#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dnu s LYS 3 N 0.00 1.21 -0.24 0.54 1.02 -1.26 -3.15 119.74 117.85 3dnu s LYS 3 Ca 0.00 -0.49 -0.04 0.00 0.02 0.00 0.00 55.97 55.46 3dnu s LYS 3 Cb 0.00 -1.14 -0.00 0.00 -0.52 0.00 0.00 37.83 36.17 3dnu s LYS 3 CO 0.00 0.26 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.17 3dnu s LEU 4 N -0.19 3.17 0.05 3.17 1.43 -0.49 -1.44 118.68 124.37 3dnu s LEU 4 Ca 0.03 -0.52 -0.30 0.00 -1.03 0.00 0.00 54.13 52.31 3dnu s LEU 4 Cb -0.07 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 3dnu s LEU 4 CO 0.00 -0.07 1.01 -0.69 0.23 0.00 0.00 176.35 176.83 3dnu s VAL 5 N 1.47 4.61 -0.29 -1.59 1.01 0.37 -0.92 120.40 125.06 3dnu s VAL 5 Ca 0.04 1.96 -0.13 0.00 0.00 0.00 0.00 61.98 63.85 3dnu s VAL 5 Cb -0.15 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.94 3dnu s VAL 5 CO -0.02 0.20 0.26 -0.89 0.00 0.00 0.00 175.10 174.65 3dnu s THR 6 N 0.69 5.26 0.00 3.92 2.01 0.51 -1.44 115.64 126.59 3dnu s THR 6 Ca 0.51 0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.75 3dnu s THR 6 Cb -0.23 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.65 3dnu s THR 6 CO 0.29 0.17 0.00 0.79 -0.69 0.00 0.00 174.62 175.18 3dnu n TRP 7 N 5.17 0.00 -0.06 4.92 7.02 0.39 -0.12 117.44 134.76 3dnu n TRP 7 Ca -0.12 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 3dnu n TRP 7 Cb 0.51 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.40 3dnu n TRP 7 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 3dnu n ASN 9 N 0.00 0.00 0.00 -0.99 3.02 -1.26 -0.90 115.26 115.13 3dnu n ASN 9 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 3dnu n ASN 9 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 3dnu n ASN 9 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dnu n ASN 10 N 0.29 0.00 -4.51 6.41 5.03 -1.26 -4.97 115.26 116.26 3dnu n ASN 10 Ca 0.00 0.00 -0.35 0.00 0.87 0.00 0.00 54.58 55.10 3dnu n ASN 10 Cb 0.00 -0.89 -0.12 0.00 -1.02 0.00 0.00 39.78 37.76 3dnu n ASN 10 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3dnu s GLN 11 N -0.31 3.73 -0.02 3.52 -1.52 -1.26 -5.08 119.66 118.71 3dnu s GLN 11 Ca 0.00 -0.47 -0.30 0.00 -1.95 0.00 0.00 55.36 52.64 3dnu s GLN 11 Cb 0.00 -3.09 -0.04 0.00 -0.22 0.00 0.00 33.01 29.66 3dnu s GLN 11 CO 0.00 0.13 1.22 0.50 -0.25 0.00 0.00 175.29 176.88 3dnu s ARG 12 N 0.71 4.37 -0.23 2.91 3.52 -1.26 -4.45 118.95 124.52 3dnu s ARG 12 Ca 0.01 1.72 -0.01 0.00 -0.13 0.00 0.00 55.73 57.32 3dnu s ARG 12 Cb -0.14 -3.50 -0.19 0.00 -1.56 0.00 0.00 34.95 29.57 3dnu s ARG 12 CO 0.02 -0.40 -0.10 0.28 -0.81 0.00 0.00 175.30 174.29 3dnu n VAL 13 N 4.41 1.56 -3.40 7.11 0.31 0.83 -4.37 118.33 124.78 3dnu n VAL 13 Ca 0.10 -0.57 0.00 0.00 -0.01 0.00 0.00 64.34 63.86 3dnu n VAL 13 Cb 0.46 -1.52 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 3dnu n VAL 13 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dnu n GLY 14 N 2.14 -0.52 2.95 2.92 0.00 -1.11 -0.77 105.19 110.79 3dnu n GLY 14 Ca -0.43 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.53 3dnu n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dnu s GLU 15 N -1.33 0.29 -0.19 1.61 2.02 -0.57 -0.36 118.70 120.18 3dnu s GLU 15 Ca 0.00 -0.24 -0.08 0.00 0.02 0.00 0.00 54.97 54.67 3dnu s GLU 15 Cb 0.00 -0.22 -0.04 0.00 0.10 0.00 0.00 34.13 33.97 3dnu s GLU 15 CO 0.00 0.05 0.08 -1.17 0.02 0.00 0.00 175.26 174.24 3dnu s LEU 16 N -0.40 3.91 0.05 1.80 2.96 -0.09 -1.92 118.68 124.98 3dnu s LEU 16 Ca -0.02 0.12 0.09 0.00 -0.22 0.00 0.00 54.13 54.10 3dnu s LEU 16 Cb -0.03 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 3dnu s LEU 16 CO -0.00 0.18 -0.26 -0.89 -1.32 0.00 0.00 176.35 174.06 3dnu s THR 17 N 0.35 2.07 -0.25 3.68 2.01 0.47 -1.40 115.64 122.57 3dnu s THR 17 Ca 0.04 -1.37 -0.02 0.00 0.31 0.00 0.00 61.69 60.66 3dnu s THR 17 Cb -0.12 -1.77 0.02 0.00 0.01 0.00 0.00 72.50 70.64 3dnu s THR 17 CO -0.00 0.34 -0.06 -0.75 -0.69 0.00 0.00 174.62 173.45 3dnu s LYS 18 N -1.24 2.89 0.63 4.92 2.20 -1.19 -0.91 119.74 127.03 3dnu s LYS 18 Ca 0.11 -0.94 -0.12 0.00 -0.36 0.00 0.00 55.97 54.66 3dnu s LYS 18 Cb -0.10 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.20 3dnu s LYS 18 CO 0.02 -0.38 1.04 -0.51 -0.36 0.00 0.00 175.35 175.15 3dnu s LEU 19 N 1.34 3.28 0.56 5.43 1.43 0.66 -4.25 118.68 127.13 3dnu s LEU 19 Ca 0.01 1.54 0.25 0.00 -1.03 0.00 0.00 54.13 54.89 3dnu s LEU 19 Cb -0.16 -4.49 1.53 0.00 0.03 0.00 0.00 46.19 43.10 3dnu s LEU 19 CO -0.04 -1.03 2.12 0.00 0.23 0.00 0.00 176.35 177.63 3dnu h ALA 20 N -0.21 1.94 -0.03 4.21 0.00 -2.00 0.30 119.26 123.48 3dnu h ALA 20 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3dnu h ALA 20 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3dnu h ALA 20 CO 0.60 -0.23 0.00 0.27 0.00 0.00 0.00 179.25 179.89 3dnu n ASN 21 N -4.13 0.52 0.00 0.00 2.04 -1.26 -4.92 115.26 107.52 3dnu n ASN 21 Ca 0.01 -1.38 0.00 0.00 -0.44 0.00 0.00 54.58 52.77 3dnu n ASN 21 Cb 0.27 -0.02 0.00 0.00 -2.53 0.00 0.00 39.78 37.50 3dnu n ASN 21 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3dnu n GLY 22 N 0.96 3.34 3.76 4.83 0.00 0.11 -5.05 105.19 113.13 3dnu n GLY 22 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 3dnu n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnu s ALA 23 N -2.36 2.70 -0.12 4.61 0.00 -1.26 -4.63 121.76 120.70 3dnu s ALA 23 Ca 0.00 1.06 -0.02 0.00 0.00 0.00 0.00 51.96 53.00 3dnu s ALA 23 Cb 0.00 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.63 3dnu s ALA 23 CO 0.00 -1.09 -0.05 -1.01 0.00 0.00 0.00 175.76 173.61 3dnu s HIS 24 N -1.52 3.00 0.11 0.00 3.76 -1.26 -0.24 115.29 119.13 3dnu s HIS 24 Ca 0.73 -0.19 0.05 0.00 -0.15 0.00 0.00 55.06 55.50 3dnu s HIS 24 Cb -0.32 -1.87 -0.04 0.00 1.11 0.00 0.00 32.58 31.46 3dnu s HIS 24 CO 0.36 0.09 -0.13 0.95 -0.85 0.00 0.00 174.74 175.17 3dnu s THR 25 N -0.06 1.23 0.02 1.30 -4.23 -0.09 -4.61 115.64 109.20 3dnu s THR 25 Ca 0.01 -1.66 0.03 0.00 -1.18 0.00 0.00 61.69 58.89 3dnu s THR 25 Cb -0.13 -1.45 -0.01 0.00 1.34 0.00 0.00 72.50 72.25 3dnu s THR 25 CO 0.03 -0.42 -0.09 0.12 -0.54 0.00 0.00 174.62 173.71 3dnu s PHE 26 N -2.11 0.81 -0.05 3.99 5.36 -0.48 -0.40 117.98 125.11 3dnu s PHE 26 Ca 0.07 -0.27 -0.00 0.00 -0.96 0.00 0.00 56.93 55.77 3dnu s PHE 26 Cb -0.05 -0.50 0.03 0.00 -0.34 0.00 0.00 43.02 42.15 3dnu s PHE 26 CO 0.02 -0.02 -0.01 0.21 -1.46 0.00 0.00 175.22 173.97 3dnu s LYS 27 N -0.74 0.50 0.45 10.12 2.20 -0.81 -0.08 119.74 131.39 3dnu s LYS 27 Ca -0.00 0.06 -0.23 0.00 -0.36 0.00 0.00 55.97 55.44 3dnu s LYS 27 Cb -0.06 -0.73 -0.08 0.00 -1.51 0.00 0.00 37.83 35.45 3dnu s LYS 27 CO 0.00 -0.19 1.14 0.71 -0.36 0.00 0.00 175.35 176.65 3dnu s TYR 28 N 1.39 2.93 0.24 4.03 1.51 -1.26 -1.51 117.35 124.69 3dnu s TYR 28 Ca -0.04 1.55 -0.30 0.00 -1.01 0.00 0.00 57.07 57.27 3dnu s TYR 28 Cb -0.13 -3.33 -0.09 0.00 -0.11 0.00 0.00 41.96 38.30 3dnu s TYR 28 CO -0.03 -1.35 1.01 0.00 -1.11 0.00 0.00 175.55 174.07 3dnu s ALA 29 N -1.58 3.36 0.28 3.71 0.00 0.05 -4.89 121.76 122.69 3dnu s ALA 29 Ca 0.63 0.73 0.01 0.00 0.00 0.00 0.00 51.96 53.34 3dnu s ALA 29 Cb -0.27 -3.27 0.57 0.00 0.00 0.00 0.00 23.12 20.16 3dnu s ALA 29 CO 0.33 0.04 1.82 -1.35 0.00 0.00 0.00 175.76 176.59 3dnu h PRO 30 N 4.18 0.89 -0.03 0.00 0.11 -1.95 0.14 132.00 135.33 3dnu h PRO 30 Ca -0.45 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 3dnu h PRO 30 Cb 1.21 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3dnu h PRO 30 CO 0.68 0.59 -0.26 1.05 -0.21 0.00 0.00 178.00 179.84 3dnu h GLU 31 N 0.91 0.05 -0.03 1.05 9.09 -1.92 -0.94 114.58 122.80 3dnu h GLU 31 Ca 0.50 -0.01 -0.02 0.00 0.05 0.00 0.00 59.36 59.88 3dnu h GLU 31 Cb 0.56 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 3dnu h GLU 31 CO -0.29 0.32 -0.07 2.35 0.05 0.00 0.00 179.01 181.37 3dnu h TRP 32 N 0.05 0.12 0.00 2.06 2.91 -1.21 -3.23 115.95 116.65 3dnu h TRP 32 Ca 0.01 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 59.97 3dnu h TRP 32 Cb 0.50 -0.02 -0.00 0.00 -0.51 0.00 0.00 29.16 29.12 3dnu h TRP 32 CO 0.00 0.66 -0.05 -0.07 -1.03 0.00 0.00 178.44 177.96 3dnu h LEU 33 N -0.46 0.00 -0.97 0.65 3.38 -1.02 -2.48 115.31 114.40 3dnu h LEU 33 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3dnu h LEU 33 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3dnu h LEU 33 CO 0.01 0.05 -0.12 0.00 0.09 0.00 0.00 178.44 178.47 3dnu h ALA 34 N 1.95 0.99 -2.72 1.53 0.00 -1.19 -3.45 119.26 116.36 3dnu h ALA 34 Ca -0.00 -0.11 -0.52 0.00 0.00 0.00 0.00 54.91 54.27 3dnu h ALA 34 Cb 0.09 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 17.90 3dnu h ALA 34 CO 0.01 0.16 0.66 0.45 0.00 0.00 0.00 179.25 180.52 3dnu s SER 35 N -6.03 6.86 0.23 0.00 0.15 -0.94 -4.89 113.70 109.09 3dnu s SER 35 Ca 0.02 2.47 0.22 0.00 0.70 0.00 0.00 55.95 59.36 3dnu s SER 35 Cb 0.09 -2.62 0.94 0.00 -1.71 0.00 0.00 66.02 62.72 3dnu s SER 35 CO 0.62 -0.54 1.66 -2.11 1.20 0.00 0.00 173.24 174.07 3dnu n ARG 36 N 2.32 0.16 -0.44 5.44 1.85 -1.26 -2.02 116.66 122.71 3dnu n ARG 36 Ca 0.05 0.43 0.08 0.00 -1.00 0.00 0.00 57.85 57.41 3dnu n ARG 36 Cb 0.42 -1.83 0.26 0.00 -1.05 0.00 0.00 32.46 30.26 3dnu n ARG 36 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3dnu n TYR 37 N -2.15 1.02 -1.67 2.89 4.02 -1.26 -4.81 117.16 115.20 3dnu n TYR 37 Ca 0.02 -0.70 -0.39 0.00 -0.01 0.00 0.00 57.90 56.82 3dnu n TYR 37 Cb 0.20 -0.23 0.04 0.00 -0.02 0.00 0.00 39.34 39.33 3dnu n TYR 37 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dnu n ALA 38 N 0.25 0.77 -2.91 -0.72 0.00 -0.85 -3.67 120.51 113.37 3dnu n ALA 38 Ca 0.20 0.09 -0.09 0.00 0.00 0.00 0.00 53.44 53.65 3dnu n ALA 38 Cb 0.79 -2.21 -0.11 0.00 0.00 0.00 0.00 19.45 17.92 3dnu n ALA 38 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3dnu s ARG 39 N -2.70 0.34 0.65 0.00 1.70 -1.26 -1.21 118.95 116.47 3dnu s ARG 39 Ca 0.72 -0.66 -0.13 0.00 -0.47 0.00 0.00 55.73 55.19 3dnu s ARG 39 Cb -0.44 0.12 -0.01 0.00 -0.57 0.00 0.00 34.95 34.05 3dnu s ARG 39 CO 0.49 -0.06 1.06 -1.25 -1.08 0.00 0.00 175.30 174.46 3dnu s PRO 40 N -1.67 3.13 0.37 3.89 0.04 -1.26 -4.94 135.00 134.56 3dnu s PRO 40 Ca -0.14 1.05 0.11 0.00 0.04 0.00 0.00 61.00 62.06 3dnu s PRO 40 Cb -0.08 -2.01 0.73 0.00 0.04 0.00 0.00 34.50 33.17 3dnu s PRO 40 CO -0.02 -0.95 1.85 1.25 0.04 0.00 0.00 177.00 179.17 3dnu h LEU 41 N -0.19 0.09 -7.30 -3.56 5.85 -1.96 -3.45 115.31 104.79 3dnu h LEU 41 Ca -0.45 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.17 3dnu h LEU 41 Cb 1.21 -0.03 -0.17 0.00 0.37 0.00 0.00 40.66 42.05 3dnu h LEU 41 CO 0.57 0.39 -0.05 -0.55 -0.34 0.00 0.00 178.44 178.47 3dnu s SER 42 N -6.92 -0.36 0.16 1.25 0.15 -1.26 -4.91 113.70 101.81 3dnu s SER 42 Ca -0.04 0.12 0.21 0.00 0.70 0.00 0.00 55.95 56.94 3dnu s SER 42 Cb 0.15 0.45 0.86 0.00 -1.71 0.00 0.00 66.02 65.77 3dnu s SER 42 CO 0.73 -0.66 1.64 0.18 1.20 0.00 0.00 173.24 176.33 3dnu n LEU 43 N 0.56 0.44 -0.28 3.45 4.77 -1.26 -0.93 117.00 123.74 3dnu n LEU 43 Ca -0.19 0.60 0.14 0.00 -0.03 0.00 0.00 56.01 56.53 3dnu n LEU 43 Cb 0.59 -0.53 0.49 0.00 -2.33 0.00 0.00 43.42 41.64 3dnu n LEU 43 CO 0.20 -0.42 0.78 -1.54 -1.33 0.00 0.00 177.39 175.08 3dnu n SER 44 N -1.97 1.02 -3.20 -1.43 3.41 -1.24 -4.27 113.62 105.94 3dnu n SER 44 Ca 0.03 -1.02 -0.24 0.00 -0.26 0.00 0.00 58.87 57.38 3dnu n SER 44 Cb 0.23 0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.17 3dnu n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dnu n LEU 45 N -0.47 2.14 -4.63 1.04 4.77 -0.11 -4.91 117.00 114.83 3dnu n LEU 45 Ca 0.15 -5.17 -0.39 0.00 -0.03 0.00 0.00 56.01 50.57 3dnu n LEU 45 Cb 0.33 0.08 0.04 0.00 -2.33 0.00 0.00 43.42 41.53 3dnu n LEU 45 CO 0.22 2.18 0.62 -0.81 -1.33 0.00 0.00 177.39 178.27 3dnu n PRO 46 N 0.65 1.20 -1.70 3.23 -0.04 -1.25 -4.28 135.00 132.80 3dnu n PRO 46 Ca 0.26 0.44 -0.43 0.00 -0.04 0.00 0.00 63.50 63.73 3dnu n PRO 46 Cb 0.50 -2.18 -0.02 0.00 -0.04 0.00 0.00 33.50 31.76 3dnu n PRO 46 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dnu n LEU 47 N -0.30 3.65 -3.58 1.53 4.77 -1.26 -4.96 117.00 116.85 3dnu n LEU 47 Ca 0.11 1.13 -0.06 0.00 -0.03 0.00 0.00 56.01 57.17 3dnu n LEU 47 Cb 0.44 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.01 3dnu n LEU 47 CO 0.53 -0.19 0.78 0.00 -1.33 0.00 0.00 177.39 177.19 3dnu s GLN 48 N -0.26 0.76 0.04 3.23 -2.07 -1.26 -5.10 119.66 115.00 3dnu s GLN 48 Ca 0.68 -0.32 0.14 0.00 -1.82 0.00 0.00 55.36 54.03 3dnu s GLN 48 Cb -0.58 0.32 -0.17 0.00 -1.09 0.00 0.00 33.01 31.49 3dnu s GLN 48 CO 0.47 -0.34 0.86 0.00 -1.32 0.00 0.00 175.29 174.96 3dnu h ARG 49 N 2.00 0.00 -7.30 9.60 3.08 -1.94 -3.40 114.38 116.41 3dnu h ARG 49 Ca -0.21 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.38 3dnu h ARG 49 Cb 1.22 0.00 0.11 0.00 0.08 0.00 0.00 29.97 31.38 3dnu h ARG 49 CO 0.28 0.47 0.19 0.20 -1.07 0.00 0.00 179.97 180.04 3dnu s GLY 50 N -4.89 1.76 0.30 0.04 0.00 -1.26 -4.77 107.32 98.50 3dnu s GLY 50 Ca -0.03 -1.72 -0.29 0.00 0.00 0.00 0.00 44.72 42.68 3dnu s GLY 50 CO 0.81 -1.05 1.36 -1.31 0.00 0.00 0.00 173.10 172.91 3dnu s ASN 51 N -4.83 6.71 -0.19 1.64 0.01 -1.26 -4.61 114.94 112.41 3dnu s ASN 51 Ca 0.70 2.69 -0.07 0.00 -0.71 0.00 0.00 52.86 55.47 3dnu s ASN 51 Cb -0.04 -2.64 -0.04 0.00 0.41 0.00 0.00 41.25 38.94 3dnu s ASN 51 CO 0.47 -0.61 0.06 -0.63 -1.51 0.00 0.00 177.10 174.88 3dnu s ILE 52 N -0.69 4.78 0.00 0.60 1.01 0.88 -4.94 121.20 122.84 3dnu s ILE 52 Ca 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 61.14 3dnu s ILE 52 Cb -0.41 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 38.90 3dnu s ILE 52 CO 0.50 0.45 0.58 0.35 0.00 0.00 0.00 174.94 176.82 3dnu n THR 53 N 3.61 0.22 -0.83 2.92 -2.24 -1.26 -1.38 114.28 115.31 3dnu n THR 53 Ca -0.16 -0.57 -0.30 0.00 -2.27 0.00 0.00 64.05 60.75 3dnu n THR 53 Cb 0.52 0.96 0.17 0.00 -2.10 0.00 0.00 70.33 69.88 3dnu n THR 53 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3dnu s SER 54 N -0.22 2.70 0.43 3.42 1.04 -1.26 -4.88 113.70 114.92 3dnu s SER 54 Ca 0.00 1.82 0.30 0.00 0.48 0.00 0.00 55.95 58.55 3dnu s SER 54 Cb 0.00 -2.41 1.44 0.00 0.10 0.00 0.00 66.02 65.15 3dnu s SER 54 CO 0.00 -3.17 1.90 0.44 0.98 0.00 0.00 173.24 173.39 3dnu h ASP 55 N -1.92 0.00 0.13 7.02 3.32 -1.95 -2.08 116.42 120.95 3dnu h ASP 55 Ca -0.49 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.54 3dnu h ASP 55 Cb 1.28 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.83 3dnu h ASP 55 CO 0.48 0.00 -0.10 0.00 -1.72 0.00 0.00 179.24 177.90 3dnu h ALA 56 N 2.08 1.70 0.53 3.45 0.00 -1.90 -0.98 119.26 124.14 3dnu h ALA 56 Ca 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3dnu h ALA 56 Cb 0.21 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.99 3dnu h ALA 56 CO 0.00 0.13 -0.26 0.28 0.00 0.00 0.00 179.25 179.40 3dnu h VAL 57 N 0.00 0.35 -0.46 0.00 2.07 -1.70 -0.58 116.25 115.94 3dnu h VAL 57 Ca -0.00 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.21 3dnu h VAL 57 Cb 0.20 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 3dnu h VAL 57 CO 0.01 0.05 0.17 0.15 0.02 0.00 0.00 177.57 177.97 3dnu h PHE 58 N -0.98 0.31 -0.53 1.57 3.57 -1.67 -2.75 116.94 116.46 3dnu h PHE 58 Ca -0.07 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.46 3dnu h PHE 58 Cb 0.63 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 3dnu h PHE 58 CO 0.00 0.12 0.35 -0.91 -2.23 0.00 0.00 178.31 175.64 3dnu h ASN 59 N 0.35 0.60 0.04 0.41 2.35 -1.18 -0.13 115.58 118.02 3dnu h ASN 59 Ca 0.21 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.97 3dnu h ASN 59 Cb 0.20 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 3dnu h ASN 59 CO -0.21 0.43 -0.15 0.15 -1.65 0.00 0.00 177.43 176.01 3dnu h PHE 60 N 0.71 -0.38 -0.00 1.19 3.57 -0.82 -0.78 116.94 120.43 3dnu h PHE 60 Ca 0.20 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.60 3dnu h PHE 60 Cb -0.07 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3dnu h PHE 60 CO -0.04 -0.22 -0.51 0.74 -2.23 0.00 0.00 178.31 176.05 3dnu h PHE 61 N -0.27 0.01 -0.30 0.41 -1.00 -1.33 -2.81 116.94 111.66 3dnu h PHE 61 Ca 0.04 -0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.71 3dnu h PHE 61 Cb 0.31 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 3dnu h PHE 61 CO -0.18 0.52 -0.25 0.22 -1.61 0.00 0.00 178.31 177.00 3dnu h ASP 62 N 0.01 0.60 0.33 2.17 3.58 -0.78 -2.33 116.42 120.00 3dnu h ASP 62 Ca -0.00 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.23 3dnu h ASP 62 Cb 0.90 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.79 3dnu h ASP 62 CO 0.07 0.84 0.00 0.59 -2.88 0.00 0.00 179.24 177.85 3dnu n ASN 63 N -4.11 0.00 0.12 2.28 3.02 -0.32 -1.95 115.26 114.30 3dnu n ASN 63 Ca -0.00 0.24 0.13 0.00 -0.03 0.00 0.00 54.58 54.91 3dnu n ASN 63 Cb 0.42 -0.36 0.30 0.00 -0.61 0.00 0.00 39.78 39.53 3dnu n ASN 63 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3dnu h LEU 64 N 0.00 0.00-10.11 3.41 3.38 -1.43 -3.46 115.31 107.09 3dnu h LEU 64 Ca 0.00 -0.05 -0.48 0.00 0.09 0.00 0.00 57.88 57.44 3dnu h LEU 64 Cb 0.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3dnu h LEU 64 CO 0.00 0.02 -0.45 -0.76 0.09 0.00 0.00 178.44 177.34 3dnu s LEU 65 N -4.80 4.24 0.45 1.67 1.43 -0.82 -3.97 118.68 116.88 3dnu s LEU 65 Ca 0.09 0.04 -0.25 0.00 -1.03 0.00 0.00 54.13 52.97 3dnu s LEU 65 Cb 0.11 -2.78 -0.09 0.00 0.03 0.00 0.00 46.19 43.46 3dnu s LEU 65 CO 0.65 -0.04 1.32 -2.65 0.23 0.00 0.00 176.35 175.85 3dnu n PRO 66 N -1.21 1.97 0.09 1.29 -0.02 -1.24 -4.59 135.00 131.30 3dnu n PRO 66 Ca -0.09 0.71 -0.03 0.00 -2.02 0.00 0.00 63.50 62.07 3dnu n PRO 66 Cb 0.57 -2.47 0.19 0.00 -0.02 0.00 0.00 33.50 31.77 3dnu n PRO 66 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3dnu h ASP 67 N 2.03 0.24 -2.94 2.55 3.45 -1.80 -3.46 116.42 116.50 3dnu h ASP 67 Ca -0.49 -0.11 -0.54 0.00 0.43 0.00 0.00 57.03 56.31 3dnu h ASP 67 Cb 1.29 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.99 3dnu h ASP 67 CO 0.60 0.68 0.80 -0.55 -1.57 0.00 0.00 179.24 179.20 3dnu s SER 68 N -6.88 6.88 0.39 6.45 0.15 -1.26 -4.92 113.70 114.50 3dnu s SER 68 Ca -0.04 2.08 0.11 0.00 0.70 0.00 0.00 55.95 58.80 3dnu s SER 68 Cb 0.13 -2.56 0.78 0.00 -1.71 0.00 0.00 66.02 62.66 3dnu s SER 68 CO 0.78 -0.69 1.89 -0.65 1.20 0.00 0.00 173.24 175.77 3dnu h PRO 69 N 7.70 0.15 -0.42 5.44 0.11 -1.97 -1.49 132.00 141.52 3dnu h PRO 69 Ca -0.38 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 3dnu h PRO 69 Cb 1.18 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 3dnu h PRO 69 CO 0.89 0.36 0.04 0.82 -0.21 0.00 0.00 178.00 179.91 3dnu h ILE 70 N 0.14 1.25 -0.70 4.15 5.03 -1.99 -1.48 117.51 123.91 3dnu h ILE 70 Ca 0.02 -0.93 -0.04 0.00 -0.12 0.00 0.00 64.86 63.79 3dnu h ILE 70 Cb 0.46 1.04 -0.03 0.00 -3.03 0.00 0.00 36.82 35.26 3dnu h ILE 70 CO 0.03 0.32 0.26 0.58 -0.68 0.00 0.00 178.15 178.66 3dnu h VAL 71 N 0.55 1.25 -0.21 1.67 2.07 -1.77 -2.40 116.25 117.41 3dnu h VAL 71 Ca 0.12 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 3dnu h VAL 71 Cb 0.41 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3dnu h VAL 71 CO 0.01 0.32 0.00 0.03 0.02 0.00 0.00 177.57 177.96 3dnu h ARG 72 N 1.00 0.31 -0.61 1.57 3.08 -1.03 -1.01 114.38 117.69 3dnu h ARG 72 Ca 0.23 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.15 3dnu h ARG 72 Cb 0.23 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3dnu h ARG 72 CO -0.02 0.34 0.04 -0.44 -1.07 0.00 0.00 179.97 178.82 3dnu h ASP 73 N 0.31 1.00 -0.39 7.04 3.32 -0.79 -1.71 116.42 125.20 3dnu h ASP 73 Ca 0.07 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 56.79 3dnu h ASP 73 Cb 0.20 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3dnu h ASP 73 CO 0.00 1.03 -0.02 0.03 -1.72 0.00 0.00 179.24 178.57 3dnu h ARG 74 N 0.95 0.78 -0.25 3.56 3.08 -0.85 -2.04 114.38 119.62 3dnu h ARG 74 Ca 0.18 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 3dnu h ARG 74 Cb 0.49 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3dnu h ARG 74 CO 0.02 0.80 0.10 0.82 -1.07 0.00 0.00 179.97 180.64 3dnu h ILE 75 N 0.73 1.17 -0.76 2.04 2.04 -0.90 -0.76 117.51 121.06 3dnu h ILE 75 Ca 0.14 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.50 3dnu h ILE 75 Cb 0.47 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 3dnu h ILE 75 CO 0.02 0.17 0.50 0.58 0.00 0.00 0.00 178.15 179.42 3dnu h VAL 76 N 0.25 1.18 -0.57 1.67 2.07 -1.11 -2.33 116.25 117.41 3dnu h VAL 76 Ca 0.08 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 3dnu h VAL 76 Cb 0.17 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 3dnu h VAL 76 CO -0.01 0.19 0.21 0.50 0.02 0.00 0.00 177.57 178.48 3dnu h LYS 77 N 1.02 0.87 0.71 1.57 1.63 -1.17 -0.41 116.57 120.78 3dnu h LYS 77 Ca 0.28 -0.17 -0.04 0.00 -0.85 0.00 0.00 60.65 59.88 3dnu h LYS 77 Cb -0.09 -0.13 0.01 0.00 -0.60 0.00 0.00 32.23 31.41 3dnu h LYS 77 CO -0.07 0.76 -0.34 0.00 -3.45 0.00 0.00 179.45 176.35 3dnu h ARG 78 N 0.79 -0.92 -0.65 1.90 3.08 -0.72 -3.26 114.38 114.59 3dnu h ARG 78 Ca 0.19 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3dnu h ARG 78 Cb 0.23 0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.49 3dnu h ARG 78 CO -0.01 -0.62 0.00 0.66 -1.07 0.00 0.00 179.97 178.93 3dnu n TYR 79 N -4.60 1.10 -3.90 3.04 4.02 -0.91 -4.91 117.16 110.99 3dnu n TYR 79 Ca -0.12 -0.41 -0.28 0.00 -0.01 0.00 0.00 57.90 57.08 3dnu n TYR 79 Cb 0.38 -0.25 0.02 0.00 -0.02 0.00 0.00 39.34 39.46 3dnu n TYR 79 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 3dnu n HIS 80 N 0.54 -2.06 -1.56 -0.72 8.25 -0.27 -4.87 115.22 114.53 3dnu n HIS 80 Ca 0.17 0.86 -0.37 0.00 -0.26 0.00 0.00 57.72 58.11 3dnu n HIS 80 Cb 0.71 -3.93 0.06 0.00 1.12 0.00 0.00 29.99 27.95 3dnu n HIS 80 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dnu n ALA 81 N -4.51 0.01 -0.13 -1.41 0.00 -0.59 -4.88 120.51 109.00 3dnu n ALA 81 Ca -0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 53.44 53.31 3dnu n ALA 81 Cb 0.58 -2.09 0.25 0.00 0.00 0.00 0.00 19.45 18.18 3dnu n ALA 81 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dnu h LYS 82 N 0.28 0.81 0.00 0.00 1.57 -1.89 -3.47 116.57 113.88 3dnu h LYS 82 Ca -0.48 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.16 3dnu h LYS 82 Cb 1.36 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.52 3dnu h LYS 82 CO 0.50 0.65 0.05 -1.13 -0.57 0.00 0.00 179.45 178.95 3dnu n SER 83 N -4.34 -0.56 0.04 0.86 3.41 -1.26 -5.03 113.62 106.73 3dnu n SER 83 Ca 0.05 -1.44 0.12 0.00 -0.26 0.00 0.00 58.87 57.33 3dnu n SER 83 Cb 0.15 0.95 0.18 0.00 -0.26 0.00 0.00 64.21 65.23 3dnu n SER 83 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3dnu n ARG 84 N -0.15 0.19 -1.71 4.33 1.74 -1.26 -4.61 116.66 115.19 3dnu n ARG 84 Ca -0.02 0.05 -0.39 0.00 -0.77 0.00 0.00 57.85 56.72 3dnu n ARG 84 Cb 0.16 -1.61 0.04 0.00 -1.02 0.00 0.00 32.46 30.02 3dnu n ARG 84 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3dnu n GLN 85 N -1.89 1.62 -0.20 5.56 1.13 -1.26 -4.80 117.38 117.54 3dnu n GLN 85 Ca 0.04 0.59 0.00 0.00 -1.94 0.00 0.00 57.00 55.69 3dnu n GLN 85 Cb 0.40 -2.46 0.11 0.00 0.11 0.00 0.00 30.24 28.40 3dnu n GLN 85 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 3dnu h PRO 86 N 1.44 0.33 -0.97 -1.09 0.11 -1.99 -2.20 132.00 127.62 3dnu h PRO 86 Ca -0.50 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.67 3dnu h PRO 86 Cb 1.31 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 32.28 3dnu h PRO 86 CO 0.57 0.22 0.63 0.35 -0.21 0.00 0.00 178.00 179.55 3dnu h PHE 87 N 0.34 1.13 0.00 0.65 3.57 -1.97 0.25 116.94 120.92 3dnu h PHE 87 Ca 0.31 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.71 3dnu h PHE 87 Cb 0.41 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 3dnu h PHE 87 CO -0.20 0.56 -0.62 -0.44 -2.23 0.00 0.00 178.31 175.37 3dnu h ASP 88 N 1.08 0.00 -0.17 0.41 3.32 -1.75 -1.98 116.42 117.34 3dnu h ASP 88 Ca 0.43 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.36 3dnu h ASP 88 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3dnu h ASP 88 CO -0.18 0.62 -0.37 -0.07 -1.72 0.00 0.00 179.24 177.52 3dnu h LEU 89 N 0.00 0.61 -1.67 1.55 3.38 -0.71 -2.98 115.31 115.48 3dnu h LEU 89 Ca -0.01 -0.56 -0.03 0.00 0.09 0.00 0.00 57.88 57.37 3dnu h LEU 89 Cb 1.23 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 3dnu h LEU 89 CO 0.08 1.06 -0.15 -0.07 0.09 0.00 0.00 178.44 179.45 3dnu h LEU 90 N 0.19 0.00 -1.47 1.67 3.38 -0.96 -1.33 115.31 116.79 3dnu h LEU 90 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dnu h LEU 90 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3dnu h LEU 90 CO 0.08 0.15 0.00 0.28 0.09 0.00 0.00 178.44 179.04 3dnu h SER 91 N 0.00 0.00 0.00 -0.43 0.02 -1.20 -0.21 113.55 111.74 3dnu h SER 91 Ca -0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.65 3dnu h SER 91 Cb 0.47 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.95 3dnu h SER 91 CO 0.02 0.00 -2.10 -0.62 -1.14 0.00 0.00 176.83 172.99 3dnu n GLU 92 N -2.71 0.47 -0.05 3.45 -0.58 -0.59 -4.76 120.64 115.88 3dnu n GLU 92 Ca 0.00 0.12 0.02 0.00 -0.42 0.00 0.00 57.16 56.88 3dnu n GLU 92 Cb 0.21 -1.36 0.04 0.00 -0.57 0.00 0.00 31.44 29.75 3dnu n GLU 92 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 3dnu n ILE 93 N -3.16 0.99 1.32 -3.67 -5.35 -0.70 -4.62 119.36 104.17 3dnu n ILE 93 Ca -0.35 -0.99 0.11 0.00 -0.27 0.00 0.00 62.75 61.25 3dnu n ILE 93 Cb 0.85 0.51 0.64 0.00 -1.74 0.00 0.00 39.64 39.90 3dnu n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dnu n GLY 94 N -0.22 -0.74 0.30 3.28 0.00 -0.09 -2.66 105.19 105.05 3dnu n GLY 94 Ca 0.03 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.85 3dnu n GLY 94 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3dnu h ARG 95 N 0.00 1.03 -4.22 1.61 2.43 -1.62 -0.68 114.38 112.93 3dnu h ARG 95 Ca 0.00 -0.21 -0.62 0.00 -0.81 0.00 0.00 59.98 58.34 3dnu h ARG 95 Cb 0.03 -0.16 -0.39 0.00 -0.42 0.00 0.00 29.97 29.04 3dnu h ARG 95 CO 0.00 0.88 -0.76 0.34 -1.51 0.00 0.00 179.97 178.93 3dnu s ASP 96 N -6.27 4.17 0.46 -3.80 -1.08 -0.95 -4.52 116.67 104.69 3dnu s ASP 96 Ca -0.12 -1.59 0.01 0.00 -0.52 0.00 0.00 52.55 50.32 3dnu s ASP 96 Cb 0.14 -1.22 -0.00 0.00 -1.46 0.00 0.00 42.92 40.38 3dnu s ASP 96 CO 0.82 -0.33 0.02 -1.20 0.52 0.00 0.00 175.17 175.01 3dnu n SER 97 N 4.60 2.95 -4.76 -0.34 7.64 -1.25 -0.37 113.62 122.09 3dnu n SER 97 Ca -0.04 -3.08 -0.36 0.00 1.01 0.00 0.00 58.87 56.39 3dnu n SER 97 Cb 0.43 0.45 0.02 0.00 -1.01 0.00 0.00 64.21 64.10 3dnu n SER 97 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3dnu s VAL 98 N -2.77 2.76 0.00 0.44 1.01 -1.25 -4.67 120.40 115.92 3dnu s VAL 98 Ca 0.03 0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.51 3dnu s VAL 98 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3dnu s VAL 98 CO 0.02 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.65 3dnu n GLY 99 N 0.45 0.34 0.42 4.51 0.00 -1.26 -4.18 105.19 105.46 3dnu n GLY 99 Ca 0.12 -0.89 0.04 0.00 0.00 0.00 0.00 46.02 45.29 3dnu n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnu n ALA 100 N 5.59 2.16 -2.52 4.61 0.00 -1.21 -4.37 120.51 124.77 3dnu n ALA 100 Ca 0.00 -1.03 -0.43 0.00 0.00 0.00 0.00 53.44 51.98 3dnu n ALA 100 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 3dnu n ALA 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3dnu s VAL 101 N -0.96 4.43 -0.20 0.00 -7.23 -1.26 -4.20 120.40 110.98 3dnu s VAL 101 Ca 0.15 1.73 -0.01 0.00 -1.81 0.00 0.00 61.98 62.04 3dnu s VAL 101 Cb 0.08 -4.12 0.01 0.00 0.56 0.00 0.00 36.38 32.91 3dnu s VAL 101 CO 0.11 -0.10 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.78 3dnu s THR 102 N 2.94 2.61 -0.19 5.32 2.01 -0.08 -3.85 115.64 124.41 3dnu s THR 102 Ca 0.52 -0.82 -0.04 0.00 0.31 0.00 0.00 61.69 61.65 3dnu s THR 102 Cb -0.20 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.11 3dnu s THR 102 CO 0.15 0.44 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.74 3dnu s LEU 103 N 1.35 3.22 -0.04 4.42 1.43 -0.26 -0.47 118.68 128.34 3dnu s LEU 103 Ca 0.04 -0.19 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 3dnu s LEU 103 Cb -0.14 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.30 3dnu s LEU 103 CO -0.08 0.10 -0.05 -0.63 0.23 0.00 0.00 176.35 175.91 3dnu s ILE 104 N 0.81 0.53 0.39 -0.59 1.01 -0.52 -3.68 121.20 119.15 3dnu s ILE 104 Ca -0.00 -0.14 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 3dnu s ILE 104 Cb -0.14 -0.54 -0.11 0.00 0.01 0.00 0.00 42.46 41.67 3dnu s ILE 104 CO 0.02 0.21 1.01 -2.65 0.00 0.00 0.00 174.94 173.54 3dnu n PRO 105 N 3.89 1.38 0.16 2.79 -0.02 -1.26 -0.48 135.00 141.46 3dnu n PRO 105 Ca -0.24 0.49 0.05 0.00 -2.02 0.00 0.00 63.50 61.78 3dnu n PRO 105 Cb 0.52 -2.01 0.50 0.00 -0.02 0.00 0.00 33.50 32.48 3dnu n PRO 105 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3dnu h GLU 106 N 1.66 0.17 -0.82 -0.52 4.57 -1.61 -2.14 114.58 115.88 3dnu h GLU 106 Ca -0.44 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3dnu h GLU 106 Cb 1.34 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 3dnu h GLU 106 CO 0.58 0.21 0.00 -0.40 -1.18 0.00 0.00 179.01 178.22 3dnu n ASP 107 N -4.41 0.82 -4.43 1.04 5.75 -1.26 -4.78 116.55 109.28 3dnu n ASP 107 Ca -0.01 -1.81 -0.30 0.00 -0.01 0.00 0.00 54.79 52.66 3dnu n ASP 107 Cb 0.17 -0.41 -0.13 0.00 -1.03 0.00 0.00 41.12 39.72 3dnu n ASP 107 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 3dnu s GLU 108 N -1.10 1.83 0.00 0.11 2.56 -0.81 -5.28 118.70 116.01 3dnu s GLU 108 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.97 53.85 3dnu s GLU 108 Cb 0.00 -2.08 0.00 0.00 2.00 0.00 0.00 34.13 34.05 3dnu s GLU 108 CO 0.00 0.50 0.00 2.41 -0.56 0.00 0.00 175.26 177.61 3dnu n THR 109 N 1.30 0.00 -0.09 -1.70 -1.04 -1.26 -4.97 114.28 106.52 3dnu n THR 109 Ca -0.16 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 61.66 3dnu n THR 109 Cb 0.52 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.97 3dnu n THR 109 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 3dnu n ILE 114 N 0.00 1.00 0.00 12.58 -5.35 -1.26 -5.25 119.36 121.08 3dnu n ILE 114 Ca 0.00 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 3dnu n ILE 114 Cb 0.00 -1.76 0.00 0.00 -1.74 0.00 0.00 39.64 36.14 3dnu n ILE 114 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dnu n ALA 116 N -3.81 0.00 -3.72 -1.28 0.00 -1.26 -4.76 120.51 105.67 3dnu n ALA 116 Ca -0.33 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.03 3dnu n ALA 116 Cb 0.72 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.14 3dnu n ALA 116 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 3dnu s TRP 117 N -2.05 -0.06 -0.16 0.00 -2.14 -1.26 -1.44 118.94 111.83 3dnu s TRP 117 Ca 0.00 -0.39 0.01 0.00 2.66 0.00 0.00 56.10 58.38 3dnu s TRP 117 Cb 0.00 0.61 0.02 0.00 -3.10 0.00 0.00 33.47 31.00 3dnu s TRP 117 CO 0.00 -1.21 -0.18 -2.00 -2.66 0.00 0.00 176.95 170.90 3dnu s GLU 118 N -3.85 2.72 0.31 3.25 2.12 -0.12 -4.90 118.70 118.23 3dnu s GLU 118 Ca 0.14 -0.73 -0.28 0.00 0.36 0.00 0.00 54.97 54.46 3dnu s GLU 118 Cb -0.05 -2.35 -0.09 0.00 0.26 0.00 0.00 34.13 31.90 3dnu s GLU 118 CO 0.08 -0.17 1.07 0.21 -0.54 0.00 0.00 175.26 175.90 3dnu s LYS 119 N 1.25 4.54 -0.13 4.30 2.20 -1.26 -0.87 119.74 129.76 3dnu s LYS 119 Ca 0.02 1.70 -0.06 0.00 -0.36 0.00 0.00 55.97 57.27 3dnu s LYS 119 Cb -0.14 -3.03 -0.04 0.00 -1.51 0.00 0.00 37.83 33.11 3dnu s LYS 119 CO -0.10 0.15 0.08 -0.51 -0.36 0.00 0.00 175.35 174.61 3dnu s LEU 120 N -1.73 3.98 0.73 5.43 1.43 -0.49 -4.91 118.68 123.13 3dnu s LEU 120 Ca 0.47 0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.71 3dnu s LEU 120 Cb -0.29 -1.97 0.03 0.00 0.03 0.00 0.00 46.19 43.99 3dnu s LEU 120 CO 0.37 0.32 1.09 0.42 0.23 0.00 0.00 176.35 178.77 3dnu s THR 121 N -0.48 3.53 0.35 5.49 -4.23 -1.26 -4.65 115.64 114.38 3dnu s THR 121 Ca 0.10 0.50 0.05 0.00 -1.18 0.00 0.00 61.69 61.16 3dnu s THR 121 Cb -0.12 -3.37 0.30 0.00 1.34 0.00 0.00 72.50 70.65 3dnu s THR 121 CO 0.02 -0.65 1.93 -0.08 -0.54 0.00 0.00 174.62 175.30 3dnu h GLU 122 N -0.79 0.79 -0.38 3.99 4.81 -1.99 0.31 114.58 121.32 3dnu h GLU 122 Ca -0.45 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.67 3dnu h GLU 122 Cb 1.25 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 3dnu h GLU 122 CO 0.61 0.52 0.02 0.00 -0.73 0.00 0.00 179.01 179.43 3dnu h ALA 123 N 1.58 0.51 0.00 2.92 0.00 -1.98 -1.56 119.26 120.73 3dnu h ALA 123 Ca 0.36 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3dnu h ALA 123 Cb 0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3dnu h ALA 123 CO -0.14 0.26 -0.54 -0.09 0.00 0.00 0.00 179.25 178.75 3dnu h ARG 124 N 0.49 0.00 -0.18 0.00 2.43 -1.66 -1.85 114.38 113.61 3dnu h ARG 124 Ca 0.11 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 3dnu h ARG 124 Cb 0.43 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 3dnu h ARG 124 CO 0.02 0.54 -0.04 1.25 -1.51 0.00 0.00 179.97 180.23 3dnu h LEU 125 N 0.00 0.34 -0.85 3.80 5.85 -0.82 0.15 115.31 123.77 3dnu h LEU 125 Ca -0.01 -0.36 0.04 0.00 0.84 0.00 0.00 57.88 58.39 3dnu h LEU 125 Cb 1.01 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.89 3dnu h LEU 125 CO 0.07 0.62 0.55 -0.08 -0.34 0.00 0.00 178.44 179.26 3dnu h GLU 126 N 0.05 1.02 0.02 1.25 4.81 -1.16 0.65 114.58 121.22 3dnu h GLU 126 Ca 0.05 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3dnu h GLU 126 Cb 0.47 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3dnu h GLU 126 CO 0.02 0.68 -0.01 1.49 -0.73 0.00 0.00 179.01 180.45 3dnu h GLU 127 N 1.05 -0.02 -0.65 1.92 4.81 -1.10 0.14 114.58 120.72 3dnu h GLU 127 Ca 0.35 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 3dnu h GLU 127 Cb 0.03 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 3dnu h GLU 127 CO -0.13 0.09 0.38 0.28 -0.73 0.00 0.00 179.01 178.90 3dnu h VAL 128 N -0.13 1.20 0.03 0.32 2.07 -0.17 -2.58 116.25 116.99 3dnu h VAL 128 Ca -0.00 -0.46 -0.27 0.00 0.82 0.00 0.00 66.70 66.79 3dnu h VAL 128 Cb 0.12 0.32 0.02 0.00 -1.52 0.00 0.00 31.29 30.23 3dnu h VAL 128 CO 0.00 0.21 -1.06 -0.07 0.02 0.00 0.00 177.57 176.67 3dnu h LEU 129 N 0.89 0.88 -1.11 2.57 3.38 -0.73 -3.24 115.31 117.96 3dnu h LEU 129 Ca 0.23 -0.76 -0.05 0.00 0.09 0.00 0.00 57.88 57.39 3dnu h LEU 129 Cb 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 3dnu h LEU 129 CO -0.04 1.54 0.12 0.71 0.09 0.00 0.00 178.44 180.85 3dnu h THR 130 N 0.33 1.21 -0.11 0.22 1.35 -0.75 -2.58 112.91 112.59 3dnu h THR 130 Ca -0.14 -0.77 0.03 0.00 -0.55 0.00 0.00 66.41 64.98 3dnu h THR 130 Cb 1.73 0.71 -0.00 0.00 -1.73 0.00 0.00 68.15 68.86 3dnu h THR 130 CO 0.21 0.28 0.42 0.00 -0.25 0.00 0.00 175.52 176.18 3dnu h ALA 131 N 1.40 1.58 0.00 6.62 0.00 -1.48 -0.61 119.26 126.78 3dnu h ALA 131 Ca 0.16 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 3dnu h ALA 131 Cb 0.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3dnu h ALA 131 CO -0.00 -0.48 -0.55 1.88 0.00 0.00 0.00 179.25 180.10 3dnu h TYR 132 N 0.00 0.00 0.02 0.00 -1.99 -1.59 -3.24 116.97 110.16 3dnu h TYR 132 Ca 0.05 0.00 -0.23 0.00 2.00 0.00 0.00 58.73 60.55 3dnu h TYR 132 Cb 0.89 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.60 3dnu h TYR 132 CO 0.00 0.44 -1.14 0.87 -0.00 0.00 0.00 178.16 178.33 3dnu h LYS 133 N 0.00 0.04 0.00 4.88 1.57 -1.26 -3.48 116.57 118.32 3dnu h LYS 133 Ca -0.02 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.55 3dnu h LYS 133 Cb 1.35 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.67 3dnu h LYS 133 CO 0.05 0.97 -1.04 0.00 -0.57 0.00 0.00 179.45 178.86 3dnu n ALA 134 N -2.41 0.69 0.00 3.86 0.00 -1.18 -5.18 120.51 116.29 3dnu n ALA 134 Ca -0.04 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.86 3dnu n ALA 134 Cb 0.97 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 20.21 3dnu n ALA 134 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3dnu n ASP 146 N -4.50 0.00 -3.19 0.00 10.43 -1.26 -5.04 116.55 112.99 3dnu n ASP 146 Ca -0.22 0.00 -0.21 0.00 2.57 0.00 0.00 54.79 56.93 3dnu n ASP 146 Cb 0.51 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.42 3dnu n ASP 146 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 3dnu n PHE 147 N 0.00 0.19 -3.60 1.24 -0.00 -1.26 -4.59 117.46 109.43 3dnu n PHE 147 Ca 0.00 -3.74 -0.33 0.00 -0.00 0.00 0.00 57.45 53.39 3dnu n PHE 147 Cb 0.00 -0.40 -0.07 0.00 -0.00 0.00 0.00 39.48 39.01 3dnu n PHE 147 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3dnu n ARG 148 N 0.69 2.59 -5.18 -4.13 5.12 -1.26 -4.97 116.66 109.52 3dnu n ARG 148 Ca 0.24 -4.53 -0.32 0.00 -1.93 0.00 0.00 57.85 51.31 3dnu n ARG 148 Cb 0.60 -2.36 -0.16 0.00 -1.16 0.00 0.00 32.46 29.38 3dnu n ARG 148 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3dnu s ILE 149 N -1.77 2.22 -0.08 0.55 1.01 -1.22 -2.23 121.20 119.68 3dnu s ILE 149 Ca 0.30 -0.99 0.03 0.00 0.00 0.00 0.00 60.65 59.99 3dnu s ILE 149 Cb -0.01 -1.84 -0.02 0.00 0.01 0.00 0.00 42.46 40.61 3dnu s ILE 149 CO -0.09 0.56 -0.15 -0.55 0.00 0.00 0.00 174.94 174.70 3dnu s SER 150 N 0.03 3.88 -0.03 3.58 0.15 0.50 -4.92 113.70 116.90 3dnu s SER 150 Ca -0.09 -0.29 0.02 0.00 0.70 0.00 0.00 55.95 56.29 3dnu s SER 150 Cb -0.15 -1.11 0.01 0.00 -1.71 0.00 0.00 66.02 63.06 3dnu s SER 150 CO 0.06 0.27 -0.08 -0.69 1.20 0.00 0.00 173.24 173.99 3dnu s VAL 151 N -0.27 0.73 -0.20 4.45 1.01 -1.26 -3.79 120.40 121.06 3dnu s VAL 151 Ca 0.02 -0.30 -0.26 0.00 0.00 0.00 0.00 61.98 61.43 3dnu s VAL 151 Cb -0.13 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 3dnu s VAL 151 CO 0.03 0.24 0.90 0.00 0.00 0.00 0.00 175.10 176.26 3dnu s ALA 152 N 0.38 3.60 0.00 5.51 0.00 -1.25 -3.62 121.76 126.38 3dnu s ALA 152 Ca -0.06 0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.94 3dnu s ALA 152 Cb -0.10 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.67 3dnu s ALA 152 CO 0.01 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.34 3dnu n GLY 153 N 3.50 1.47 0.06 0.00 0.00 -1.26 -4.99 105.19 103.97 3dnu n GLY 153 Ca 0.07 -0.90 -0.05 0.00 0.00 0.00 0.00 46.02 45.14 3dnu n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnu n ALA 154 N -3.00 1.76 -2.28 4.61 0.00 -1.26 -2.36 120.51 117.98 3dnu n ALA 154 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.55 3dnu n ALA 154 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.33 3dnu n ALA 154 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dnu n GLN 155 N -2.48 3.48 -3.94 0.00 3.00 -1.26 -4.51 117.38 111.68 3dnu n GLN 155 Ca -0.21 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.48 3dnu n GLN 155 Cb 0.90 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 31.00 3dnu n GLN 155 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 3dnu s GLU 156 N 4.25 1.72 0.29 -1.09 2.56 -1.26 -4.86 118.70 120.31 3dnu s GLU 156 Ca 0.00 -2.29 0.09 0.00 0.00 0.00 0.00 54.97 52.77 3dnu s GLU 156 Cb 0.00 -3.14 -0.04 0.00 2.00 0.00 0.00 34.13 32.95 3dnu s GLU 156 CO 0.00 -1.06 0.05 -1.59 -0.56 0.00 0.00 175.26 172.10 3dnu s LYS 157 N 0.18 2.33 0.00 4.30 -2.85 -1.26 -4.51 119.74 117.93 3dnu s LYS 157 Ca 0.15 -1.47 0.00 0.00 -1.00 0.00 0.00 55.97 53.65 3dnu s LYS 157 Cb -0.24 -2.16 0.00 0.00 -2.06 0.00 0.00 37.83 33.37 3dnu s LYS 157 CO -0.03 0.27 0.00 -2.37 0.10 0.00 0.00 175.35 173.32 3dnu n THR 158 N -0.99 0.00 -3.62 3.79 5.66 -0.56 -4.62 114.28 113.94 3dnu n THR 158 Ca -0.05 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.79 3dnu n THR 158 Cb 0.60 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.31 3dnu n THR 158 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3dnu s ALA 159 N -2.00 -1.32 0.20 1.79 0.00 -1.26 -0.72 121.76 118.45 3dnu s ALA 159 Ca 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 51.96 52.76 3dnu s ALA 159 Cb 0.00 0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 3dnu s ALA 159 CO 0.00 -0.35 0.17 -0.51 0.00 0.00 0.00 175.76 175.07 3dnu s LEU 160 N -1.36 1.11 -0.19 0.00 1.43 -0.80 -4.94 118.68 113.92 3dnu s LEU 160 Ca -0.11 -1.30 -0.06 0.00 -1.03 0.00 0.00 54.13 51.62 3dnu s LEU 160 Cb -0.02 0.56 -0.03 0.00 0.03 0.00 0.00 46.19 46.73 3dnu s LEU 160 CO 0.06 -0.87 0.04 -0.22 0.23 0.00 0.00 176.35 175.59 3dnu s LEU 161 N -3.13 3.57 -0.21 1.79 2.96 -0.48 -1.26 118.68 121.93 3dnu s LEU 161 Ca 0.35 -0.04 -0.11 0.00 -0.22 0.00 0.00 54.13 54.11 3dnu s LEU 161 Cb 0.06 -1.91 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 3dnu s LEU 161 CO 0.10 0.12 0.17 -0.60 -1.32 0.00 0.00 176.35 174.83 3dnu s ARG 162 N 0.66 4.16 -0.22 1.98 6.06 -1.26 0.13 118.95 130.44 3dnu s ARG 162 Ca 0.02 -0.19 -0.00 0.00 -2.50 0.00 0.00 55.73 53.06 3dnu s ARG 162 Cb -0.14 -3.47 0.06 0.00 0.06 0.00 0.00 34.95 31.47 3dnu s ARG 162 CO 0.02 0.20 -0.02 0.42 -2.50 0.00 0.00 175.30 173.41 3dnu s ILE 163 N 0.65 1.21 0.00 4.11 -1.09 -0.64 -4.98 121.20 120.47 3dnu s ILE 163 Ca 0.09 -1.03 0.00 0.00 -2.23 0.00 0.00 60.65 57.48 3dnu s ILE 163 Cb -0.12 -1.56 0.00 0.00 -1.58 0.00 0.00 42.46 39.19 3dnu s ILE 163 CO 0.01 -0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.18 3dnu n GLY 164 N 4.79 3.47 1.54 6.18 0.00 -1.26 -1.51 105.19 118.40 3dnu n GLY 164 Ca -0.11 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 45.90 3dnu n GLY 164 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dnu n ASN 165 N 6.84 4.98 -4.49 1.61 5.15 -1.26 -4.97 115.26 123.13 3dnu n ASN 165 Ca 0.00 -2.79 -0.29 0.00 -0.60 0.00 0.00 54.58 50.90 3dnu n ASN 165 Cb 0.00 -0.61 -0.11 0.00 -0.53 0.00 0.00 39.78 38.53 3dnu n ASN 165 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3dnu s ASP 166 N -1.08 3.85 -0.10 1.20 1.01 -0.57 -5.12 116.67 115.85 3dnu s ASP 166 Ca 0.50 -0.60 -0.08 0.00 0.71 0.00 0.00 52.55 53.08 3dnu s ASP 166 Cb 0.37 -0.52 -0.04 0.00 1.01 0.00 0.00 42.92 43.74 3dnu s ASP 166 CO 0.17 0.17 0.17 0.26 0.21 0.00 0.00 175.17 176.14 3dnu s TRP 167 N -1.24 3.61 0.06 4.23 0.52 -1.26 -1.62 118.94 123.25 3dnu s TRP 167 Ca 0.19 0.57 -0.03 0.00 0.02 0.00 0.00 56.10 56.84 3dnu s TRP 167 Cb -0.10 -1.97 -0.03 0.00 -1.15 0.00 0.00 33.47 30.22 3dnu s TRP 167 CO 0.10 0.73 0.04 0.00 0.02 0.00 0.00 176.95 177.84 3dnu s ILE 169 N -3.90 5.13 0.52 0.00 -1.09 -0.05 -1.38 121.20 120.43 3dnu s ILE 169 Ca 0.07 0.11 -0.19 0.00 -2.23 0.00 0.00 60.65 58.40 3dnu s ILE 169 Cb 0.07 -3.42 -0.07 0.00 -1.58 0.00 0.00 42.46 37.46 3dnu s ILE 169 CO -0.10 0.29 1.08 -2.16 -1.23 0.00 0.00 174.94 172.82 3dnu s PRO 170 N 1.54 3.55 0.10 2.79 0.04 -1.26 -0.95 135.00 140.81 3dnu s PRO 170 Ca 0.07 1.46 0.01 0.00 0.04 0.00 0.00 61.00 62.58 3dnu s PRO 170 Cb -0.15 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 3dnu s PRO 170 CO 0.08 -0.66 0.24 0.15 0.04 0.00 0.00 177.00 176.85 3dnu s LYS 171 N -3.33 3.44 6.67 4.56 1.02 -0.52 -4.77 119.74 126.81 3dnu s LYS 171 Ca 0.69 -0.51 0.00 0.00 0.02 0.00 0.00 55.97 56.18 3dnu s LYS 171 Cb -0.20 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 34.10 3dnu s LYS 171 CO 0.25 0.57 0.00 0.41 -0.92 0.00 0.00 175.35 175.66 3dnu n GLY 172 N -0.05 3.55 1.78 -3.33 0.00 -1.26 -1.07 105.19 104.80 3dnu n GLY 172 Ca -0.06 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.00 3dnu n GLY 172 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3dnu n ILE 173 N 0.00 2.67 -1.93 -0.61 -5.35 -1.26 -4.95 119.36 107.93 3dnu n ILE 173 Ca 0.00 -1.45 -0.41 0.00 -0.27 0.00 0.00 62.75 60.62 3dnu n ILE 173 Cb 0.00 -0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 37.63 3dnu n ILE 173 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3dnu s THR 174 N -2.72 2.45 0.77 7.28 2.01 -0.23 -4.97 115.64 120.23 3dnu s THR 174 Ca 0.53 0.38 -0.12 0.00 0.31 0.00 0.00 61.69 62.79 3dnu s THR 174 Cb 0.41 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.73 3dnu s THR 174 CO 0.16 0.06 1.11 -2.84 -0.69 0.00 0.00 174.62 172.41 3dnu s PRO 175 N -0.36 2.29 0.49 4.92 0.02 -1.26 -4.63 135.00 136.47 3dnu s PRO 175 Ca 0.61 0.50 -0.00 0.00 0.02 0.00 0.00 61.00 62.13 3dnu s PRO 175 Cb -0.44 -1.95 0.01 0.00 0.02 0.00 0.00 34.50 32.13 3dnu s PRO 175 CO 0.44 -1.45 0.73 0.95 -0.33 0.00 0.00 177.00 177.34 3dnu s THR 176 N -3.28 3.64 0.00 0.99 -4.23 -1.26 -4.76 115.64 106.75 3dnu s THR 176 Ca 0.60 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.64 3dnu s THR 176 Cb -0.13 -3.36 0.00 0.00 1.34 0.00 0.00 72.50 70.35 3dnu s THR 176 CO 0.53 -0.27 0.00 0.35 -0.54 0.00 0.00 174.62 174.69 3dnu n THR 177 N -2.21 0.00 -4.09 3.99 -2.24 -0.39 -4.92 114.28 104.41 3dnu n THR 177 Ca 0.03 -0.20 -0.14 0.00 -2.27 0.00 0.00 64.05 61.47 3dnu n THR 177 Cb 0.58 0.70 -0.13 0.00 -2.10 0.00 0.00 70.33 69.38 3dnu n THR 177 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3dnu s HIS 178 N -1.51 0.50 -0.11 4.78 3.76 -0.70 -1.45 115.29 120.56 3dnu s HIS 178 Ca 0.00 -0.27 -0.18 0.00 -0.15 0.00 0.00 55.06 54.46 3dnu s HIS 178 Cb 0.00 -0.31 -0.04 0.00 1.11 0.00 0.00 32.58 33.33 3dnu s HIS 178 CO 0.00 -0.05 0.49 0.42 -0.85 0.00 0.00 174.74 174.75 3dnu s ILE 179 N -0.68 5.17 -0.18 0.60 -1.09 -0.14 -1.91 121.20 122.97 3dnu s ILE 179 Ca -0.04 0.98 -0.04 0.00 -2.23 0.00 0.00 60.65 59.32 3dnu s ILE 179 Cb -0.05 -3.83 -0.02 0.00 -1.58 0.00 0.00 42.46 36.98 3dnu s ILE 179 CO 0.00 0.33 -0.04 -0.63 -1.23 0.00 0.00 174.94 173.38 3dnu s ILE 180 N 0.55 3.69 -0.06 2.92 -1.09 0.10 -0.51 121.20 126.80 3dnu s ILE 180 Ca 0.26 -0.41 0.05 0.00 -2.23 0.00 0.00 60.65 58.32 3dnu s ILE 180 Cb -0.15 -2.64 -0.02 0.00 -1.58 0.00 0.00 42.46 38.07 3dnu s ILE 180 CO 0.11 0.46 -0.20 -0.54 -1.23 0.00 0.00 174.94 173.53 3dnu s LYS 181 N 0.85 2.63 0.31 2.79 1.02 0.26 -1.49 119.74 126.10 3dnu s LYS 181 Ca -0.01 -0.81 0.06 0.00 0.02 0.00 0.00 55.97 55.23 3dnu s LYS 181 Cb -0.15 -2.29 -0.02 0.00 -0.52 0.00 0.00 37.83 34.86 3dnu s LYS 181 CO 0.02 0.44 0.43 -0.51 -0.92 0.00 0.00 175.35 174.81 3dnu s LEU 182 N -0.29 4.04 0.35 3.17 2.01 -1.26 -0.79 118.68 125.91 3dnu s LEU 182 Ca 0.01 -0.14 -0.28 0.00 0.01 0.00 0.00 54.13 53.72 3dnu s LEU 182 Cb -0.13 -2.75 -0.12 0.00 0.01 0.00 0.00 46.19 43.21 3dnu s LEU 182 CO 0.03 -0.34 1.45 -2.65 1.01 0.00 0.00 176.35 175.85 3dnu n PRO 183 N -1.57 2.51 0.00 1.29 -0.02 -1.26 -4.78 135.00 131.17 3dnu n PRO 183 Ca -0.02 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3dnu n PRO 183 Cb 0.58 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 3dnu n PRO 183 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3dnu n ILE 184 N 0.73 0.00 -1.80 4.25 5.41 -1.26 -5.02 119.36 121.68 3dnu n ILE 184 Ca 0.04 0.25 -0.20 0.00 1.00 0.00 0.00 62.75 63.84 3dnu n ILE 184 Cb 0.37 -0.57 -0.07 0.00 -0.71 0.00 0.00 39.64 38.67 3dnu n ILE 184 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3dnu n LEU 196 N -0.27 -1.56 0.11 1.39 7.99 -1.26 -4.77 117.00 118.64 3dnu n LEU 196 Ca 0.00 0.36 0.10 0.00 -0.01 0.00 0.00 56.01 56.46 3dnu n LEU 196 Cb 0.00 -2.78 0.45 0.00 -0.11 0.00 0.00 43.42 40.98 3dnu n LEU 196 CO 0.00 -0.82 0.79 -1.54 -1.51 0.00 0.00 177.39 174.31 3dnu n SER 197 N -1.45 0.47 -1.07 -1.43 3.41 -1.26 -1.92 113.62 110.37 3dnu n SER 197 Ca -0.21 0.66 0.01 0.00 -0.26 0.00 0.00 58.87 59.08 3dnu n SER 197 Cb 0.66 -0.75 0.23 0.00 -0.26 0.00 0.00 64.21 64.09 3dnu n SER 197 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dnu n GLN 198 N -2.07 2.35 0.20 4.33 6.02 -1.26 -4.71 117.38 122.23 3dnu n GLN 198 Ca 0.01 -3.01 0.07 0.00 -0.01 0.00 0.00 57.00 54.05 3dnu n GLN 198 Cb 0.12 -1.84 0.57 0.00 1.02 0.00 0.00 30.24 30.11 3dnu n GLN 198 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3dnu h SER 199 N 1.35 0.10 -0.05 1.08 4.64 -1.71 0.11 113.55 119.06 3dnu h SER 199 Ca 0.13 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 3dnu h SER 199 Cb 1.61 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.67 3dnu h SER 199 CO 0.34 0.11 0.01 0.58 -0.87 0.00 0.00 176.83 177.00 3dnu h VAL 200 N 0.11 1.22 -0.50 0.95 2.07 -1.86 -1.01 116.25 117.23 3dnu h VAL 200 Ca 0.03 -0.66 -0.09 0.00 0.82 0.00 0.00 66.70 66.80 3dnu h VAL 200 Cb 0.06 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 3dnu h VAL 200 CO -0.00 0.18 -0.05 0.44 0.02 0.00 0.00 177.57 178.16 3dnu h ASP 201 N -0.17 0.87 0.68 0.57 3.32 -1.80 -1.82 116.42 118.07 3dnu h ASP 201 Ca 0.02 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.79 3dnu h ASP 201 Cb 0.28 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3dnu h ASP 201 CO 0.00 0.96 -0.36 -1.13 -1.72 0.00 0.00 179.24 177.00 3dnu h ASN 202 N 0.81 -0.87 -0.67 6.45 -0.73 -0.72 -1.56 115.58 118.28 3dnu h ASN 202 Ca 0.14 0.04 -0.02 0.00 1.87 0.00 0.00 56.30 58.33 3dnu h ASN 202 Cb 0.56 0.24 -0.03 0.00 0.27 0.00 0.00 38.32 39.35 3dnu h ASN 202 CO 0.03 -0.59 0.36 -0.08 -0.37 0.00 0.00 177.43 176.78 3dnu h GLU 203 N -0.95 0.97 -0.27 6.67 4.81 -1.17 -1.17 114.58 123.46 3dnu h GLU 203 Ca -0.09 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.05 3dnu h GLU 203 Cb 0.75 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 3dnu h GLU 203 CO 0.13 0.73 0.11 -0.92 -0.73 0.00 0.00 179.01 178.32 3dnu h TYR 204 N 0.97 0.19 -0.37 0.92 3.20 -1.17 -0.34 116.97 120.37 3dnu h TYR 204 Ca 0.24 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 3dnu h TYR 204 Cb 0.06 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 3dnu h TYR 204 CO 0.01 0.09 0.23 -0.92 -1.64 0.00 0.00 178.16 175.93 3dnu h TYR 205 N 0.24 0.49 -0.47 -3.82 3.20 -0.80 -1.23 116.97 114.58 3dnu h TYR 205 Ca 0.12 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 3dnu h TYR 205 Cb 0.07 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 3dnu h TYR 205 CO -0.12 0.35 0.04 0.00 -1.64 0.00 0.00 178.16 176.79 3dnu h LEU 207 N 0.72 0.69 -0.23 0.00 3.38 -0.89 -1.40 115.31 117.58 3dnu h LEU 207 Ca 0.15 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3dnu h LEU 207 Cb 0.39 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3dnu h LEU 207 CO 0.01 0.83 0.15 -0.07 0.09 0.00 0.00 178.44 179.45 3dnu h LEU 208 N 0.54 0.26 -0.66 1.67 3.38 -0.83 -1.88 115.31 117.79 3dnu h LEU 208 Ca 0.11 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3dnu h LEU 208 Cb 0.47 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 3dnu h LEU 208 CO 0.02 0.19 0.43 0.25 0.09 0.00 0.00 178.44 179.42 3dnu h LEU 209 N 0.31 0.76 -0.57 1.67 5.85 -1.01 -0.87 115.31 121.44 3dnu h LEU 209 Ca 0.09 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3dnu h LEU 209 Cb -0.03 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 3dnu h LEU 209 CO -0.02 0.55 0.33 0.00 -0.34 0.00 0.00 178.44 178.96 3dnu h ALA 210 N 1.24 0.73 -0.42 1.25 0.00 -1.11 -1.59 119.26 119.35 3dnu h ALA 210 Ca 0.24 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3dnu h ALA 210 Cb -0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3dnu h ALA 210 CO -0.05 0.23 0.16 -0.22 0.00 0.00 0.00 179.25 179.37 3dnu h LYS 211 N 0.77 0.63 -0.16 0.00 3.64 -1.07 -1.67 116.57 118.70 3dnu h LYS 211 Ca 0.20 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3dnu h LYS 211 Cb 0.01 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3dnu h LYS 211 CO -0.04 0.59 0.11 1.49 -2.27 0.00 0.00 179.45 179.33 3dnu h GLU 212 N 0.53 0.21 -0.41 1.90 4.57 -0.83 -1.84 114.58 118.70 3dnu h GLU 212 Ca 0.14 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3dnu h GLU 212 Cb 0.20 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3dnu h GLU 212 CO -0.01 0.14 0.00 1.28 -1.18 0.00 0.00 179.01 179.24 3dnu n LEU 213 N -4.51 2.11 0.00 1.64 4.77 -0.63 -4.93 117.00 115.45 3dnu n LEU 213 Ca -0.01 -1.06 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 3dnu n LEU 213 Cb 0.08 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 3dnu n LEU 213 CO 0.35 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 3dnu n GLY 214 N 0.99 0.74 3.84 -0.72 0.00 -0.69 -5.05 105.19 104.31 3dnu n GLY 214 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3dnu n GLY 214 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dnu s LEU 215 N 0.00 3.75 -0.68 0.99 1.43 -0.68 -5.00 118.68 118.49 3dnu s LEU 215 Ca 0.00 1.50 -0.24 0.00 -1.03 0.00 0.00 54.13 54.36 3dnu s LEU 215 Cb 0.00 -4.40 0.06 0.00 0.03 0.00 0.00 46.19 41.88 3dnu s LEU 215 CO 0.00 -0.48 1.04 0.21 0.23 0.00 0.00 176.35 177.35 3dnu s ASN 216 N -2.86 6.17 0.04 2.29 3.04 -1.26 -4.38 114.94 117.98 3dnu s ASN 216 Ca 0.58 -0.86 -0.01 0.00 0.04 0.00 0.00 52.86 52.61 3dnu s ASN 216 Cb -0.10 -2.45 -0.03 0.00 -1.54 0.00 0.00 41.25 37.13 3dnu s ASN 216 CO 0.27 -1.54 -0.02 0.68 -3.04 0.00 0.00 177.10 173.45 3dnu s VAL 217 N 4.48 0.17 0.68 -5.21 -7.23 -1.26 -1.25 120.40 110.78 3dnu s VAL 217 Ca 0.25 -1.40 -0.13 0.00 -1.81 0.00 0.00 61.98 58.89 3dnu s VAL 217 Cb -0.15 -0.99 0.01 0.00 0.56 0.00 0.00 36.38 35.82 3dnu s VAL 217 CO 0.11 -0.77 1.08 -2.16 -0.31 0.00 0.00 175.10 173.06 3dnu s PRO 218 N -2.87 2.79 0.51 4.82 0.04 -1.26 -4.97 135.00 134.05 3dnu s PRO 218 Ca -0.03 1.21 -0.15 0.00 0.04 0.00 0.00 61.00 62.08 3dnu s PRO 218 Cb 0.00 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.51 3dnu s PRO 218 CO -0.06 -1.24 0.96 -0.51 0.04 0.00 0.00 177.00 176.19 3dnu s ASP 219 N -3.06 6.54 0.13 6.66 1.01 -1.26 -4.91 116.67 121.78 3dnu s ASP 219 Ca 0.63 1.47 -0.10 0.00 0.71 0.00 0.00 52.55 55.26 3dnu s ASP 219 Cb -0.17 -2.47 0.00 0.00 1.01 0.00 0.00 42.92 41.29 3dnu s ASP 219 CO 0.47 -0.60 0.27 0.00 0.21 0.00 0.00 175.17 175.51 3dnu s ALA 220 N -2.68 -0.25 0.02 5.23 0.00 -1.26 -1.35 121.76 121.47 3dnu s ALA 220 Ca 0.57 -0.64 -0.06 0.00 0.00 0.00 0.00 51.96 51.83 3dnu s ALA 220 Cb -0.10 0.68 -0.01 0.00 0.00 0.00 0.00 23.12 23.70 3dnu s ALA 220 CO 0.35 -0.60 0.10 -1.83 0.00 0.00 0.00 175.76 173.78 3dnu s GLU 221 N -3.90 0.50 -0.19 0.00 -1.05 -0.29 -4.99 118.70 108.78 3dnu s GLU 221 Ca 0.10 -0.55 -0.20 0.00 -0.15 0.00 0.00 54.97 54.17 3dnu s GLU 221 Cb 0.04 0.20 -0.03 0.00 -0.44 0.00 0.00 34.13 33.90 3dnu s GLU 221 CO -0.06 -0.12 0.59 0.42 0.95 0.00 0.00 175.26 177.04 3dnu s ILE 222 N -1.83 5.06 0.10 1.83 1.01 -1.26 -0.61 121.20 125.49 3dnu s ILE 222 Ca -0.11 1.12 0.05 0.00 0.00 0.00 0.00 60.65 61.70 3dnu s ILE 222 Cb -0.06 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 3dnu s ILE 222 CO -0.01 0.15 -0.00 0.27 0.00 0.00 0.00 174.94 175.34 3dnu s ILE 223 N 1.72 3.97 -0.08 2.92 -4.36 0.18 -4.96 121.20 120.60 3dnu s ILE 223 Ca 0.28 -1.03 0.02 0.00 -0.26 0.00 0.00 60.65 59.66 3dnu s ILE 223 Cb -0.16 -2.90 0.02 0.00 1.25 0.00 0.00 42.46 40.67 3dnu s ILE 223 CO 0.10 0.11 -0.11 -0.54 0.24 0.00 0.00 174.94 174.74 3dnu s LYS 224 N -2.34 1.62 -0.29 0.37 1.02 -1.26 -1.48 119.74 117.38 3dnu s LYS 224 Ca 0.26 -0.36 -0.01 0.00 0.02 0.00 0.00 55.97 55.88 3dnu s LYS 224 Cb -0.12 -1.43 0.09 0.00 -0.52 0.00 0.00 37.83 35.86 3dnu s LYS 224 CO 0.18 -0.05 0.07 0.00 -0.92 0.00 0.00 175.35 174.63 3dnu s ALA 225 N 0.92 1.61 0.00 5.17 0.00 -0.69 -4.99 121.76 123.77 3dnu s ALA 225 Ca -0.10 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.30 3dnu s ALA 225 Cb -0.15 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.41 3dnu s ALA 225 CO 0.01 -1.54 0.00 0.41 0.00 0.00 0.00 175.76 174.63 3dnu n GLY 226 N 4.81 2.22 0.85 0.00 0.00 -1.26 -0.49 105.19 111.32 3dnu n GLY 226 Ca -0.04 0.35 0.12 0.00 0.00 0.00 0.00 46.02 46.45 3dnu n GLY 226 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dnu n ASN 227 N 10.40 2.59 -4.88 1.61 5.15 -1.26 -4.93 115.26 123.93 3dnu n ASN 227 Ca 0.00 -1.85 -0.36 0.00 -0.60 0.00 0.00 54.58 51.77 3dnu n ASN 227 Cb 0.00 -0.10 -0.06 0.00 -0.53 0.00 0.00 39.78 39.09 3dnu n ASN 227 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3dnu s VAL 228 N -1.80 5.38 -0.16 3.44 0.11 0.36 -5.08 120.40 122.64 3dnu s VAL 228 Ca 0.34 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.61 3dnu s VAL 228 Cb 0.20 -3.51 0.03 0.00 -1.53 0.00 0.00 36.38 31.58 3dnu s VAL 228 CO 0.30 0.49 -0.10 -0.60 -3.33 0.00 0.00 175.10 171.87 3dnu s ARG 229 N -1.39 1.92 0.19 1.54 3.52 -1.26 -1.71 118.95 121.76 3dnu s ARG 229 Ca 0.22 -0.58 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 3dnu s ARG 229 Cb -0.13 -2.09 -0.05 0.00 -1.56 0.00 0.00 34.95 31.12 3dnu s ARG 229 CO 0.11 -0.34 0.02 0.00 -0.81 0.00 0.00 175.30 174.28 3dnu s ALA 230 N 1.53 1.42 -0.19 6.12 0.00 -0.55 -4.39 121.76 125.70 3dnu s ALA 230 Ca 0.02 -1.64 -0.06 0.00 0.00 0.00 0.00 51.96 50.28 3dnu s ALA 230 Cb -0.14 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.58 3dnu s ALA 230 CO -0.09 -0.34 0.03 -1.17 0.00 0.00 0.00 175.76 174.18 3dnu s LEU 231 N -3.20 3.49 -0.30 0.00 2.96 0.03 -0.64 118.68 121.02 3dnu s LEU 231 Ca 0.27 -0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 54.02 3dnu s LEU 231 Cb 0.06 -1.88 0.01 0.00 0.50 0.00 0.00 46.19 44.88 3dnu s LEU 231 CO 0.06 0.11 0.09 0.00 -1.32 0.00 0.00 176.35 175.29 3dnu s ALA 232 N 0.74 3.10 -0.18 5.97 0.00 0.22 -0.58 121.76 131.04 3dnu s ALA 232 Ca 0.01 -1.45 -0.05 0.00 0.00 0.00 0.00 51.96 50.48 3dnu s ALA 232 Cb -0.14 -2.19 -0.03 0.00 0.00 0.00 0.00 23.12 20.77 3dnu s ALA 232 CO 0.02 -0.93 -0.01 0.08 0.00 0.00 0.00 175.76 174.92 3dnu s VAL 233 N 1.51 4.01 0.23 0.00 1.01 0.33 -1.14 120.40 126.37 3dnu s VAL 233 Ca 0.03 -0.30 -0.31 0.00 0.00 0.00 0.00 61.98 61.40 3dnu s VAL 233 Cb -0.17 -2.79 -0.11 0.00 0.00 0.00 0.00 36.38 33.31 3dnu s VAL 233 CO 0.03 0.46 1.54 -1.61 0.00 0.00 0.00 175.10 175.52 3dnu s GLU 234 N 0.70 4.20 0.08 2.72 2.02 -0.46 -0.97 118.70 126.99 3dnu s GLU 234 Ca -0.00 2.42 -0.29 0.00 0.02 0.00 0.00 54.97 57.12 3dnu s GLU 234 Cb -0.14 -3.09 -0.05 0.00 0.10 0.00 0.00 34.13 30.94 3dnu s GLU 234 CO 0.02 -0.56 0.93 1.03 0.02 0.00 0.00 175.26 176.70 3dnu s ARG 235 N 0.14 4.64 0.00 1.61 0.52 -0.53 -4.69 118.95 120.65 3dnu s ARG 235 Ca 0.65 1.38 0.23 0.00 -0.52 0.00 0.00 55.73 57.47 3dnu s ARG 235 Cb -0.45 -3.39 0.48 0.00 0.52 0.00 0.00 34.95 32.11 3dnu s ARG 235 CO 0.40 0.18 1.42 1.97 0.02 0.00 0.00 175.30 179.30 3dnu n PHE 236 N 2.97 0.26 -1.11 -0.53 1.16 -1.26 -3.91 117.46 115.05 3dnu n PHE 236 Ca 0.02 -0.13 -0.09 0.00 -1.87 0.00 0.00 57.45 55.38 3dnu n PHE 236 Cb 0.50 0.00 0.27 0.00 -1.61 0.00 0.00 39.48 38.64 3dnu n PHE 236 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 3dnu n ASP 237 N 1.12 4.49 -3.93 5.98 5.75 -1.26 -4.90 116.55 123.80 3dnu n ASP 237 Ca 0.17 -3.33 -0.10 0.00 -0.01 0.00 0.00 54.79 51.52 3dnu n ASP 237 Cb 0.53 -0.76 -0.11 0.00 -1.03 0.00 0.00 41.12 39.75 3dnu n ASP 237 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3dnu s ARG 238 N -3.07 0.31 -0.17 0.11 1.81 -1.25 -0.81 118.95 115.88 3dnu s ARG 238 Ca 0.55 -0.45 -0.07 0.00 -1.72 0.00 0.00 55.73 54.04 3dnu s ARG 238 Cb 0.45 0.12 0.07 0.00 -0.45 0.00 0.00 34.95 35.14 3dnu s ARG 238 CO 0.12 -0.06 0.38 0.50 -0.68 0.00 0.00 175.30 175.56 3dnu s ARG 239 N -1.20 0.32 0.42 3.54 3.52 -0.02 -4.92 118.95 120.60 3dnu s ARG 239 Ca -0.13 0.86 -0.22 0.00 -0.13 0.00 0.00 55.73 56.11 3dnu s ARG 239 Cb -0.08 0.11 -0.10 0.00 -1.56 0.00 0.00 34.95 33.32 3dnu s ARG 239 CO -0.00 -0.21 1.00 -1.58 -0.81 0.00 0.00 175.30 173.70 3dnu s TRP 240 N 2.01 3.27 0.89 5.12 0.52 -1.26 -0.83 118.94 128.66 3dnu s TRP 240 Ca -0.05 1.64 -0.12 0.00 0.02 0.00 0.00 56.10 57.59 3dnu s TRP 240 Cb -0.10 -3.00 0.13 0.00 -1.15 0.00 0.00 33.47 29.34 3dnu s TRP 240 CO -0.12 -0.41 1.13 0.54 0.02 0.00 0.00 176.95 178.11 3dnu s ASN 241 N -1.86 3.65 0.29 2.95 4.22 -0.48 -4.91 114.94 118.78 3dnu s ASN 241 Ca 0.60 1.05 0.02 0.00 -2.14 0.00 0.00 52.86 52.39 3dnu s ASN 241 Cb -0.16 -1.67 0.58 0.00 1.28 0.00 0.00 41.25 41.28 3dnu s ASN 241 CO 0.21 -2.47 1.83 0.00 -2.04 0.00 0.00 177.10 174.63 3dnu h ALA 242 N -1.44 1.54 -0.01 3.54 0.00 -1.97 -1.84 119.26 119.09 3dnu h ALA 242 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3dnu h ALA 242 Cb 1.32 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3dnu h ALA 242 CO 0.61 0.20 0.00 0.39 0.00 0.00 0.00 179.25 180.45 3dnu n GLU 243 N -4.62 1.24 -3.69 0.00 1.02 -1.26 -4.94 120.64 108.39 3dnu n GLU 243 Ca 0.19 -0.35 -0.27 0.00 -0.02 0.00 0.00 57.16 56.71 3dnu n GLU 243 Cb 0.37 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.34 3dnu n GLU 243 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3dnu n ARG 244 N -0.57 -6.03 -0.00 3.49 5.12 -0.69 -4.89 116.66 113.09 3dnu n ARG 244 Ca 0.22 0.69 0.05 0.00 -1.93 0.00 0.00 57.85 56.88 3dnu n ARG 244 Cb 0.20 -5.62 -0.07 0.00 -1.16 0.00 0.00 32.46 25.82 3dnu n ARG 244 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3dnu n THR 245 N -4.71 0.00 -3.98 0.55 -2.24 -1.26 -4.99 114.28 97.65 3dnu n THR 245 Ca 0.01 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.39 3dnu n THR 245 Cb 0.55 0.64 -0.15 0.00 -2.10 0.00 0.00 70.33 69.26 3dnu n THR 245 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3dnu s VAL 246 N -2.30 0.21 -0.25 2.28 1.01 -1.26 -5.06 120.40 115.02 3dnu s VAL 246 Ca -0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 3dnu s VAL 246 Cb 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 36.38 36.21 3dnu s VAL 246 CO 0.41 0.11 -0.02 -0.22 0.00 0.00 0.00 175.10 175.38 3dnu s LEU 247 N 0.58 3.28 0.09 3.92 2.96 -1.26 -1.39 118.68 126.87 3dnu s LEU 247 Ca -0.06 -0.72 -0.02 0.00 -0.22 0.00 0.00 54.13 53.11 3dnu s LEU 247 Cb -0.09 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 3dnu s LEU 247 CO -0.01 -0.12 0.28 -0.76 -1.32 0.00 0.00 176.35 174.42 3dnu s LEU 248 N 1.40 4.32 0.01 -0.68 1.43 -0.01 -4.70 118.68 120.46 3dnu s LEU 248 Ca 0.02 0.41 -0.07 0.00 -1.03 0.00 0.00 54.13 53.47 3dnu s LEU 248 Cb -0.16 -3.10 -0.05 0.00 0.03 0.00 0.00 46.19 42.91 3dnu s LEU 248 CO -0.02 0.12 0.28 -0.13 0.23 0.00 0.00 176.35 176.82 3dnu s ARG 249 N -2.55 3.59 -0.13 1.70 0.52 -1.26 -0.84 118.95 119.98 3dnu s ARG 249 Ca 0.37 -0.06 0.01 0.00 -0.52 0.00 0.00 55.73 55.53 3dnu s ARG 249 Cb -0.13 -3.08 -0.01 0.00 0.52 0.00 0.00 34.95 32.26 3dnu s ARG 249 CO 0.26 0.64 -0.15 -0.51 0.02 0.00 0.00 175.30 175.57 3dnu s LEU 250 N -1.75 2.59 0.26 2.53 1.43 0.01 -4.81 118.68 118.93 3dnu s LEU 250 Ca 0.28 -0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 52.70 3dnu s LEU 250 Cb -0.13 -1.57 -0.10 0.00 0.03 0.00 0.00 46.19 44.42 3dnu s LEU 250 CO 0.16 0.16 1.36 -2.84 0.23 0.00 0.00 176.35 175.42 3dnu s PRO 251 N 0.37 4.34 0.19 1.29 0.02 -1.26 -3.33 135.00 136.62 3dnu s PRO 251 Ca -0.12 2.20 -0.23 0.00 0.02 0.00 0.00 61.00 62.87 3dnu s PRO 251 Cb -0.16 -3.12 0.05 0.00 0.02 0.00 0.00 34.50 31.29 3dnu s PRO 251 CO 0.06 -0.29 0.70 1.14 -0.33 0.00 0.00 177.00 178.28 3dnu s GLN 252 N -0.73 1.43 0.04 5.54 -2.07 -1.26 -2.04 119.66 120.58 3dnu s GLN 252 Ca 0.55 -0.68 -0.16 0.00 -1.82 0.00 0.00 55.36 53.26 3dnu s GLN 252 Cb -0.39 0.56 0.03 0.00 -1.09 0.00 0.00 33.01 32.12 3dnu s GLN 252 CO 0.45 -0.64 0.36 -1.83 -1.32 0.00 0.00 175.29 172.30 3dnu s GLU 253 N -3.72 0.86 0.00 9.60 -1.05 -0.53 -4.65 118.70 119.21 3dnu s GLU 253 Ca 0.06 -0.42 0.00 0.00 -0.15 0.00 0.00 54.97 54.46 3dnu s GLU 253 Cb -0.03 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.04 3dnu s GLU 253 CO -0.04 -0.29 0.00 -0.40 0.95 0.00 0.00 175.26 175.49 3dnu n ASP 254 N 0.56 0.00 0.00 0.83 3.85 -1.26 -0.78 116.55 119.74 3dnu n ASP 254 Ca -0.19 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 53.89 3dnu n ASP 254 Cb 0.59 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.36 3dnu n ASP 254 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3dnu h GLN 257 N 0.00 0.89 -0.13 0.00 4.20 -1.93 0.16 115.11 118.30 3dnu h GLN 257 Ca 0.00 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 3dnu h GLN 257 Cb 0.00 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 3dnu h GLN 257 CO 0.00 0.66 -0.14 1.15 -0.67 0.00 0.00 178.83 179.83 3dnu h THR 258 N 0.88 1.17 -0.39 -0.54 2.02 -1.39 -2.12 112.91 112.55 3dnu h THR 258 Ca 0.23 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.64 3dnu h THR 258 Cb 0.02 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 3dnu h THR 258 CO -0.04 0.24 0.00 0.49 0.37 0.00 0.00 175.52 176.58 3dnu n PHE 259 N -4.28 0.50 -1.16 3.16 0.99 -1.08 -3.72 117.46 111.87 3dnu n PHE 259 Ca -0.01 -0.25 -0.05 0.00 -0.00 0.00 0.00 57.45 57.14 3dnu n PHE 259 Cb 0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.72 3dnu n PHE 259 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3dnu n GLY 260 N 1.39 0.80 3.90 1.37 0.00 -0.60 -5.02 105.19 107.03 3dnu n GLY 260 Ca 0.19 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 3dnu n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dnu s LEU 261 N -1.24 4.18 0.56 0.99 1.43 0.46 -4.58 118.68 120.47 3dnu s LEU 261 Ca 0.00 0.67 -0.15 0.00 -1.03 0.00 0.00 54.13 53.61 3dnu s LEU 261 Cb 0.00 -3.44 -0.06 0.00 0.03 0.00 0.00 46.19 42.73 3dnu s LEU 261 CO 0.00 -0.07 1.01 -2.16 0.23 0.00 0.00 176.35 175.37 3dnu s PRO 262 N -3.07 3.69 0.61 1.29 0.04 -1.26 -4.36 135.00 131.95 3dnu s PRO 262 Ca 0.43 0.99 0.35 0.00 0.04 0.00 0.00 61.00 62.81 3dnu s PRO 262 Cb -0.11 -2.10 1.98 0.00 0.04 0.00 0.00 34.50 34.31 3dnu s PRO 262 CO 0.26 -0.49 2.26 0.66 0.04 0.00 0.00 177.00 179.74 3dnu h SER 263 N 0.56 0.00 0.01 6.66 4.64 -1.95 -2.07 113.55 121.40 3dnu h SER 263 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3dnu h SER 263 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3dnu h SER 263 CO 0.60 0.02 0.00 0.77 -0.87 0.00 0.00 176.83 177.35 3dnu h SER 264 N 0.00 0.00 -0.31 4.97 4.64 -2.00 -1.79 113.55 119.06 3dnu h SER 264 Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 3dnu h SER 264 Cb 0.07 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.09 3dnu h SER 264 CO 0.00 0.00 -0.05 1.33 -0.87 0.00 0.00 176.83 177.24 3dnu n VAL 265 N -2.87 2.44 0.28 0.95 0.24 -0.78 -4.73 118.33 113.86 3dnu n VAL 265 Ca -0.03 -2.46 0.12 0.00 -2.04 0.00 0.00 64.34 59.93 3dnu n VAL 265 Cb 0.06 -0.30 0.78 0.00 -1.47 0.00 0.00 33.84 32.91 3dnu n VAL 265 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 3dnu h LYS 266 N 1.18 0.00 -6.30 7.34 2.10 -1.47 -2.54 116.57 116.88 3dnu h LYS 266 Ca 0.15 0.00 -0.56 0.00 -2.00 0.00 0.00 60.65 58.24 3dnu h LYS 266 Cb 1.57 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.86 3dnu h LYS 266 CO 0.32 0.03 -0.04 0.71 -2.00 0.00 0.00 179.45 178.47 3dnu s TYR 267 N -4.73 3.71 0.34 0.07 1.51 -1.26 -1.56 117.35 115.43 3dnu s TYR 267 Ca -0.05 1.19 0.06 0.00 -1.01 0.00 0.00 57.07 57.26 3dnu s TYR 267 Cb 0.16 -2.45 0.71 0.00 -0.11 0.00 0.00 41.96 40.27 3dnu s TYR 267 CO 0.60 0.50 1.91 1.49 -1.11 0.00 0.00 175.55 178.94 3dnu h GLU 268 N 4.02 0.78 0.00 -0.62 4.81 -1.76 -0.09 114.58 121.73 3dnu h GLU 268 Ca -0.49 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3dnu h GLU 268 Cb 1.20 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.41 3dnu h GLU 268 CO 0.64 0.52 0.00 0.66 -0.73 0.00 0.00 179.01 180.10 3dnu h SER 269 N 0.81 0.00 -0.50 1.04 4.64 -1.87 -0.62 113.55 117.05 3dnu h SER 269 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3dnu h SER 269 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3dnu h SER 269 CO -0.16 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.27 3dnu n ASP 270 N -2.62 3.63 0.00 4.97 10.43 -0.17 -4.92 116.55 127.87 3dnu n ASP 270 Ca 0.00 -2.00 0.00 0.00 2.57 0.00 0.00 54.79 55.37 3dnu n ASP 270 Cb 0.19 -0.32 0.00 0.00 1.84 0.00 0.00 41.12 42.83 3dnu n ASP 270 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3dnu n GLY 271 N 1.55 0.76 3.78 0.44 0.00 -0.24 -4.79 105.19 106.69 3dnu n GLY 271 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3dnu n GLY 271 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dnu s GLY 272 N -0.83 1.58 0.26 -0.02 0.00 -0.44 -4.95 107.32 102.93 3dnu s GLY 272 Ca 0.00 -0.46 -0.29 0.00 0.00 0.00 0.00 44.72 43.96 3dnu s GLY 272 CO 0.00 0.08 1.13 2.56 0.00 0.00 0.00 173.10 176.87 3dnu s PRO 273 N -5.23 4.60 0.00 2.90 0.04 -1.26 -4.25 135.00 131.80 3dnu s PRO 273 Ca 0.63 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.51 3dnu s PRO 273 Cb -0.15 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.19 3dnu s PRO 273 CO 0.54 0.14 0.00 0.41 0.04 0.00 0.00 177.00 178.12 3dnu n GLY 274 N 1.37 5.02 0.20 0.56 0.00 -1.26 -4.60 105.19 106.48 3dnu n GLY 274 Ca -0.00 -1.99 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 3dnu n GLY 274 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dnu h ILE 275 N 0.00 1.12 -0.19 -0.61 2.04 -1.97 -2.02 117.51 115.88 3dnu h ILE 275 Ca 0.00 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 3dnu h ILE 275 Cb 0.00 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 3dnu h ILE 275 CO 0.00 0.12 0.11 0.00 0.00 0.00 0.00 178.15 178.38 3dnu h ALA 276 N 1.18 0.25 -0.55 1.87 0.00 -1.96 -2.99 119.26 117.06 3dnu h ALA 276 Ca 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3dnu h ALA 276 Cb -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3dnu h ALA 276 CO -0.04 -0.23 0.22 -0.09 0.00 0.00 0.00 179.25 179.10 3dnu h ARG 277 N 0.22 0.83 -1.57 0.00 9.65 -1.91 -1.45 114.38 120.14 3dnu h ARG 277 Ca 0.07 -0.15 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 3dnu h ARG 277 Cb 0.05 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.49 3dnu h ARG 277 CO -0.01 0.72 0.00 -0.89 2.80 0.00 0.00 179.97 182.59 3dnu n ILE 278 N -4.50 0.53 0.00 1.20 5.41 -0.77 -1.64 119.36 119.59 3dnu n ILE 278 Ca 0.03 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.75 3dnu n ILE 278 Cb 0.16 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 3dnu n ILE 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dnu n ALA 280 N 0.87 0.00 -0.21 -1.39 0.00 -0.55 -0.85 120.51 118.38 3dnu n ALA 280 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3dnu n ALA 280 Cb 0.24 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.90 3dnu n ALA 280 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3dnu h PHE 281 N 0.00 0.97 0.00 0.00 3.57 -1.57 -3.35 116.94 116.55 3dnu h PHE 281 Ca 0.00 -0.01 -0.39 0.00 3.53 0.00 0.00 57.97 61.09 3dnu h PHE 281 Cb 0.00 -0.31 0.02 0.00 2.79 0.00 0.00 35.95 38.45 3dnu h PHE 281 CO 0.00 0.67 2.51 1.28 -2.23 0.00 0.00 178.31 180.54 3dnu n LEU 282 N -4.37 4.64 0.00 0.59 4.77 -0.03 -3.86 117.00 118.75 3dnu n LEU 282 Ca 0.07 -2.82 0.00 0.00 -0.03 0.00 0.00 56.01 53.23 3dnu n LEU 282 Cb 0.09 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 3dnu n LEU 282 CO 0.38 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 3dnu n GLY 284 N 3.86 0.00 3.77 -0.72 0.00 -1.26 -4.34 105.19 106.50 3dnu n GLY 284 Ca 0.43 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 3dnu n GLY 284 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dnu s SER 285 N 0.00 5.31 0.18 1.61 0.15 -1.25 -4.73 113.70 114.97 3dnu s SER 285 Ca 0.00 2.13 0.20 0.00 0.70 0.00 0.00 55.95 58.98 3dnu s SER 285 Cb 0.00 -2.57 0.86 0.00 -1.71 0.00 0.00 66.02 62.60 3dnu s SER 285 CO 0.00 -1.50 1.61 -1.54 1.20 0.00 0.00 173.24 173.01 3dnu n SER 286 N -1.90 0.45 -2.53 5.45 3.41 0.21 -2.33 113.62 116.37 3dnu n SER 286 Ca 0.11 0.62 -0.19 0.00 -0.26 0.00 0.00 58.87 59.16 3dnu n SER 286 Cb 0.51 -0.71 0.02 0.00 -0.26 0.00 0.00 64.21 63.77 3dnu n SER 286 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dnu n GLU 287 N -2.01 2.52 -0.12 4.33 -0.58 -1.26 -4.97 120.64 118.55 3dnu n GLU 287 Ca 0.02 -3.97 -0.06 0.00 -0.42 0.00 0.00 57.16 52.73 3dnu n GLU 287 Cb 0.19 -1.85 0.00 0.00 -0.57 0.00 0.00 31.44 29.21 3dnu n GLU 287 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dnu h ALA 288 N 2.70 0.02 0.16 0.62 0.00 -1.66 0.12 119.26 121.23 3dnu h ALA 288 Ca 0.14 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.19 3dnu h ALA 288 Cb 1.09 0.54 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 3dnu h ALA 288 CO 0.68 -0.61 -0.19 1.25 0.00 0.00 0.00 179.25 180.38 3dnu h LEU 289 N -0.16 -0.53 -0.65 0.00 5.85 -1.89 -0.56 115.31 117.36 3dnu h LEU 289 Ca 0.19 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 3dnu h LEU 289 Cb 0.46 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 3dnu h LEU 289 CO -0.50 -0.28 0.22 0.50 -0.34 0.00 0.00 178.44 178.04 3dnu h LYS 290 N -0.40 1.00 -0.42 1.25 3.64 -1.94 -2.32 116.57 117.37 3dnu h LYS 290 Ca 0.01 -0.20 -0.14 0.00 -1.27 0.00 0.00 60.65 59.04 3dnu h LYS 290 Cb 0.39 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 3dnu h LYS 290 CO -0.07 0.86 -0.29 -0.44 -2.27 0.00 0.00 179.45 177.24 3dnu h ASP 291 N 0.93 0.97 -0.52 4.20 3.32 -0.57 0.10 116.42 124.85 3dnu h ASP 291 Ca 0.21 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.78 3dnu h ASP 291 Cb 0.27 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 3dnu h ASP 291 CO -0.01 1.18 -0.01 0.03 -1.72 0.00 0.00 179.24 178.71 3dnu h ARG 292 N 0.78 0.96 -0.03 3.56 3.08 -1.08 0.18 114.38 121.84 3dnu h ARG 292 Ca 0.09 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 3dnu h ARG 292 Cb 0.87 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 3dnu h ARG 292 CO 0.08 0.95 -0.00 -0.92 -1.07 0.00 0.00 179.97 179.01 3dnu h TYR 293 N 0.88 0.05 -0.74 3.04 3.20 -1.11 -3.11 116.97 119.18 3dnu h TYR 293 Ca 0.16 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 3dnu h TYR 293 Cb 0.53 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 3dnu h TYR 293 CO 0.03 0.36 0.43 -0.44 -1.64 0.00 0.00 178.16 176.90 3dnu h ASP 294 N -0.27 0.91 0.00 -2.11 3.32 -0.65 0.11 116.42 117.73 3dnu h ASP 294 Ca 0.01 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.98 3dnu h ASP 294 Cb 0.34 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3dnu h ASP 294 CO 0.00 0.72 0.00 0.33 -1.72 0.00 0.00 179.24 178.57 3dnu n PHE 295 N -4.49 0.00 0.00 4.55 7.35 0.64 -1.12 117.46 124.39 3dnu n PHE 295 Ca 0.07 -0.03 0.00 0.00 -0.76 0.00 0.00 57.45 56.73 3dnu n PHE 295 Cb 0.07 -0.06 0.00 0.00 0.35 0.00 0.00 39.48 39.84 3dnu n PHE 295 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 3dnu n LYS 297 N 0.64 0.00 0.12 -4.13 4.81 0.37 -1.98 118.16 118.00 3dnu n LYS 297 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 3dnu n LYS 297 Cb 0.05 0.00 0.37 0.00 0.02 0.00 0.00 35.03 35.47 3dnu n LYS 297 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 3dnu h PHE 298 N 0.00 0.22 -0.60 5.64 3.57 -1.37 -0.66 116.94 123.75 3dnu h PHE 298 Ca 0.00 -0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.38 3dnu h PHE 298 Cb 0.00 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 3dnu h PHE 298 CO 0.00 0.39 0.01 1.96 -2.23 0.00 0.00 178.31 178.44 3dnu h GLN 299 N 0.20 1.04 -0.53 1.11 1.08 -1.67 0.11 115.11 116.45 3dnu h GLN 299 Ca 0.04 -0.32 -0.10 0.00 -1.45 0.00 0.00 58.65 56.82 3dnu h GLN 299 Cb 0.45 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 3dnu h GLN 299 CO 0.03 1.01 -0.07 0.28 -0.95 0.00 0.00 178.83 179.13 3dnu h VAL 300 N 0.95 1.27 -0.52 -0.54 2.07 -1.71 -2.31 116.25 115.46 3dnu h VAL 300 Ca 0.17 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.49 3dnu h VAL 300 Cb 0.54 0.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 3dnu h VAL 300 CO 0.03 0.42 0.32 0.15 0.02 0.00 0.00 177.57 178.51 3dnu h PHE 301 N 0.85 0.69 -0.83 1.57 3.57 -0.81 -0.72 116.94 121.26 3dnu h PHE 301 Ca 0.14 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 3dnu h PHE 301 Cb 0.62 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.09 3dnu h PHE 301 CO 0.04 0.47 0.45 1.96 -2.23 0.00 0.00 178.31 179.01 3dnu h GLN 302 N 0.70 1.15 0.28 1.11 4.20 -0.79 -1.38 115.11 120.38 3dnu h GLN 302 Ca 0.19 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 3dnu h GLN 302 Cb -0.02 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.54 3dnu h GLN 302 CO -0.04 0.85 -0.15 2.35 -0.67 0.00 0.00 178.83 181.17 3dnu h TRP 303 N 1.16 -0.38 -0.94 2.96 7.01 -1.05 0.37 115.95 125.07 3dnu h TRP 303 Ca 0.29 -0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.39 3dnu h TRP 303 Cb 0.03 0.13 -0.07 0.00 -2.10 0.00 0.00 29.16 27.15 3dnu h TRP 303 CO 0.01 -0.24 0.60 -0.07 -2.79 0.00 0.00 178.44 175.96 3dnu h LEU 304 N -0.40 0.85 -2.47 0.65 3.38 -0.48 -2.39 115.31 114.45 3dnu h LEU 304 Ca -0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dnu h LEU 304 Cb 0.31 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3dnu h LEU 304 CO 0.05 0.48 0.00 2.30 0.09 0.00 0.00 178.44 181.36 3dnu n ILE 305 N -4.56 0.81 -3.05 1.22 -5.35 -0.58 -4.11 119.36 103.73 3dnu n ILE 305 Ca 0.17 -0.87 -0.19 0.00 -0.27 0.00 0.00 62.75 61.58 3dnu n ILE 305 Cb 0.34 0.59 0.04 0.00 -1.74 0.00 0.00 39.64 38.86 3dnu n ILE 305 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dnu n GLY 306 N 1.57 -0.32 3.60 3.28 0.00 -0.41 -4.14 105.19 108.78 3dnu n GLY 306 Ca 0.22 0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 3dnu n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnu s ALA 307 N -3.13 3.41 -2.21 4.61 0.00 -0.01 -0.84 121.76 123.59 3dnu s ALA 307 Ca 0.33 -0.46 0.19 0.00 0.00 0.00 0.00 51.96 52.02 3dnu s ALA 307 Cb -0.14 -3.52 0.26 0.00 0.00 0.00 0.00 23.12 19.71 3dnu s ALA 307 CO 0.40 -1.58 1.21 0.25 0.00 0.00 0.00 175.76 176.04 3dnu n THR 308 N 5.95 0.28 -1.59 0.00 -2.24 -1.26 -4.50 114.28 110.92 3dnu n THR 308 Ca 0.07 -0.64 -0.08 0.00 -2.27 0.00 0.00 64.05 61.13 3dnu n THR 308 Cb 0.48 1.15 0.16 0.00 -2.10 0.00 0.00 70.33 70.03 3dnu n THR 308 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dnu n GLN 309 N 1.15 2.15 -1.34 -0.78 1.13 -1.26 -3.68 117.38 114.74 3dnu n GLN 309 Ca 0.14 -3.41 -0.34 0.00 -1.94 0.00 0.00 57.00 51.46 3dnu n GLN 309 Cb 0.51 -1.89 -0.05 0.00 0.11 0.00 0.00 30.24 28.91 3dnu n GLN 309 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dnu n GLY 310 N -1.04 4.14 3.79 1.08 0.00 -1.26 -4.89 105.19 107.00 3dnu n GLY 310 Ca 0.34 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 3dnu n GLY 310 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3dnu s HIS 311 N 1.38 1.13 0.52 1.61 -3.43 -1.26 -4.78 115.29 110.46 3dnu s HIS 311 Ca 0.67 0.39 0.19 0.00 -0.80 0.00 0.00 55.06 55.51 3dnu s HIS 311 Cb 0.21 -3.84 1.31 0.00 -1.43 0.00 0.00 32.58 28.83 3dnu s HIS 311 CO -0.06 -3.17 2.09 0.00 -2.00 0.00 0.00 174.74 171.60 3dnu h ALA 312 N -2.04 2.17 0.00 -1.38 0.00 -1.54 -0.91 119.26 115.56 3dnu h ALA 312 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3dnu h ALA 312 Cb 1.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3dnu h ALA 312 CO 0.36 -0.23 0.00 1.63 0.00 0.00 0.00 179.25 181.02 3dnu n LYS 313 N -4.48 0.63 -0.01 0.00 5.02 -1.26 -2.74 118.16 115.31 3dnu n LYS 313 Ca 0.02 0.02 0.13 0.00 -2.02 0.00 0.00 58.31 56.46 3dnu n LYS 313 Cb 0.27 -1.50 0.52 0.00 -0.02 0.00 0.00 35.03 34.30 3dnu n LYS 313 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3dnu n ASN 314 N -1.14 1.44 -4.19 4.39 4.13 -0.35 -4.79 115.26 114.76 3dnu n ASN 314 Ca 0.17 -1.51 -0.27 0.00 1.68 0.00 0.00 54.58 54.65 3dnu n ASN 314 Cb 0.15 -0.02 -0.16 0.00 -1.54 0.00 0.00 39.78 38.21 3dnu n ASN 314 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3dnu s PHE 315 N -1.96 1.84 0.17 3.10 0.40 -1.11 -4.42 117.98 116.01 3dnu s PHE 315 Ca 0.37 -0.43 -0.01 0.00 -0.60 0.00 0.00 56.93 56.27 3dnu s PHE 315 Cb 0.20 -1.20 -0.04 0.00 0.51 0.00 0.00 43.02 42.49 3dnu s PHE 315 CO 0.32 -0.09 0.09 -1.12 0.70 0.00 0.00 175.22 175.12 3dnu s SER 316 N -0.28 0.32 0.03 1.36 0.01 -1.26 -4.41 113.70 109.47 3dnu s SER 316 Ca 0.03 -1.31 0.03 0.00 1.31 0.00 0.00 55.95 56.01 3dnu s SER 316 Cb -0.10 0.32 -0.02 0.00 0.21 0.00 0.00 66.02 66.44 3dnu s SER 316 CO 0.01 -0.78 -0.09 0.68 0.41 0.00 0.00 173.24 173.47 3dnu s VAL 317 N -4.07 0.70 0.22 3.43 -7.23 0.04 -1.14 120.40 112.35 3dnu s VAL 317 Ca 0.32 -0.82 -0.28 0.00 -1.81 0.00 0.00 61.98 59.39 3dnu s VAL 317 Cb 0.07 -0.68 -0.09 0.00 0.56 0.00 0.00 36.38 36.25 3dnu s VAL 317 CO 0.08 -0.11 0.89 -0.36 -0.31 0.00 0.00 175.10 175.28 3dnu s PHE 318 N -0.85 3.95 -0.28 2.82 0.40 0.70 -1.45 117.98 123.27 3dnu s PHE 318 Ca -0.03 1.82 -0.10 0.00 -0.60 0.00 0.00 56.93 58.03 3dnu s PHE 318 Cb -0.07 -2.91 -0.04 0.00 0.51 0.00 0.00 43.02 40.51 3dnu s PHE 318 CO 0.01 0.46 0.16 0.42 0.70 0.00 0.00 175.22 176.97 3dnu s ILE 319 N -1.19 5.04 0.38 0.64 1.01 -0.86 -2.49 121.20 123.73 3dnu s ILE 319 Ca 0.40 0.05 0.06 0.00 0.00 0.00 0.00 60.65 61.16 3dnu s ILE 319 Cb -0.25 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 38.82 3dnu s ILE 319 CO 0.30 0.25 0.54 -1.10 0.00 0.00 0.00 174.94 174.93 3dnu s GLN 320 N 1.72 2.99 0.21 2.79 -0.21 -0.08 -4.61 119.66 122.47 3dnu s GLN 320 Ca 0.07 -1.03 -0.29 0.00 0.02 0.00 0.00 55.36 54.13 3dnu s GLN 320 Cb -0.16 -2.76 -0.16 0.00 1.00 0.00 0.00 33.01 30.93 3dnu s GLN 320 CO 0.09 -0.12 0.73 0.00 -2.12 0.00 0.00 175.29 173.87 3dnu n ALA 321 N -1.79 -2.02 -0.61 6.09 0.00 -1.26 -0.45 120.51 120.48 3dnu n ALA 321 Ca 0.03 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3dnu n ALA 321 Cb 0.58 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 18.27 3dnu n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dnu n GLY 322 N 1.75 1.28 1.13 0.00 0.00 -0.35 -3.51 105.19 105.49 3dnu n GLY 322 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3dnu n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dnu n GLY 323 N -2.00 0.75 3.75 -0.02 0.00 0.41 -4.91 105.19 103.17 3dnu n GLY 323 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3dnu n GLY 323 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dnu s SER 324 N -2.23 3.15 0.14 1.61 1.04 -1.23 -4.80 113.70 111.38 3dnu s SER 324 Ca 0.00 1.02 -0.18 0.00 0.48 0.00 0.00 55.95 57.27 3dnu s SER 324 Cb 0.00 -1.62 0.05 0.00 0.10 0.00 0.00 66.02 64.54 3dnu s SER 324 CO 0.00 -2.79 0.47 -0.72 0.98 0.00 0.00 173.24 171.18 3dnu s TYR 325 N -3.17 -0.31 0.02 5.02 1.13 -1.26 -0.90 117.35 117.88 3dnu s TYR 325 Ca 0.64 0.02 -0.18 0.00 -1.41 0.00 0.00 57.07 56.14 3dnu s TYR 325 Cb -0.16 0.36 0.03 0.00 -1.10 0.00 0.00 41.96 41.09 3dnu s TYR 325 CO 0.55 -0.76 0.40 -0.98 -2.51 0.00 0.00 175.55 172.26 3dnu s ARG 326 N -3.79 0.87 0.32 -3.49 1.70 -1.04 -0.62 118.95 112.90 3dnu s ARG 326 Ca 0.03 -0.29 -0.29 0.00 -0.47 0.00 0.00 55.73 54.71 3dnu s ARG 326 Cb 0.01 0.39 -0.11 0.00 -0.57 0.00 0.00 34.95 34.67 3dnu s ARG 326 CO -0.12 -0.28 1.50 -1.17 -1.08 0.00 0.00 175.30 174.15 3dnu s LEU 327 N -1.80 4.35 0.82 -1.89 2.96 -1.26 -0.21 118.68 121.64 3dnu s LEU 327 Ca -0.07 2.92 -0.07 0.00 -0.22 0.00 0.00 54.13 56.68 3dnu s LEU 327 Cb -0.02 -3.65 0.15 0.00 0.50 0.00 0.00 46.19 43.18 3dnu s LEU 327 CO 0.00 -0.83 1.13 0.42 -1.32 0.00 0.00 176.35 175.75 3dnu s THR 328 N -0.53 2.09 1.01 3.68 -4.23 -0.29 -4.73 115.64 112.64 3dnu s THR 328 Ca 0.57 -0.33 -0.12 0.00 -1.18 0.00 0.00 61.69 60.63 3dnu s THR 328 Cb -0.46 -2.76 0.20 0.00 1.34 0.00 0.00 72.50 70.82 3dnu s THR 328 CO 0.53 0.00 1.08 -2.84 -0.54 0.00 0.00 174.62 172.85 3dnu s PRO 329 N -5.45 0.28 0.56 3.99 0.02 -1.26 -4.82 135.00 128.32 3dnu s PRO 329 Ca 0.69 0.89 -0.07 0.00 0.02 0.00 0.00 61.00 62.53 3dnu s PRO 329 Cb -0.05 -1.69 -0.03 0.00 0.02 0.00 0.00 34.50 32.75 3dnu s PRO 329 CO 0.48 -2.93 0.90 -0.06 -0.33 0.00 0.00 177.00 175.06 3dnu s PHE 330 N -2.72 3.51 0.32 6.54 0.08 -0.38 -4.77 117.98 120.56 3dnu s PHE 330 Ca 0.66 0.94 -0.18 0.00 0.12 0.00 0.00 56.93 58.47 3dnu s PHE 330 Cb -0.21 -2.55 0.06 0.00 -0.57 0.00 0.00 43.02 39.74 3dnu s PHE 330 CO 0.60 -0.56 0.84 1.52 -0.10 0.00 0.00 175.22 177.53 3dnu s TYR 331 N -2.96 0.06 -1.28 0.36 -0.85 -1.26 -4.16 117.35 107.27 3dnu s TYR 331 Ca 0.51 -0.63 -0.08 0.00 -0.52 0.00 0.00 57.07 56.35 3dnu s TYR 331 Cb -0.11 0.79 -0.00 0.00 0.38 0.00 0.00 41.96 43.02 3dnu s TYR 331 CO 0.48 -1.36 0.63 -0.25 -1.52 0.00 0.00 175.55 173.53 3dnu n ASP 332 N -1.21 -2.45 -4.55 -0.18 8.00 -1.26 -4.95 116.55 109.95 3dnu n ASP 332 Ca -0.07 -0.97 -0.39 0.00 0.71 0.00 0.00 54.79 54.08 3dnu n ASP 332 Cb 0.60 -3.43 -0.11 0.00 -0.02 0.00 0.00 41.12 38.16 3dnu n ASP 332 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dnu s ILE 333 N -3.70 5.16 -0.01 0.53 1.01 -1.26 -4.97 121.20 117.95 3dnu s ILE 333 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 60.65 60.82 3dnu s ILE 333 Cb -0.06 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.89 3dnu s ILE 333 CO 0.86 0.17 0.02 -0.51 0.00 0.00 0.00 174.94 175.48 3dnu s ILE 334 N 1.73 -0.00 0.03 2.92 2.07 -1.26 -4.24 121.20 122.44 3dnu s ILE 334 Ca 0.07 0.01 -0.15 0.00 -1.41 0.00 0.00 60.65 59.16 3dnu s ILE 334 Cb -0.16 -0.04 -0.06 0.00 0.13 0.00 0.00 42.46 42.33 3dnu s ILE 334 CO 0.10 0.00 0.45 -0.55 -1.91 0.00 0.00 174.94 173.03 3dnu s SER 335 N 0.06 6.85 0.00 4.50 0.15 -1.26 -4.24 113.70 119.75 3dnu s SER 335 Ca -0.00 1.02 0.27 0.00 0.70 0.00 0.00 55.95 57.94 3dnu s SER 335 Cb -0.01 -2.27 0.96 0.00 -1.71 0.00 0.00 66.02 63.00 3dnu s SER 335 CO -0.00 0.29 1.70 0.00 1.20 0.00 0.00 173.24 176.43 3dnu n ALA 336 N 1.67 2.95 -0.37 5.45 0.00 -0.02 -4.28 120.51 125.92 3dnu n ALA 336 Ca -0.12 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3dnu n ALA 336 Cb 0.52 -1.24 0.14 0.00 0.00 0.00 0.00 19.45 18.87 3dnu n ALA 336 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 3dnu h PHE 337 N 0.67 1.22 0.00 0.00 0.05 -1.80 -1.90 116.94 115.18 3dnu h PHE 337 Ca 0.00 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.82 3dnu h PHE 337 Cb 0.44 -0.41 0.00 0.00 2.00 0.00 0.00 35.95 37.98 3dnu h PHE 337 CO 0.00 0.69 0.00 -2.30 -0.18 0.00 0.00 178.31 176.52 3dnu n PRO 338 N -4.46 0.01 0.00 1.51 -0.02 -1.26 -1.36 135.00 129.42 3dnu n PRO 338 Ca 0.14 0.30 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 3dnu n PRO 338 Cb 0.11 -1.51 0.11 0.00 -0.02 0.00 0.00 33.50 32.18 3dnu n PRO 338 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3dnu n VAL 339 N -1.52 0.00 -1.75 -1.45 0.31 -0.72 -4.88 118.33 108.32 3dnu n VAL 339 Ca 0.03 -0.10 -0.34 0.00 -0.01 0.00 0.00 64.34 63.91 3dnu n VAL 339 Cb 0.14 0.77 0.05 0.00 -0.91 0.00 0.00 33.84 33.90 3dnu n VAL 339 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3dnu s LEU 340 N -2.73 3.45 0.00 7.52 1.43 -0.47 -4.04 118.68 123.83 3dnu s LEU 340 Ca 0.15 2.20 0.00 0.00 -1.03 0.00 0.00 54.13 55.45 3dnu s LEU 340 Cb 0.18 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.82 3dnu s LEU 340 CO 0.67 -1.79 0.00 0.61 0.23 0.00 0.00 176.35 176.07 3dnu n GLY 341 N 0.01 1.61 0.00 -3.19 0.00 -0.64 -4.78 105.19 98.19 3dnu n GLY 341 Ca 0.12 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3dnu n GLY 341 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dnu n GLY 342 N 0.00 0.00 0.00 -0.02 0.00 -1.26 -3.42 105.19 100.49 3dnu n GLY 342 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3dnu n GLY 342 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dnu n THR 343 N 0.00 0.00 -0.46 2.61 -2.24 -1.26 -4.95 114.28 107.98 3dnu n THR 343 Ca 0.00 0.34 0.00 0.00 -2.27 0.00 0.00 64.05 62.12 3dnu n THR 343 Cb 0.00 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 67.52 3dnu n THR 343 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dnu n GLY 344 N 1.48 0.83 3.69 3.38 0.00 -1.22 -5.10 105.19 108.25 3dnu n GLY 344 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 3dnu n GLY 344 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dnu n ILE 345 N 0.00 0.23 -4.14 -0.61 2.08 -1.26 -4.85 119.36 110.82 3dnu n ILE 345 Ca 0.00 -0.04 -0.24 0.00 0.56 0.00 0.00 62.75 63.02 3dnu n ILE 345 Cb 0.00 -1.94 -0.06 0.00 -0.75 0.00 0.00 39.64 36.89 3dnu n ILE 345 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 3dnu s HIS 346 N 2.15 3.03 0.23 1.39 2.46 -1.26 -1.62 115.29 121.68 3dnu s HIS 346 Ca 0.81 -0.09 -0.06 0.00 0.47 0.00 0.00 55.06 56.19 3dnu s HIS 346 Cb -0.55 -1.42 0.40 0.00 -0.13 0.00 0.00 32.58 30.89 3dnu s HIS 346 CO 0.38 0.53 1.73 0.97 -2.47 0.00 0.00 174.74 175.88 3dnu h ILE 347 N 1.92 0.67 0.00 0.89 6.09 -1.99 0.34 117.51 125.42 3dnu h ILE 347 Ca -0.47 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 62.88 3dnu h ILE 347 Cb 1.22 0.23 0.00 0.00 0.47 0.00 0.00 36.82 38.74 3dnu h ILE 347 CO 0.61 0.07 0.00 -1.54 -3.07 0.00 0.00 178.15 174.22 3dnu n SER 348 N -5.03 0.05 0.01 2.19 3.41 -1.26 -2.10 113.62 110.89 3dnu n SER 348 Ca 0.13 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 3dnu n SER 348 Cb 0.38 -0.53 0.24 0.00 -0.26 0.00 0.00 64.21 64.05 3dnu n SER 348 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dnu n ASP 349 N -1.56 0.51 -4.68 4.04 8.00 0.11 -4.89 116.55 118.07 3dnu n ASP 349 Ca 0.01 -0.19 -0.43 0.00 0.71 0.00 0.00 54.79 54.90 3dnu n ASP 349 Cb 0.08 0.24 -0.02 0.00 -0.02 0.00 0.00 41.12 41.40 3dnu n ASP 349 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dnu s LEU 350 N -3.16 4.23 0.05 0.64 1.43 -0.89 -5.00 118.68 115.97 3dnu s LEU 350 Ca 0.10 1.57 0.07 0.00 -1.03 0.00 0.00 54.13 54.84 3dnu s LEU 350 Cb 0.17 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.81 3dnu s LEU 350 CO 0.70 -0.51 -0.20 -0.54 0.23 0.00 0.00 176.35 176.03 3dnu s LYS 351 N 2.25 1.31 0.34 1.70 -0.14 -1.26 -1.75 119.74 122.19 3dnu s LYS 351 Ca 0.49 -0.93 -0.27 0.00 -1.36 0.00 0.00 55.97 53.90 3dnu s LYS 351 Cb -0.19 -1.42 -0.09 0.00 -1.68 0.00 0.00 37.83 34.45 3dnu s LYS 351 CO 0.17 0.36 1.17 -0.51 -0.76 0.00 0.00 175.35 175.78 3dnu s LEU 352 N -1.22 4.37 0.00 3.17 1.43 0.12 -4.54 118.68 122.00 3dnu s LEU 352 Ca 0.07 2.38 0.00 0.00 -1.03 0.00 0.00 54.13 55.55 3dnu s LEU 352 Cb -0.09 -3.81 0.00 0.00 0.03 0.00 0.00 46.19 42.32 3dnu s LEU 352 CO 0.02 -0.45 0.16 0.00 0.23 0.00 0.00 176.35 176.31 3dnu n ALA 353 N 0.61 1.53 -2.35 4.21 0.00 -1.24 -4.93 120.51 118.34 3dnu n ALA 353 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.37 3dnu n ALA 353 Cb 0.45 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.81 3dnu n ALA 353 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3dnu s GLY 355 N 0.20 0.42 0.42 0.00 0.00 -1.26 -4.36 107.32 102.74 3dnu s GLY 355 Ca 0.00 -1.00 0.08 0.00 0.00 0.00 0.00 44.72 43.80 3dnu s GLY 355 CO 0.00 -1.07 0.54 1.08 0.00 0.00 0.00 173.10 173.64 3dnu s LEU 356 N -2.93 3.61 0.36 0.66 1.43 -0.11 -4.70 118.68 117.00 3dnu s LEU 356 Ca 0.11 -0.48 -0.27 0.00 -1.03 0.00 0.00 54.13 52.46 3dnu s LEU 356 Cb 0.06 -2.54 -0.09 0.00 0.03 0.00 0.00 46.19 43.65 3dnu s LEU 356 CO -0.07 -0.75 1.18 0.20 0.23 0.00 0.00 176.35 177.14 3dnu s ASN 357 N -4.32 6.74 0.18 2.29 0.02 -1.26 -0.33 114.94 118.27 3dnu s ASN 357 Ca 0.54 2.39 0.03 0.00 -1.02 0.00 0.00 52.86 54.80 3dnu s ASN 357 Cb -0.09 -2.62 -0.05 0.00 0.02 0.00 0.00 41.25 38.51 3dnu s ASN 357 CO 0.32 -0.52 -0.03 0.00 0.02 0.00 0.00 177.10 176.89 3dnu s ALA 358 N -1.31 1.47 0.52 0.60 0.00 -0.20 -4.39 121.76 118.44 3dnu s ALA 358 Ca 0.53 -1.60 0.21 0.00 0.00 0.00 0.00 51.96 51.10 3dnu s ALA 358 Cb -0.32 0.39 1.39 0.00 0.00 0.00 0.00 23.12 24.57 3dnu s ALA 358 CO 0.42 -0.24 2.14 0.66 0.00 0.00 0.00 175.76 178.73 3dnu h SER 359 N 2.68 0.00 -0.07 0.00 4.64 -1.97 -2.86 113.55 115.97 3dnu h SER 359 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3dnu h SER 359 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3dnu h SER 359 CO 0.63 0.05 0.00 0.29 -0.87 0.00 0.00 176.83 176.93 3dnu n LYS 360 N -4.22 2.19 0.00 4.77 5.02 -1.26 -5.06 118.16 119.60 3dnu n LYS 360 Ca -0.03 -2.24 0.00 0.00 -2.02 0.00 0.00 58.31 54.02 3dnu n LYS 360 Cb 0.13 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 3dnu n LYS 360 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dnu n GLY 361 N -0.84 -0.39 3.43 0.72 0.00 -1.08 -5.13 105.19 101.90 3dnu n GLY 361 Ca 0.11 0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 3dnu n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dnu s LYS 362 N 0.00 1.54 -0.19 1.61 1.02 -1.26 -1.03 119.74 121.42 3dnu s LYS 362 Ca 0.00 -1.45 -0.01 0.00 0.02 0.00 0.00 55.97 54.53 3dnu s LYS 362 Cb 0.00 -1.89 -0.00 0.00 -0.52 0.00 0.00 37.83 35.42 3dnu s LYS 362 CO 0.00 0.42 -0.11 0.21 -0.92 0.00 0.00 175.35 174.95 3dnu s LYS 363 N -2.50 3.25 0.00 1.68 2.47 0.55 -4.64 119.74 120.56 3dnu s LYS 363 Ca 0.19 -0.71 0.00 0.00 -1.56 0.00 0.00 55.97 53.90 3dnu s LYS 363 Cb -0.09 -2.78 0.00 0.00 -1.46 0.00 0.00 37.83 33.50 3dnu s LYS 363 CO 0.09 -0.10 0.00 0.25 0.16 0.00 0.00 175.35 175.75 3dnu n THR 364 N 4.44 0.00 -2.41 3.43 -2.24 -1.26 -0.93 114.28 115.31 3dnu n THR 364 Ca -0.19 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 3dnu n THR 364 Cb 0.51 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.46 3dnu n THR 364 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dnu s ALA 365 N -1.75 3.61 0.27 6.98 0.00 -1.26 -0.70 121.76 128.90 3dnu s ALA 365 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.38 3dnu s ALA 365 Cb 0.00 -3.65 0.58 0.00 0.00 0.00 0.00 23.12 20.05 3dnu s ALA 365 CO 0.00 -1.29 1.76 0.82 0.00 0.00 0.00 175.76 177.05 3dnu h ILE 366 N 5.58 0.71 0.00 0.00 2.04 -1.67 0.49 117.51 124.67 3dnu h ILE 366 Ca -0.27 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3dnu h ILE 366 Cb 1.10 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3dnu h ILE 366 CO 0.98 0.12 0.00 -0.67 0.00 0.00 0.00 178.15 178.58 3dnu n ASP 367 N -4.86 0.55 -0.38 1.72 4.64 -1.26 -2.60 116.55 114.36 3dnu n ASP 367 Ca 0.18 0.64 0.07 0.00 -1.38 0.00 0.00 54.79 54.30 3dnu n ASP 367 Cb 0.47 -0.75 0.01 0.00 -1.04 0.00 0.00 41.12 39.81 3dnu n ASP 367 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 3dnu n LYS 368 N -2.11 1.65 -3.10 -0.67 5.02 0.11 -5.01 118.16 114.06 3dnu n LYS 368 Ca 0.02 -0.88 -0.39 0.00 -2.02 0.00 0.00 58.31 55.04 3dnu n LYS 368 Cb 0.22 -1.23 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 3dnu n LYS 368 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3dnu s ILE 369 N -1.61 4.62 0.26 -0.18 1.01 -0.87 -5.01 121.20 119.42 3dnu s ILE 369 Ca 0.13 1.48 0.01 0.00 0.00 0.00 0.00 60.65 62.28 3dnu s ILE 369 Cb 0.12 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 3dnu s ILE 369 CO 0.32 0.49 0.10 -0.31 0.00 0.00 0.00 174.94 175.53 3dnu s TYR 370 N -0.78 1.55 0.44 3.97 1.51 -1.26 -5.04 117.35 117.75 3dnu s TYR 370 Ca 0.34 -1.18 0.19 0.00 -1.01 0.00 0.00 57.07 55.41 3dnu s TYR 370 Cb -0.21 -0.91 1.14 0.00 -0.11 0.00 0.00 41.96 41.87 3dnu s TYR 370 CO 0.22 -0.33 1.89 -1.35 -1.11 0.00 0.00 175.55 174.87 3dnu h PRO 371 N 2.37 0.33 -0.71 -1.71 0.11 -1.98 -1.72 132.00 128.69 3dnu h PRO 371 Ca -0.38 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.81 3dnu h PRO 371 Cb 1.25 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 3dnu h PRO 371 CO 0.61 0.22 0.47 0.07 -0.21 0.00 0.00 178.00 179.16 3dnu h ARG 372 N 0.34 0.56 -0.27 1.05 0.11 -1.99 -0.09 114.38 114.10 3dnu h ARG 372 Ca 0.42 -0.03 -0.17 0.00 0.10 0.00 0.00 59.98 60.30 3dnu h ARG 372 Cb 1.12 -0.13 -0.00 0.00 1.11 0.00 0.00 29.97 32.07 3dnu h ARG 372 CO -0.13 0.37 -0.51 0.45 0.10 0.00 0.00 179.97 180.25 3dnu h HIS 373 N 0.57 0.93 -0.28 4.08 3.86 -1.59 -0.16 115.15 122.56 3dnu h HIS 373 Ca 0.33 -0.32 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 3dnu h HIS 373 Cb 0.52 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 3dnu h HIS 373 CO -0.00 1.10 -0.13 0.74 0.86 0.00 0.00 177.93 180.50 3dnu h PHE 374 N 0.59 0.67 -0.77 2.45 -1.00 -1.32 -1.79 116.94 115.77 3dnu h PHE 374 Ca 0.02 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.63 3dnu h PHE 374 Cb 1.08 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 40.45 3dnu h PHE 374 CO 0.06 0.82 0.45 -0.07 -1.61 0.00 0.00 178.31 177.96 3dnu h LEU 375 N 0.33 0.93 -1.06 1.54 3.38 -0.96 -0.77 115.31 118.70 3dnu h LEU 375 Ca 0.06 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 3dnu h LEU 375 Cb 0.64 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3dnu h LEU 375 CO 0.04 0.73 0.02 0.00 0.09 0.00 0.00 178.44 179.32 3dnu h ALA 376 N 1.24 1.23 -0.20 1.53 0.00 -0.94 -0.79 119.26 121.33 3dnu h ALA 376 Ca 0.27 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3dnu h ALA 376 Cb -0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3dnu h ALA 376 CO -0.05 0.51 -0.14 1.15 0.00 0.00 0.00 179.25 180.72 3dnu h THR 377 N 0.65 1.32 -0.77 0.00 2.02 -1.04 -2.75 112.91 112.35 3dnu h THR 377 Ca 0.14 -1.26 0.06 0.00 0.77 0.00 0.00 66.41 66.12 3dnu h THR 377 Cb 0.38 1.71 -0.06 0.00 -1.74 0.00 0.00 68.15 68.43 3dnu h THR 377 CO 0.01 0.38 0.46 0.00 0.37 0.00 0.00 175.52 176.74 3dnu h ALA 378 N 0.67 1.05 0.16 6.16 0.00 -0.84 -1.96 119.26 124.49 3dnu h ALA 378 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3dnu h ALA 378 Cb 0.66 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3dnu h ALA 378 CO 0.04 0.17 -0.11 -0.22 0.00 0.00 0.00 179.25 179.14 3dnu h LYS 379 N 0.84 -0.26 0.00 0.00 3.64 -1.00 -0.96 116.57 118.84 3dnu h LYS 379 Ca 0.34 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.70 3dnu h LYS 379 Cb 0.17 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 3dnu h LYS 379 CO -0.17 -0.17 -0.17 -0.39 -2.27 0.00 0.00 179.45 176.27 3dnu h VAL 380 N -0.27 0.51 -0.35 2.00 -1.51 -1.27 -2.67 116.25 112.70 3dnu h VAL 380 Ca -0.01 -0.87 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 3dnu h VAL 380 Cb 0.23 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 3dnu h VAL 380 CO 0.01 0.17 0.00 0.18 -1.23 0.00 0.00 177.57 176.70 3dnu n LEU 381 N -3.45 2.41 -3.60 4.19 4.77 -0.76 -4.95 117.00 115.61 3dnu n LEU 381 Ca -0.01 -1.11 -0.24 0.00 -0.03 0.00 0.00 56.01 54.62 3dnu n LEU 381 Cb 0.35 -0.23 0.08 0.00 -2.33 0.00 0.00 43.42 41.29 3dnu n LEU 381 CO 0.32 0.56 0.24 0.54 -1.33 0.00 0.00 177.39 177.71 3dnu n ARG 382 N 0.81 -7.89 -3.64 3.23 1.74 -0.74 -4.98 116.66 105.19 3dnu n ARG 382 Ca 0.17 0.82 -0.38 0.00 -0.77 0.00 0.00 57.85 57.69 3dnu n ARG 382 Cb 0.41 -5.88 -0.11 0.00 -1.02 0.00 0.00 32.46 25.86 3dnu n ARG 382 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3dnu s PHE 383 N -3.32 3.18 -0.10 -1.55 5.36 -0.44 -5.03 117.98 116.07 3dnu s PHE 383 Ca 0.57 -0.23 -0.40 0.00 -0.96 0.00 0.00 56.93 55.91 3dnu s PHE 383 Cb -0.25 -2.35 -0.18 0.00 -0.34 0.00 0.00 43.02 39.90 3dnu s PHE 383 CO 0.73 -0.31 1.42 -2.30 -1.46 0.00 0.00 175.22 173.30 3dnu n PRO 384 N 5.01 0.74 -0.31 10.12 -0.02 -1.26 -4.39 135.00 144.89 3dnu n PRO 384 Ca -0.14 0.27 0.07 0.00 -2.02 0.00 0.00 63.50 61.68 3dnu n PRO 384 Cb 0.51 -1.87 0.28 0.00 -0.02 0.00 0.00 33.50 32.39 3dnu n PRO 384 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3dnu h GLU 385 N 4.94 0.90 -0.55 -0.52 4.81 -1.96 -0.53 114.58 121.68 3dnu h GLU 385 Ca -0.48 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.69 3dnu h GLU 385 Cb 1.36 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 3dnu h GLU 385 CO 0.82 0.60 0.32 -0.24 -0.73 0.00 0.00 179.01 179.78 3dnu h VAL 386 N 0.93 1.16 0.00 0.32 3.04 -2.04 -0.53 116.25 119.13 3dnu h VAL 386 Ca 0.44 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.75 3dnu h VAL 386 Cb 0.43 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.11 3dnu h VAL 386 CO -0.20 0.17 0.00 0.00 -1.01 0.00 0.00 177.57 176.53 3dnu n GLN 387 N -4.41 0.53 0.00 4.17 6.02 -0.21 -1.51 117.38 121.97 3dnu n GLN 387 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 3dnu n GLN 387 Cb 0.09 -1.24 0.00 0.00 1.02 0.00 0.00 30.24 30.10 3dnu n GLN 387 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3dnu n HIS 389 N 0.64 0.00 -0.27 1.08 8.25 -0.21 -1.56 115.22 123.15 3dnu n HIS 389 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 3dnu n HIS 389 Cb 0.24 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.42 3dnu n HIS 389 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3dnu h GLU 390 N 0.00 0.93 -0.24 -0.41 4.81 -1.51 0.16 114.58 118.31 3dnu h GLU 390 Ca 0.00 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3dnu h GLU 390 Cb 0.00 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 3dnu h GLU 390 CO 0.00 0.61 0.13 0.82 -0.73 0.00 0.00 179.01 179.84 3dnu h ILE 391 N 0.95 1.12 -0.40 2.32 2.04 -1.56 -0.03 117.51 121.95 3dnu h ILE 391 Ca 0.29 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.77 3dnu h ILE 391 Cb -0.04 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 3dnu h ILE 391 CO -0.09 0.12 0.07 -0.07 0.00 0.00 0.00 178.15 178.18 3dnu h LEU 392 N 0.27 0.63 -0.81 1.44 3.38 -1.77 -2.07 115.31 116.39 3dnu h LEU 392 Ca 0.08 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 3dnu h LEU 392 Cb 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3dnu h LEU 392 CO -0.01 0.73 -0.12 0.77 0.09 0.00 0.00 178.44 179.90 3dnu h SER 393 N 0.51 0.76 -0.47 -0.43 4.64 -0.60 -0.76 113.55 117.20 3dnu h SER 393 Ca 0.12 -0.23 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 3dnu h SER 393 Cb 0.37 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 3dnu h SER 393 CO 0.01 0.90 0.22 0.44 -0.87 0.00 0.00 176.83 177.53 3dnu h ASP 394 N 0.69 0.62 -0.15 4.97 3.45 -0.87 -1.03 116.42 124.10 3dnu h ASP 394 Ca 0.12 -0.14 -0.08 0.00 0.43 0.00 0.00 57.03 57.36 3dnu h ASP 394 Cb 0.60 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 3dnu h ASP 394 CO 0.04 0.58 -0.16 -0.26 -1.57 0.00 0.00 179.24 177.88 3dnu h PHE 395 N 0.61 0.59 -0.61 4.55 0.04 -1.13 -2.78 116.94 118.22 3dnu h PHE 395 Ca 0.16 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.83 3dnu h PHE 395 Cb 0.13 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 3dnu h PHE 395 CO -0.01 0.67 0.40 0.00 -0.60 0.00 0.00 178.31 178.77 3dnu h ALA 396 N 1.34 0.77 -0.54 2.45 0.00 -0.60 -1.99 119.26 120.69 3dnu h ALA 396 Ca 0.09 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.63 3dnu h ALA 396 Cb 0.56 -0.25 -0.16 0.00 0.00 0.00 0.00 17.79 17.94 3dnu h ALA 396 CO 0.04 0.21 0.40 2.89 0.00 0.00 0.00 179.25 182.79 3dnu n ARG 397 N -4.65 1.76 0.00 0.00 1.85 -0.44 -4.76 116.66 110.42 3dnu n ARG 397 Ca 0.04 -1.68 0.00 0.00 -1.00 0.00 0.00 57.85 55.22 3dnu n ARG 397 Cb 0.02 -1.66 0.00 0.00 -1.05 0.00 0.00 32.46 29.78 3dnu n ARG 397 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 3dnu n ILE 399 N -0.16 0.00 0.06 8.89 2.08 -0.75 -4.72 119.36 124.77 3dnu n ILE 399 Ca 0.33 0.00 -0.11 0.00 0.56 0.00 0.00 62.75 63.53 3dnu n ILE 399 Cb 0.92 0.00 -0.05 0.00 -0.75 0.00 0.00 39.64 39.76 3dnu n ILE 399 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3dnu h PRO 400 N 0.00 -0.32 -0.84 0.38 0.11 -1.85 -0.85 132.00 128.62 3dnu h PRO 400 Ca 0.00 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3dnu h PRO 400 Cb 0.00 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.14 3dnu h PRO 400 CO 0.00 -0.21 0.49 0.00 -0.21 0.00 0.00 178.00 178.07 3dnu h ALA 401 N 0.56 1.07 -0.93 -0.75 0.00 -1.99 -2.50 119.26 114.72 3dnu h ALA 401 Ca 0.06 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.87 3dnu h ALA 401 Cb 0.40 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3dnu h ALA 401 CO -0.18 0.55 0.62 0.00 0.00 0.00 0.00 179.25 180.23 3dnu h ALA 402 N 1.27 1.19 -0.42 0.00 0.00 -1.80 0.11 119.26 119.60 3dnu h ALA 402 Ca 0.30 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3dnu h ALA 402 Cb -0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 3dnu h ALA 402 CO -0.05 0.57 -0.04 -0.07 0.00 0.00 0.00 179.25 179.66 3dnu h LEU 403 N 1.25 0.68 -0.19 0.00 3.38 -0.84 -2.32 115.31 117.27 3dnu h LEU 403 Ca 0.35 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 58.09 3dnu h LEU 403 Cb -0.13 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.44 3dnu h LEU 403 CO -0.08 0.77 -0.11 0.44 0.09 0.00 0.00 178.44 179.54 3dnu h ASP 404 N 0.66 0.43 -0.57 -0.43 3.32 -0.92 -3.27 116.42 115.64 3dnu h ASP 404 Ca 0.13 -0.43 0.01 0.00 0.02 0.00 0.00 57.03 56.76 3dnu h ASP 404 Cb 0.46 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 3dnu h ASP 404 CO 0.02 0.76 0.37 0.78 -1.72 0.00 0.00 179.24 179.46 3dnu h ASN 405 N 0.09 0.62 -0.19 6.45 2.35 -0.58 -2.77 115.58 121.55 3dnu h ASN 405 Ca 0.04 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 3dnu h ASN 405 Cb 0.62 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 3dnu h ASN 405 CO 0.03 0.44 0.10 0.58 -1.65 0.00 0.00 177.43 176.94 3dnu h VAL 406 N 0.73 1.08 -0.80 2.81 2.07 -1.47 -3.01 116.25 117.66 3dnu h VAL 406 Ca 0.21 -0.22 0.16 0.00 0.82 0.00 0.00 66.70 67.67 3dnu h VAL 406 Cb -0.03 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 3dnu h VAL 406 CO -0.05 0.09 0.53 0.11 0.02 0.00 0.00 177.57 178.27 3dnu h LYS 407 N 0.30 0.41 0.00 1.57 1.79 -1.61 -0.01 116.57 119.01 3dnu h LYS 407 Ca 0.08 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 3dnu h LYS 407 Cb 0.04 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.59 3dnu h LYS 407 CO -0.01 0.27 -0.10 1.79 -1.08 0.00 0.00 179.45 180.32 3dnu h THR 408 N 0.42 0.50 -0.72 -0.16 1.35 -1.71 -2.31 112.91 110.27 3dnu h THR 408 Ca 0.40 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 3dnu h THR 408 Cb 0.94 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 3dnu h THR 408 CO -0.14 0.10 0.00 -1.20 -0.25 0.00 0.00 175.52 174.03 3dnu n SER 409 N -3.58 4.06 -4.78 5.36 7.64 -0.02 -4.92 113.62 117.38 3dnu n SER 409 Ca -0.02 -2.07 -0.37 0.00 1.01 0.00 0.00 58.87 57.43 3dnu n SER 409 Cb 0.23 -0.51 -0.07 0.00 -1.01 0.00 0.00 64.21 62.86 3dnu n SER 409 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3dnu s LEU 410 N -1.13 4.33 0.98 -3.43 1.43 -0.87 -5.08 118.68 114.90 3dnu s LEU 410 Ca 0.49 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 54.11 3dnu s LEU 410 Cb 0.27 -2.40 0.18 0.00 0.03 0.00 0.00 46.19 44.27 3dnu s LEU 410 CO 0.32 0.20 1.09 -2.16 0.23 0.00 0.00 176.35 176.03 3dnu s PRO 411 N -0.14 0.57 0.51 1.29 0.04 -1.26 -4.90 135.00 131.11 3dnu s PRO 411 Ca 0.19 1.09 0.29 0.00 0.04 0.00 0.00 61.00 62.61 3dnu s PRO 411 Cb -0.14 -1.71 1.31 0.00 0.04 0.00 0.00 34.50 34.01 3dnu s PRO 411 CO 0.07 -2.79 1.98 1.79 0.04 0.00 0.00 177.00 178.09 3dnu h THR 412 N -1.96 0.36 -0.39 1.26 1.35 -1.98 -2.49 112.91 109.06 3dnu h THR 412 Ca -0.51 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 3dnu h THR 412 Cb 1.29 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 3dnu h THR 412 CO 0.49 0.11 0.00 -0.90 -0.25 0.00 0.00 175.52 174.97 3dnu n ASP 413 N -3.35 2.21 -4.74 5.36 5.75 -1.26 -4.93 116.55 115.58 3dnu n ASP 413 Ca -0.01 -2.03 -0.41 0.00 -0.01 0.00 0.00 54.79 52.33 3dnu n ASP 413 Cb 0.31 -0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 40.09 3dnu n ASP 413 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 3dnu s PHE 414 N -1.50 3.00 -0.06 2.11 2.19 -0.94 -4.90 117.98 117.88 3dnu s PHE 414 Ca 0.27 0.96 -0.29 0.00 0.33 0.00 0.00 56.93 58.19 3dnu s PHE 414 Cb 0.14 -3.85 -0.07 0.00 -1.31 0.00 0.00 43.02 37.93 3dnu s PHE 414 CO 0.17 -2.83 1.96 -1.25 1.83 0.00 0.00 175.22 175.11 3dnu s PRO 415 N -0.19 3.88 0.42 10.12 0.04 -1.26 -4.89 135.00 143.11 3dnu s PRO 415 Ca 0.61 2.35 0.09 0.00 0.04 0.00 0.00 61.00 64.09 3dnu s PRO 415 Cb -0.42 -4.18 0.89 0.00 0.04 0.00 0.00 34.50 30.82 3dnu s PRO 415 CO 0.42 -1.25 2.02 0.93 0.04 0.00 0.00 177.00 179.16 3dnu h GLU 416 N 11.55 0.35 0.00 4.56 5.08 -1.97 -2.39 114.58 131.76 3dnu h GLU 416 Ca -0.45 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 57.82 3dnu h GLU 416 Cb 1.22 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 3dnu h GLU 416 CO 0.95 0.31 -0.21 -2.95 -1.00 0.00 0.00 179.01 176.12 3dnu h ASN 417 N 0.35 0.00 -0.14 1.42 -1.07 -1.99 -1.04 115.58 113.10 3dnu h ASN 417 Ca 0.09 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.42 3dnu h ASN 417 Cb 0.11 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.36 3dnu h ASN 417 CO -0.01 0.21 -0.06 0.58 0.07 0.00 0.00 177.43 178.22 3dnu h VAL 418 N 0.00 1.31 -0.11 6.14 2.07 -1.83 -0.89 116.25 122.94 3dnu h VAL 418 Ca -0.00 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.45 3dnu h VAL 418 Cb 0.39 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3dnu h VAL 418 CO 0.03 0.31 0.07 0.58 0.02 0.00 0.00 177.57 178.58 3dnu h VAL 419 N -0.04 1.02 -0.28 2.57 2.07 -1.49 -1.69 116.25 118.41 3dnu h VAL 419 Ca 0.03 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.53 3dnu h VAL 419 Cb 0.52 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 3dnu h VAL 419 CO 0.02 0.03 0.12 0.74 0.02 0.00 0.00 177.57 178.50 3dnu h THR 420 N 0.14 0.97 -0.26 2.57 2.02 -1.16 0.62 112.91 117.81 3dnu h THR 420 Ca 0.04 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 3dnu h THR 420 Cb -0.01 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 3dnu h THR 420 CO -0.02 0.05 0.15 0.00 0.37 0.00 0.00 175.52 176.07 3dnu h ALA 421 N 1.16 0.33 -0.01 6.16 0.00 -1.05 -1.91 119.26 123.93 3dnu h ALA 421 Ca 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3dnu h ALA 421 Cb 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3dnu h ALA 421 CO -0.10 -0.16 -0.06 0.28 0.00 0.00 0.00 179.25 179.22 3dnu h VAL 422 N 0.32 1.50 -0.24 0.00 2.07 -1.17 -2.99 116.25 115.74 3dnu h VAL 422 Ca 0.09 -1.56 0.05 0.00 0.82 0.00 0.00 66.70 66.10 3dnu h VAL 422 Cb 0.04 2.51 -0.06 0.00 -1.52 0.00 0.00 31.29 32.26 3dnu h VAL 422 CO -0.02 0.42 -0.12 -0.33 0.02 0.00 0.00 177.57 177.54 3dnu h GLU 423 N -0.55 -0.09 -0.86 1.57 5.08 -0.91 -0.02 114.58 118.80 3dnu h GLU 423 Ca -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dnu h GLU 423 Cb 0.71 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 3dnu h GLU 423 CO 0.01 -0.06 0.54 0.66 -1.00 0.00 0.00 179.01 179.17 3dnu h SER 424 N -0.09 1.01 0.26 1.42 4.64 -1.44 -0.52 113.55 118.83 3dnu h SER 424 Ca 0.13 -0.05 -0.21 0.00 -0.47 0.00 0.00 61.79 61.19 3dnu h SER 424 Cb 0.29 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3dnu h SER 424 CO -0.30 0.76 -0.84 0.78 -0.87 0.00 0.00 176.83 176.36 3dnu h ASN 425 N 1.18 0.55 -0.43 4.97 2.35 -1.34 -1.93 115.58 120.92 3dnu h ASN 425 Ca 0.31 -0.40 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 3dnu h ASN 425 Cb -0.09 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.10 3dnu h ASN 425 CO -0.06 1.17 0.15 0.58 -1.65 0.00 0.00 177.43 177.62 3dnu h VAL 426 N 0.28 1.21 -0.44 2.81 2.07 -0.79 -2.35 116.25 119.04 3dnu h VAL 426 Ca -0.06 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 3dnu h VAL 426 Cb 1.45 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 3dnu h VAL 426 CO 0.15 0.25 0.09 -0.07 0.02 0.00 0.00 177.57 178.01 3dnu h LEU 427 N 0.56 0.62 -0.14 2.57 3.38 -1.00 0.73 115.31 122.03 3dnu h LEU 427 Ca 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3dnu h LEU 427 Cb 0.24 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3dnu h LEU 427 CO -0.01 0.63 0.07 -0.09 0.09 0.00 0.00 178.44 179.13 3dnu h ARG 428 N 0.65 0.20 -0.16 1.13 2.43 -1.13 -2.17 114.38 115.32 3dnu h ARG 428 Ca 0.15 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.14 3dnu h ARG 428 Cb 0.27 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3dnu h ARG 428 CO 0.00 0.25 -0.53 -0.07 -1.51 0.00 0.00 179.97 178.12 3dnu h LEU 429 N 0.10 0.51 -1.99 3.80 3.38 -1.25 -2.88 115.31 116.97 3dnu h LEU 429 Ca 0.05 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.78 3dnu h LEU 429 Cb 0.12 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3dnu h LEU 429 CO -0.01 0.94 0.08 -0.74 0.09 0.00 0.00 178.44 178.80 3dnu h HIS 430 N 0.36 0.01 -0.57 1.13 2.76 -0.66 -0.42 115.15 117.76 3dnu h HIS 430 Ca 0.01 0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.28 3dnu h HIS 430 Cb 1.04 -0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.97 3dnu h HIS 430 CO 0.04 0.01 0.38 0.78 -1.30 0.00 0.00 177.93 177.84 3dnu h GLY 431 N 0.01 0.49 2.00 5.26 0.00 -1.16 0.11 103.07 109.78 3dnu h GLY 431 Ca 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 3dnu h GLY 431 CO -0.00 0.09 -0.15 3.21 0.00 0.00 0.00 176.54 179.68 3dnu h ARG 432 N 0.35 0.00 0.07 4.80 3.08 -1.21 -2.13 114.38 119.34 3dnu h ARG 432 Ca 0.26 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 60.08 3dnu h ARG 432 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3dnu h ARG 432 CO -0.07 0.15 -1.19 -0.07 -1.07 0.00 0.00 179.97 177.73 3dnu h LEU 433 N 0.00 0.23 -1.15 3.04 3.38 -1.11 -3.32 115.31 116.37 3dnu h LEU 433 Ca -0.00 -0.79 -0.05 0.00 0.09 0.00 0.00 57.88 57.13 3dnu h LEU 433 Cb 0.51 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3dnu h LEU 433 CO 0.02 1.51 0.01 0.77 0.09 0.00 0.00 178.44 180.84 3dnu h SER 434 N -0.57 0.57 0.20 -0.43 4.64 -1.19 0.22 113.55 116.99 3dnu h SER 434 Ca -0.28 -0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 60.88 3dnu h SER 434 Cb 1.54 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 3dnu h SER 434 CO -0.02 0.63 -0.23 0.03 -0.87 0.00 0.00 176.83 176.37 3dnu h ARG 435 N 0.57 0.06 0.00 4.77 3.08 -1.55 -3.00 114.38 118.31 3dnu h ARG 435 Ca 0.12 -0.01 -0.26 0.00 0.07 0.00 0.00 59.98 59.89 3dnu h ARG 435 Cb 0.35 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 3dnu h ARG 435 CO 0.01 0.29 -1.75 -1.91 -1.07 0.00 0.00 179.97 175.53 3dnu n GLU 436 N -4.24 0.64 0.00 0.04 2.13 -0.83 -5.12 120.64 113.25 3dnu n GLU 436 Ca -0.02 0.21 0.00 0.00 0.66 0.00 0.00 57.16 58.01 3dnu n GLU 436 Cb 0.30 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 30.27 3dnu n GLU 436 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38