dyo n GLU 689 N 4.64 0.61 -1.90 4.56 0.00 -1.26 -4.80 120.64 122.49 3dyo n GLU 689 Ca -0.19 -0.28 -0.42 0.00 0.00 0.00 0.00 57.16 56.27 3dyo n GLU 689 Cb 0.51 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.42 3dyo n GLU 689 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3dyo s SER 690 N -2.58 6.56 0.61 -1.84 0.15 -1.26 -4.94 113.70 110.39 3dyo s SER 690 Ca 0.24 2.64 -0.19 0.00 0.70 0.00 0.00 55.95 59.35 3dyo s SER 690 Cb 0.19 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.88 3dyo s SER 690 CO 0.52 -0.86 1.12 0.00 1.20 0.00 0.00 173.24 175.23 3dyo n ALA 691 N 4.18 0.67 0.00 5.45 0.00 -1.26 -4.80 120.51 124.74 3dyo n ALA 691 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.61 3dyo n ALA 691 Cb 0.38 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3dyo n ALA 691 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dyo n GLY 692 N 1.10 2.53 3.57 0.00 0.00 0.17 -4.93 105.19 107.64 3dyo n GLY 692 Ca 0.14 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.69 3.88 0.08 1.61 2.00 -1.26 0.23 119.66 124.51 3dyo s GLN 693 Ca 0.00 -0.38 -0.25 0.00 -2.00 0.00 0.00 55.36 52.73 3dyo s GLN 693 Cb 0.00 -3.31 -0.06 0.00 0.80 0.00 0.00 33.01 30.43 3dyo s GLN 693 CO 0.00 0.07 0.78 -0.51 -0.50 0.00 0.00 175.29 175.14 3dyo s LEU 694 N 0.93 4.49 0.01 3.68 1.43 0.16 -2.01 118.68 127.38 3dyo s LEU 694 Ca 0.05 1.53 0.05 0.00 -1.03 0.00 0.00 54.13 54.73 3dyo s LEU 694 Cb -0.14 -3.28 -0.02 0.00 0.03 0.00 0.00 46.19 42.79 3dyo s LEU 694 CO 0.03 0.06 -0.16 0.26 0.23 0.00 0.00 176.35 176.77 3dyo s TRP 695 N -0.35 1.42 -0.18 0.29 0.52 -0.17 -0.06 118.94 120.41 3dyo s TRP 695 Ca 0.38 -0.30 -0.03 0.00 0.02 0.00 0.00 56.10 56.18 3dyo s TRP 695 Cb -0.21 -0.89 -0.01 0.00 -1.15 0.00 0.00 33.47 31.20 3dyo s TRP 695 CO 0.24 0.00 -0.07 -1.17 0.02 0.00 0.00 176.95 175.98 3dyo s LEU 696 N -0.64 2.91 -0.09 2.99 2.96 0.34 -1.11 118.68 126.04 3dyo s LEU 696 Ca 0.05 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 3dyo s LEU 696 Cb -0.07 -1.71 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 3dyo s LEU 696 CO 0.00 0.07 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.99 3dyo s THR 697 N 0.95 2.31 0.10 3.68 2.01 -0.04 0.35 115.64 124.99 3dyo s THR 697 Ca -0.01 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.13 3dyo s THR 697 Cb -0.15 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 3dyo s THR 697 CO 0.00 0.56 -0.19 0.68 -0.69 0.00 0.00 174.62 174.98 3dyo s VAL 698 N 0.12 2.78 -0.05 3.82 -7.23 0.24 -0.97 120.40 119.11 3dyo s VAL 698 Ca -0.11 -1.46 -0.05 0.00 -1.81 0.00 0.00 61.98 58.56 3dyo s VAL 698 Cb -0.16 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.55 3dyo s VAL 698 CO 0.06 0.15 0.13 -0.13 -0.31 0.00 0.00 175.10 175.01 3dyo s ARG 699 N -1.98 0.19 -0.21 4.82 0.52 -0.05 -1.79 118.95 120.46 3dyo s ARG 699 Ca 0.17 0.13 -0.10 0.00 -0.52 0.00 0.00 55.73 55.41 3dyo s ARG 699 Cb -0.10 0.09 -0.05 0.00 0.52 0.00 0.00 34.95 35.40 3dyo s ARG 699 CO 0.09 -0.03 0.15 0.08 0.02 0.00 0.00 175.30 175.61 3dyo s VAL 700 N -0.06 5.39 0.06 3.52 1.01 0.10 -0.19 120.40 130.23 3dyo s VAL 700 Ca -0.01 0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.27 3dyo s VAL 700 Cb -0.02 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.84 3dyo s VAL 700 CO 0.00 0.41 -0.23 -0.69 0.00 0.00 0.00 175.10 174.60 3dyo s VAL 701 N 0.53 1.84 -0.49 2.92 1.01 0.10 -1.37 120.40 124.94 3dyo s VAL 701 Ca 0.09 -1.36 -0.15 0.00 0.00 0.00 0.00 61.98 60.56 3dyo s VAL 701 Cb -0.12 -1.61 0.09 0.00 0.00 0.00 0.00 36.38 34.75 3dyo s VAL 701 CO -0.00 0.18 0.41 -1.10 0.00 0.00 0.00 175.10 174.60 3dyo s GLN 702 N -1.40 2.94 0.29 2.72 -0.21 0.09 0.12 119.66 124.21 3dyo s GLN 702 Ca 0.09 -1.48 -0.01 0.00 0.02 0.00 0.00 55.36 53.98 3dyo s GLN 702 Cb -0.09 -4.15 0.44 0.00 1.00 0.00 0.00 33.01 30.21 3dyo s GLN 702 CO 0.03 -1.12 1.87 -1.35 -2.12 0.00 0.00 175.29 172.60 3dyo h PRO 703 N 8.76 0.85 -6.01 2.91 0.11 -1.89 0.77 132.00 137.51 3dyo h PRO 703 Ca -0.28 -0.14 -0.61 0.00 0.11 0.00 0.00 66.00 65.08 3dyo h PRO 703 Cb 1.10 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.03 3dyo h PRO 703 CO 0.92 0.71 -0.43 -0.80 -0.21 0.00 0.00 178.00 178.19 3dyo s ASN 704 N -6.53 6.41 0.74 -2.05 -0.87 -1.26 -3.74 114.94 107.63 3dyo s ASN 704 Ca -0.10 0.39 -0.13 0.00 -1.57 0.00 0.00 52.86 51.45 3dyo s ASN 704 Cb 0.16 -2.01 0.04 0.00 -0.02 0.00 0.00 41.25 39.43 3dyo s ASN 704 CO 0.79 0.13 1.12 0.00 -2.57 0.00 0.00 177.10 176.57 3dyo s ALA 705 N -1.56 2.23 0.34 0.60 0.00 -1.26 -4.44 121.76 117.66 3dyo s ALA 705 Ca 0.37 0.47 0.03 0.00 0.00 0.00 0.00 51.96 52.84 3dyo s ALA 705 Cb -0.13 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 3dyo s ALA 705 CO 0.27 -1.71 0.12 0.25 0.00 0.00 0.00 175.76 174.68 3dyo n THR 706 N -3.11 0.00 0.31 0.00 -2.24 0.67 -4.89 114.28 105.03 3dyo n THR 706 Ca 0.10 -1.95 0.18 0.00 -2.27 0.00 0.00 64.05 60.11 3dyo n THR 706 Cb 0.52 0.69 0.98 0.00 -2.10 0.00 0.00 70.33 70.42 3dyo n THR 706 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dyo h ALA 707 N 1.54 1.25 -0.01 6.98 0.00 -1.99 -3.13 119.26 123.91 3dyo h ALA 707 Ca -0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dyo h ALA 707 Cb 0.99 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3dyo h ALA 707 CO 0.42 0.03 0.00 -2.67 0.00 0.00 0.00 179.25 177.02 3dyo n TRP 708 N -3.47 0.01 -3.63 0.00 4.27 -1.26 -5.05 117.44 108.31 3dyo n TRP 708 Ca -0.03 -0.19 -0.10 0.00 -3.89 0.00 0.00 57.50 53.29 3dyo n TRP 708 Cb 0.12 -0.02 -0.04 0.00 -1.36 0.00 0.00 31.31 30.01 3dyo n TRP 708 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 3dyo s SER 709 N -0.41 -0.26 0.42 -0.67 1.04 -1.18 -4.70 113.70 107.95 3dyo s SER 709 Ca 0.01 -0.32 -0.07 0.00 0.48 0.00 0.00 55.95 56.05 3dyo s SER 709 Cb 0.00 0.49 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 3dyo s SER 709 CO 0.01 -0.88 0.75 -1.61 0.98 0.00 0.00 173.24 172.48 3dyo s GLU 710 N -3.81 3.65 0.36 4.02 2.02 -1.26 -0.24 118.70 123.44 3dyo s GLU 710 Ca 0.04 0.28 -0.28 0.00 0.02 0.00 0.00 54.97 55.03 3dyo s GLU 710 Cb 0.01 -2.42 -0.12 0.00 0.10 0.00 0.00 34.13 31.71 3dyo s GLU 710 CO -0.11 -0.08 1.39 0.00 0.02 0.00 0.00 175.26 176.48 3dyo n ALA 711 N -1.70 1.81 -0.19 5.21 0.00 -1.26 -1.81 120.51 122.57 3dyo n ALA 711 Ca 0.01 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.80 3dyo n ALA 711 Cb 0.54 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.66 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 0.65 0.64 3.72 0.00 0.00 0.27 -4.92 105.19 105.55 3dyo n GLY 712 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 2.71 -3.25 1.61 -0.00 -0.75 -4.58 115.22 108.95 3dyo n HIS 713 Ca 0.00 0.23 -0.41 0.00 0.46 0.00 0.00 57.72 58.00 3dyo n HIS 713 Cb 0.00 -2.59 -0.08 0.00 -0.12 0.00 0.00 29.99 27.20 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 0.30 5.03 -0.41 3.57 1.01 -1.26 -0.73 121.20 128.71 3dyo s ILE 714 Ca 0.68 0.45 0.22 0.00 0.00 0.00 0.00 60.65 61.99 3dyo s ILE 714 Cb -0.53 -3.92 -0.26 0.00 0.01 0.00 0.00 42.46 37.76 3dyo s ILE 714 CO 0.44 -0.14 0.71 -1.54 0.00 0.00 0.00 174.94 174.41 3dyo n SER 715 N 5.68 0.42 -3.51 3.58 3.41 -0.47 -5.03 113.62 117.70 3dyo n SER 715 Ca -0.05 -0.31 -0.10 0.00 -0.26 0.00 0.00 58.87 58.15 3dyo n SER 715 Cb 0.49 1.47 -0.03 0.00 -0.26 0.00 0.00 64.21 65.88 3dyo n SER 715 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo s ALA 716 N -3.31 -1.82 0.24 7.33 0.00 -1.24 -4.67 121.76 118.29 3dyo s ALA 716 Ca -0.01 1.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 3dyo s ALA 716 Cb 0.14 0.23 0.01 0.00 0.00 0.00 0.00 23.12 23.50 3dyo s ALA 716 CO 0.88 -0.61 0.57 1.67 0.00 0.00 0.00 175.76 178.27 3dyo s TRP 717 N -2.70 0.05 -0.03 0.00 -2.14 -1.26 0.01 118.94 112.88 3dyo s TRP 717 Ca 0.03 -0.44 -0.29 0.00 2.66 0.00 0.00 56.10 58.06 3dyo s TRP 717 Cb -0.01 0.42 0.10 0.00 -3.10 0.00 0.00 33.47 30.88 3dyo s TRP 717 CO -0.06 -1.05 0.86 -1.14 -2.66 0.00 0.00 176.95 172.89 3dyo s GLN 718 N -3.95 0.85 0.04 3.25 2.00 -0.74 -4.99 119.66 116.13 3dyo s GLN 718 Ca 0.15 -0.15 -0.00 0.00 -2.00 0.00 0.00 55.36 53.36 3dyo s GLN 718 Cb -0.03 0.39 -0.03 0.00 0.80 0.00 0.00 33.01 34.15 3dyo s GLN 718 CO 0.05 -0.34 -0.03 -0.65 -0.50 0.00 0.00 175.29 173.82 3dyo s GLN 719 N -2.50 0.50 0.03 1.67 -0.21 -1.26 -0.60 119.66 117.30 3dyo s GLN 719 Ca 0.01 -0.97 -0.02 0.00 0.02 0.00 0.00 55.36 54.41 3dyo s GLN 719 Cb -0.01 0.14 -0.02 0.00 1.00 0.00 0.00 33.01 34.12 3dyo s GLN 719 CO -0.05 -0.08 -0.00 -1.58 -2.12 0.00 0.00 175.29 171.46 3dyo s TRP 720 N -2.85 0.34 -0.02 0.91 0.51 0.15 -4.99 118.94 113.00 3dyo s TRP 720 Ca -0.03 -0.71 -0.23 0.00 -2.12 0.00 0.00 56.10 53.01 3dyo s TRP 720 Cb 0.00 -0.25 -0.05 0.00 -0.81 0.00 0.00 33.47 32.37 3dyo s TRP 720 CO -0.06 -0.29 0.70 1.03 -0.51 0.00 0.00 176.95 177.82 3dyo s ARG 721 N -2.54 4.43 0.00 4.98 0.52 -1.26 -0.50 118.95 124.58 3dyo s ARG 721 Ca -0.06 0.91 0.00 0.00 -0.52 0.00 0.00 55.73 56.07 3dyo s ARG 721 Cb -0.02 -3.40 0.00 0.00 0.52 0.00 0.00 34.95 32.05 3dyo s ARG 721 CO -0.05 0.20 0.00 1.28 0.02 0.00 0.00 175.30 176.75 3dyo n LEU 722 N 3.25 0.00 -4.76 2.53 4.77 0.91 -4.92 117.00 118.78 3dyo n LEU 722 Ca -0.03 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.62 3dyo n LEU 722 Cb 0.51 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.65 3dyo n LEU 722 CO 0.46 0.00 0.76 0.00 -1.33 0.00 0.00 177.39 177.29 3dyo s ALA 723 N -2.87 2.42 -0.05 -1.18 0.00 -1.26 -4.64 121.76 114.19 3dyo s ALA 723 Ca 0.00 0.68 0.04 0.00 0.00 0.00 0.00 51.96 52.68 3dyo s ALA 723 Cb 0.00 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.76 3dyo s ALA 723 CO 0.00 -1.34 -0.17 -2.00 0.00 0.00 0.00 175.76 172.25 3dyo s GLU 724 N -3.92 1.84 -0.46 0.00 2.12 -1.26 -0.66 118.70 116.36 3dyo s GLU 724 Ca 0.70 -0.59 -0.06 0.00 0.36 0.00 0.00 54.97 55.38 3dyo s GLU 724 Cb -0.23 -1.56 0.12 0.00 0.26 0.00 0.00 34.13 32.71 3dyo s GLU 724 CO 0.40 0.20 0.30 -0.80 -0.54 0.00 0.00 175.26 174.82 3dyo s ASN 725 N 0.16 5.49 0.30 -1.70 0.01 0.13 -4.95 114.94 114.39 3dyo s ASN 725 Ca -0.06 -2.05 -0.29 0.00 -0.71 0.00 0.00 52.86 49.74 3dyo s ASN 725 Cb -0.13 -1.92 -0.10 0.00 0.41 0.00 0.00 41.25 39.51 3dyo s ASN 725 CO 0.03 -0.60 1.27 -0.76 -1.51 0.00 0.00 177.10 175.53 3dyo s LEU 726 N 1.14 4.45 -0.07 0.60 1.43 -1.26 0.42 118.68 125.38 3dyo s LEU 726 Ca 0.08 2.58 -0.30 0.00 -1.03 0.00 0.00 54.13 55.46 3dyo s LEU 726 Cb -0.24 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.31 3dyo s LEU 726 CO -0.03 -0.47 1.16 -0.55 0.23 0.00 0.00 176.35 176.70 3dyo s SER 727 N -0.43 7.09 0.00 2.29 0.15 -1.26 -4.86 113.70 116.68 3dyo s SER 727 Ca 0.49 1.74 0.05 0.00 0.70 0.00 0.00 55.95 58.94 3dyo s SER 727 Cb -0.38 -2.56 0.10 0.00 -1.71 0.00 0.00 66.02 61.47 3dyo s SER 727 CO 0.49 -0.56 0.91 1.33 1.20 0.00 0.00 173.24 176.61 3dyo n VAL 728 N 4.64 0.56 -2.37 4.45 0.24 -1.26 -5.03 118.33 119.56 3dyo n VAL 728 Ca 0.11 -0.78 -0.42 0.00 -2.04 0.00 0.00 64.34 61.20 3dyo n VAL 728 Cb 0.47 0.77 -0.03 0.00 -1.47 0.00 0.00 33.84 33.58 3dyo n VAL 728 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3dyo s THR 729 N -0.74 4.02 -0.35 3.34 2.01 -1.26 -4.94 115.64 117.71 3dyo s THR 729 Ca 0.08 1.38 -0.29 0.00 0.31 0.00 0.00 61.69 63.18 3dyo s THR 729 Cb 0.05 -3.89 0.01 0.00 0.01 0.00 0.00 72.50 68.68 3dyo s THR 729 CO 0.07 0.02 1.25 -0.22 -0.69 0.00 0.00 174.62 175.05 3dyo s LEU 730 N 2.07 3.80 0.66 4.42 0.20 -1.26 -4.99 118.68 123.57 3dyo s LEU 730 Ca 0.59 0.99 -0.18 0.00 0.69 0.00 0.00 54.13 56.23 3dyo s LEU 730 Cb -0.28 -3.54 -0.01 0.00 -0.43 0.00 0.00 46.19 41.93 3dyo s LEU 730 CO 0.25 -1.13 1.22 -2.65 -0.29 0.00 0.00 176.35 173.74 3dyo n PRO 731 N 7.45 0.99 -1.97 0.98 -0.02 -1.26 -4.93 135.00 136.24 3dyo n PRO 731 Ca 0.14 0.39 -0.43 0.00 -2.02 0.00 0.00 63.50 61.59 3dyo n PRO 731 Cb 0.47 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.47 3dyo n PRO 731 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dyo s ALA 732 N -1.47 3.42 0.41 3.55 0.00 -1.26 -4.97 121.76 121.45 3dyo s ALA 732 Ca 0.81 0.81 -0.27 0.00 0.00 0.00 0.00 51.96 53.31 3dyo s ALA 732 Cb -0.38 -3.82 -0.10 0.00 0.00 0.00 0.00 23.12 18.82 3dyo s ALA 732 CO 0.42 -1.72 1.45 0.00 0.00 0.00 0.00 175.76 175.91 3dyo n ALA 733 N 8.00 2.14 -2.73 0.00 0.00 -1.26 -5.01 120.51 121.65 3dyo n ALA 733 Ca 0.19 0.29 -0.28 0.00 0.00 0.00 0.00 53.44 53.65 3dyo n ALA 733 Cb 0.44 -2.40 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 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 -0.32 6.40 -0.81 0.00 1.04 -1.26 -5.02 113.70 113.73 3dyo s SER 734 Ca 0.57 0.45 0.01 0.00 0.48 0.00 0.00 55.95 57.46 3dyo s SER 734 Cb -0.47 -2.03 0.34 0.00 0.10 0.00 0.00 66.02 63.97 3dyo s SER 734 CO 0.60 -0.06 1.58 1.41 0.98 0.00 0.00 173.24 177.76 3dyo n HIS 735 N -0.67 3.20 -3.64 5.02 -0.00 -1.26 -4.93 115.22 112.94 3dyo n HIS 735 Ca -0.04 -2.91 -0.03 0.00 -0.00 0.00 0.00 57.72 54.74 3dyo n HIS 735 Cb 0.54 -0.90 -0.06 0.00 -0.00 0.00 0.00 29.99 29.57 3dyo n HIS 735 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3dyo s ALA 736 N -3.99 -2.18 -0.09 -1.41 0.00 -1.26 -5.15 121.76 107.69 3dyo s ALA 736 Ca 0.45 1.74 0.04 0.00 0.00 0.00 0.00 51.96 54.19 3dyo s ALA 736 Cb 0.29 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.74 3dyo s ALA 736 CO -0.20 -0.15 -0.22 -1.50 0.00 0.00 0.00 175.76 173.69 3dyo s ILE 737 N -0.24 1.92 0.51 0.00 -1.16 -1.26 -4.17 121.20 116.80 3dyo s ILE 737 Ca 0.07 -0.94 -0.22 0.00 -0.51 0.00 0.00 60.65 59.05 3dyo s ILE 737 Cb -0.04 -1.66 -0.06 0.00 0.61 0.00 0.00 42.46 41.31 3dyo s ILE 737 CO -0.13 0.53 1.27 -2.84 -2.81 0.00 0.00 174.94 170.96 3dyo s PRO 738 N 0.34 3.40 -0.23 3.50 0.02 -1.26 -4.94 135.00 135.83 3dyo s PRO 738 Ca -0.17 2.03 -0.08 0.00 0.02 0.00 0.00 61.00 62.80 3dyo s PRO 738 Cb -0.17 -2.31 -0.04 0.00 0.02 0.00 0.00 34.50 31.99 3dyo s PRO 738 CO 0.08 -0.92 0.10 -1.58 -0.33 0.00 0.00 177.00 174.35 3dyo s HIS 739 N -1.41 3.20 -0.18 6.54 2.46 -0.13 -4.74 115.29 121.04 3dyo s HIS 739 Ca 0.68 -0.05 -0.18 0.00 0.47 0.00 0.00 55.06 55.98 3dyo s HIS 739 Cb -0.35 -2.21 -0.04 0.00 -0.13 0.00 0.00 32.58 29.85 3dyo s HIS 739 CO 0.42 -0.08 0.48 -1.17 -2.47 0.00 0.00 174.74 171.92 3dyo s LEU 740 N 1.11 4.18 -0.06 8.88 2.96 -1.26 -0.40 118.68 134.09 3dyo s LEU 740 Ca 0.05 0.68 0.06 0.00 -0.22 0.00 0.00 54.13 54.70 3dyo s LEU 740 Cb -0.14 -2.66 -0.01 0.00 0.50 0.00 0.00 46.19 43.88 3dyo s LEU 740 CO 0.04 -0.11 -0.25 -0.89 -1.32 0.00 0.00 176.35 173.82 3dyo s THR 741 N 1.29 2.08 0.08 3.68 2.01 0.47 -4.97 115.64 120.29 3dyo s THR 741 Ca 0.23 -1.06 0.10 0.00 0.31 0.00 0.00 61.69 61.27 3dyo s THR 741 Cb -0.15 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.57 3dyo s THR 741 CO 0.09 0.57 -0.26 -0.89 -0.69 0.00 0.00 174.62 173.45 3dyo s THR 742 N -0.16 2.10 0.30 -0.82 2.01 -1.26 -0.91 115.64 116.90 3dyo s THR 742 Ca -0.04 -1.51 0.04 0.00 0.31 0.00 0.00 61.69 60.49 3dyo s THR 742 Cb -0.14 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.52 3dyo s THR 742 CO 0.04 0.22 0.27 -0.94 -0.69 0.00 0.00 174.62 173.52 3dyo s SER 743 N -1.57 1.19 0.50 3.53 1.04 -0.00 -5.00 113.70 113.39 3dyo s SER 743 Ca 0.12 -1.62 0.29 0.00 0.48 0.00 0.00 55.95 55.21 3dyo s SER 743 Cb -0.10 0.53 1.22 0.00 0.10 0.00 0.00 66.02 67.77 3dyo s SER 743 CO 0.04 -1.04 1.94 -0.33 0.98 0.00 0.00 173.24 174.82 3dyo h GLU 744 N 2.25 0.00 0.00 4.02 4.39 -2.03 -3.18 114.58 120.03 3dyo h GLU 744 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3dyo h GLU 744 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 3dyo h GLU 744 CO 0.40 0.11 -0.67 -1.33 -1.16 0.00 0.00 179.01 176.37 3dyo n MET 745 N -3.29 2.37 -3.74 2.33 2.81 -1.26 -4.78 117.12 111.56 3dyo n MET 745 Ca -0.00 -0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.79 3dyo n MET 745 Cb 0.34 -1.16 -0.04 0.00 -0.71 0.00 0.00 33.22 31.65 3dyo n MET 745 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3dyo s ASP 746 N -2.33 -0.24 -0.15 7.83 1.01 -1.20 -0.68 116.67 120.90 3dyo s ASP 746 Ca 0.05 -0.48 0.01 0.00 0.71 0.00 0.00 52.55 52.84 3dyo s ASP 746 Cb 0.11 0.56 0.01 0.00 1.01 0.00 0.00 42.92 44.60 3dyo s ASP 746 CO 0.57 -1.03 -0.19 -0.36 0.21 0.00 0.00 175.17 174.38 3dyo s PHE 747 N -3.87 2.73 -0.05 4.23 0.40 -0.49 -0.82 117.98 120.12 3dyo s PHE 747 Ca 0.09 -1.24 0.06 0.00 -0.60 0.00 0.00 56.93 55.24 3dyo s PHE 747 Cb -0.00 -1.86 -0.02 0.00 0.51 0.00 0.00 43.02 41.64 3dyo s PHE 747 CO -0.04 -0.57 -0.22 0.00 0.70 0.00 0.00 175.22 175.09 3dyo s ILE 749 N -0.43 1.51 -0.02 0.00 1.09 0.40 -0.39 121.20 123.36 3dyo s ILE 749 Ca 0.04 -0.80 0.04 0.00 -1.10 0.00 0.00 60.65 58.83 3dyo s ILE 749 Cb -0.12 -1.27 -0.01 0.00 -1.06 0.00 0.00 42.46 40.01 3dyo s ILE 749 CO 0.01 0.43 -0.13 -0.70 -0.10 0.00 0.00 174.94 174.45 3dyo s GLU 750 N -0.31 1.25 -0.24 2.79 2.12 0.47 -0.94 118.70 123.84 3dyo s GLU 750 Ca 0.04 -0.48 -0.03 0.00 0.36 0.00 0.00 54.97 54.86 3dyo s GLU 750 Cb -0.09 -1.16 0.13 0.00 0.26 0.00 0.00 34.13 33.27 3dyo s GLU 750 CO 0.00 0.24 0.40 -1.17 -0.54 0.00 0.00 175.26 174.19 3dyo s LEU 751 N -0.09 -0.70 0.00 2.70 2.96 0.01 -0.95 118.68 122.61 3dyo s LEU 751 Ca 0.01 0.38 0.00 0.00 -0.22 0.00 0.00 54.13 54.30 3dyo s LEU 751 Cb -0.08 1.23 0.00 0.00 0.50 0.00 0.00 46.19 47.84 3dyo s LEU 751 CO 0.00 -0.29 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 3dyo n GLY 752 N 5.37 3.15 0.76 7.98 0.00 -1.26 0.10 105.19 121.30 3dyo n GLY 752 Ca -0.04 0.16 0.04 0.00 0.00 0.00 0.00 46.02 46.18 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 4.55 2.16 -4.51 1.61 6.94 -1.26 -4.87 115.26 119.88 3dyo n ASN 753 Ca 0.00 -2.15 -0.26 0.00 -0.02 0.00 0.00 54.58 52.15 3dyo n ASN 753 Cb 0.00 -0.35 -0.10 0.00 -2.36 0.00 0.00 39.78 36.97 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 -1.64 1.84 -0.04 -3.83 1.02 0.28 -1.39 119.74 115.98 3dyo s LYS 754 Ca 0.21 -1.42 -0.09 0.00 0.02 0.00 0.00 55.97 54.70 3dyo s LYS 754 Cb 0.13 -2.01 0.01 0.00 -0.52 0.00 0.00 37.83 35.45 3dyo s LYS 754 CO 0.11 0.41 0.20 1.03 -0.92 0.00 0.00 175.35 176.18 3dyo s ARG 755 N -2.88 0.41 -0.03 1.68 0.52 -0.77 -0.81 118.95 117.07 3dyo s ARG 755 Ca 0.24 -0.06 0.04 0.00 -0.52 0.00 0.00 55.73 55.43 3dyo s ARG 755 Cb -0.08 0.18 -0.00 0.00 0.52 0.00 0.00 34.95 35.57 3dyo s ARG 755 CO 0.13 -0.09 -0.14 -1.58 0.02 0.00 0.00 175.30 173.64 3dyo s TRP 756 N -0.72 1.42 -0.14 -0.53 0.51 -0.12 -0.22 118.94 119.16 3dyo s TRP 756 Ca -0.08 -0.38 0.00 0.00 -2.12 0.00 0.00 56.10 53.52 3dyo s TRP 756 Cb -0.05 -0.97 0.02 0.00 -0.81 0.00 0.00 33.47 31.67 3dyo s TRP 756 CO 0.01 -0.13 -0.14 -1.14 -0.51 0.00 0.00 176.95 175.05 3dyo s GLN 757 N 0.06 2.22 -0.29 4.98 0.74 -0.16 -0.45 119.66 126.76 3dyo s GLN 757 Ca -0.03 -0.53 -0.07 0.00 0.05 0.00 0.00 55.36 54.79 3dyo s GLN 757 Cb -0.10 -2.03 0.00 0.00 1.10 0.00 0.00 33.01 31.99 3dyo s GLN 757 CO 0.01 -0.21 0.07 -0.06 -0.55 0.00 0.00 175.29 174.55 3dyo s PHE 758 N 1.43 3.13 -0.19 1.67 0.40 -0.42 0.14 117.98 124.14 3dyo s PHE 758 Ca 0.03 -0.93 -0.29 0.00 -0.60 0.00 0.00 56.93 55.14 3dyo s PHE 758 Cb -0.13 -2.24 -0.02 0.00 0.51 0.00 0.00 43.02 41.14 3dyo s PHE 758 CO -0.09 -0.56 1.39 1.21 0.70 0.00 0.00 175.22 177.87 3dyo s ASN 759 N 1.51 6.75 0.60 1.36 3.84 0.37 -1.39 114.94 127.97 3dyo s ASN 759 Ca 0.03 1.65 0.39 0.00 0.21 0.00 0.00 52.86 55.14 3dyo s ASN 759 Cb -0.17 -2.54 1.84 0.00 -0.55 0.00 0.00 41.25 39.83 3dyo s ASN 759 CO 0.02 -0.94 2.15 0.03 -2.79 0.00 0.00 177.10 175.57 3dyo h ARG 760 N 9.07 0.00 0.11 0.43 3.08 -1.20 0.85 114.38 126.71 3dyo h ARG 760 Ca -0.29 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.40 3dyo h ARG 760 Cb 1.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.15 3dyo h ARG 760 CO 0.99 0.00 -1.95 0.94 -1.07 0.00 0.00 179.97 178.88 3dyo n GLN 761 N -3.08 0.74 0.04 0.04 0.00 -1.26 -4.25 117.38 109.61 3dyo n GLN 761 Ca -0.01 0.27 0.02 0.00 -0.00 0.00 0.00 57.00 57.28 3dyo n GLN 761 Cb 0.20 -1.73 -0.07 0.00 0.00 0.00 0.00 30.24 28.64 3dyo n GLN 761 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 3dyo n SER 762 N -3.41 0.83 -0.35 1.69 3.41 -1.02 -4.84 113.62 109.91 3dyo n SER 762 Ca -0.29 0.36 -0.05 0.00 -0.26 0.00 0.00 58.87 58.63 3dyo n SER 762 Cb 1.05 0.26 -0.02 0.00 -0.26 0.00 0.00 64.21 65.24 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 1.36 0.74 3.51 5.00 0.00 0.29 -4.78 105.19 111.31 3dyo n GLY 763 Ca -0.08 -0.83 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.17 2.47 -0.41 1.61 0.40 -1.21 -4.91 117.98 113.77 3dyo s PHE 764 Ca 0.00 -0.29 -0.29 0.00 -0.60 0.00 0.00 56.93 55.76 3dyo s PHE 764 Cb 0.00 -1.17 0.00 0.00 0.51 0.00 0.00 43.02 42.36 3dyo s PHE 764 CO 0.00 0.56 1.49 -1.17 0.70 0.00 0.00 175.22 176.80 3dyo s LEU 765 N -3.01 3.56 0.05 -0.37 2.96 -1.26 -0.48 118.68 120.12 3dyo s LEU 765 Ca 0.25 0.89 0.22 0.00 -0.22 0.00 0.00 54.13 55.28 3dyo s LEU 765 Cb -0.07 -3.51 -0.08 0.00 0.50 0.00 0.00 46.19 43.03 3dyo s LEU 765 CO 0.14 -1.51 0.88 -1.54 -1.32 0.00 0.00 176.35 173.00 3dyo n SER 766 N 9.18 0.53 -3.44 3.68 3.41 0.37 -2.19 113.62 125.15 3dyo n SER 766 Ca 0.18 -0.14 -0.13 0.00 -0.26 0.00 0.00 58.87 58.52 3dyo n SER 766 Cb 0.48 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 65.46 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 -3.29 1.22 -0.03 4.33 2.00 -1.05 -4.42 119.66 118.42 3dyo s GLN 767 Ca 0.00 -0.33 -0.10 0.00 -2.00 0.00 0.00 55.36 52.93 3dyo s GLN 767 Cb 0.14 0.56 0.01 0.00 0.80 0.00 0.00 33.01 34.52 3dyo s GLN 767 CO 0.83 -0.51 0.22 -1.64 -0.50 0.00 0.00 175.29 173.69 3dyo s MET 768 N -3.27 0.46 -0.02 1.67 -1.94 -1.26 -0.99 119.30 113.95 3dyo s MET 768 Ca -0.01 -0.08 0.05 0.00 -1.71 0.00 0.00 55.69 53.94 3dyo s MET 768 Cb -0.01 0.20 -0.01 0.00 2.01 0.00 0.00 34.83 37.02 3dyo s MET 768 CO -0.09 -0.10 -0.18 -1.58 -0.01 0.00 0.00 175.02 173.05 3dyo s TRP 769 N -0.83 1.69 -0.13 -0.03 0.51 0.70 0.16 118.94 121.00 3dyo s TRP 769 Ca -0.09 -0.36 0.00 0.00 -2.12 0.00 0.00 56.10 53.54 3dyo s TRP 769 Cb -0.05 -1.10 0.02 0.00 -0.81 0.00 0.00 33.47 31.53 3dyo s TRP 769 CO 0.02 -0.06 -0.13 0.42 -0.51 0.00 0.00 176.95 176.69 3dyo s ILE 770 N -0.34 1.41 -1.51 2.03 1.01 0.78 -1.84 121.20 122.74 3dyo s ILE 770 Ca 0.05 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 3dyo s ILE 770 Cb -0.08 -1.34 0.06 0.00 0.01 0.00 0.00 42.46 41.11 3dyo s ILE 770 CO -0.00 0.43 0.61 0.61 0.00 0.00 0.00 174.94 176.59 3dyo n GLY 771 N 4.69 -0.33 2.64 6.18 0.00 -0.49 -0.57 105.19 117.32 3dyo n GLY 771 Ca -0.16 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3dyo n GLY 771 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dyo n ASP 772 N -2.87 -2.57 -4.48 1.61 8.00 -1.26 -4.98 116.55 110.00 3dyo n ASP 772 Ca -0.15 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.02 3dyo n ASP 772 Cb 0.61 -1.18 -0.12 0.00 -0.02 0.00 0.00 41.12 40.41 3dyo n ASP 772 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3dyo s LYS 773 N -0.50 3.53 0.25 -1.24 3.01 0.27 -5.06 119.74 120.00 3dyo s LYS 773 Ca 0.00 -0.55 -0.30 0.00 -1.01 0.00 0.00 55.97 54.11 3dyo s LYS 773 Cb 0.00 -2.83 -0.09 0.00 -1.01 0.00 0.00 37.83 33.90 3dyo s LYS 773 CO 0.00 0.28 1.24 0.15 0.51 0.00 0.00 175.35 177.53 3dyo s LYS 774 N 0.24 4.46 -0.03 1.68 -0.14 -1.26 -0.16 119.74 124.52 3dyo s LYS 774 Ca -0.04 2.01 0.20 0.00 -1.36 0.00 0.00 55.97 56.78 3dyo s LYS 774 Cb -0.14 -3.17 -0.31 0.00 -1.68 0.00 0.00 37.83 32.53 3dyo s LYS 774 CO 0.03 -0.09 0.43 1.04 -0.76 0.00 0.00 175.35 176.00 3dyo n GLN 775 N 1.77 0.61 -4.30 1.68 1.13 0.41 -4.76 117.38 113.92 3dyo n GLN 775 Ca 0.02 -0.18 -0.30 0.00 -1.94 0.00 0.00 57.00 54.61 3dyo n GLN 775 Cb 0.43 -1.47 -0.10 0.00 0.11 0.00 0.00 30.24 29.21 3dyo n GLN 775 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3dyo s LEU 776 N -4.40 3.02 -0.17 1.08 1.43 -1.26 0.40 118.68 118.78 3dyo s LEU 776 Ca -0.07 -0.36 0.17 0.00 -1.03 0.00 0.00 54.13 52.84 3dyo s LEU 776 Cb 0.13 -1.81 -0.24 0.00 0.03 0.00 0.00 46.19 44.30 3dyo s LEU 776 CO 0.82 0.20 0.10 0.18 0.23 0.00 0.00 176.35 177.88 3dyo n LEU 777 N 0.89 0.00 -3.95 1.79 4.77 0.36 -4.63 117.00 116.22 3dyo n LEU 777 Ca -0.14 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.69 3dyo n LEU 777 Cb 0.52 0.42 -0.14 0.00 -2.33 0.00 0.00 43.42 41.90 3dyo n LEU 777 CO 0.32 0.42 -0.39 0.42 -1.33 0.00 0.00 177.39 176.83 3dyo s THR 778 N -2.53 0.34 0.92 -5.08 -4.23 -1.00 -4.93 115.64 99.13 3dyo s THR 778 Ca -0.09 -0.26 -0.11 0.00 -1.18 0.00 0.00 61.69 60.05 3dyo s THR 778 Cb 0.06 -0.31 0.10 0.00 1.34 0.00 0.00 72.50 73.70 3dyo s THR 778 CO 0.77 0.05 0.86 -2.65 -0.54 0.00 0.00 174.62 173.11 3dyo n PRO 779 N 2.84 -0.34 -2.74 3.99 -0.02 -1.26 -3.11 135.00 134.35 3dyo n PRO 779 Ca -0.14 -0.04 -0.43 0.00 -2.02 0.00 0.00 63.50 60.87 3dyo n PRO 779 Cb 0.58 -2.17 -0.03 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 -4.35 3.90 0.13 2.45 2.96 -0.93 -4.41 118.68 118.42 3dyo s LEU 780 Ca 0.64 0.42 0.05 0.00 -0.22 0.00 0.00 54.13 55.02 3dyo s LEU 780 Cb -0.23 -3.34 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 3dyo s LEU 780 CO 0.61 -1.04 -0.12 -0.13 -1.32 0.00 0.00 176.35 174.35 3dyo s ARG 781 N 3.86 1.01 0.64 1.98 0.52 -0.37 -4.23 118.95 122.36 3dyo s ARG 781 Ca 0.41 -1.29 -0.17 0.00 -0.52 0.00 0.00 55.73 54.16 3dyo s ARG 781 Cb -0.10 -0.77 -0.01 0.00 0.52 0.00 0.00 34.95 34.59 3dyo s ARG 781 CO 0.25 0.13 1.21 -0.51 0.02 0.00 0.00 175.30 176.40 3dyo s ASP 782 N -2.66 4.83 -0.04 0.23 1.11 -1.26 -0.09 116.67 118.79 3dyo s ASP 782 Ca 0.11 2.39 -0.01 0.00 0.18 0.00 0.00 52.55 55.22 3dyo s ASP 782 Cb -0.03 -2.60 0.03 0.00 1.07 0.00 0.00 42.92 41.40 3dyo s ASP 782 CO 0.02 -1.84 0.02 -1.58 1.18 0.00 0.00 175.17 172.98 3dyo s GLN 783 N -3.54 0.17 0.00 8.23 0.74 0.95 -4.75 119.66 121.46 3dyo s GLN 783 Ca 0.77 0.18 0.04 0.00 0.05 0.00 0.00 55.36 56.40 3dyo s GLN 783 Cb -0.31 -0.50 0.08 0.00 1.10 0.00 0.00 33.01 33.38 3dyo s GLN 783 CO 0.38 -0.21 0.86 1.19 -0.55 0.00 0.00 175.29 176.96 3dyo n PHE 784 N 4.57 0.09 -4.43 1.67 3.01 -1.26 -2.25 117.46 118.86 3dyo n PHE 784 Ca -0.18 -0.24 -0.21 0.00 1.01 0.00 0.00 57.45 57.83 3dyo n PHE 784 Cb 0.50 -0.02 -0.11 0.00 -0.01 0.00 0.00 39.48 39.85 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 -0.67 1.23 0.02 4.37 -4.23 -1.26 -2.86 115.64 112.23 3dyo s THR 785 Ca 0.07 -2.02 -0.03 0.00 -1.18 0.00 0.00 61.69 58.52 3dyo s THR 785 Cb 0.04 -2.68 -0.01 0.00 1.34 0.00 0.00 72.50 71.19 3dyo s THR 785 CO 0.06 -0.09 0.05 0.00 -0.54 0.00 0.00 174.62 174.10 3dyo s ARG 786 N -3.86 0.44 -0.13 3.99 1.70 -1.26 -4.78 118.95 115.04 3dyo s ARG 786 Ca 0.34 -0.61 -0.29 0.00 -0.47 0.00 0.00 55.73 54.70 3dyo s ARG 786 Cb 0.08 0.17 -0.05 0.00 -0.57 0.00 0.00 34.95 34.57 3dyo s ARG 786 CO 0.14 -0.09 1.90 0.00 -1.08 0.00 0.00 175.30 176.17 3dyo s ALA 787 N -1.82 3.22 0.28 7.88 0.00 -1.26 -4.86 121.76 125.20 3dyo s ALA 787 Ca -0.12 0.85 -0.30 0.00 0.00 0.00 0.00 51.96 52.38 3dyo s ALA 787 Cb -0.06 -3.91 -0.12 0.00 0.00 0.00 0.00 23.12 19.03 3dyo s ALA 787 CO -0.01 -2.06 1.62 -0.35 0.00 0.00 0.00 175.76 174.96 3dyo n PRO 788 N 7.92 2.74 -1.45 0.00 -0.04 -1.26 -1.64 135.00 141.27 3dyo n PRO 788 Ca 0.22 0.98 -0.29 0.00 -0.04 0.00 0.00 63.50 64.36 3dyo n PRO 788 Cb 0.44 -2.77 0.12 0.00 -0.04 0.00 0.00 33.50 31.24 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 -0.21 2.26 0.48 1.53 1.43 -1.26 -4.64 118.68 118.28 3dyo s LEU 789 Ca 0.66 1.23 0.13 0.00 -1.03 0.00 0.00 54.13 55.11 3dyo s LEU 789 Cb -0.49 -3.68 1.11 0.00 0.03 0.00 0.00 46.19 43.15 3dyo s LEU 789 CO 0.46 -2.38 2.11 0.44 0.23 0.00 0.00 176.35 177.20 3dyo h ASP 790 N -1.37 0.16 0.43 2.29 3.32 -1.87 0.26 116.42 119.64 3dyo h ASP 790 Ca -0.49 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.47 3dyo h ASP 790 Cb 1.30 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 3dyo h ASP 790 CO 0.59 0.13 -0.40 0.78 -1.72 0.00 0.00 179.24 178.62 3dyo h ASN 791 N 0.19 0.00 0.68 6.45 2.35 -1.85 0.77 115.58 124.17 3dyo h ASN 791 Ca 0.05 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.65 3dyo h ASN 791 Cb 0.01 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 3dyo h ASN 791 CO -0.01 0.40 -0.73 0.44 -1.65 0.00 0.00 177.43 175.89 3dyo h ASP 792 N 0.00 0.04 0.03 5.81 3.32 -0.83 -3.33 116.42 121.47 3dyo h ASP 792 Ca -0.00 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 3dyo h ASP 792 Cb 0.73 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.27 3dyo h ASP 792 CO 0.05 0.75 -0.23 0.40 -1.72 0.00 0.00 179.24 178.50 3dyo h ILE 793 N 0.02 1.68 0.00 0.35 2.04 -0.93 -1.41 117.51 119.26 3dyo h ILE 793 Ca -0.01 -2.28 0.00 0.00 1.00 0.00 0.00 64.86 63.57 3dyo h ILE 793 Cb 1.29 3.21 0.00 0.00 -0.74 0.00 0.00 36.82 40.57 3dyo h ILE 793 CO 0.10 0.61 0.00 0.61 0.00 0.00 0.00 178.15 179.47 3dyo n GLY 794 N 1.48 2.86 0.57 5.37 0.00 0.23 -2.40 105.19 113.31 3dyo n GLY 794 Ca -0.11 -0.36 0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 0.11 -1.69 1.61 0.24 -1.26 -4.91 118.33 112.42 3dyo n VAL 795 Ca 0.00 -0.33 -0.42 0.00 -2.04 0.00 0.00 64.34 61.55 3dyo n VAL 795 Cb 0.00 0.53 -0.00 0.00 -1.47 0.00 0.00 33.84 32.89 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 0.36 2.61 -3.98 -1.34 2.88 -1.01 -4.83 113.62 108.31 3dyo n SER 796 Ca 0.18 1.19 -0.09 0.00 -1.33 0.00 0.00 58.87 58.81 3dyo n SER 796 Cb 0.37 -1.47 -0.10 0.00 -0.75 0.00 0.00 64.21 62.26 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 -1.92 0.46 0.29 -1.46 2.02 -0.32 -4.90 118.70 112.88 3dyo s GLU 797 Ca 0.57 -0.77 0.01 0.00 0.02 0.00 0.00 54.97 54.80 3dyo s GLU 797 Cb -0.57 0.17 0.70 0.00 0.10 0.00 0.00 34.13 34.54 3dyo s GLU 797 CO 0.61 -0.09 1.63 0.00 0.02 0.00 0.00 175.26 177.43 3dyo h ALA 798 N 4.02 1.21 -0.00 5.21 0.00 -1.99 0.29 119.26 128.00 3dyo h ALA 798 Ca -0.32 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3dyo h ALA 798 Cb 1.19 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.36 3dyo h ALA 798 CO 0.49 -0.50 -0.31 0.25 0.00 0.00 0.00 179.25 179.18 3dyo n THR 799 N -5.30 0.00 -2.93 0.00 -2.24 -1.26 -4.49 114.28 98.07 3dyo n THR 799 Ca 0.21 -0.02 -0.09 0.00 -2.27 0.00 0.00 64.05 61.89 3dyo n THR 799 Cb 0.69 0.05 -0.02 0.00 -2.10 0.00 0.00 70.33 68.95 3dyo n THR 799 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3dyo s ARG 800 N -2.90 1.01 0.28 -0.78 3.52 -0.01 -5.13 118.95 114.95 3dyo s ARG 800 Ca 0.15 -1.21 -0.29 0.00 -0.13 0.00 0.00 55.73 54.24 3dyo s ARG 800 Cb 0.18 -0.33 -0.10 0.00 -1.56 0.00 0.00 34.95 33.15 3dyo s ARG 800 CO 0.62 -1.33 1.28 0.42 -0.81 0.00 0.00 175.30 175.48 3dyo s ILE 801 N 0.79 2.99 -0.50 4.11 -1.09 -0.60 -1.18 121.20 125.72 3dyo s ILE 801 Ca 0.29 0.93 -0.07 0.00 -2.23 0.00 0.00 60.65 59.58 3dyo s ILE 801 Cb 0.00 -3.59 0.13 0.00 -1.58 0.00 0.00 42.46 37.42 3dyo s ILE 801 CO -0.08 0.19 0.35 -0.62 -1.23 0.00 0.00 174.94 173.55 3dyo s ASP 802 N -0.28 5.56 0.08 3.58 2.15 -1.26 -4.86 116.67 121.64 3dyo s ASP 802 Ca 0.51 -2.17 0.09 0.00 0.43 0.00 0.00 52.55 51.41 3dyo s ASP 802 Cb -0.38 -1.94 0.41 0.00 -0.30 0.00 0.00 42.92 40.71 3dyo s ASP 802 CO 0.46 -0.59 1.26 -0.81 -0.17 0.00 0.00 175.17 175.33 3dyo n PRO 803 N 4.50 0.04 0.11 4.34 -0.04 -1.26 -1.60 135.00 141.09 3dyo n PRO 803 Ca -0.02 0.48 0.12 0.00 -0.04 0.00 0.00 63.50 64.04 3dyo n PRO 803 Cb 0.41 -1.62 0.20 0.00 -0.04 0.00 0.00 33.50 32.45 3dyo n PRO 803 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3dyo h ASN 804 N 0.00 0.00 -3.95 3.54 -1.24 -1.96 -3.37 115.58 108.60 3dyo h ASN 804 Ca 0.00 -0.09 -0.53 0.00 0.71 0.00 0.00 56.30 56.40 3dyo h ASN 804 Cb 0.07 0.00 0.09 0.00 0.73 0.00 0.00 38.32 39.21 3dyo h ASN 804 CO 0.00 0.04 0.64 0.00 -1.29 0.00 0.00 177.43 176.82 3dyo s ALA 805 N -3.19 3.29 0.23 1.57 0.00 -0.63 -4.73 121.76 118.30 3dyo s ALA 805 Ca 0.06 1.30 -0.07 0.00 0.00 0.00 0.00 51.96 53.26 3dyo s ALA 805 Cb 0.11 -3.51 0.41 0.00 0.00 0.00 0.00 23.12 20.12 3dyo s ALA 805 CO 0.69 -0.90 1.69 -1.49 0.00 0.00 0.00 175.76 175.75 3dyo h TRP 806 N 2.67 0.25 -0.37 0.00 4.06 -1.84 -0.43 115.95 120.28 3dyo h TRP 806 Ca -0.50 0.04 -0.02 0.00 2.06 0.00 0.00 58.89 60.47 3dyo h TRP 806 Cb 1.25 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.39 3dyo h TRP 806 CO 0.53 -0.07 0.14 -0.24 -3.56 0.00 0.00 178.44 175.24 3dyo h VAL 807 N 0.27 1.15 -0.30 1.49 3.04 -1.59 -1.67 116.25 118.64 3dyo h VAL 807 Ca 0.38 -0.48 -0.14 0.00 -1.01 0.00 0.00 66.70 65.45 3dyo h VAL 807 Cb 0.63 0.72 -0.01 0.00 -2.01 0.00 0.00 31.29 30.62 3dyo h VAL 807 CO -0.48 0.18 -0.37 -0.33 -1.01 0.00 0.00 177.57 175.57 3dyo h GLU 808 N 0.53 0.68 -0.38 4.17 4.39 -1.44 0.85 114.58 123.38 3dyo h GLU 808 Ca 0.13 -0.34 -0.04 0.00 0.34 0.00 0.00 59.36 59.46 3dyo h GLU 808 Cb 0.13 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3dyo h GLU 808 CO -0.01 0.94 0.10 0.00 -1.16 0.00 0.00 179.01 178.88 3dyo h ARG 809 N 0.57 0.61 -0.34 2.33 3.08 -0.44 0.19 114.38 120.37 3dyo h ARG 809 Ca 0.05 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3dyo h ARG 809 Cb 0.89 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 3dyo h ARG 809 CO 0.08 0.63 0.16 -1.49 -1.07 0.00 0.00 179.97 178.28 3dyo h TRP 810 N 0.47 0.50 0.39 3.04 6.55 -1.18 -0.83 115.95 124.88 3dyo h TRP 810 Ca 0.12 -0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.92 3dyo h TRP 810 Cb 0.29 -0.15 0.00 0.00 -0.86 0.00 0.00 29.16 28.44 3dyo h TRP 810 CO 0.01 0.44 -0.19 0.87 -1.05 0.00 0.00 178.44 178.52 3dyo h LYS 811 N 0.41 -0.51 -0.54 0.49 1.57 -0.66 0.01 116.57 117.35 3dyo h LYS 811 Ca 0.12 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 59.04 3dyo h LYS 811 Cb 0.13 0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 3dyo h LYS 811 CO -0.01 -0.25 0.37 0.00 -0.57 0.00 0.00 179.45 178.99 3dyo h ALA 812 N -0.15 2.14 -0.01 3.86 0.00 -0.58 0.32 119.26 124.84 3dyo h ALA 812 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dyo h ALA 812 Cb 0.49 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3dyo h ALA 812 CO 0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 179.25 179.04 3dyo n ALA 813 N -2.55 2.66 -0.72 0.00 0.00 -0.32 -4.89 120.51 114.69 3dyo n ALA 813 Ca 0.09 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.22 3dyo n ALA 813 Cb 0.41 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 1.13 0.69 0.33 0.00 0.00 0.11 -4.86 105.19 102.59 3dyo n GLY 814 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.25 3dyo n GLY 814 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3dyo h HIS 815 N 0.00 0.98 0.00 1.61 3.86 -1.19 0.13 115.15 120.54 3dyo h HIS 815 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3dyo h HIS 815 Cb 0.00 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.16 3dyo h HIS 815 CO 0.00 0.44 -0.06 1.88 0.86 0.00 0.00 177.93 181.05 3dyo h TYR 816 N 0.92 0.00 -0.01 2.45 -1.99 -1.86 -3.32 116.97 113.16 3dyo h TYR 816 Ca 0.41 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.14 3dyo h TYR 816 Cb 0.32 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.05 3dyo h TYR 816 CO -0.04 0.00 -0.20 0.00 -0.00 0.00 0.00 178.16 177.92 3dyo n GLN 817 N -2.35 1.68 -1.85 4.88 10.64 -0.43 -4.99 117.38 124.97 3dyo n GLN 817 Ca 0.05 -0.82 -0.41 0.00 -1.83 0.00 0.00 57.00 54.00 3dyo n GLN 817 Cb 0.44 -1.18 -0.01 0.00 -0.86 0.00 0.00 30.24 28.64 3dyo n GLN 817 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3dyo s ALA 818 N -1.46 3.57 0.03 2.61 0.00 0.33 -5.01 121.76 121.84 3dyo s ALA 818 Ca 0.11 1.53 0.08 0.00 0.00 0.00 0.00 51.96 53.68 3dyo s ALA 818 Cb 0.10 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 3dyo s ALA 818 CO 0.28 -0.99 -0.23 -1.83 0.00 0.00 0.00 175.76 172.99 3dyo s GLU 819 N -1.94 1.95 0.64 0.00 -1.05 -1.26 -4.91 118.70 112.15 3dyo s GLU 819 Ca 0.53 -1.03 -0.18 0.00 -0.15 0.00 0.00 54.97 54.14 3dyo s GLU 819 Cb -0.46 -2.08 -0.02 0.00 -0.44 0.00 0.00 34.13 31.13 3dyo s GLU 819 CO 0.61 0.53 1.08 0.00 0.95 0.00 0.00 175.26 178.43 3dyo n ALA 820 N 1.77 0.44 -3.73 -0.84 0.00 -1.26 -4.02 120.51 112.87 3dyo n ALA 820 Ca -0.17 -0.04 -0.21 0.00 0.00 0.00 0.00 53.44 53.03 3dyo n ALA 820 Cb 0.52 -2.19 -0.17 0.00 0.00 0.00 0.00 19.45 17.61 3dyo n ALA 820 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyo s ALA 821 N -1.53 0.56 -0.07 0.00 0.00 0.13 -4.94 121.76 115.90 3dyo s ALA 821 Ca 0.78 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.43 3dyo s ALA 821 Cb -0.39 -0.63 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 3dyo s ALA 821 CO 0.45 -0.37 1.44 -1.17 0.00 0.00 0.00 175.76 176.11 3dyo s LEU 822 N 1.77 4.27 -0.20 0.00 2.96 -1.26 -0.88 118.68 125.33 3dyo s LEU 822 Ca 0.01 2.01 0.15 0.00 -0.22 0.00 0.00 54.13 56.09 3dyo s LEU 822 Cb -0.13 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.79 3dyo s LEU 822 CO -0.04 -0.80 0.02 0.18 -1.32 0.00 0.00 176.35 174.39 3dyo n LEU 823 N 6.38 0.46 -3.55 -0.68 4.77 0.91 -4.96 117.00 120.33 3dyo n LEU 823 Ca 0.15 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.97 3dyo n LEU 823 Cb 0.44 0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 41.75 3dyo n LEU 823 CO 0.59 0.55 0.63 -1.58 -1.33 0.00 0.00 177.39 176.25 3dyo s GLN 824 N -2.48 0.81 -0.29 3.23 0.74 -0.71 -4.91 119.66 116.05 3dyo s GLN 824 Ca -0.13 0.17 -0.00 0.00 0.05 0.00 0.00 55.36 55.45 3dyo s GLN 824 Cb 0.06 0.38 0.19 0.00 1.10 0.00 0.00 33.01 34.75 3dyo s GLN 824 CO 0.77 -0.26 0.73 0.00 -0.55 0.00 0.00 175.29 175.98 3dyo s THR 826 N 2.87 1.68 -0.02 0.00 -4.23 -0.06 -4.98 115.64 110.91 3dyo s THR 826 Ca 0.15 -2.14 0.03 0.00 -1.18 0.00 0.00 61.69 58.55 3dyo s THR 826 Cb -0.09 -1.98 -0.01 0.00 1.34 0.00 0.00 72.50 71.77 3dyo s THR 826 CO -0.23 -0.57 -0.11 0.00 -0.54 0.00 0.00 174.62 173.16 3dyo s ALA 827 N -2.86 0.97 -0.02 3.99 0.00 -1.26 -0.45 121.76 122.14 3dyo s ALA 827 Ca 0.21 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.72 3dyo s ALA 827 Cb -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.83 3dyo s ALA 827 CO 0.06 0.21 -0.07 -0.51 0.00 0.00 0.00 175.76 175.45 3dyo s ASP 828 N -0.12 0.95 -0.24 0.00 1.01 0.06 -4.99 116.67 113.33 3dyo s ASP 828 Ca 0.02 -0.14 -0.14 0.00 0.71 0.00 0.00 52.55 52.99 3dyo s ASP 828 Cb -0.06 -0.22 -0.04 0.00 1.01 0.00 0.00 42.92 43.61 3dyo s ASP 828 CO -0.00 0.06 0.33 -0.89 0.21 0.00 0.00 175.17 174.87 3dyo s THR 829 N 0.13 5.23 0.58 -1.27 2.01 -1.26 -0.70 115.64 120.36 3dyo s THR 829 Ca -0.02 0.52 0.08 0.00 0.31 0.00 0.00 61.69 62.58 3dyo s THR 829 Cb -0.07 -3.66 0.08 0.00 0.01 0.00 0.00 72.50 68.86 3dyo s THR 829 CO -0.00 0.24 0.64 -0.76 -0.69 0.00 0.00 174.62 174.06 3dyo s LEU 830 N 1.53 2.86 0.20 4.42 1.43 0.12 -4.99 118.68 124.26 3dyo s LEU 830 Ca 0.14 -1.07 -0.15 0.00 -1.03 0.00 0.00 54.13 52.03 3dyo s LEU 830 Cb -0.15 -1.34 0.20 0.00 0.03 0.00 0.00 46.19 44.94 3dyo s LEU 830 CO 0.08 -1.31 1.63 0.00 0.23 0.00 0.00 176.35 176.98 3dyo h ALA 831 N 0.37 0.36 -0.11 4.21 0.00 -2.01 -3.23 119.26 118.85 3dyo h ALA 831 Ca -0.32 0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 3dyo h ALA 831 Cb 1.30 0.47 -0.34 0.00 0.00 0.00 0.00 17.79 19.22 3dyo h ALA 831 CO 0.47 -0.45 -0.89 -0.40 0.00 0.00 0.00 179.25 177.99 3dyo n ASP 832 N -5.41 0.66 -3.76 0.00 5.75 -1.26 -4.97 116.55 107.57 3dyo n ASP 832 Ca 0.06 -2.02 -0.06 0.00 -0.01 0.00 0.00 54.79 52.76 3dyo n ASP 832 Cb 0.31 -0.18 -0.02 0.00 -1.03 0.00 0.00 41.12 40.20 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 -0.94 -1.46 -0.07 2.12 0.00 -1.22 -2.06 121.76 118.12 3dyo s ALA 833 Ca 0.25 0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.26 3dyo s ALA 833 Cb 0.32 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 24.16 3dyo s ALA 833 CO -0.11 -0.99 -0.17 0.08 0.00 0.00 0.00 175.76 174.57 3dyo s VAL 834 N -3.61 2.77 -0.22 0.00 1.01 -0.75 0.14 120.40 119.74 3dyo s VAL 834 Ca 0.10 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 3dyo s VAL 834 Cb -0.03 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.27 3dyo s VAL 834 CO 0.02 0.57 -0.09 -0.22 0.00 0.00 0.00 175.10 175.38 3dyo s LEU 835 N -0.27 2.83 -0.17 3.92 2.96 0.13 -1.24 118.68 126.84 3dyo s LEU 835 Ca 0.01 -0.67 -0.07 0.00 -0.22 0.00 0.00 54.13 53.17 3dyo s LEU 835 Cb -0.13 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.88 3dyo s LEU 835 CO 0.03 -0.06 0.08 -0.63 -1.32 0.00 0.00 176.35 174.45 3dyo s ILE 836 N 1.36 4.97 -0.08 6.68 -1.09 0.09 -0.76 121.20 132.37 3dyo s ILE 836 Ca 0.03 0.03 0.04 0.00 -2.23 0.00 0.00 60.65 58.52 3dyo s ILE 836 Cb -0.15 -3.23 -0.00 0.00 -1.58 0.00 0.00 42.46 37.50 3dyo s ILE 836 CO -0.06 0.49 -0.22 -0.89 -1.23 0.00 0.00 174.94 173.02 3dyo s THR 837 N 0.09 1.87 0.11 2.92 2.01 0.41 -0.52 115.64 122.54 3dyo s THR 837 Ca 0.06 -0.93 0.03 0.00 0.31 0.00 0.00 61.69 61.16 3dyo s THR 837 Cb -0.12 -1.62 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 3dyo s THR 837 CO 0.00 0.52 -0.09 0.42 -0.69 0.00 0.00 174.62 174.79 3dyo s THR 838 N 0.23 0.91 -0.10 -0.82 -4.23 -0.52 -0.88 115.64 110.24 3dyo s THR 838 Ca -0.13 -1.86 -0.07 0.00 -1.18 0.00 0.00 61.69 58.45 3dyo s THR 838 Cb -0.16 -1.60 0.03 0.00 1.34 0.00 0.00 72.50 72.11 3dyo s THR 838 CO 0.06 -0.72 0.24 0.00 -0.54 0.00 0.00 174.62 173.66 3dyo s ALA 839 N -3.10 -0.56 0.05 3.99 0.00 -0.61 -0.68 121.76 120.84 3dyo s ALA 839 Ca 0.11 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.90 3dyo s ALA 839 Cb 0.01 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 3dyo s ALA 839 CO -0.02 -0.15 -0.06 -1.01 0.00 0.00 0.00 175.76 174.53 3dyo s HIS 840 N 0.70 0.59 -0.01 0.00 3.76 -0.43 -0.07 115.29 119.83 3dyo s HIS 840 Ca -0.05 -0.69 0.03 0.00 -0.15 0.00 0.00 55.06 54.20 3dyo s HIS 840 Cb -0.06 -0.37 -0.01 0.00 1.11 0.00 0.00 32.58 33.25 3dyo s HIS 840 CO -0.04 -0.17 -0.10 0.00 -0.85 0.00 0.00 174.74 173.57 3dyo s ALA 841 N -2.30 0.85 -0.15 -1.40 0.00 -0.06 -0.52 121.76 118.18 3dyo s ALA 841 Ca -0.04 -0.43 -0.01 0.00 0.00 0.00 0.00 51.96 51.48 3dyo s ALA 841 Cb -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 3dyo s ALA 841 CO -0.03 0.20 -0.11 -1.58 0.00 0.00 0.00 175.76 174.24 3dyo s TRP 842 N -0.19 2.86 0.12 0.00 0.51 -0.77 0.17 118.94 121.63 3dyo s TRP 842 Ca 0.03 -0.74 0.03 0.00 -2.12 0.00 0.00 56.10 53.30 3dyo s TRP 842 Cb -0.04 -1.91 -0.04 0.00 -0.81 0.00 0.00 33.47 30.66 3dyo s TRP 842 CO -0.00 -0.30 -0.07 -0.65 -0.51 0.00 0.00 176.95 175.41 3dyo s GLN 843 N 0.64 0.93 -0.07 4.98 -0.21 -1.26 -0.95 119.66 123.72 3dyo s GLN 843 Ca -0.06 -1.39 -0.03 0.00 0.02 0.00 0.00 55.36 53.90 3dyo s GLN 843 Cb -0.15 -0.34 0.04 0.00 1.00 0.00 0.00 33.01 33.55 3dyo s GLN 843 CO 0.03 0.00 0.13 -1.58 -2.12 0.00 0.00 175.29 171.75 3dyo s HIS 844 N -3.53 -0.14 -1.62 0.91 2.46 0.23 -4.24 115.29 109.36 3dyo s HIS 844 Ca 0.14 0.48 -0.16 0.00 0.47 0.00 0.00 55.06 55.99 3dyo s HIS 844 Cb 0.04 -0.18 0.12 0.00 -0.13 0.00 0.00 32.58 32.44 3dyo s HIS 844 CO -0.02 -0.20 0.84 1.04 -2.47 0.00 0.00 174.74 173.93 3dyo n GLN 845 N 4.64 -4.06 -0.69 2.88 1.13 -1.26 0.14 117.38 120.16 3dyo n GLN 845 Ca -0.18 0.46 0.00 0.00 -1.94 0.00 0.00 57.00 55.34 3dyo n GLN 845 Cb 0.51 -5.21 0.00 0.00 0.11 0.00 0.00 30.24 25.64 3dyo n GLN 845 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dyo n GLY 846 N -1.54 0.92 3.67 1.08 0.00 -1.26 -5.02 105.19 103.04 3dyo n GLY 846 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.27 4.03 -0.36 1.61 2.47 0.12 -5.05 119.74 122.29 3dyo s LYS 847 Ca 0.00 -0.30 -0.24 0.00 -1.56 0.00 0.00 55.97 53.87 3dyo s LYS 847 Cb 0.00 -3.27 0.01 0.00 -1.46 0.00 0.00 37.83 33.11 3dyo s LYS 847 CO 0.00 0.29 0.83 0.99 0.16 0.00 0.00 175.35 177.62 3dyo s THR 848 N 0.34 4.69 -0.10 3.43 2.01 -1.26 0.74 115.64 125.48 3dyo s THR 848 Ca 0.05 1.01 -0.21 0.00 0.31 0.00 0.00 61.69 62.84 3dyo s THR 848 Cb -0.12 -4.25 -0.27 0.00 0.01 0.00 0.00 72.50 67.87 3dyo s THR 848 CO -0.01 -0.46 0.68 -0.07 -0.69 0.00 0.00 174.62 174.08 3dyo h LEU 849 N 9.83 0.29 -7.75 4.42 3.38 -1.41 -3.42 115.31 120.65 3dyo h LEU 849 Ca -0.24 -0.88 -0.13 0.00 0.09 0.00 0.00 57.88 56.72 3dyo h LEU 849 Cb 1.09 -0.09 -0.19 0.00 0.09 0.00 0.00 40.66 41.55 3dyo h LEU 849 CO 0.93 1.39 -0.45 -0.36 0.09 0.00 0.00 178.44 180.05 3dyo s PHE 850 N -2.39 0.06 -0.05 1.13 0.40 -1.20 -0.95 117.98 114.97 3dyo s PHE 850 Ca -0.18 -0.21 0.03 0.00 -0.60 0.00 0.00 56.93 55.96 3dyo s PHE 850 Cb 0.02 -0.05 0.01 0.00 0.51 0.00 0.00 43.02 43.51 3dyo s PHE 850 CO 0.75 -0.35 -0.12 0.42 0.70 0.00 0.00 175.22 176.62 3dyo s ILE 851 N -1.94 1.11 -0.21 0.64 1.01 -0.05 -1.85 121.20 119.91 3dyo s ILE 851 Ca -0.10 -0.49 -0.00 0.00 0.00 0.00 0.00 60.65 60.05 3dyo s ILE 851 Cb -0.04 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.44 3dyo s ILE 851 CO -0.01 0.34 -0.14 -0.55 0.00 0.00 0.00 174.94 174.59 3dyo s SER 852 N 0.49 3.68 -0.11 3.58 0.15 0.32 -0.46 113.70 121.35 3dyo s SER 852 Ca -0.11 -0.69 -0.01 0.00 0.70 0.00 0.00 55.95 55.84 3dyo s SER 852 Cb -0.14 -1.57 -0.03 0.00 -1.71 0.00 0.00 66.02 62.57 3dyo s SER 852 CO 0.03 -0.04 -0.08 -0.13 1.20 0.00 0.00 173.24 174.22 3dyo s ARG 853 N 1.32 3.16 0.13 5.44 0.52 -0.29 -1.32 118.95 127.91 3dyo s ARG 853 Ca 0.03 -0.58 -0.00 0.00 -0.52 0.00 0.00 55.73 54.66 3dyo s ARG 853 Cb -0.14 -2.69 -0.04 0.00 0.52 0.00 0.00 34.95 32.60 3dyo s ARG 853 CO -0.09 0.44 0.03 0.15 0.02 0.00 0.00 175.30 175.85 3dyo s LYS 854 N -0.20 0.91 0.01 3.54 1.02 0.15 -1.40 119.74 123.77 3dyo s LYS 854 Ca 0.02 -1.42 0.02 0.00 0.02 0.00 0.00 55.97 54.61 3dyo s LYS 854 Cb -0.13 0.14 -0.01 0.00 -0.52 0.00 0.00 37.83 37.31 3dyo s LYS 854 CO 0.03 -0.21 -0.07 0.95 -0.92 0.00 0.00 175.35 175.12 3dyo s THR 855 N -3.95 0.56 -0.14 2.17 -4.23 -0.61 -1.43 115.64 108.00 3dyo s THR 855 Ca 0.21 -0.53 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 3dyo s THR 855 Cb 0.07 -0.52 0.02 0.00 1.34 0.00 0.00 72.50 73.42 3dyo s THR 855 CO 0.00 -0.00 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.65 3dyo s TYR 856 N -0.52 1.96 -0.25 3.99 1.51 0.32 -0.72 117.35 123.64 3dyo s TYR 856 Ca -0.01 -1.06 0.00 0.00 -1.01 0.00 0.00 57.07 54.99 3dyo s TYR 856 Cb -0.05 -1.48 0.04 0.00 -0.11 0.00 0.00 41.96 40.36 3dyo s TYR 856 CO 0.00 -0.61 -0.08 0.50 -1.11 0.00 0.00 175.55 174.24 3dyo s ARG 857 N 1.52 2.60 -0.30 -0.62 3.52 0.10 -0.73 118.95 125.03 3dyo s ARG 857 Ca 0.04 -1.12 -0.12 0.00 -0.13 0.00 0.00 55.73 54.40 3dyo s ARG 857 Cb -0.13 -2.93 -0.04 0.00 -1.56 0.00 0.00 34.95 30.29 3dyo s ARG 857 CO -0.09 -0.47 0.20 0.42 -0.81 0.00 0.00 175.30 174.55 3dyo s ILE 858 N 1.24 5.25 0.55 4.11 1.01 -0.37 -1.48 121.20 131.51 3dyo s ILE 858 Ca -0.03 0.00 0.07 0.00 0.00 0.00 0.00 60.65 60.69 3dyo s ILE 858 Cb -0.18 -3.58 0.05 0.00 0.01 0.00 0.00 42.46 38.77 3dyo s ILE 858 CO -0.05 0.15 0.51 1.51 0.00 0.00 0.00 174.94 177.06 3dyo s ASP 859 N 1.74 4.76 0.46 3.58 -4.77 -0.90 -1.80 116.67 119.74 3dyo s ASP 859 Ca 0.07 -1.13 0.26 0.00 -3.30 0.00 0.00 52.55 48.44 3dyo s ASP 859 Cb -0.17 0.38 1.43 0.00 -1.09 0.00 0.00 42.92 43.47 3dyo s ASP 859 CO 0.10 -1.17 1.78 1.23 0.70 0.00 0.00 175.17 177.82 3dyo h GLY 860 N 0.60 0.00 -2.52 2.12 0.00 -1.58 0.27 103.07 101.96 3dyo h GLY 860 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 3dyo h GLY 860 CO 0.53 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.93 3dyo n SER 861 N -2.50 3.69 0.00 0.19 3.41 -1.26 -4.67 113.62 112.47 3dyo n SER 861 Ca -0.02 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.54 3dyo n SER 861 Cb 0.17 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 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 1.50 0.57 3.83 5.00 0.00 0.95 -4.99 105.19 112.04 3dyo n GLY 862 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.44 4.16 -0.28 1.61 -0.21 -1.25 -4.74 119.66 118.50 3dyo s GLN 863 Ca 0.00 0.81 0.01 0.00 0.02 0.00 0.00 55.36 56.20 3dyo s GLN 863 Cb 0.00 -2.66 0.05 0.00 1.00 0.00 0.00 33.01 31.40 3dyo s GLN 863 CO 0.00 0.28 -0.06 1.41 -2.12 0.00 0.00 175.29 174.80 3dyo s MET 864 N -2.44 2.36 -0.26 2.91 -2.45 0.33 -2.11 119.30 117.63 3dyo s MET 864 Ca 0.49 -1.29 -0.20 0.00 -1.25 0.00 0.00 55.69 53.44 3dyo s MET 864 Cb -0.14 -3.03 -0.02 0.00 1.25 0.00 0.00 34.83 32.89 3dyo s MET 864 CO 0.19 -0.58 0.60 0.00 1.05 0.00 0.00 175.02 176.28 3dyo s ALA 865 N 1.18 3.60 -0.25 4.11 0.00 -0.55 -0.51 121.76 129.35 3dyo s ALA 865 Ca -0.07 -0.50 -0.05 0.00 0.00 0.00 0.00 51.96 51.34 3dyo s ALA 865 Cb -0.20 -3.00 -0.00 0.00 0.00 0.00 0.00 23.12 19.92 3dyo s ALA 865 CO -0.03 -0.81 0.01 0.42 0.00 0.00 0.00 175.76 175.34 3dyo s ILE 866 N 2.46 3.66 -0.18 0.00 1.01 0.58 0.01 121.20 128.74 3dyo s ILE 866 Ca 0.25 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.32 3dyo s ILE 866 Cb -0.15 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 3dyo s ILE 866 CO 0.09 0.30 -0.01 -0.89 0.00 0.00 0.00 174.94 174.43 3dyo s THR 867 N 1.50 4.00 -0.06 2.92 2.01 0.10 -0.95 115.64 125.16 3dyo s THR 867 Ca 0.05 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 61.78 3dyo s THR 867 Cb -0.15 -2.78 -0.00 0.00 0.01 0.00 0.00 72.50 69.57 3dyo s THR 867 CO -0.01 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.50 3dyo s VAL 868 N 0.67 1.60 -0.13 3.82 1.01 -0.19 -1.58 120.40 125.62 3dyo s VAL 868 Ca -0.01 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 3dyo s VAL 868 Cb -0.14 -1.38 0.04 0.00 0.00 0.00 0.00 36.38 34.90 3dyo s VAL 868 CO 0.02 0.46 0.02 -1.81 0.00 0.00 0.00 175.10 173.79 3dyo s ASP 869 N 0.10 2.14 0.04 3.32 1.01 -0.49 -0.76 116.67 122.04 3dyo s ASP 869 Ca -0.07 -0.40 0.07 0.00 0.71 0.00 0.00 52.55 52.85 3dyo s ASP 869 Cb -0.13 -0.48 -0.03 0.00 1.01 0.00 0.00 42.92 43.28 3dyo s ASP 869 CO 0.03 -0.25 -0.15 -0.69 0.21 0.00 0.00 175.17 174.32 3dyo s VAL 870 N 1.94 2.98 -0.09 -1.27 1.01 0.64 -1.14 120.40 124.47 3dyo s VAL 870 Ca 0.03 -1.14 0.02 0.00 0.00 0.00 0.00 61.98 60.89 3dyo s VAL 870 Cb -0.14 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 3dyo s VAL 870 CO -0.07 0.32 -0.15 -1.61 0.00 0.00 0.00 175.10 173.59 3dyo s GLU 871 N -1.53 2.92 -0.12 2.72 2.02 0.39 -1.22 118.70 123.88 3dyo s GLU 871 Ca 0.16 -0.72 0.02 0.00 0.02 0.00 0.00 54.97 54.45 3dyo s GLU 871 Cb -0.11 -2.47 0.01 0.00 0.10 0.00 0.00 34.13 31.67 3dyo s GLU 871 CO 0.07 0.40 -0.18 0.08 0.02 0.00 0.00 175.26 175.65 3dyo s VAL 872 N -0.16 1.71 0.13 2.63 1.01 0.19 -0.87 120.40 125.04 3dyo s VAL 872 Ca -0.01 -0.77 -0.35 0.00 0.00 0.00 0.00 61.98 60.85 3dyo s VAL 872 Cb -0.14 -1.54 -0.15 0.00 0.00 0.00 0.00 36.38 34.55 3dyo s VAL 872 CO 0.03 0.48 1.50 0.00 0.00 0.00 0.00 175.10 177.12 3dyo n ALA 873 N 4.18 0.53 0.25 5.51 0.00 -0.13 -4.57 120.51 126.29 3dyo n ALA 873 Ca -0.19 0.47 0.15 0.00 0.00 0.00 0.00 53.44 53.87 3dyo n ALA 873 Cb 0.51 -2.26 0.86 0.00 0.00 0.00 0.00 19.45 18.57 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 5.49 0.00 -0.64 0.00 4.64 -1.93 -1.53 113.55 119.59 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 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3dyo h SER 874 CO 0.85 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.91 3dyo n ASP 875 N -3.89 4.27 -4.93 4.97 5.75 -1.26 -4.90 116.55 116.57 3dyo n ASP 875 Ca -0.01 -2.26 -0.28 0.00 -0.01 0.00 0.00 54.79 52.22 3dyo n ASP 875 Cb 0.19 -0.51 -0.04 0.00 -1.03 0.00 0.00 41.12 39.73 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 -1.50 5.30 0.31 2.12 -1.32 -0.58 -5.05 115.64 114.93 3dyo s THR 876 Ca 0.47 -0.44 -0.28 0.00 -1.21 0.00 0.00 61.69 60.23 3dyo s THR 876 Cb 0.28 -3.69 -0.13 0.00 -1.51 0.00 0.00 72.50 67.45 3dyo s THR 876 CO 0.26 -0.03 1.19 -2.65 -2.21 0.00 0.00 174.62 171.18 3dyo n PRO 877 N -0.25 1.79 -1.73 7.08 -0.02 -1.26 -4.84 135.00 135.76 3dyo n PRO 877 Ca -0.05 0.63 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 3dyo n PRO 877 Cb 0.53 -2.13 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 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 0.47 2.82 -1.77 6.00 8.25 -1.26 -4.93 115.22 124.80 3dyo n HIS 878 Ca 0.08 0.14 -0.32 0.00 -0.26 0.00 0.00 57.72 57.36 3dyo n HIS 878 Cb 0.34 -2.64 0.04 0.00 1.12 0.00 0.00 29.99 28.84 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 0.34 3.00 0.36 -0.41 0.04 -1.26 -4.85 135.00 132.22 3dyo s PRO 879 Ca 0.70 1.16 0.08 0.00 0.04 0.00 0.00 61.00 62.97 3dyo s PRO 879 Cb -0.50 -1.99 0.70 0.00 0.04 0.00 0.00 34.50 32.75 3dyo s PRO 879 CO 0.40 -1.06 1.87 0.00 0.04 0.00 0.00 177.00 178.26 3dyo h ALA 880 N -0.14 1.42 -2.66 8.56 0.00 -1.88 -3.40 119.26 121.16 3dyo h ALA 880 Ca -0.46 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.30 3dyo h ALA 880 Cb 1.22 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 3dyo h ALA 880 CO 0.56 0.40 0.35 -0.98 0.00 0.00 0.00 179.25 179.59 3dyo s ARG 881 N -4.69 1.25 -0.30 0.00 1.70 -1.20 -0.61 118.95 115.10 3dyo s ARG 881 Ca -0.06 -0.58 -0.02 0.00 -0.47 0.00 0.00 55.73 54.60 3dyo s ARG 881 Cb 0.15 0.50 0.10 0.00 -0.57 0.00 0.00 34.95 35.13 3dyo s ARG 881 CO 0.74 -0.56 0.11 0.42 -1.08 0.00 0.00 175.30 174.93 3dyo s ILE 882 N -3.51 0.54 0.00 4.99 1.01 -0.17 -4.07 121.20 119.99 3dyo s ILE 882 Ca 0.07 -1.17 0.00 0.00 0.00 0.00 0.00 60.65 59.55 3dyo s ILE 882 Cb -0.02 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 41.03 3dyo s ILE 882 CO -0.04 -0.69 0.00 0.61 0.00 0.00 0.00 174.94 174.82 3dyo n GLY 883 N 4.99 2.48 3.26 6.18 0.00 -0.96 0.14 105.19 121.28 3dyo n GLY 883 Ca -0.03 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 45.03 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 2.50 0.08 0.99 1.43 -0.27 -0.04 118.68 123.37 3dyo s LEU 884 Ca 0.00 -0.96 -0.10 0.00 -1.03 0.00 0.00 54.13 52.05 3dyo s LEU 884 Cb 0.00 -0.45 0.00 0.00 0.03 0.00 0.00 46.19 45.78 3dyo s LEU 884 CO 0.00 -0.26 0.21 0.54 0.23 0.00 0.00 176.35 177.08 3dyo s ASN 885 N -2.99 0.06 0.23 2.29 4.22 0.87 -1.08 114.94 118.54 3dyo s ASN 885 Ca 0.15 -0.54 -0.21 0.00 -2.14 0.00 0.00 52.86 50.11 3dyo s ASN 885 Cb -0.00 0.34 0.04 0.00 1.28 0.00 0.00 41.25 42.91 3dyo s ASN 885 CO 0.02 -0.70 0.65 0.00 -2.04 0.00 0.00 177.10 175.04 3dyo s GLN 887 N -3.85 2.56 0.34 0.00 0.74 -1.18 -1.85 119.66 116.43 3dyo s GLN 887 Ca 0.07 -1.20 -0.27 0.00 0.05 0.00 0.00 55.36 54.01 3dyo s GLN 887 Cb -0.04 -3.36 -0.09 0.00 1.10 0.00 0.00 33.01 30.62 3dyo s GLN 887 CO -0.01 -0.64 1.09 -0.51 -0.55 0.00 0.00 175.29 174.67 3dyo s LEU 888 N 1.35 4.34 0.30 3.68 1.43 0.11 0.14 118.68 130.03 3dyo s LEU 888 Ca -0.03 2.20 0.02 0.00 -1.03 0.00 0.00 54.13 55.29 3dyo s LEU 888 Cb -0.20 -3.90 0.47 0.00 0.03 0.00 0.00 46.19 42.60 3dyo s LEU 888 CO 0.02 -0.37 1.81 0.00 0.23 0.00 0.00 176.35 178.04 3dyo h ALA 889 N 3.13 1.23 -2.32 4.21 0.00 -0.32 -1.37 119.26 123.82 3dyo h ALA 889 Ca -0.48 -0.24 -0.50 0.00 0.00 0.00 0.00 54.91 53.69 3dyo h ALA 889 Cb 1.22 -0.16 0.04 0.00 0.00 0.00 0.00 17.79 18.89 3dyo h ALA 889 CO 0.64 0.51 0.23 1.14 0.00 0.00 0.00 179.25 181.77 3dyo s GLN 890 N -4.91 3.56 -0.27 0.00 -2.07 -1.26 -4.18 119.66 110.53 3dyo s GLN 890 Ca -0.08 0.41 -0.00 0.00 -1.82 0.00 0.00 55.36 53.87 3dyo s GLN 890 Cb 0.15 -2.26 0.08 0.00 -1.09 0.00 0.00 33.01 29.89 3dyo s GLN 890 CO 0.79 -0.35 0.04 0.08 -1.32 0.00 0.00 175.29 174.53 3dyo s VAL 891 N -2.91 1.09 0.30 3.63 1.01 -1.26 -3.02 120.40 119.23 3dyo s VAL 891 Ca 0.50 -1.25 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3dyo s VAL 891 Cb -0.11 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 3dyo s VAL 891 CO 0.48 -0.42 0.36 0.00 0.00 0.00 0.00 175.10 175.53 3dyo s ALA 892 N 1.55 3.97 0.13 5.51 0.00 -1.26 -5.03 121.76 126.64 3dyo s ALA 892 Ca 0.03 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.57 3dyo s ALA 892 Cb -0.18 -1.53 -0.11 0.00 0.00 0.00 0.00 23.12 21.30 3dyo s ALA 892 CO -0.15 0.10 1.30 0.93 0.00 0.00 0.00 175.76 177.93 3dyo h GLU 893 N 1.13 0.23 -6.02 0.00 5.08 -2.01 -3.44 114.58 109.55 3dyo h GLU 893 Ca -0.48 -0.29 -0.54 0.00 -1.00 0.00 0.00 59.36 57.05 3dyo h GLU 893 Cb 1.25 0.09 -0.17 0.00 0.50 0.00 0.00 28.75 30.42 3dyo h GLU 893 CO 0.57 1.05 -0.78 1.03 -1.00 0.00 0.00 179.01 179.89 3dyo s ARG 894 N -3.02 1.39 -0.15 2.33 1.81 -1.26 -0.97 118.95 119.08 3dyo s ARG 894 Ca -0.03 -1.52 0.01 0.00 -1.72 0.00 0.00 55.73 52.48 3dyo s ARG 894 Cb 0.09 -1.45 0.02 0.00 -0.45 0.00 0.00 34.95 33.16 3dyo s ARG 894 CO 0.85 0.29 -0.18 0.08 -0.68 0.00 0.00 175.30 175.65 3dyo s VAL 895 N -2.22 1.83 -0.07 3.52 1.01 0.37 -4.49 120.40 120.36 3dyo s VAL 895 Ca 0.20 -0.82 0.05 0.00 0.00 0.00 0.00 61.98 61.41 3dyo s VAL 895 Cb -0.05 -1.67 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 3dyo s VAL 895 CO 0.08 0.50 -0.22 0.21 0.00 0.00 0.00 175.10 175.68 3dyo s ASN 896 N 1.18 2.75 0.04 3.32 3.84 -1.03 -1.62 114.94 123.42 3dyo s ASN 896 Ca 0.00 -0.47 -0.16 0.00 0.21 0.00 0.00 52.86 52.44 3dyo s ASN 896 Cb -0.14 -0.93 0.03 0.00 -0.55 0.00 0.00 41.25 39.66 3dyo s ASN 896 CO -0.08 0.18 0.35 -1.66 -2.79 0.00 0.00 177.10 173.11 3dyo s TRP 897 N 0.08 -0.18 -0.39 0.43 -2.14 -0.14 0.02 118.94 116.62 3dyo s TRP 897 Ca -0.09 0.09 -0.06 0.00 2.66 0.00 0.00 56.10 58.71 3dyo s TRP 897 Cb -0.14 0.15 0.08 0.00 -3.10 0.00 0.00 33.47 30.46 3dyo s TRP 897 CO 0.05 -0.53 0.19 -1.17 -2.66 0.00 0.00 176.95 172.82 3dyo s LEU 898 N -2.02 4.92 0.00 -4.66 2.96 -0.19 -0.09 118.68 119.60 3dyo s LEU 898 Ca -0.05 -1.62 0.00 0.00 -0.22 0.00 0.00 54.13 52.24 3dyo s LEU 898 Cb -0.01 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.80 3dyo s LEU 898 CO -0.03 -0.48 0.00 0.61 -1.32 0.00 0.00 176.35 175.13 3dyo n GLY 899 N 4.75 -0.69 3.74 7.98 0.00 -0.73 -0.88 105.19 119.36 3dyo n GLY 899 Ca -0.08 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 44.67 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 4.47 0.00 0.99 1.43 -0.79 -1.87 118.68 122.91 3dyo s LEU 900 Ca 0.00 2.07 0.00 0.00 -1.03 0.00 0.00 54.13 55.17 3dyo s LEU 900 Cb 0.00 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.62 3dyo s LEU 900 CO 0.00 -0.25 0.00 0.61 0.23 0.00 0.00 176.35 176.94 3dyo n GLY 901 N 2.17 -0.68 0.10 -3.19 0.00 -0.91 -4.42 105.19 98.26 3dyo n GLY 901 Ca 0.03 -0.74 0.13 0.00 0.00 0.00 0.00 46.02 45.44 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 0.19 132.00 124.66 3dyo h PRO 902 Ca 0.00 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.67 3dyo h PRO 902 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 3dyo h PRO 902 CO 0.00 0.00 0.25 -0.65 -0.23 0.00 0.00 178.00 177.37 3dyo s GLN 903 N -3.13 2.19 0.26 0.86 -0.21 -1.26 -5.00 119.66 113.37 3dyo s GLN 903 Ca 0.09 -0.19 -0.30 0.00 0.02 0.00 0.00 55.36 54.98 3dyo s GLN 903 Cb 0.12 -2.14 -0.14 0.00 1.00 0.00 0.00 33.01 31.86 3dyo s GLN 903 CO 0.63 -1.27 1.31 -1.91 -2.12 0.00 0.00 175.29 171.93 3dyo n GLU 904 N -2.97 1.86 -3.72 2.91 2.13 -1.26 -4.90 120.64 114.70 3dyo n GLU 904 Ca 0.08 0.66 -0.14 0.00 0.66 0.00 0.00 57.16 58.42 3dyo n GLU 904 Cb 0.60 -2.25 -0.09 0.00 0.27 0.00 0.00 31.44 29.97 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 0.03 -0.43 0.34 4.31 2.20 0.75 -4.90 114.94 117.24 3dyo s ASN 905 Ca 0.65 0.74 0.10 0.00 -0.94 0.00 0.00 52.86 53.41 3dyo s ASN 905 Cb -0.66 0.78 -0.06 0.00 -2.00 0.00 0.00 41.25 39.30 3dyo s ASN 905 CO 0.54 -0.23 -0.10 -0.31 -2.94 0.00 0.00 177.10 174.06 3dyo s TYR 906 N -0.12 2.40 0.30 1.54 1.51 -0.79 -3.82 117.35 118.38 3dyo s TYR 906 Ca -0.03 -0.49 0.04 0.00 -1.01 0.00 0.00 57.07 55.58 3dyo s TYR 906 Cb -0.03 -1.36 0.64 0.00 -0.11 0.00 0.00 41.96 41.09 3dyo s TYR 906 CO 0.02 0.59 1.85 -1.35 -1.11 0.00 0.00 175.55 175.55 3dyo h PRO 907 N 2.03 0.88 -0.65 -1.71 0.11 -1.85 0.10 132.00 130.92 3dyo h PRO 907 Ca -0.42 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3dyo h PRO 907 Cb 1.25 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3dyo h PRO 907 CO 0.70 0.58 0.00 -0.40 -0.21 0.00 0.00 178.00 178.67 3dyo n ASP 908 N -4.60 5.02 -3.05 -2.05 5.75 -1.26 -4.30 116.55 112.07 3dyo n ASP 908 Ca 0.18 -2.56 -0.15 0.00 -0.01 0.00 0.00 54.79 52.25 3dyo n ASP 908 Cb 0.39 -0.61 0.01 0.00 -1.03 0.00 0.00 41.12 39.87 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 1.03 0.99 -0.07 0.11 0.63 0.31 -0.08 116.66 119.58 3dyo n ARG 909 Ca 0.26 -2.96 0.01 0.00 -0.92 0.00 0.00 57.85 54.24 3dyo n ARG 909 Cb 0.97 -1.49 0.01 0.00 0.45 0.00 0.00 32.46 32.40 3dyo n ARG 909 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 3dyo n LEU 910 N 0.28 0.70 0.12 6.15 -0.00 -0.90 -1.88 117.00 121.47 3dyo n LEU 910 Ca 0.19 -0.88 -0.02 0.00 -0.00 0.00 0.00 56.01 55.30 3dyo n LEU 910 Cb 0.68 -0.03 0.21 0.00 -0.00 0.00 0.00 43.42 44.28 3dyo n LEU 910 CO 0.16 0.22 0.59 0.71 -0.00 0.00 0.00 177.39 179.07 3dyo h THR 911 N 2.49 1.34 0.00 1.47 1.35 -1.92 -2.63 112.91 115.02 3dyo h THR 911 Ca 0.00 -1.69 -0.08 0.00 -0.55 0.00 0.00 66.41 64.09 3dyo h THR 911 Cb 0.91 1.84 -0.01 0.00 -1.73 0.00 0.00 68.15 69.16 3dyo h THR 911 CO 0.00 0.50 -0.40 0.00 -0.25 0.00 0.00 175.52 175.36 3dyo h ALA 912 N 1.38 1.14 -2.74 6.62 0.00 -1.88 -3.45 119.26 120.33 3dyo h ALA 912 Ca 0.00 -0.37 -0.51 0.00 0.00 0.00 0.00 54.91 54.04 3dyo h ALA 912 Cb 0.90 -0.06 0.07 0.00 0.00 0.00 0.00 17.79 18.70 3dyo h ALA 912 CO 0.07 0.50 0.51 0.00 0.00 0.00 0.00 179.25 180.33 3dyo s ALA 913 N -3.85 3.04 0.05 0.00 0.00 -0.99 -4.99 121.76 115.01 3dyo s ALA 913 Ca -0.01 0.99 0.06 0.00 0.00 0.00 0.00 51.96 53.00 3dyo s ALA 913 Cb 0.13 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 3dyo s ALA 913 CO 0.70 -0.68 -0.13 0.00 0.00 0.00 0.00 175.76 175.65 3dyo s PHE 915 N -1.01 3.45 0.01 0.00 5.36 -1.26 -2.14 117.98 122.38 3dyo s PHE 915 Ca 0.17 1.55 -0.02 0.00 -0.96 0.00 0.00 56.93 57.67 3dyo s PHE 915 Cb -0.11 -3.22 0.01 0.00 -0.34 0.00 0.00 43.02 39.36 3dyo s PHE 915 CO 0.08 -0.32 0.07 -3.47 -1.46 0.00 0.00 175.22 170.12 3dyo n ASP 916 N 5.48 -0.09 -4.61 6.13 -0.08 -0.78 -4.92 116.55 117.68 3dyo n ASP 916 Ca 0.10 -1.04 -0.37 0.00 -1.51 0.00 0.00 54.79 51.98 3dyo n ASP 916 Cb 0.48 0.15 -0.10 0.00 2.34 0.00 0.00 41.12 43.98 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 3.97 0.14 -0.67 6.06 -1.26 -1.77 118.95 123.41 3dyo s ARG 917 Ca 0.02 -0.32 0.09 0.00 -2.50 0.00 0.00 55.73 53.02 3dyo s ARG 917 Cb -0.00 -3.50 -0.04 0.00 0.06 0.00 0.00 34.95 31.47 3dyo s ARG 917 CO 0.00 -0.01 -0.18 -1.58 -2.50 0.00 0.00 175.30 171.03 3dyo s TRP 918 N 1.24 2.51 -0.22 5.12 0.52 0.87 -4.96 118.94 124.03 3dyo s TRP 918 Ca 0.07 -0.27 -0.04 0.00 0.02 0.00 0.00 56.10 55.88 3dyo s TRP 918 Cb -0.14 -1.30 0.11 0.00 -1.15 0.00 0.00 33.47 30.99 3dyo s TRP 918 CO 0.06 0.43 0.32 0.34 0.02 0.00 0.00 176.95 178.11 3dyo s ASP 919 N -2.36 0.59 0.20 2.95 -1.08 -1.26 -0.97 116.67 114.75 3dyo s ASP 919 Ca 0.20 0.16 0.03 0.00 -0.52 0.00 0.00 52.55 52.42 3dyo s ASP 919 Cb -0.10 0.85 -0.05 0.00 -1.46 0.00 0.00 42.92 42.16 3dyo s ASP 919 CO 0.11 -0.30 -0.01 -0.76 0.52 0.00 0.00 175.17 174.73 3dyo s LEU 920 N 2.47 2.18 0.54 -1.34 1.43 -0.64 -4.98 118.68 118.33 3dyo s LEU 920 Ca 0.09 -1.19 -0.20 0.00 -1.03 0.00 0.00 54.13 51.80 3dyo s LEU 920 Cb -0.15 -0.19 -0.06 0.00 0.03 0.00 0.00 46.19 45.82 3dyo s LEU 920 CO -0.14 -0.52 1.16 -2.16 0.23 0.00 0.00 176.35 174.92 3dyo s PRO 921 N -3.87 3.35 0.29 1.29 0.04 -1.26 -0.47 135.00 134.36 3dyo s PRO 921 Ca 0.26 1.71 0.04 0.00 0.04 0.00 0.00 61.00 63.04 3dyo s PRO 921 Cb 0.06 -2.07 0.64 0.00 0.04 0.00 0.00 34.50 33.16 3dyo s PRO 921 CO 0.06 -0.88 1.81 1.25 0.04 0.00 0.00 177.00 179.29 3dyo h LEU 922 N 1.30 0.86 -1.71 -3.56 5.85 -1.34 -1.16 115.31 115.56 3dyo h LEU 922 Ca -0.50 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.34 3dyo h LEU 922 Cb 1.27 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 3dyo h LEU 922 CO 0.57 0.40 0.29 0.77 -0.34 0.00 0.00 178.44 180.13 3dyo h SER 923 N 0.89 0.32 0.00 1.25 4.64 -1.91 0.35 113.55 119.09 3dyo h SER 923 Ca 0.53 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3dyo h SER 923 Cb 0.66 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3dyo h SER 923 CO -0.31 0.21 0.00 0.47 -0.87 0.00 0.00 176.83 176.33 3dyo n ASP 924 N -4.48 0.00 -0.96 4.97 8.00 -0.44 -1.50 116.55 122.14 3dyo n ASP 924 Ca 0.05 -0.54 0.12 0.00 0.71 0.00 0.00 54.79 55.12 3dyo n ASP 924 Cb 0.23 0.00 0.25 0.00 -0.02 0.00 0.00 41.12 41.58 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 -0.94 2.27 -5.10 -1.24 2.81 0.12 -4.78 117.12 110.25 3dyo n MET 925 Ca 0.10 -1.90 -0.30 0.00 -1.81 0.00 0.00 57.70 53.79 3dyo n MET 925 Cb 0.05 -1.48 -0.17 0.00 -0.71 0.00 0.00 33.22 30.92 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 -1.64 2.23 -0.28 2.03 5.04 -0.56 -4.46 117.35 119.71 3dyo s TYR 926 Ca 0.36 -0.74 -0.08 0.00 -2.44 0.00 0.00 57.07 54.17 3dyo s TYR 926 Cb 0.21 -1.48 -0.02 0.00 0.35 0.00 0.00 41.96 41.02 3dyo s TYR 926 CO 0.30 -0.26 0.10 0.99 -1.34 0.00 0.00 175.55 175.33 3dyo s THR 927 N 0.07 4.33 -1.21 4.34 2.01 -1.26 -4.98 115.64 118.94 3dyo s THR 927 Ca -0.08 -0.34 -0.08 0.00 0.31 0.00 0.00 61.69 61.49 3dyo s THR 927 Cb -0.14 -3.12 -0.11 0.00 0.01 0.00 0.00 72.50 69.14 3dyo s THR 927 CO 0.05 0.21 2.91 -0.81 -0.69 0.00 0.00 174.62 176.29 3dyo n PRO 928 N 4.93 3.10 -1.67 4.92 -0.04 -1.26 -4.89 135.00 140.09 3dyo n PRO 928 Ca -0.15 -1.84 -0.43 0.00 -0.04 0.00 0.00 63.50 61.04 3dyo n PRO 928 Cb 0.50 -2.58 -0.01 0.00 -0.04 0.00 0.00 33.50 31.36 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 3.48 2.00 -0.27 0.54 4.02 -1.26 -4.86 117.16 120.81 3dyo n TYR 929 Ca 0.66 0.57 -0.05 0.00 -0.01 0.00 0.00 57.90 59.07 3dyo n TYR 929 Cb 0.33 -2.38 0.06 0.00 -0.02 0.00 0.00 39.34 37.33 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 2.49 1.21 -3.49 -0.72 2.07 -1.97 -3.31 116.25 112.53 3dyo h VAL 930 Ca -0.44 -0.46 -0.67 0.00 0.82 0.00 0.00 66.70 65.95 3dyo h VAL 930 Cb 1.30 0.19 -0.17 0.00 -1.52 0.00 0.00 31.29 31.09 3dyo h VAL 930 CO 0.64 0.22 0.01 0.12 0.02 0.00 0.00 177.57 178.58 3dyo s PHE 931 N -5.98 3.09 0.45 1.57 5.36 -1.26 -1.44 117.98 119.76 3dyo s PHE 931 Ca -0.13 -0.26 -0.24 0.00 -0.96 0.00 0.00 56.93 55.34 3dyo s PHE 931 Cb 0.15 -3.26 -0.08 0.00 -0.34 0.00 0.00 43.02 39.49 3dyo s PHE 931 CO 0.79 -0.86 1.20 -2.14 -1.46 0.00 0.00 175.22 172.74 3dyo s PRO 932 N 2.58 3.80 0.12 10.12 0.02 -1.25 -4.96 135.00 145.44 3dyo s PRO 932 Ca 0.18 1.87 -0.04 0.00 0.02 0.00 0.00 61.00 63.03 3dyo s PRO 932 Cb -0.16 -2.50 0.02 0.00 0.02 0.00 0.00 34.50 31.87 3dyo s PRO 932 CO 0.16 -0.54 0.23 -1.13 -0.33 0.00 0.00 177.00 175.38 3dyo n SER 933 N -0.32 -0.66 -4.68 2.53 3.41 -1.26 -4.73 113.62 107.91 3dyo n SER 933 Ca 0.06 -1.52 -0.44 0.00 -0.26 0.00 0.00 58.87 56.71 3dyo n SER 933 Cb 0.47 1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 65.51 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 -0.17 2.15 -3.76 4.33 4.07 -0.65 -4.93 120.64 121.68 3dyo n GLU 934 Ca -0.02 0.77 -0.08 0.00 -0.06 0.00 0.00 57.16 57.77 3dyo n GLU 934 Cb 0.19 -2.45 -0.02 0.00 -0.06 0.00 0.00 31.44 29.09 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 0.37 -0.32 0.00 4.31 2.20 -1.26 -4.89 114.94 115.35 3dyo s ASN 935 Ca 0.68 -0.46 0.00 0.00 -0.94 0.00 0.00 52.86 52.14 3dyo s ASN 935 Cb -0.63 0.68 0.00 0.00 -2.00 0.00 0.00 41.25 39.30 3dyo s ASN 935 CO 0.49 -1.23 0.00 0.61 -2.94 0.00 0.00 177.10 174.03 3dyo n GLY 936 N -0.44 0.78 3.73 0.45 0.00 -1.26 -4.82 105.19 103.63 3dyo n GLY 936 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 3dyo n GLY 936 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dyo s LEU 937 N 0.00 3.50 -0.08 0.99 2.96 -1.26 -4.58 118.68 120.21 3dyo s LEU 937 Ca 0.00 2.57 0.02 0.00 -0.22 0.00 0.00 54.13 56.50 3dyo s LEU 937 Cb 0.00 -4.61 0.01 0.00 0.50 0.00 0.00 46.19 42.09 3dyo s LEU 937 CO 0.00 -2.10 -0.14 -0.13 -1.32 0.00 0.00 176.35 172.67 3dyo s ARG 938 N -3.51 1.92 0.45 1.98 3.00 0.55 -0.18 118.95 123.17 3dyo s ARG 938 Ca 0.81 -0.47 0.08 0.00 0.00 0.00 0.00 55.73 56.14 3dyo s ARG 938 Cb -0.36 -1.61 0.00 0.00 0.00 0.00 0.00 34.95 32.98 3dyo s ARG 938 CO 0.41 -0.01 0.46 0.00 0.00 0.00 0.00 175.30 176.16 3dyo n GLY 940 N -1.70 -0.53 3.79 0.00 0.00 -1.21 -1.89 105.19 103.65 3dyo n GLY 940 Ca 0.05 0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 3dyo n GLY 940 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyo s THR 941 N -3.21 5.08 -0.08 2.61 2.01 -0.22 -3.89 115.64 117.95 3dyo s THR 941 Ca 0.41 0.89 0.15 0.00 0.31 0.00 0.00 61.69 63.44 3dyo s THR 941 Cb -0.18 -3.76 -0.22 0.00 0.01 0.00 0.00 72.50 68.35 3dyo s THR 941 CO 0.51 0.48 0.35 0.54 -0.69 0.00 0.00 174.62 175.80 3dyo n ARG 942 N 2.58 0.60 -3.65 4.92 5.12 -0.06 -1.02 116.66 125.16 3dyo n ARG 942 Ca -0.11 -0.12 -0.11 0.00 -1.93 0.00 0.00 57.85 55.58 3dyo n ARG 942 Cb 0.52 -1.34 -0.08 0.00 -1.16 0.00 0.00 32.46 30.41 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 -2.97 0.72 -0.05 5.56 2.12 -1.21 -0.68 118.70 122.20 3dyo s GLU 943 Ca -0.04 1.05 0.02 0.00 0.36 0.00 0.00 54.97 56.36 3dyo s GLU 943 Cb 0.10 0.24 0.01 0.00 0.26 0.00 0.00 34.13 34.74 3dyo s GLU 943 CO 0.61 -0.12 -0.11 -1.17 -0.54 0.00 0.00 175.26 173.93 3dyo s LEU 944 N 1.01 1.69 -0.07 2.70 2.96 0.01 -1.02 118.68 125.97 3dyo s LEU 944 Ca -0.05 -0.24 0.04 0.00 -0.22 0.00 0.00 54.13 53.65 3dyo s LEU 944 Cb -0.05 -0.70 0.00 0.00 0.50 0.00 0.00 46.19 45.94 3dyo s LEU 944 CO -0.09 0.05 -0.18 0.20 -1.32 0.00 0.00 176.35 175.00 3dyo s ASN 945 N 0.45 2.35 -0.23 3.68 0.01 0.10 -1.27 114.94 120.03 3dyo s ASN 945 Ca -0.09 -0.40 -0.06 0.00 -0.71 0.00 0.00 52.86 51.60 3dyo s ASN 945 Cb -0.13 -0.89 0.11 0.00 0.41 0.00 0.00 41.25 40.75 3dyo s ASN 945 CO 0.02 0.13 0.45 -0.47 -1.51 0.00 0.00 177.10 175.72 3dyo s TYR 946 N 0.29 -0.93 0.00 2.20 5.04 -0.02 -2.46 117.35 121.47 3dyo s TYR 946 Ca -0.11 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 3dyo s TYR 946 Cb -0.15 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.49 3dyo s TYR 946 CO 0.04 -0.58 0.00 0.41 -1.34 0.00 0.00 175.55 174.08 3dyo n GLY 947 N 5.40 3.18 0.04 8.97 0.00 -1.26 -0.82 105.19 120.69 3dyo n GLY 947 Ca -0.07 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 45.83 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 0.46 -3.30 1.61 -0.04 -1.26 -4.87 135.00 141.61 3dyo n PRO 948 Ca 0.00 -0.08 -0.32 0.00 -0.04 0.00 0.00 63.50 63.07 3dyo n PRO 948 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 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 -2.59 3.41 -0.02 0.54 3.76 -0.00 -0.42 115.29 119.97 3dyo s HIS 949 Ca 0.27 0.99 0.00 0.00 -0.15 0.00 0.00 55.06 56.17 3dyo s HIS 949 Cb 0.20 -2.35 0.02 0.00 1.11 0.00 0.00 32.58 31.56 3dyo s HIS 949 CO 0.48 0.19 0.01 -1.14 -0.85 0.00 0.00 174.74 173.43 3dyo s GLN 950 N -2.95 0.15 -0.09 1.40 0.74 0.40 -0.84 119.66 118.47 3dyo s GLN 950 Ca 0.50 0.09 0.03 0.00 0.05 0.00 0.00 55.36 56.03 3dyo s GLN 950 Cb -0.11 -0.34 0.01 0.00 1.10 0.00 0.00 33.01 33.67 3dyo s GLN 950 CO 0.21 -0.12 -0.19 -1.58 -0.55 0.00 0.00 175.29 173.06 3dyo s TRP 951 N 0.84 2.14 0.17 1.67 0.51 -0.40 -0.04 118.94 123.82 3dyo s TRP 951 Ca -0.08 -0.87 0.10 0.00 -2.12 0.00 0.00 56.10 53.13 3dyo s TRP 951 Cb -0.11 -1.47 -0.04 0.00 -0.81 0.00 0.00 33.47 31.04 3dyo s TRP 951 CO -0.02 -0.38 -0.17 1.03 -0.51 0.00 0.00 176.95 176.90 3dyo s ARG 952 N 0.51 1.80 0.00 4.98 0.52 -0.14 -0.81 118.95 125.82 3dyo s ARG 952 Ca -0.16 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 53.72 3dyo s ARG 952 Cb -0.17 -2.04 0.00 0.00 0.52 0.00 0.00 34.95 33.26 3dyo s ARG 952 CO 0.06 0.44 0.00 0.41 0.02 0.00 0.00 175.30 176.23 3dyo n GLY 953 N 0.32 -0.53 2.70 -3.53 0.00 0.14 -1.59 105.19 102.70 3dyo n GLY 953 Ca -0.13 -0.36 -0.17 0.00 0.00 0.00 0.00 46.02 45.36 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 0.76 0.34 1.61 2.15 -1.23 -4.20 116.67 112.09 3dyo s ASP 954 Ca 0.00 -1.90 0.04 0.00 0.43 0.00 0.00 52.55 51.12 3dyo s ASP 954 Cb 0.00 0.59 -0.02 0.00 -0.30 0.00 0.00 42.92 43.19 3dyo s ASP 954 CO 0.00 -0.21 0.35 0.72 -0.17 0.00 0.00 175.17 175.86 3dyo s PHE 955 N 1.07 1.55 0.13 -5.34 -0.12 -0.19 -4.88 117.98 110.19 3dyo s PHE 955 Ca 0.22 -1.56 0.10 0.00 -0.05 0.00 0.00 56.93 55.64 3dyo s PHE 955 Cb -0.09 -0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 41.75 3dyo s PHE 955 CO -0.06 -0.97 -0.23 -0.65 -0.05 0.00 0.00 175.22 173.26 3dyo s GLN 956 N -3.27 1.57 0.12 1.99 -1.52 -0.30 -1.05 119.66 117.20 3dyo s GLN 956 Ca 0.37 -1.28 -0.14 0.00 -1.95 0.00 0.00 55.36 52.36 3dyo s GLN 956 Cb 0.01 -1.99 0.03 0.00 -0.22 0.00 0.00 33.01 30.84 3dyo s GLN 956 CO 0.26 0.46 0.36 -0.59 -0.25 0.00 0.00 175.29 175.53 3dyo s PHE 957 N -1.11 -0.12 0.05 0.91 -0.12 -0.57 0.05 117.98 117.07 3dyo s PHE 957 Ca 0.16 -0.22 0.01 0.00 -0.05 0.00 0.00 56.93 56.82 3dyo s PHE 957 Cb -0.10 0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.45 3dyo s PHE 957 CO 0.08 -0.68 -0.05 0.54 -0.05 0.00 0.00 175.22 175.06 3dyo s ASN 958 N -2.82 0.67 -0.20 1.98 2.20 -0.60 -0.33 114.94 115.84 3dyo s ASN 958 Ca 0.04 -0.73 -0.11 0.00 -0.94 0.00 0.00 52.86 51.12 3dyo s ASN 958 Cb 0.02 0.10 0.06 0.00 -2.00 0.00 0.00 41.25 39.44 3dyo s ASN 958 CO -0.11 -0.37 0.49 -0.51 -2.94 0.00 0.00 177.10 173.65 3dyo s ILE 959 N -2.40 -0.02 0.15 0.54 2.07 -1.26 -1.62 121.20 118.66 3dyo s ILE 959 Ca -0.04 0.07 -0.24 0.00 -1.41 0.00 0.00 60.65 59.03 3dyo s ILE 959 Cb -0.03 -0.71 0.08 0.00 0.13 0.00 0.00 42.46 41.92 3dyo s ILE 959 CO -0.03 0.03 1.05 -0.94 -1.91 0.00 0.00 174.94 173.13 3dyo s SER 960 N 1.46 -0.05 -0.00 4.50 1.04 -0.32 -4.58 113.70 115.75 3dyo s SER 960 Ca -0.10 -0.53 0.08 0.00 0.48 0.00 0.00 55.95 55.88 3dyo s SER 960 Cb -0.07 0.45 0.23 0.00 0.10 0.00 0.00 66.02 66.73 3dyo s SER 960 CO -0.15 -0.88 1.18 0.54 0.98 0.00 0.00 173.24 174.92 3dyo n ARG 961 N -0.63 1.62 -5.11 4.02 5.12 -1.26 0.13 116.66 120.55 3dyo n ARG 961 Ca -0.04 -0.94 -0.30 0.00 -1.93 0.00 0.00 57.85 54.64 3dyo n ARG 961 Cb 0.60 -1.22 -0.17 0.00 -1.16 0.00 0.00 32.46 30.51 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 -1.65 2.31 0.64 -1.55 1.51 -1.26 -0.31 117.35 117.04 3dyo s TYR 962 Ca 0.17 -0.86 -0.11 0.00 -1.01 0.00 0.00 57.07 55.27 3dyo s TYR 962 Cb 0.09 -1.55 -0.03 0.00 -0.11 0.00 0.00 41.96 40.36 3dyo s TYR 962 CO 0.12 -0.33 1.04 -1.54 -1.11 0.00 0.00 175.55 173.73 3dyo s SER 963 N 0.24 6.08 0.25 2.29 1.04 -1.26 -4.79 113.70 117.55 3dyo s SER 963 Ca -0.13 1.38 -0.05 0.00 0.48 0.00 0.00 55.95 57.62 3dyo s SER 963 Cb -0.16 -2.38 0.29 0.00 0.10 0.00 0.00 66.02 63.87 3dyo s SER 963 CO 0.06 -0.96 1.92 1.56 0.98 0.00 0.00 173.24 176.81 3dyo h GLN 964 N -0.38 1.29 -0.08 4.02 1.08 -1.99 -1.27 115.11 117.77 3dyo h GLN 964 Ca -0.44 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 3dyo h GLN 964 Cb 1.20 -0.29 -0.00 0.00 -0.05 0.00 0.00 27.48 28.34 3dyo h GLN 964 CO 0.62 0.85 0.05 0.37 -0.95 0.00 0.00 178.83 179.77 3dyo h GLN 965 N 1.33 0.10 -0.60 1.46 4.15 -1.99 -1.02 115.11 118.54 3dyo h GLN 965 Ca 0.38 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.83 3dyo h GLN 965 Cb -0.10 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.53 3dyo h GLN 965 CO -0.10 0.08 0.35 0.37 -1.93 0.00 0.00 178.83 177.61 3dyo h GLN 966 N 0.09 0.67 -0.66 1.69 4.15 -1.84 -0.21 115.11 118.99 3dyo h GLN 966 Ca 0.03 -0.04 0.08 0.00 0.77 0.00 0.00 58.65 59.49 3dyo h GLN 966 Cb 0.01 -0.15 -0.07 0.00 0.21 0.00 0.00 27.48 27.48 3dyo h GLN 966 CO -0.01 0.44 0.33 -0.07 -1.93 0.00 0.00 178.83 177.59 3dyo h LEU 967 N 0.69 0.43 -0.87 -2.39 3.38 -0.85 -0.91 115.31 114.79 3dyo h LEU 967 Ca 0.25 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.16 3dyo h LEU 967 Cb 0.07 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3dyo h LEU 967 CO -0.13 0.26 -0.41 -0.03 0.09 0.00 0.00 178.44 178.23 3dyo h MET 968 N 0.57 0.32 -0.01 1.13 4.05 -0.65 -2.97 114.93 117.38 3dyo h MET 968 Ca 0.32 -0.16 0.00 0.00 -0.28 0.00 0.00 59.70 59.58 3dyo h MET 968 Cb 0.31 -0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 3dyo h MET 968 CO -0.25 0.68 -0.23 0.39 0.23 0.00 0.00 176.91 177.73 3dyo n GLU 969 N -4.03 0.86 -4.12 0.39 1.02 -0.14 -4.83 120.64 109.79 3dyo n GLU 969 Ca -0.01 -0.49 -0.35 0.00 -0.02 0.00 0.00 57.16 56.29 3dyo n GLU 969 Cb 0.49 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 30.29 3dyo n GLU 969 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dyo s THR 970 N -2.48 3.84 -0.98 2.62 2.01 -0.46 -4.99 115.64 115.21 3dyo s THR 970 Ca 0.25 -0.36 0.25 0.00 0.31 0.00 0.00 61.69 62.14 3dyo s THR 970 Cb 0.19 -2.72 -0.02 0.00 0.01 0.00 0.00 72.50 69.96 3dyo s THR 970 CO 0.51 0.44 1.36 -1.54 -0.69 0.00 0.00 174.62 174.70 3dyo n SER 971 N 4.20 0.55 -3.77 3.53 3.41 -1.26 -4.22 113.62 116.05 3dyo n SER 971 Ca -0.17 -0.30 -0.17 0.00 -0.26 0.00 0.00 58.87 57.97 3dyo n SER 971 Cb 0.52 0.32 -0.16 0.00 -0.26 0.00 0.00 64.21 64.62 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 -3.01 0.15 0.51 7.33 3.76 -1.26 -4.41 115.29 118.36 3dyo s HIS 972 Ca 0.10 0.10 0.19 0.00 -0.15 0.00 0.00 55.06 55.31 3dyo s HIS 972 Cb 0.17 -0.35 1.29 0.00 1.11 0.00 0.00 32.58 34.80 3dyo s HIS 972 CO 0.72 -0.13 2.07 0.07 -0.85 0.00 0.00 174.74 176.62 3dyo h ARG 973 N 7.50 0.05 0.00 1.40 0.11 -1.46 -0.50 114.38 121.49 3dyo h ARG 973 Ca -0.39 -0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.68 3dyo h ARG 973 Cb 1.12 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 32.19 3dyo h ARG 973 CO 0.42 0.03 -0.06 1.12 0.10 0.00 0.00 179.97 181.59 3dyo h HIS 974 N 0.05 0.00 -0.10 4.08 2.07 -1.91 -1.96 115.15 117.38 3dyo h HIS 974 Ca 0.13 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.65 3dyo h HIS 974 Cb 0.47 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.45 3dyo h HIS 974 CO -0.00 0.06 0.00 1.28 -3.07 0.00 0.00 177.93 176.20 3dyo n LEU 975 N -3.51 1.59 -4.78 6.12 4.77 -0.19 -4.91 117.00 116.08 3dyo n LEU 975 Ca -0.02 -0.61 -0.34 0.00 -0.03 0.00 0.00 56.01 55.00 3dyo n LEU 975 Cb 0.17 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3dyo n LEU 975 CO 0.27 0.31 0.75 -0.76 -1.33 0.00 0.00 177.39 176.63 3dyo s LEU 976 N -1.75 3.73 -0.03 2.23 1.43 -0.74 -5.05 118.68 118.49 3dyo s LEU 976 Ca 0.35 2.06 0.01 0.00 -1.03 0.00 0.00 54.13 55.52 3dyo s LEU 976 Cb 0.19 -4.57 0.02 0.00 0.03 0.00 0.00 46.19 41.86 3dyo s LEU 976 CO 0.29 -1.12 -0.04 -1.38 0.23 0.00 0.00 176.35 174.33 3dyo s HIS 977 N -1.94 0.61 0.39 0.29 -3.43 -1.26 -5.10 115.29 104.86 3dyo s HIS 977 Ca 0.70 -0.14 -0.27 0.00 -0.80 0.00 0.00 55.06 54.54 3dyo s HIS 977 Cb -0.21 -0.54 -0.11 0.00 -1.43 0.00 0.00 32.58 30.30 3dyo s HIS 977 CO 0.27 -0.13 1.45 0.00 -2.00 0.00 0.00 174.74 174.32 3dyo n ALA 978 N 3.79 2.14 -1.99 -1.38 0.00 -1.26 -4.82 120.51 116.98 3dyo n ALA 978 Ca -0.23 0.32 -0.20 0.00 0.00 0.00 0.00 53.44 53.33 3dyo n ALA 978 Cb 0.52 -2.39 0.04 0.00 0.00 0.00 0.00 19.45 17.62 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 -2.15 2.52 0.51 0.00 2.02 0.58 -5.04 118.70 117.15 3dyo s GLU 979 Ca 0.55 -1.02 -0.22 0.00 0.02 0.00 0.00 54.97 54.30 3dyo s GLU 979 Cb -0.48 -2.57 -0.06 0.00 0.10 0.00 0.00 34.13 31.12 3dyo s GLU 979 CO 0.62 -0.67 1.23 -1.21 0.02 0.00 0.00 175.26 175.26 3dyo s GLU 980 N -4.67 3.41 1.80 1.61 2.02 -1.26 -4.74 118.70 116.86 3dyo s GLU 980 Ca 0.58 1.92 0.00 0.00 0.02 0.00 0.00 54.97 57.49 3dyo s GLU 980 Cb -0.09 -2.26 0.00 0.00 0.10 0.00 0.00 34.13 31.88 3dyo s GLU 980 CO 0.37 -0.88 0.00 0.41 0.02 0.00 0.00 175.26 175.18 3dyo n GLY 981 N 0.53 -1.12 3.10 -1.39 0.00 -1.26 -4.81 105.19 100.23 3dyo n GLY 981 Ca 0.10 -1.13 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 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 1.35 -0.20 2.61 2.01 -0.51 -4.66 115.64 116.23 3dyo s THR 982 Ca 0.00 -0.64 -0.16 0.00 0.31 0.00 0.00 61.69 61.20 3dyo s THR 982 Cb 0.00 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 3dyo s THR 982 CO 0.00 0.40 0.40 0.26 -0.69 0.00 0.00 174.62 174.98 3dyo s TRP 983 N 0.31 3.37 -0.19 4.92 0.52 0.35 0.09 118.94 128.31 3dyo s TRP 983 Ca -0.09 0.61 -0.01 0.00 0.02 0.00 0.00 56.10 56.62 3dyo s TRP 983 Cb -0.14 -2.52 -0.00 0.00 -1.15 0.00 0.00 33.47 29.66 3dyo s TRP 983 CO 0.03 -0.01 -0.12 -1.17 0.02 0.00 0.00 176.95 175.71 3dyo s LEU 984 N 1.31 2.58 -0.24 2.99 2.96 -0.77 -1.18 118.68 126.33 3dyo s LEU 984 Ca 0.19 -0.47 -0.02 0.00 -0.22 0.00 0.00 54.13 53.61 3dyo s LEU 984 Cb -0.15 -1.62 0.02 0.00 0.50 0.00 0.00 46.19 44.95 3dyo s LEU 984 CO 0.08 0.03 -0.07 0.20 -1.32 0.00 0.00 176.35 175.27 3dyo s ASN 985 N 1.16 4.24 -0.24 3.68 0.01 -0.64 -2.01 114.94 121.13 3dyo s ASN 985 Ca 0.01 -0.81 -0.00 0.00 -0.71 0.00 0.00 52.86 51.34 3dyo s ASN 985 Cb -0.14 -1.66 0.03 0.00 0.41 0.00 0.00 41.25 39.89 3dyo s ASN 985 CO -0.04 -0.11 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.72 3dyo s ILE 986 N 1.34 2.61 -0.05 0.60 1.01 -0.24 -1.56 121.20 124.89 3dyo s ILE 986 Ca 0.01 -1.13 0.02 0.00 0.00 0.00 0.00 60.65 59.54 3dyo s ILE 986 Cb -0.16 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 3dyo s ILE 986 CO -0.05 0.21 -0.08 -1.81 0.00 0.00 0.00 174.94 173.21 3dyo s ASP 987 N 1.28 4.58 0.08 3.58 1.01 0.11 -1.12 116.67 126.19 3dyo s ASP 987 Ca -0.01 -0.06 -0.01 0.00 0.71 0.00 0.00 52.55 53.18 3dyo s ASP 987 Cb -0.17 -1.12 -0.26 0.00 1.01 0.00 0.00 42.92 42.38 3dyo s ASP 987 CO -0.06 0.35 1.14 1.23 0.21 0.00 0.00 175.17 178.04 3dyo h GLY 988 N 5.12 0.23 -5.08 0.21 0.00 -0.59 -0.79 103.07 102.17 3dyo h GLY 988 Ca -0.48 -0.58 -0.18 0.00 0.00 0.00 0.00 47.33 46.09 3dyo h GLY 988 CO 0.52 0.51 -0.63 -1.36 0.00 0.00 0.00 176.54 175.58 3dyo s PHE 989 N -2.66 0.11 -0.11 5.60 0.40 -0.91 -4.70 117.98 115.71 3dyo s PHE 989 Ca -0.03 -0.23 -0.10 0.00 -0.60 0.00 0.00 56.93 55.97 3dyo s PHE 989 Cb 0.08 -0.09 0.03 0.00 0.51 0.00 0.00 43.02 43.55 3dyo s PHE 989 CO 0.86 -0.17 0.29 -1.58 0.70 0.00 0.00 175.22 175.33 3dyo s HIS 990 N -1.00 -0.32 0.65 0.36 2.46 -1.26 -1.00 115.29 115.18 3dyo s HIS 990 Ca -0.11 0.79 -0.14 0.00 0.47 0.00 0.00 55.06 56.07 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 -0.16 1.08 1.41 -2.47 0.00 0.00 174.74 174.60 3dyo s MET 991 N 0.21 2.95 1.00 2.88 1.75 0.22 -4.76 119.30 123.55 3dyo s MET 991 Ca -0.00 1.23 -0.12 0.00 -1.25 0.00 0.00 55.69 55.54 3dyo s MET 991 Cb -0.02 -1.98 0.19 0.00 2.84 0.00 0.00 34.83 35.85 3dyo s MET 991 CO -0.00 -1.11 1.08 0.20 -0.65 0.00 0.00 175.02 174.54 3dyo s GLY 992 N -2.94 1.59 -0.02 2.11 0.00 -0.69 -4.70 107.32 102.67 3dyo s GLY 992 Ca 0.64 -0.07 0.22 0.00 0.00 0.00 0.00 44.72 45.50 3dyo s GLY 992 CO 0.44 0.50 0.51 0.29 0.00 0.00 0.00 173.10 174.84 3dyo n ILE 993 N -4.29 0.18 -4.37 0.90 -5.35 -1.26 -4.95 119.36 100.22 3dyo n ILE 993 Ca 0.06 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 3dyo n ILE 993 Cb 0.55 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.37 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 1.29 -1.14 0.00 3.28 0.00 -1.26 -4.77 105.19 102.59 3dyo n GLY 994 Ca -0.06 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.34 0.42 -0.02 0.00 -1.26 -0.55 105.19 103.45 3dyo n GLY 995 Ca 0.00 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 -5.01 1.61 3.32 -1.80 -1.79 116.42 112.75 3dyo h ASP 996 Ca 0.00 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.10 3dyo h ASP 996 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3dyo h ASP 996 CO 0.00 0.00 0.25 1.51 -1.72 0.00 0.00 179.24 179.28 3dyo s ASP 997 N -5.63 -0.19 -0.21 6.45 1.47 -1.26 -4.21 116.67 113.09 3dyo s ASP 997 Ca -0.05 -0.75 0.11 0.00 1.18 0.00 0.00 52.55 53.04 3dyo s ASP 997 Cb 0.19 0.76 0.42 0.00 -0.34 0.00 0.00 42.92 43.95 3dyo s ASP 997 CO 0.69 -1.43 1.22 -1.20 0.68 0.00 0.00 175.17 175.13 3dyo n SER 998 N -0.72 1.87 0.00 2.11 7.64 -1.26 -4.66 113.62 118.60 3dyo n SER 998 Ca -0.05 -3.88 0.00 0.00 1.01 0.00 0.00 58.87 55.95 3dyo n SER 998 Cb 0.59 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 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 -1.08 0.00 -3.65 1.43 2.14 -1.26 -4.14 117.44 110.88 3dyo n TRP 999 Ca 0.20 -0.08 -0.15 0.00 2.07 0.00 0.00 57.50 59.55 3dyo n TRP 999 Cb 0.71 -0.01 -0.07 0.00 -0.81 0.00 0.00 31.31 31.13 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 -0.16 -0.37 0.12 -0.67 1.04 -1.26 -4.58 113.70 107.82 3dyo s SER 1000Ca 0.00 0.25 -0.34 0.00 0.48 0.00 0.00 55.95 56.34 3dyo s SER 1000Cb 0.00 0.42 -0.14 0.00 0.10 0.00 0.00 66.02 66.40 3dyo s SER 1000CO 0.00 -0.57 1.60 -2.65 0.98 0.00 0.00 173.24 172.59 3dyo n PRO 1001N 0.90 2.04 0.00 4.02 -0.02 -1.26 -4.78 135.00 135.90 3dyo n PRO 1001Ca -0.20 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3dyo n PRO 1001Cb 0.58 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3dyo n PRO 1001CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dyo n SER 1002N 3.77 1.09 -4.69 2.55 3.41 -1.26 -5.03 113.62 113.46 3dyo n SER 1002Ca 0.18 -1.54 -0.41 0.00 -0.26 0.00 0.00 58.87 56.83 3dyo n SER 1002Cb 0.28 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.19 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 -0.54 4.90 0.49 -3.33 1.01 -1.26 -4.42 120.40 117.25 3dyo s VAL 1003Ca 0.00 1.75 -0.22 0.00 0.00 0.00 0.00 61.98 63.51 3dyo s VAL 1003Cb 0.00 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.13 3dyo s VAL 1003CO 0.00 0.10 1.21 -0.55 0.00 0.00 0.00 175.10 175.87 3dyo s SER 1004N 1.03 5.86 0.33 3.32 0.15 -1.26 -4.89 113.70 118.24 3dyo s SER 1004Ca 0.43 2.42 0.10 0.00 0.70 0.00 0.00 55.95 59.60 3dyo s SER 1004Cb -0.18 -2.61 0.88 0.00 -1.71 0.00 0.00 66.02 62.40 3dyo s SER 1004CO 0.18 -1.14 1.76 0.00 1.20 0.00 0.00 173.24 175.25 3dyo h ALA 1005N 1.78 1.85 0.00 5.45 0.00 -1.96 0.13 119.26 126.52 3dyo h ALA 1005Ca -0.50 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3dyo h ALA 1005Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3dyo h ALA 1005CO 0.59 -0.26 0.00 -0.85 0.00 0.00 0.00 179.25 178.73 3dyo n GLU 1006N -4.76 0.01 -0.10 0.00 0.00 -1.26 -1.99 120.64 112.54 3dyo n GLU 1006Ca 0.25 0.38 0.03 0.00 0.00 0.00 0.00 57.16 57.82 3dyo n GLU 1006Cb 0.70 -1.53 0.09 0.00 0.00 0.00 0.00 31.44 30.70 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 -1.55 0.28 -3.50 -1.84 3.01 0.44 -4.99 117.46 109.31 3dyo n PHE 1007Ca 0.02 -0.48 -0.35 0.00 1.01 0.00 0.00 57.45 57.64 3dyo n PHE 1007Cb 0.09 -0.03 -0.06 0.00 -0.01 0.00 0.00 39.48 39.47 3dyo n PHE 1007CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3dyo s GLN 1008N -0.98 3.86 -1.14 -1.08 -0.21 -0.84 -1.71 119.66 117.56 3dyo s GLN 1008Ca 0.14 0.31 -0.17 0.00 0.02 0.00 0.00 55.36 55.67 3dyo s GLN 1008Cb 0.07 -3.02 0.13 0.00 1.00 0.00 0.00 33.01 31.19 3dyo s GLN 1008CO 0.10 0.56 1.42 -0.51 -2.12 0.00 0.00 175.29 174.74 3dyo s LEU 1009N -1.77 4.65 -0.08 2.90 1.43 -1.26 -4.69 118.68 119.86 3dyo s LEU 1009Ca 0.33 -2.49 0.12 0.00 -1.03 0.00 0.00 54.13 51.05 3dyo s LEU 1009Cb -0.15 -2.45 0.29 0.00 0.03 0.00 0.00 46.19 43.91 3dyo s LEU 1009CO 0.18 -0.99 1.21 -1.54 0.23 0.00 0.00 176.35 175.44 3dyo n SER 1010N 6.74 2.80 0.29 2.29 3.41 -1.26 -4.35 113.62 123.55 3dyo n SER 1010Ca 0.36 -2.56 0.19 0.00 -0.26 0.00 0.00 58.87 56.59 3dyo n SER 1010Cb 0.46 -0.31 0.86 0.00 -0.26 0.00 0.00 64.21 64.95 3dyo n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dyo h ALA 1011N 0.93 1.00 0.00 7.33 0.00 -1.97 -3.46 119.26 123.08 3dyo h ALA 1011Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyo h ALA 1011Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3dyo h ALA 1011CO 0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.72 3dyo n GLY 1012N -0.35 2.12 3.07 0.00 0.00 -1.26 -4.90 105.19 103.86 3dyo n GLY 1012Ca -0.01 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.37 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 1.39 0.04 1.61 0.52 -1.26 0.55 118.95 121.80 3dyo s ARG 1013Ca 0.00 -0.46 0.04 0.00 -0.52 0.00 0.00 55.73 54.79 3dyo s ARG 1013Cb 0.00 -1.24 -0.02 0.00 0.52 0.00 0.00 34.95 34.21 3dyo s ARG 1013CO 0.00 0.18 -0.12 0.71 0.02 0.00 0.00 175.30 176.08 3dyo s TYR 1014N 0.13 1.07 -0.00 -0.53 1.51 -0.36 -4.98 117.35 114.19 3dyo s TYR 1014Ca -0.04 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.66 3dyo s TYR 1014Cb -0.10 -0.63 -0.01 0.00 -0.11 0.00 0.00 41.96 41.12 3dyo s TYR 1014CO 0.01 0.02 -0.07 -1.58 -1.11 0.00 0.00 175.55 172.82 3dyo s HIS 1015N -1.00 0.60 0.17 2.71 2.46 -1.26 -0.26 115.29 118.70 3dyo s HIS 1015Ca -0.01 -0.12 -0.18 0.00 0.47 0.00 0.00 55.06 55.22 3dyo s HIS 1015Cb -0.08 -0.38 0.03 0.00 -0.13 0.00 0.00 32.58 32.02 3dyo s HIS 1015CO 0.01 -0.01 0.50 1.52 -2.47 0.00 0.00 174.74 174.29 3dyo s TYR 1016N -0.17 -0.19 -0.05 3.88 -0.85 0.06 -5.01 117.35 115.02 3dyo s TYR 1016Ca 0.02 -0.13 -0.14 0.00 -0.52 0.00 0.00 57.07 56.30 3dyo s TYR 1016Cb -0.03 0.37 0.03 0.00 0.38 0.00 0.00 41.96 42.71 3dyo s TYR 1016CO -0.00 -0.85 0.33 -1.14 -1.52 0.00 0.00 175.55 172.36 3dyo s GLN 1017N -3.84 0.59 0.03 -3.49 2.00 -1.26 -1.02 119.66 112.66 3dyo s GLN 1017Ca 0.07 0.04 -0.00 0.00 -2.00 0.00 0.00 55.36 53.46 3dyo s GLN 1017Cb -0.00 0.27 -0.02 0.00 0.80 0.00 0.00 33.01 34.05 3dyo s GLN 1017CO -0.06 -0.14 -0.03 -0.51 -0.50 0.00 0.00 175.29 174.04 3dyo s LEU 1018N -0.83 2.28 -0.15 3.68 1.43 -0.12 -4.39 118.68 120.58 3dyo s LEU 1018Ca -0.09 -0.57 -0.00 0.00 -1.03 0.00 0.00 54.13 52.44 3dyo s LEU 1018Cb -0.04 0.10 -0.01 0.00 0.03 0.00 0.00 46.19 46.27 3dyo s LEU 1018CO 0.03 -0.34 -0.14 -0.69 0.23 0.00 0.00 176.35 175.45 3dyo s VAL 1019N -1.80 2.86 -0.16 -1.59 1.01 -0.62 -0.31 120.40 119.80 3dyo s VAL 1019Ca -0.13 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 3dyo s VAL 1019Cb -0.08 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 3dyo s VAL 1019CO -0.02 0.51 -0.07 0.86 0.00 0.00 0.00 175.10 176.38 3dyo s TRP 1020N 0.68 2.94 0.33 5.22 -0.11 0.34 -0.96 118.94 127.38 3dyo s TRP 1020Ca -0.07 -0.51 -0.04 0.00 1.22 0.00 0.00 56.10 56.71 3dyo s TRP 1020Cb -0.15 -1.94 0.00 0.00 -1.50 0.00 0.00 33.47 29.87 3dyo s TRP 1020CO 0.02 -0.17 0.47 0.00 -4.62 0.00 0.00 176.95 172.65 3dyo s GLN 1022N -3.17 2.75 0.00 0.00 0.74 -1.26 -0.46 119.66 118.26 3dyo s GLN 1022Ca 0.29 -0.69 0.03 0.00 0.05 0.00 0.00 55.36 55.04 3dyo s GLN 1022Cb -0.00 -2.45 0.02 0.00 1.10 0.00 0.00 33.01 31.68 3dyo s GLN 1022CO 0.18 0.51 0.60 0.36 -0.55 0.00 0.00 175.29 176.39