#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fhi h SER 14 N 0.00 0.00 -0.26 -1.84 0.87 -2.05 -3.06 113.55 107.21 3fhi h SER 14 Ca 0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.38 3fhi h SER 14 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3fhi h SER 14 CO 0.00 0.33 -0.54 0.58 -0.53 0.00 0.00 176.83 176.68 3fhi h VAL 15 N 0.00 1.28 -0.50 2.23 2.07 -2.05 -2.21 116.25 117.07 3fhi h VAL 15 Ca -0.00 -1.73 -0.09 0.00 0.82 0.00 0.00 66.70 65.70 3fhi h VAL 15 Cb 1.23 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.61 3fhi h VAL 15 CO 0.04 0.56 -0.07 0.11 0.02 0.00 0.00 177.57 178.24 3fhi h LYS 16 N 0.66 0.89 -0.65 1.57 1.79 -2.00 -0.47 116.57 118.36 3fhi h LYS 16 Ca 0.02 -0.29 -0.05 0.00 -2.18 0.00 0.00 60.65 58.15 3fhi h LYS 16 Cb 1.14 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.68 3fhi h LYS 16 CO 0.12 0.93 0.23 1.05 -1.08 0.00 0.00 179.45 180.69 3fhi h GLU 17 N 0.81 1.00 -0.25 3.15 -0.00 -1.55 -1.56 114.58 116.17 3fhi h GLU 17 Ca 0.14 -0.20 -0.01 0.00 -0.00 0.00 0.00 59.36 59.29 3fhi h GLU 17 Cb 0.58 -0.15 -0.01 0.00 -0.00 0.00 0.00 28.75 29.16 3fhi h GLU 17 CO 0.04 0.86 0.13 0.35 -0.00 0.00 0.00 179.01 180.38 3fhi h PHE 18 N 0.93 0.35 -0.11 2.06 3.57 -0.97 -2.53 116.94 120.25 3fhi h PHE 18 Ca 0.21 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.55 3fhi h PHE 18 Cb 0.26 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3fhi h PHE 18 CO 0.02 0.33 -0.57 -0.07 -2.23 0.00 0.00 178.31 175.78 3fhi h LEU 19 N 0.28 0.37 -0.91 0.59 3.38 -1.05 -0.87 115.31 117.10 3fhi h LEU 19 Ca 0.09 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3fhi h LEU 19 Cb 0.10 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3fhi h LEU 19 CO -0.01 0.86 0.06 0.00 0.09 0.00 0.00 178.44 179.44 3fhi h ALA 20 N 1.14 1.10 -0.18 1.53 0.00 -1.23 -0.14 119.26 121.48 3fhi h ALA 20 Ca 0.00 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.45 3fhi h ALA 20 Cb 1.08 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3fhi h ALA 20 CO 0.09 0.58 -0.71 1.57 0.00 0.00 0.00 179.25 180.78 3fhi h LYS 21 N 0.82 0.76 -0.93 0.00 -0.00 -1.30 -2.76 116.57 113.16 3fhi h LYS 21 Ca 0.17 -0.58 0.07 0.00 -0.00 0.00 0.00 60.65 60.30 3fhi h LYS 21 Cb 0.40 0.11 -0.06 0.00 -0.00 0.00 0.00 32.23 32.68 3fhi h LYS 21 CO 0.01 1.20 0.60 0.00 -0.00 0.00 0.00 179.45 181.26 3fhi h ALA 22 N 0.65 1.51 -0.22 0.07 0.00 -0.84 -1.03 119.26 119.39 3fhi h ALA 22 Ca -0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3fhi h ALA 22 Cb 1.33 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3fhi h ALA 22 CO 0.15 0.34 0.01 -0.22 0.00 0.00 0.00 179.25 179.53 3fhi h LYS 23 N 1.04 0.39 0.28 0.00 3.11 -0.99 -2.01 116.57 118.38 3fhi h LYS 23 Ca 0.41 -0.12 0.00 0.00 -2.81 0.00 0.00 60.65 58.13 3fhi h LYS 23 Cb 0.23 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.39 3fhi h LYS 23 CO -0.16 0.57 -0.36 1.49 -2.81 0.00 0.00 179.45 178.18 3fhi h GLU 24 N 0.16 -0.66 -0.52 1.90 4.81 -1.14 -0.94 114.58 118.18 3fhi h GLU 24 Ca 0.06 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.44 3fhi h GLU 24 Cb 0.39 0.15 -0.09 0.00 0.63 0.00 0.00 28.75 29.83 3fhi h GLU 24 CO 0.01 -0.44 -0.05 -0.44 -0.73 0.00 0.00 179.01 177.35 3fhi h ASP 25 N -0.69 -0.34 0.04 1.04 3.32 -1.21 -1.44 116.42 117.14 3fhi h ASP 25 Ca -0.01 0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3fhi h ASP 25 Cb 0.65 0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3fhi h ASP 25 CO -0.11 -0.12 -0.02 0.15 -1.72 0.00 0.00 179.24 177.42 3fhi h PHE 26 N 0.06 -0.05 -0.68 4.55 3.57 -1.08 -2.21 116.94 121.11 3fhi h PHE 26 Ca 0.26 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.79 3fhi h PHE 26 Cb 0.40 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 3fhi h PHE 26 CO -0.37 0.10 0.43 -0.07 -2.23 0.00 0.00 178.31 176.17 3fhi h LEU 27 N -0.19 0.71 -0.12 0.59 3.38 -0.89 0.62 115.31 119.41 3fhi h LEU 27 Ca -0.01 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3fhi h LEU 27 Cb 0.17 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3fhi h LEU 27 CO 0.01 0.49 0.07 0.11 0.09 0.00 0.00 178.44 179.21 3fhi h LYS 28 N 0.84 0.14 -0.09 1.13 1.57 -1.17 0.85 116.57 119.84 3fhi h LYS 28 Ca 0.27 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.98 3fhi h LYS 28 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3fhi h LYS 28 CO -0.10 0.09 -0.23 0.87 -0.57 0.00 0.00 179.45 179.51 3fhi h LYS 29 N 0.14 0.15 -0.02 3.15 1.57 -0.98 -2.68 116.57 117.91 3fhi h LYS 29 Ca 0.05 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3fhi h LYS 29 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3fhi h LYS 29 CO -0.03 0.38 -0.04 2.35 -0.57 0.00 0.00 179.45 181.55 3fhi h TRP 30 N 0.14 0.07 -0.01 -1.35 2.91 0.94 -3.07 115.95 115.59 3fhi h TRP 30 Ca 0.02 -0.03 -0.04 0.00 1.13 0.00 0.00 58.89 59.98 3fhi h TRP 30 Cb 0.49 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 29.13 3fhi h TRP 30 CO 0.00 0.64 -0.17 0.93 -1.03 0.00 0.00 178.44 178.82 3fhi h GLU 31 N -0.52 0.01 -2.45 2.65 4.39 -0.85 -3.34 114.58 114.47 3fhi h GLU 31 Ca -0.00 -0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.10 3fhi h GLU 31 Cb 0.64 -0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.89 3fhi h GLU 31 CO 0.01 0.19 -0.80 2.41 -1.16 0.00 0.00 179.01 179.65 3fhi n THR 32 N -4.33 0.51 -2.20 1.13 -1.04 -1.01 -5.11 114.28 102.22 3fhi n THR 32 Ca -0.02 -4.36 -0.34 0.00 -2.04 0.00 0.00 64.05 57.28 3fhi n THR 32 Cb 0.24 -1.97 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 3fhi n THR 32 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3fhi s PRO 33 N -1.21 3.36 0.25 -2.82 0.02 -1.16 -4.73 135.00 128.70 3fhi s PRO 33 Ca 0.33 1.45 -0.30 0.00 0.02 0.00 0.00 61.00 62.50 3fhi s PRO 33 Cb 0.07 -2.02 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 3fhi s PRO 33 CO -0.13 -0.81 1.14 -1.54 -0.33 0.00 0.00 177.00 175.33 3fhi s SER 34 N -2.13 7.18 -0.11 2.53 1.04 -1.26 -5.04 113.70 115.90 3fhi s SER 34 Ca 0.69 2.28 -0.09 0.00 0.48 0.00 0.00 55.95 59.30 3fhi s SER 34 Cb -0.20 -2.62 0.03 0.00 0.10 0.00 0.00 66.02 63.33 3fhi s SER 34 CO 0.29 -0.24 0.30 -1.10 0.98 0.00 0.00 173.24 173.47 3fhi s GLN 35 N -1.06 0.33 -1.11 4.02 -0.21 -1.26 -4.96 119.66 115.41 3fhi s GLN 35 Ca 0.47 0.46 -0.07 0.00 0.02 0.00 0.00 55.36 56.24 3fhi s GLN 35 Cb -0.33 0.11 -0.04 0.00 1.00 0.00 0.00 33.01 33.75 3fhi s GLN 35 CO 0.40 -0.07 0.89 -1.71 -2.12 0.00 0.00 175.29 172.69 3fhi n ASN 36 N 3.22 -5.19 -1.03 5.90 5.15 -1.08 -4.93 115.26 117.31 3fhi n ASN 36 Ca -0.16 -0.75 0.12 0.00 -0.60 0.00 0.00 54.58 53.19 3fhi n ASN 36 Cb 0.57 -4.81 0.18 0.00 -0.53 0.00 0.00 39.78 35.19 3fhi n ASN 36 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3fhi n THR 37 N -3.62 0.25 -3.14 -0.44 -2.24 -0.74 -4.98 114.28 99.37 3fhi n THR 37 Ca -0.13 -0.61 -0.01 0.00 -2.27 0.00 0.00 64.05 61.03 3fhi n THR 37 Cb 0.63 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 70.04 3fhi n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fhi n ALA 38 N 1.35 -0.22 -3.24 6.98 0.00 -1.25 -4.90 120.51 119.22 3fhi n ALA 38 Ca 0.17 -0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.36 3fhi n ALA 38 Cb 0.59 0.11 -0.04 0.00 0.00 0.00 0.00 19.45 20.11 3fhi n ALA 38 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3fhi s GLN 39 N -2.01 1.26 0.11 0.00 -1.52 -1.26 -4.68 119.66 111.56 3fhi s GLN 39 Ca 0.02 -0.71 -0.18 0.00 -1.95 0.00 0.00 55.36 52.54 3fhi s GLN 39 Cb -0.01 0.52 -0.05 0.00 -0.22 0.00 0.00 33.01 33.26 3fhi s GLN 39 CO 0.01 -0.53 1.61 1.25 -0.25 0.00 0.00 175.29 177.38 3fhi h LEU 40 N 2.20 0.46 0.00 2.90 5.85 -1.97 -2.92 115.31 121.83 3fhi h LEU 40 Ca -0.32 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.18 3fhi h LEU 40 Cb 1.27 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3fhi h LEU 40 CO 0.40 0.56 0.00 0.47 -0.34 0.00 0.00 178.44 179.54 3fhi n ASP 41 N -4.67 0.00 -0.12 1.25 8.00 -1.26 -1.79 116.55 117.96 3fhi n ASP 41 Ca -0.02 0.13 0.15 0.00 0.71 0.00 0.00 54.79 55.76 3fhi n ASP 41 Cb 0.18 -0.21 0.70 0.00 -0.02 0.00 0.00 41.12 41.77 3fhi n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fhi n GLN 42 N -1.21 0.85 -4.57 -1.24 6.02 -1.10 -4.88 117.38 111.25 3fhi n GLN 42 Ca 0.02 -0.24 -0.21 0.00 -0.01 0.00 0.00 57.00 56.56 3fhi n GLN 42 Cb 0.03 -1.50 -0.15 0.00 1.02 0.00 0.00 30.24 29.64 3fhi n GLN 42 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3fhi s PHE 43 N -2.31 1.15 -0.12 1.08 0.08 -0.74 -0.61 117.98 116.52 3fhi s PHE 43 Ca 0.35 -0.23 -0.10 0.00 0.12 0.00 0.00 56.93 57.06 3fhi s PHE 43 Cb 0.21 -0.75 -0.05 0.00 -0.57 0.00 0.00 43.02 41.86 3fhi s PHE 43 CO 0.43 -0.04 0.22 0.16 -0.10 0.00 0.00 175.22 175.89 3fhi s ASP 44 N -0.22 6.45 -0.21 1.36 -4.77 0.16 -4.89 116.67 114.54 3fhi s ASP 44 Ca 0.03 0.53 -0.14 0.00 -3.30 0.00 0.00 52.55 49.67 3fhi s ASP 44 Cb -0.06 -2.13 -0.04 0.00 -1.09 0.00 0.00 42.92 39.60 3fhi s ASP 44 CO -0.00 0.30 0.34 -0.13 0.70 0.00 0.00 175.17 176.37 3fhi s ARG 45 N -0.52 4.15 -0.22 2.11 0.52 -1.26 0.27 118.95 123.98 3fhi s ARG 45 Ca 0.16 0.08 -0.14 0.00 -0.52 0.00 0.00 55.73 55.31 3fhi s ARG 45 Cb -0.13 -3.54 -0.09 0.00 0.52 0.00 0.00 34.95 31.71 3fhi s ARG 45 CO 0.05 -0.01 -0.32 -0.89 0.02 0.00 0.00 175.30 174.14 3fhi n ILE 46 N 4.33 1.41 -3.64 1.52 2.08 -0.04 -4.97 119.36 120.05 3fhi n ILE 46 Ca -0.10 -0.20 -0.07 0.00 0.56 0.00 0.00 62.75 62.95 3fhi n ILE 46 Cb 0.51 -1.97 -0.07 0.00 -0.75 0.00 0.00 39.64 37.36 3fhi n ILE 46 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 3fhi s LYS 47 N -2.57 0.41 0.08 0.38 2.20 -1.18 -4.99 119.74 114.07 3fhi s LYS 47 Ca -0.33 0.54 -0.31 0.00 -0.36 0.00 0.00 55.97 55.52 3fhi s LYS 47 Cb 0.11 0.17 -0.08 0.00 -1.51 0.00 0.00 37.83 36.52 3fhi s LYS 47 CO 0.43 -0.06 1.62 0.99 -0.36 0.00 0.00 175.35 177.97 3fhi s THR 48 N 0.48 3.04 -0.06 3.43 2.01 -1.26 0.50 115.64 123.78 3fhi s THR 48 Ca 0.01 0.54 0.12 0.00 0.31 0.00 0.00 61.69 62.66 3fhi s THR 48 Cb -0.05 -3.35 -0.23 0.00 0.01 0.00 0.00 72.50 68.89 3fhi s THR 48 CO -0.10 0.01 0.60 0.18 -0.69 0.00 0.00 174.62 174.62 3fhi n LEU 49 N 5.32 0.91 -3.59 4.42 4.77 0.51 -4.55 117.00 124.79 3fhi n LEU 49 Ca 0.15 0.38 -0.09 0.00 -0.03 0.00 0.00 56.01 56.42 3fhi n LEU 49 Cb 0.40 0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 3fhi n LEU 49 CO 0.62 0.42 0.83 -0.83 -1.33 0.00 0.00 177.39 177.10 3fhi s GLY 50 N -5.16 -0.22 0.41 -0.72 0.00 -1.07 -4.66 107.32 95.90 3fhi s GLY 50 Ca -0.06 2.16 0.07 0.00 0.00 0.00 0.00 44.72 46.89 3fhi s GLY 50 CO 0.82 1.07 0.26 -0.51 0.00 0.00 0.00 173.10 174.73 3fhi s THR 51 N -1.06 2.48 0.36 0.90 -4.23 -1.26 -1.46 115.64 111.37 3fhi s THR 51 Ca -0.00 -1.56 -0.14 0.00 -1.18 0.00 0.00 61.69 58.81 3fhi s THR 51 Cb -0.01 -3.00 0.04 0.00 1.34 0.00 0.00 72.50 70.88 3fhi s THR 51 CO 0.00 -0.01 0.73 -0.83 -0.54 0.00 0.00 174.62 173.97 3fhi s GLY 52 N -3.99 0.47 0.60 3.99 0.00 -0.89 -4.97 107.32 102.54 3fhi s GLY 52 Ca 0.44 -0.81 0.32 0.00 0.00 0.00 0.00 44.72 44.67 3fhi s GLY 52 CO 0.25 -0.39 2.25 1.76 0.00 0.00 0.00 173.10 176.97 3fhi h SER 53 N 2.02 0.00 0.00 1.64 0.02 -2.04 -3.36 113.55 111.83 3fhi h SER 53 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3fhi h SER 53 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3fhi h SER 53 CO 0.38 0.00 -0.97 0.49 -1.14 0.00 0.00 176.83 175.59 3fhi n PHE 54 N -3.72 0.00 -4.60 3.45 3.72 -1.26 -5.12 117.46 109.93 3fhi n PHE 54 Ca -0.02 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.10 3fhi n PHE 54 Cb 0.11 0.01 -0.09 0.00 -0.94 0.00 0.00 39.48 38.57 3fhi n PHE 54 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3fhi s GLY 55 N -4.73 2.60 -0.07 1.37 0.00 -1.26 -4.71 107.32 100.53 3fhi s GLY 55 Ca 0.00 -1.39 0.03 0.00 0.00 0.00 0.00 44.72 43.36 3fhi s GLY 55 CO 0.00 -2.00 -0.15 -1.60 0.00 0.00 0.00 173.10 169.35 3fhi s ARG 56 N -3.80 1.96 -0.17 2.90 3.52 -0.86 -2.10 118.95 120.41 3fhi s ARG 56 Ca 0.23 -0.52 -0.02 0.00 -0.13 0.00 0.00 55.73 55.29 3fhi s ARG 56 Cb 0.05 -1.59 -0.01 0.00 -1.56 0.00 0.00 34.95 31.84 3fhi s ARG 56 CO 0.12 0.08 -0.09 0.08 -0.81 0.00 0.00 175.30 174.68 3fhi s VAL 57 N 0.53 3.18 -0.02 7.11 1.01 -0.54 -0.23 120.40 131.45 3fhi s VAL 57 Ca -0.14 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.32 3fhi s VAL 57 Cb -0.16 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3fhi s VAL 57 CO 0.05 0.48 -0.21 -0.04 0.00 0.00 0.00 175.10 175.38 3fhi s MET 58 N 0.87 2.20 -0.00 2.72 -1.94 -0.35 -0.37 119.30 122.44 3fhi s MET 58 Ca -0.02 -0.88 -0.30 0.00 -1.71 0.00 0.00 55.69 52.78 3fhi s MET 58 Cb -0.15 -2.16 -0.06 0.00 2.01 0.00 0.00 34.83 34.47 3fhi s MET 58 CO 0.00 0.57 1.50 -1.17 -0.01 0.00 0.00 175.02 175.92 3fhi s LEU 59 N -0.81 4.32 0.17 -0.03 2.96 0.18 -1.08 118.68 124.38 3fhi s LEU 59 Ca 0.11 2.20 0.10 0.00 -0.22 0.00 0.00 54.13 56.32 3fhi s LEU 59 Cb -0.10 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 3fhi s LEU 59 CO 0.01 -0.80 -0.22 0.68 -1.32 0.00 0.00 176.35 174.69 3fhi s VAL 60 N 2.85 2.10 -0.19 1.68 -7.23 0.01 -0.86 120.40 118.76 3fhi s VAL 60 Ca 0.68 -1.91 -0.03 0.00 -1.81 0.00 0.00 61.98 58.91 3fhi s VAL 60 Cb -0.33 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.64 3fhi s VAL 60 CO 0.28 -0.15 -0.08 -0.75 -0.31 0.00 0.00 175.10 174.09 3fhi s LYS 61 N -2.56 3.36 -0.04 4.82 2.20 0.14 -0.79 119.74 126.86 3fhi s LYS 61 Ca 0.17 -0.65 -0.30 0.00 -0.36 0.00 0.00 55.97 54.83 3fhi s LYS 61 Cb -0.08 -2.88 -0.06 0.00 -1.51 0.00 0.00 37.83 33.31 3fhi s LYS 61 CO 0.08 -0.09 1.61 -1.58 -0.36 0.00 0.00 175.35 175.01 3fhi s HIS 62 N 1.15 2.16 0.09 4.03 5.65 0.15 0.36 115.29 128.89 3fhi s HIS 62 Ca 0.02 0.31 -0.27 0.00 0.25 0.00 0.00 55.06 55.36 3fhi s HIS 62 Cb -0.14 -3.87 -0.14 0.00 -1.18 0.00 0.00 32.58 27.24 3fhi s HIS 62 CO -0.02 -3.60 1.67 0.87 -0.65 0.00 0.00 174.74 173.01 3fhi h LYS 63 N 9.15 -0.44 -0.45 2.88 1.57 -1.18 0.18 116.57 128.29 3fhi h LYS 63 Ca -0.39 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.38 3fhi h LYS 63 Cb 1.18 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.57 3fhi h LYS 63 CO 0.95 -0.29 0.11 0.93 -0.57 0.00 0.00 179.45 180.57 3fhi h GLU 64 N -0.45 0.72 0.00 3.15 5.08 -1.92 -3.30 114.58 117.85 3fhi h GLU 64 Ca -0.02 -0.17 -0.25 0.00 -1.00 0.00 0.00 59.36 57.92 3fhi h GLU 64 Cb 0.39 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 3fhi h GLU 64 CO 0.00 0.72 -1.75 -1.13 -1.00 0.00 0.00 179.01 175.85 3fhi n SER 65 N -4.51 0.66 0.00 1.42 3.41 -1.19 -4.97 113.62 108.45 3fhi n SER 65 Ca 0.00 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 3fhi n SER 65 Cb 0.22 0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3fhi n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fhi n GLY 66 N 1.52 0.98 3.77 5.00 0.00 0.63 -5.03 105.19 112.06 3fhi n GLY 66 Ca -0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 3fhi n GLY 66 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fhi s ASN 67 N -3.02 6.59 -0.07 1.61 0.02 -1.25 -4.70 114.94 114.12 3fhi s ASN 67 Ca 0.00 2.83 -0.10 0.00 -1.02 0.00 0.00 52.86 54.57 3fhi s ASN 67 Cb 0.00 -2.66 -0.05 0.00 0.02 0.00 0.00 41.25 38.57 3fhi s ASN 67 CO 0.00 -0.68 0.25 -1.00 0.02 0.00 0.00 177.10 175.68 3fhi s HIS 68 N -1.05 3.65 0.16 2.20 3.76 -1.26 0.32 115.29 123.08 3fhi s HIS 68 Ca 0.51 0.71 0.02 0.00 -0.15 0.00 0.00 55.06 56.15 3fhi s HIS 68 Cb -0.43 -2.08 -0.05 0.00 1.11 0.00 0.00 32.58 31.14 3fhi s HIS 68 CO 0.56 0.70 -0.00 0.71 -0.85 0.00 0.00 174.74 175.86 3fhi s TYR 69 N -1.05 1.17 -0.33 1.40 2.02 0.03 -4.25 117.35 116.33 3fhi s TYR 69 Ca 0.19 -1.02 -0.09 0.00 -0.37 0.00 0.00 57.07 55.78 3fhi s TYR 69 Cb -0.14 -0.67 0.01 0.00 -0.40 0.00 0.00 41.96 40.77 3fhi s TYR 69 CO 0.08 -0.21 0.16 0.00 -1.57 0.00 0.00 175.55 174.00 3fhi s ALA 70 N -3.67 3.22 -0.29 3.71 0.00 0.18 -0.81 121.76 124.11 3fhi s ALA 70 Ca 0.23 -1.54 -0.11 0.00 0.00 0.00 0.00 51.96 50.54 3fhi s ALA 70 Cb 0.06 -2.41 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 3fhi s ALA 70 CO 0.03 -1.11 0.19 1.41 0.00 0.00 0.00 175.76 176.28 3fhi s MET 71 N 1.56 3.83 -0.12 0.00 1.75 -0.25 0.08 119.30 126.16 3fhi s MET 71 Ca 0.03 -0.40 -0.23 0.00 -1.25 0.00 0.00 55.69 53.84 3fhi s MET 71 Cb -0.18 -3.65 -0.03 0.00 2.84 0.00 0.00 34.83 33.81 3fhi s MET 71 CO 0.05 -0.23 0.71 0.21 -0.65 0.00 0.00 175.02 175.11 3fhi s LYS 72 N 1.74 4.36 -0.18 4.11 2.20 0.12 -1.21 119.74 130.88 3fhi s LYS 72 Ca 0.07 0.85 -0.02 0.00 -0.36 0.00 0.00 55.97 56.50 3fhi s LYS 72 Cb -0.16 -3.50 -0.01 0.00 -1.51 0.00 0.00 37.83 32.65 3fhi s LYS 72 CO 0.10 -0.09 -0.09 0.42 -0.36 0.00 0.00 175.35 175.34 3fhi s ILE 73 N 1.33 3.21 -0.16 5.43 1.01 0.68 -1.41 121.20 131.29 3fhi s ILE 73 Ca 0.36 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.44 3fhi s ILE 73 Cb -0.17 -2.41 0.02 0.00 0.01 0.00 0.00 42.46 39.91 3fhi s ILE 73 CO 0.15 0.48 -0.19 -0.76 0.00 0.00 0.00 174.94 174.61 3fhi s LEU 74 N 0.95 2.05 -0.08 2.97 1.43 -0.33 -2.02 118.68 123.64 3fhi s LEU 74 Ca -0.01 -0.61 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 3fhi s LEU 74 Cb -0.15 -1.41 -0.06 0.00 0.03 0.00 0.00 46.19 44.59 3fhi s LEU 74 CO -0.00 0.01 1.91 -0.62 0.23 0.00 0.00 176.35 177.88 3fhi s ASP 75 N 1.20 6.25 0.29 2.29 3.68 -1.26 -0.15 116.67 128.97 3fhi s ASP 75 Ca 0.02 2.25 0.01 0.00 2.13 0.00 0.00 52.55 56.96 3fhi s ASP 75 Cb -0.14 -2.53 0.54 0.00 -1.45 0.00 0.00 42.92 39.35 3fhi s ASP 75 CO -0.10 -1.27 1.87 0.11 0.13 0.00 0.00 175.17 175.91 3fhi h LYS 76 N 11.42 0.99 -0.16 4.34 1.57 -1.39 -0.82 116.57 132.52 3fhi h LYS 76 Ca -0.43 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.16 3fhi h LYS 76 Cb 1.21 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 3fhi h LYS 76 CO 0.96 0.66 -0.45 1.96 -0.57 0.00 0.00 179.45 182.00 3fhi h GLN 77 N 1.02 0.40 -0.14 3.15 4.20 -1.91 -1.77 115.11 120.07 3fhi h GLN 77 Ca 0.45 -0.21 -0.23 0.00 0.06 0.00 0.00 58.65 58.72 3fhi h GLN 77 Cb 0.37 0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.17 3fhi h GLN 77 CO -0.21 0.77 -0.81 -0.22 -0.67 0.00 0.00 178.83 177.69 3fhi h LYS 78 N 0.33 0.79 -0.95 1.46 3.64 -1.80 -0.43 116.57 119.60 3fhi h LYS 78 Ca 0.02 -0.67 0.03 0.00 -1.27 0.00 0.00 60.65 58.77 3fhi h LYS 78 Cb 0.92 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.83 3fhi h LYS 78 CO 0.08 1.27 0.62 0.28 -2.27 0.00 0.00 179.45 179.43 3fhi h VAL 79 N 0.53 1.17 -0.20 2.00 2.07 -1.07 0.13 116.25 120.88 3fhi h VAL 79 Ca -0.06 -0.42 -0.12 0.00 0.82 0.00 0.00 66.70 66.92 3fhi h VAL 79 Cb 1.45 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3fhi h VAL 79 CO 0.17 0.22 -0.36 0.58 0.02 0.00 0.00 177.57 178.20 3fhi h VAL 80 N 1.21 1.33 -0.79 2.57 2.07 -1.22 0.25 116.25 121.67 3fhi h VAL 80 Ca 0.38 -1.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 3fhi h VAL 80 Cb -0.01 1.85 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 3fhi h VAL 80 CO -0.12 0.49 0.42 0.50 0.02 0.00 0.00 177.57 178.89 3fhi h LYS 81 N 0.27 1.10 -0.05 1.57 1.63 -0.83 -2.40 116.57 117.87 3fhi h LYS 81 Ca 0.01 -0.13 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 3fhi h LYS 81 Cb 0.95 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 3fhi h LYS 81 CO 0.08 0.82 0.00 1.28 -3.45 0.00 0.00 179.45 178.18 3fhi n LEU 82 N -4.42 0.63 -3.65 5.20 4.77 0.42 -4.91 117.00 115.05 3fhi n LEU 82 Ca 0.07 -0.25 -0.25 0.00 -0.03 0.00 0.00 56.01 55.55 3fhi n LEU 82 Cb 0.10 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.23 3fhi n LEU 82 CO 0.38 0.13 0.23 0.29 -1.33 0.00 0.00 177.39 177.08 3fhi n LYS 83 N -0.40 -7.60 -0.84 3.23 5.02 -0.90 -4.93 118.16 111.74 3fhi n LYS 83 Ca 0.17 0.79 -0.05 0.00 -2.02 0.00 0.00 58.31 57.20 3fhi n LYS 83 Cb 0.18 -5.83 0.23 0.00 -0.02 0.00 0.00 35.03 29.59 3fhi n LYS 83 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3fhi n GLN 84 N -4.96 2.49 0.32 1.97 1.13 0.82 -4.72 117.38 114.43 3fhi n GLN 84 Ca 0.01 -3.07 -0.17 0.00 -1.94 0.00 0.00 57.00 51.84 3fhi n GLN 84 Cb 0.56 -1.96 -0.09 0.00 0.11 0.00 0.00 30.24 28.86 3fhi n GLN 84 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3fhi h ILE 85 N 1.48 0.41 -0.42 5.09 2.04 -1.91 0.71 117.51 124.91 3fhi h ILE 85 Ca 0.25 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 66.03 3fhi h ILE 85 Cb 1.95 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 3fhi h ILE 85 CO 0.54 0.02 0.24 -0.33 0.00 0.00 0.00 178.15 178.62 3fhi h GLU 86 N -0.85 0.47 -0.63 2.37 3.07 -1.95 -1.85 114.58 115.21 3fhi h GLU 86 Ca -0.08 -0.03 0.04 0.00 -0.50 0.00 0.00 59.36 58.79 3fhi h GLU 86 Cb 0.62 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.38 3fhi h GLU 86 CO 0.13 0.31 0.37 0.45 -1.40 0.00 0.00 179.01 178.88 3fhi h HIS 87 N 0.48 0.69 -0.38 4.33 3.86 -1.83 -1.10 115.15 121.21 3fhi h HIS 87 Ca 0.17 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.26 3fhi h HIS 87 Cb 0.02 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 3fhi h HIS 87 CO -0.08 0.37 -0.31 1.15 0.86 0.00 0.00 177.93 179.93 3fhi h THR 88 N 0.72 1.28 -0.45 2.45 2.02 -0.39 -0.95 112.91 117.59 3fhi h THR 88 Ca 0.26 -1.46 -0.04 0.00 0.77 0.00 0.00 66.41 65.95 3fhi h THR 88 Cb 0.08 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 3fhi h THR 88 CO -0.13 0.49 0.13 -0.07 0.37 0.00 0.00 175.52 176.31 3fhi h LEU 89 N 0.70 0.67 -0.50 2.58 3.38 -1.15 -2.25 115.31 118.74 3fhi h LEU 89 Ca 0.08 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 57.90 3fhi h LEU 89 Cb 0.85 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.37 3fhi h LEU 89 CO 0.07 0.71 0.16 0.78 0.09 0.00 0.00 178.44 180.25 3fhi h ASN 90 N 0.59 0.14 -0.07 -0.43 2.35 -1.08 -1.44 115.58 115.65 3fhi h ASN 90 Ca 0.14 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.97 3fhi h ASN 90 Cb 0.29 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 3fhi h ASN 90 CO -0.00 0.11 0.00 -0.08 -1.65 0.00 0.00 177.43 175.81 3fhi h GLU 91 N 0.33 0.03 -0.02 0.81 4.81 -0.87 0.17 114.58 119.84 3fhi h GLU 91 Ca 0.24 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 3fhi h GLU 91 Cb 0.28 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 3fhi h GLU 91 CO -0.26 0.02 0.00 -0.22 -0.73 0.00 0.00 179.01 177.82 3fhi h LYS 92 N 0.03 0.04 -0.72 1.92 3.64 -1.30 -1.98 116.57 118.20 3fhi h LYS 92 Ca 0.03 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 3fhi h LYS 92 Cb 0.03 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3fhi h LYS 92 CO -0.05 0.30 0.33 -0.09 -2.27 0.00 0.00 179.45 177.66 3fhi h ARG 93 N -0.23 1.05 -0.03 1.90 2.43 -1.04 -1.42 114.38 117.04 3fhi h ARG 93 Ca 0.01 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 58.98 3fhi h ARG 93 Cb 0.28 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3fhi h ARG 93 CO 0.00 0.84 -0.11 0.82 -1.51 0.00 0.00 179.97 180.01 3fhi h ILE 94 N 1.01 1.48 -0.37 1.20 2.04 -0.72 -3.08 117.51 119.07 3fhi h ILE 94 Ca 0.24 -1.58 0.03 0.00 1.00 0.00 0.00 64.86 64.56 3fhi h ILE 94 Cb 0.15 2.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.66 3fhi h ILE 94 CO -0.03 0.43 0.25 0.25 0.00 0.00 0.00 178.15 179.05 3fhi h LEU 95 N -0.46 0.32 -0.47 1.44 5.85 -1.18 -0.14 115.31 120.67 3fhi h LEU 95 Ca -0.01 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3fhi h LEU 95 Cb 0.75 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3fhi h LEU 95 CO 0.02 0.22 0.00 0.06 -0.34 0.00 0.00 178.44 178.41 3fhi h GLN 96 N 0.38 0.00 0.00 1.25 -0.00 -1.31 -3.30 115.11 112.13 3fhi h GLN 96 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.80 3fhi h GLN 96 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.63 3fhi h GLN 96 CO -0.04 0.00 -1.44 0.00 -0.00 0.00 0.00 178.83 177.36 3fhi n ALA 97 N -2.08 3.16 -2.46 0.06 0.00 -0.14 -4.94 120.51 114.11 3fhi n ALA 97 Ca 0.03 -0.45 -0.27 0.00 0.00 0.00 0.00 53.44 52.75 3fhi n ALA 97 Cb 0.45 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 3fhi n ALA 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3fhi s VAL 98 N -3.34 4.99 -0.27 0.00 -7.23 -0.74 -4.37 120.40 109.46 3fhi s VAL 98 Ca -0.02 -0.02 -0.02 0.00 -1.81 0.00 0.00 61.98 60.11 3fhi s VAL 98 Cb 0.14 -3.82 0.16 0.00 0.56 0.00 0.00 36.38 33.41 3fhi s VAL 98 CO 0.85 -0.59 0.47 0.21 -0.31 0.00 0.00 175.10 175.74 3fhi s ASN 99 N -3.75 -0.43 -0.05 4.85 2.47 -1.26 -4.99 114.94 111.77 3fhi s ASN 99 Ca 0.44 0.50 -0.16 0.00 0.42 0.00 0.00 52.86 54.07 3fhi s ASN 99 Cb -0.10 1.55 0.03 0.00 -1.45 0.00 0.00 41.25 41.28 3fhi s ASN 99 CO 0.37 -0.28 0.36 0.12 -3.72 0.00 0.00 177.10 173.95 3fhi s PHE 100 N 2.68 -0.28 0.60 0.43 5.36 -1.26 -5.05 117.98 120.45 3fhi s PHE 100 Ca 0.16 0.52 0.29 0.00 -0.96 0.00 0.00 56.93 56.93 3fhi s PHE 100 Cb -0.15 0.14 1.52 0.00 -0.34 0.00 0.00 43.02 44.19 3fhi s PHE 100 CO -0.18 -0.37 1.94 -1.35 -1.46 0.00 0.00 175.22 173.80 3fhi h PRO 101 N 4.15 0.00 -0.31 10.12 0.11 -1.98 -2.37 132.00 141.72 3fhi h PRO 101 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3fhi h PRO 101 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3fhi h PRO 101 CO 0.37 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.35 3fhi n PHE 102 N -3.65 0.62 -4.53 0.65 0.99 -1.26 -4.92 117.46 105.36 3fhi n PHE 102 Ca 0.06 -0.63 -0.34 0.00 -0.00 0.00 0.00 57.45 56.54 3fhi n PHE 102 Cb 0.58 -0.12 -0.11 0.00 -1.00 0.00 0.00 39.48 38.82 3fhi n PHE 102 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3fhi s LEU 103 N -1.62 3.26 0.33 4.37 1.43 -0.89 0.11 118.68 125.67 3fhi s LEU 103 Ca 0.29 -0.02 -0.29 0.00 -1.03 0.00 0.00 54.13 53.08 3fhi s LEU 103 Cb 0.19 -1.74 -0.11 0.00 0.03 0.00 0.00 46.19 44.57 3fhi s LEU 103 CO 0.13 0.32 1.41 0.54 0.23 0.00 0.00 176.35 178.98 3fhi s VAL 104 N -0.52 2.45 -0.08 -1.59 0.11 -0.39 -4.71 120.40 115.67 3fhi s VAL 104 Ca 0.08 0.43 -0.24 0.00 -2.93 0.00 0.00 61.98 59.32 3fhi s VAL 104 Cb -0.12 -3.28 -0.03 0.00 -1.53 0.00 0.00 36.38 31.42 3fhi s VAL 104 CO 0.02 0.09 0.76 -0.54 -3.33 0.00 0.00 175.10 172.10 3fhi s LYS 105 N -1.50 4.41 -0.34 1.54 1.02 -1.26 -4.99 119.74 118.63 3fhi s LYS 105 Ca 0.53 0.96 -0.22 0.00 0.02 0.00 0.00 55.97 57.26 3fhi s LYS 105 Cb -0.43 -3.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.40 3fhi s LYS 105 CO 0.54 -0.04 0.72 -1.17 -0.92 0.00 0.00 175.35 174.48 3fhi s LEU 106 N 1.14 4.16 -0.15 3.17 2.96 -1.26 -1.54 118.68 127.16 3fhi s LEU 106 Ca 0.39 0.37 -0.16 0.00 -0.22 0.00 0.00 54.13 54.51 3fhi s LEU 106 Cb -0.18 -2.94 -0.24 0.00 0.50 0.00 0.00 46.19 43.34 3fhi s LEU 106 CO 0.18 -0.63 0.39 -0.33 -1.32 0.00 0.00 176.35 174.64 3fhi h GLU 107 N 8.36 0.15 -3.99 1.98 4.39 -0.93 -3.47 114.58 121.06 3fhi h GLU 107 Ca -0.25 -0.25 -0.14 0.00 0.34 0.00 0.00 59.36 59.05 3fhi h GLU 107 Cb 1.10 0.09 -0.18 0.00 -0.10 0.00 0.00 28.75 29.66 3fhi h GLU 107 CO 0.87 1.12 -0.63 -0.06 -1.16 0.00 0.00 179.01 179.15 3fhi s PHE 108 N -2.44 0.31 0.02 4.33 0.08 -0.89 -5.02 117.98 114.37 3fhi s PHE 108 Ca -0.24 -0.66 -0.05 0.00 0.12 0.00 0.00 56.93 56.10 3fhi s PHE 108 Cb 0.05 -0.23 -0.01 0.00 -0.57 0.00 0.00 43.02 42.26 3fhi s PHE 108 CO 0.70 -0.30 0.08 -1.54 -0.10 0.00 0.00 175.22 174.06 3fhi s SER 109 N -2.08 0.14 0.15 1.36 1.04 -1.26 -0.08 113.70 112.97 3fhi s SER 109 Ca -0.06 -0.42 -0.25 0.00 0.48 0.00 0.00 55.95 55.70 3fhi s SER 109 Cb -0.02 0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.36 3fhi s SER 109 CO -0.05 -0.42 0.98 0.72 0.98 0.00 0.00 173.24 175.46 3fhi s PHE 110 N -1.94 -0.12 0.14 5.02 -0.71 -0.96 -1.80 117.98 117.61 3fhi s PHE 110 Ca -0.11 -0.18 0.00 0.00 -1.04 0.00 0.00 56.93 55.61 3fhi s PHE 110 Cb -0.05 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.35 3fhi s PHE 110 CO -0.02 -0.80 0.01 -1.59 -1.34 0.00 0.00 175.22 171.49 3fhi s LYS 111 N -3.23 0.97 0.00 1.99 0.00 -1.26 -1.04 119.74 117.17 3fhi s LYS 111 Ca 0.13 -1.45 0.00 0.00 0.00 0.00 0.00 55.97 54.64 3fhi s LYS 111 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 37.83 37.80 3fhi s LYS 111 CO 0.02 -0.17 0.00 -0.40 0.00 0.00 0.00 175.35 174.80 3fhi n ASP 112 N -0.13 0.76 0.24 0.03 5.68 -0.72 -5.01 116.55 117.39 3fhi n ASP 112 Ca -0.07 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.29 3fhi n ASP 112 Cb 0.63 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.19 3fhi n ASP 112 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 3fhi h ASN 113 N 0.00 0.00 0.00 -1.12 -0.26 -1.93 -3.37 115.58 108.90 3fhi h ASN 113 Ca 0.00 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.65 3fhi h ASN 113 Cb 0.00 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 3fhi h ASN 113 CO 0.00 0.14 -1.32 -1.20 -1.06 0.00 0.00 177.43 173.99 3fhi n SER 114 N -4.22 2.87 -4.40 5.81 7.64 -1.26 -0.32 113.62 119.73 3fhi n SER 114 Ca -0.02 -0.01 -0.28 0.00 1.01 0.00 0.00 58.87 59.57 3fhi n SER 114 Cb 0.21 -0.11 -0.12 0.00 -1.01 0.00 0.00 64.21 63.18 3fhi n SER 114 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3fhi s ASN 115 N -4.76 3.37 0.05 6.43 0.01 -1.26 -0.94 114.94 117.84 3fhi s ASN 115 Ca -0.08 -0.80 -0.07 0.00 -0.71 0.00 0.00 52.86 51.20 3fhi s ASN 115 Cb 0.02 -0.23 -0.05 0.00 0.41 0.00 0.00 41.25 41.40 3fhi s ASN 115 CO 0.12 0.15 0.33 -0.76 -1.51 0.00 0.00 177.10 175.44 3fhi s LEU 116 N -2.33 4.35 -0.03 0.60 1.43 0.78 -1.76 118.68 121.72 3fhi s LEU 116 Ca 0.17 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.93 3fhi s LEU 116 Cb -0.09 -2.88 0.01 0.00 0.03 0.00 0.00 46.19 43.26 3fhi s LEU 116 CO 0.08 0.19 -0.05 -0.31 0.23 0.00 0.00 176.35 176.49 3fhi s TYR 117 N -1.39 0.63 -0.16 0.29 2.02 -0.20 -1.19 117.35 117.35 3fhi s TYR 117 Ca 0.32 -0.14 -0.00 0.00 -0.37 0.00 0.00 57.07 56.87 3fhi s TYR 117 Cb -0.13 -0.52 0.04 0.00 -0.40 0.00 0.00 41.96 40.94 3fhi s TYR 117 CO 0.18 -0.11 -0.08 -1.64 -1.57 0.00 0.00 175.55 172.33 3fhi s MET 118 N 0.51 1.68 -0.40 -0.62 -1.94 -0.50 -2.27 119.30 115.77 3fhi s MET 118 Ca -0.06 -0.52 -0.13 0.00 -1.71 0.00 0.00 55.69 53.26 3fhi s MET 118 Cb -0.10 -2.00 0.04 0.00 2.01 0.00 0.00 34.83 34.77 3fhi s MET 118 CO -0.00 -0.37 0.27 0.08 -0.01 0.00 0.00 175.02 174.99 3fhi s VAL 119 N 1.59 4.85 0.25 -6.03 1.01 0.89 0.16 120.40 123.11 3fhi s VAL 119 Ca 0.02 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3fhi s VAL 119 Cb -0.14 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 3fhi s VAL 119 CO -0.08 -0.34 0.27 -0.04 0.00 0.00 0.00 175.10 174.91 3fhi s MET 120 N 1.59 3.15 0.22 2.72 -1.94 0.11 -0.23 119.30 124.93 3fhi s MET 120 Ca 0.03 -0.93 -0.32 0.00 -1.71 0.00 0.00 55.69 52.77 3fhi s MET 120 Cb -0.20 -2.71 -0.14 0.00 2.01 0.00 0.00 34.83 33.79 3fhi s MET 120 CO 0.07 0.41 1.38 -1.91 -0.01 0.00 0.00 175.02 174.97 3fhi n GLU 121 N -1.28 1.91 -2.64 2.03 2.13 -0.59 -0.65 120.64 121.55 3fhi n GLU 121 Ca -0.08 0.68 -0.43 0.00 0.66 0.00 0.00 57.16 57.99 3fhi n GLU 121 Cb 0.57 -2.32 -0.02 0.00 0.27 0.00 0.00 31.44 29.94 3fhi n GLU 121 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 3fhi s TYR 122 N -0.00 3.20 -0.52 4.31 5.04 -1.26 -4.34 117.35 123.77 3fhi s TYR 122 Ca 0.70 1.28 -0.15 0.00 -2.44 0.00 0.00 57.07 56.45 3fhi s TYR 122 Cb -0.68 -3.57 0.12 0.00 0.35 0.00 0.00 41.96 38.18 3fhi s TYR 122 CO 0.49 -0.70 0.47 0.08 -1.34 0.00 0.00 175.55 174.55 3fhi s VAL 123 N 3.52 5.14 -1.57 3.14 1.01 -1.26 -4.94 120.40 125.44 3fhi s VAL 123 Ca 0.45 -1.45 0.28 0.00 0.00 0.00 0.00 61.98 61.27 3fhi s VAL 123 Cb -0.13 -4.26 0.39 0.00 0.00 0.00 0.00 36.38 32.37 3fhi s VAL 123 CO 0.13 -0.81 1.80 0.00 0.00 0.00 0.00 175.10 176.21 3fhi n ALA 124 N 5.22 2.82 0.79 5.51 0.00 -1.26 -3.76 120.51 129.83 3fhi n ALA 124 Ca -0.13 -0.28 0.11 0.00 0.00 0.00 0.00 53.44 53.14 3fhi n ALA 124 Cb 0.41 -1.31 0.49 0.00 0.00 0.00 0.00 19.45 19.04 3fhi n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fhi n GLY 125 N 1.32 -1.31 0.00 0.00 0.00 -0.58 -4.53 105.19 100.09 3fhi n GLY 125 Ca 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3fhi n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fhi n GLY 126 N 0.89 -0.20 3.77 -0.02 0.00 -1.25 -4.64 105.19 103.74 3fhi n GLY 126 Ca 0.06 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 3fhi n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fhi s GLU 127 N -1.76 4.09 0.24 1.61 2.02 -1.26 -0.60 118.70 123.03 3fhi s GLU 127 Ca 0.00 2.21 -0.05 0.00 0.02 0.00 0.00 54.97 57.16 3fhi s GLU 127 Cb 0.00 -2.86 0.43 0.00 0.10 0.00 0.00 34.13 31.79 3fhi s GLU 127 CO 0.00 -0.41 1.75 1.98 0.02 0.00 0.00 175.26 178.60 3fhi h MET 128 N 2.90 0.52 -0.98 1.61 1.85 -0.25 -2.90 114.93 117.68 3fhi h MET 128 Ca -0.50 -0.03 0.20 0.00 -0.61 0.00 0.00 59.70 58.76 3fhi h MET 128 Cb 1.24 -0.12 -0.19 0.00 0.43 0.00 0.00 31.60 32.97 3fhi h MET 128 CO 0.63 0.34 -0.24 0.35 -0.40 0.00 0.00 176.91 177.60 3fhi h PHE 129 N 0.53 -0.51 -0.09 1.39 3.57 -1.73 0.17 116.94 120.27 3fhi h PHE 129 Ca 0.40 0.09 -0.20 0.00 3.53 0.00 0.00 57.97 61.78 3fhi h PHE 129 Cb 0.54 0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.66 3fhi h PHE 129 CO -0.13 -0.42 -0.78 0.66 -2.23 0.00 0.00 178.31 175.40 3fhi h SER 130 N 0.00 0.64 -0.45 0.41 4.64 -1.84 -0.69 113.55 116.26 3fhi h SER 130 Ca 0.47 -0.44 -0.06 0.00 -0.47 0.00 0.00 61.79 61.29 3fhi h SER 130 Cb 0.73 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3fhi h SER 130 CO -1.01 1.20 0.03 0.45 -0.87 0.00 0.00 176.83 176.63 3fhi h HIS 131 N 0.36 0.84 -0.65 4.77 3.86 -1.33 -1.22 115.15 121.78 3fhi h HIS 131 Ca -0.05 -0.14 0.01 0.00 -1.16 0.00 0.00 60.37 59.04 3fhi h HIS 131 Cb 1.38 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 29.60 3fhi h HIS 131 CO 0.06 0.81 0.42 1.25 0.86 0.00 0.00 177.93 181.33 3fhi h LEU 132 N 0.63 0.71 -0.90 2.43 5.85 -0.60 0.11 115.31 123.54 3fhi h LEU 132 Ca 0.13 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 3fhi h LEU 132 Cb 0.45 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3fhi h LEU 132 CO 0.02 0.51 -0.51 0.03 -0.34 0.00 0.00 178.44 178.14 3fhi h ARG 133 N 0.85 0.08 0.02 1.25 2.47 -0.95 0.39 114.38 118.50 3fhi h ARG 133 Ca 0.25 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.92 3fhi h ARG 133 Cb -0.06 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 3fhi h ARG 133 CO -0.07 0.58 -0.01 -0.09 0.56 0.00 0.00 179.97 180.94 3fhi h ARG 134 N 0.07 -0.03 -0.02 0.04 2.43 -0.79 -3.31 114.38 112.77 3fhi h ARG 134 Ca -0.00 0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.04 3fhi h ARG 134 Cb 0.93 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 3fhi h ARG 134 CO 0.07 0.66 -0.59 0.82 -1.51 0.00 0.00 179.97 179.42 3fhi h ILE 135 N -0.78 1.41 0.00 1.20 2.04 -0.79 -3.48 117.51 117.12 3fhi h ILE 135 Ca -0.00 -2.00 0.00 0.00 1.00 0.00 0.00 64.86 63.85 3fhi h ILE 135 Cb 0.70 2.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.85 3fhi h ILE 135 CO 0.01 0.58 0.00 0.61 0.00 0.00 0.00 178.15 179.34 3fhi n GLY 136 N 0.18 2.46 3.21 5.37 0.00 0.14 -4.90 105.19 111.64 3fhi n GLY 136 Ca -0.01 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 3fhi n GLY 136 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3fhi s ARG 137 N 0.00 0.86 -0.04 1.61 1.70 -1.26 -4.17 118.95 117.65 3fhi s ARG 137 Ca 0.00 -1.03 -0.09 0.00 -0.47 0.00 0.00 55.73 54.14 3fhi s ARG 137 Cb 0.00 0.33 -0.05 0.00 -0.57 0.00 0.00 34.95 34.66 3fhi s ARG 137 CO 0.00 -0.27 0.25 -0.06 -1.08 0.00 0.00 175.30 174.15 3fhi s PHE 138 N -3.89 3.62 0.88 5.89 2.99 0.97 -5.01 117.98 123.43 3fhi s PHE 138 Ca 0.07 0.66 -0.12 0.00 0.00 0.00 0.00 56.93 57.54 3fhi s PHE 138 Cb 0.05 -2.04 0.08 0.00 0.00 0.00 0.00 43.02 41.11 3fhi s PHE 138 CO -0.09 0.67 0.91 -1.13 -0.00 0.00 0.00 175.22 175.58 3fhi n SER 139 N 1.61 -0.25 -0.15 1.36 3.41 -1.26 -4.30 113.62 114.03 3fhi n SER 139 Ca -0.15 0.46 -0.05 0.00 -0.26 0.00 0.00 58.87 58.87 3fhi n SER 139 Cb 0.54 -1.39 0.04 0.00 -0.26 0.00 0.00 64.21 63.13 3fhi n SER 139 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3fhi h GLU 140 N -1.39 0.46 -0.99 4.33 5.08 -1.96 -0.71 114.58 119.40 3fhi h GLU 140 Ca -0.44 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 57.93 3fhi h GLU 140 Cb 1.29 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 3fhi h GLU 140 CO 0.41 0.30 0.65 -1.35 -1.00 0.00 0.00 179.01 178.02 3fhi h PRO 141 N 0.47 1.22 0.50 2.33 0.11 -1.98 0.74 132.00 135.39 3fhi h PRO 141 Ca 0.21 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 3fhi h PRO 141 Cb 0.11 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 3fhi h PRO 141 CO -0.14 0.81 -0.28 1.25 -0.21 0.00 0.00 178.00 179.42 3fhi h HIS 142 N 1.26 -0.74 -0.74 0.65 6.17 -1.83 -1.48 115.15 118.43 3fhi h HIS 142 Ca 0.40 -0.01 0.13 0.00 0.71 0.00 0.00 60.37 61.59 3fhi h HIS 142 Cb 0.00 0.26 -0.09 0.00 2.52 0.00 0.00 27.41 30.10 3fhi h HIS 142 CO -0.00 -0.44 0.31 0.00 0.71 0.00 0.00 177.93 178.51 3fhi h ALA 143 N -0.26 1.04 -0.32 5.26 0.00 -0.98 -2.57 119.26 121.42 3fhi h ALA 143 Ca -0.06 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3fhi h ALA 143 Cb 0.59 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3fhi h ALA 143 CO 0.08 -0.17 -0.23 -0.09 0.00 0.00 0.00 179.25 178.84 3fhi h ARG 144 N 0.48 0.62 -0.30 0.00 2.43 -0.70 0.38 114.38 117.28 3fhi h ARG 144 Ca 0.40 -0.24 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 3fhi h ARG 144 Cb 0.56 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 3fhi h ARG 144 CO -0.37 0.80 0.17 0.35 -1.51 0.00 0.00 179.97 179.41 3fhi h PHE 145 N 0.55 0.33 -0.50 2.20 3.57 -0.87 -1.39 116.94 120.82 3fhi h PHE 145 Ca 0.08 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.47 3fhi h PHE 145 Cb 0.69 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 3fhi h PHE 145 CO 0.03 0.19 -0.16 1.88 -2.23 0.00 0.00 178.31 178.02 3fhi h TYR 146 N 0.36 1.12 -0.85 0.41 0.05 -1.25 -3.18 116.97 113.62 3fhi h TYR 146 Ca 0.12 -0.25 -0.00 0.00 0.05 0.00 0.00 58.73 58.65 3fhi h TYR 146 Cb 0.00 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.44 3fhi h TYR 146 CO -0.08 1.07 0.52 0.00 -1.05 0.00 0.00 178.16 178.62 3fhi h ALA 147 N 0.89 1.08 -0.85 3.88 0.00 -0.75 -2.53 119.26 120.98 3fhi h ALA 147 Ca 0.12 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3fhi h ALA 147 Cb 0.73 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 3fhi h ALA 147 CO 0.06 0.54 0.56 0.00 0.00 0.00 0.00 179.25 180.40 3fhi h ALA 148 N 1.28 1.11 -0.71 0.00 0.00 -1.25 0.85 119.26 120.54 3fhi h ALA 148 Ca 0.31 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 3fhi h ALA 148 Cb -0.06 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 3fhi h ALA 148 CO -0.06 0.42 0.19 1.96 0.00 0.00 0.00 179.25 181.76 3fhi h GLN 149 N 1.10 1.12 -0.39 0.00 4.20 -1.46 -1.47 115.11 118.21 3fhi h GLN 149 Ca 0.33 -0.26 -0.14 0.00 0.06 0.00 0.00 58.65 58.64 3fhi h GLN 149 Cb -0.04 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 3fhi h GLN 149 CO -0.10 0.98 -0.30 0.82 -0.67 0.00 0.00 178.83 179.56 3fhi h ILE 150 N 1.06 1.28 -0.53 2.54 1.08 -0.95 -1.33 117.51 120.67 3fhi h ILE 150 Ca 0.22 -1.47 0.03 0.00 -0.39 0.00 0.00 64.86 63.26 3fhi h ILE 150 Cb 0.35 1.35 -0.04 0.00 -3.07 0.00 0.00 36.82 35.41 3fhi h ILE 150 CO -0.00 0.49 0.31 0.58 -0.69 0.00 0.00 178.15 178.84 3fhi h VAL 151 N 0.71 1.03 -0.72 1.67 2.07 -0.59 0.03 116.25 120.46 3fhi h VAL 151 Ca 0.07 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 3fhi h VAL 151 Cb 0.88 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 3fhi h VAL 151 CO 0.08 0.11 0.19 -0.07 0.02 0.00 0.00 177.57 177.90 3fhi h LEU 152 N 0.61 1.08 -0.27 2.57 3.38 -1.19 -0.32 115.31 121.16 3fhi h LEU 152 Ca 0.22 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3fhi h LEU 152 Cb 0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3fhi h LEU 152 CO -0.11 1.02 0.08 0.74 0.09 0.00 0.00 178.44 180.26 3fhi h THR 153 N 1.09 1.21 -0.43 0.22 2.02 -0.74 -1.00 112.91 115.26 3fhi h THR 153 Ca 0.23 -0.67 -0.08 0.00 0.77 0.00 0.00 66.41 66.66 3fhi h THR 153 Cb 0.36 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 3fhi h THR 153 CO -0.00 0.22 -0.08 -0.26 0.37 0.00 0.00 175.52 175.77 3fhi h PHE 154 N 0.28 0.82 -0.28 3.16 0.04 -0.95 0.12 116.94 120.11 3fhi h PHE 154 Ca 0.09 -0.14 0.06 0.00 2.80 0.00 0.00 57.97 60.78 3fhi h PHE 154 Cb 0.26 -0.22 -0.06 0.00 2.20 0.00 0.00 35.95 38.14 3fhi h PHE 154 CO 0.01 0.80 -0.11 1.49 -0.60 0.00 0.00 178.31 179.90 3fhi h GLU 155 N 0.69 -0.06 0.50 1.51 4.81 -0.83 0.11 114.58 121.31 3fhi h GLU 155 Ca 0.12 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3fhi h GLU 155 Cb 0.54 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3fhi h GLU 155 CO 0.03 -0.04 -0.24 -0.92 -0.73 0.00 0.00 179.01 177.11 3fhi h TYR 156 N -0.06 -0.63 -0.31 0.92 3.20 -0.95 -2.34 116.97 116.80 3fhi h TYR 156 Ca 0.14 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.03 3fhi h TYR 156 Cb 0.28 0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 3fhi h TYR 156 CO -0.31 -0.38 0.11 -0.07 -1.64 0.00 0.00 178.16 175.87 3fhi h LEU 157 N -0.71 0.12 -1.20 2.82 3.38 -0.91 -2.60 115.31 116.21 3fhi h LEU 157 Ca -0.07 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3fhi h LEU 157 Cb 0.53 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3fhi h LEU 157 CO 0.11 0.10 -0.20 0.45 0.09 0.00 0.00 178.44 179.00 3fhi h HIS 158 N 0.24 0.34 0.00 1.13 3.86 -0.82 -1.11 115.15 118.78 3fhi h HIS 158 Ca 0.14 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 3fhi h HIS 158 Cb 0.11 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 3fhi h HIS 158 CO -0.13 0.50 -0.19 0.66 0.86 0.00 0.00 177.93 179.63 3fhi h SER 159 N 0.29 0.00 -0.32 2.45 4.64 -1.05 0.11 113.55 119.66 3fhi h SER 159 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3fhi h SER 159 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3fhi h SER 159 CO 0.03 0.19 0.00 0.18 -0.87 0.00 0.00 176.83 176.36 3fhi n LEU 160 N -4.08 1.93 -3.79 5.97 4.77 -0.80 -4.93 117.00 116.07 3fhi n LEU 160 Ca -0.02 -0.97 -0.23 0.00 -0.03 0.00 0.00 56.01 54.76 3fhi n LEU 160 Cb 0.26 -0.27 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3fhi n LEU 160 CO 0.35 0.43 -0.11 0.47 -1.33 0.00 0.00 177.39 177.20 3fhi n ASP 161 N 0.43 -0.99 -4.32 -1.43 10.43 0.03 -4.88 116.55 115.81 3fhi n ASP 161 Ca 0.11 -0.88 -0.32 0.00 2.57 0.00 0.00 54.79 56.27 3fhi n ASP 161 Cb 0.33 -3.74 -0.15 0.00 1.84 0.00 0.00 41.12 39.39 3fhi n ASP 161 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3fhi s LEU 162 N -6.78 2.33 -0.02 0.64 1.43 -0.49 0.13 118.68 115.91 3fhi s LEU 162 Ca 0.02 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 52.69 3fhi s LEU 162 Cb -0.01 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 3fhi s LEU 162 CO 0.84 0.24 0.08 -0.51 0.23 0.00 0.00 176.35 177.22 3fhi s ILE 163 N -0.12 4.75 -0.22 -0.59 2.07 0.01 -3.60 121.20 123.51 3fhi s ILE 163 Ca -0.04 -0.33 -0.16 0.00 -1.41 0.00 0.00 60.65 58.71 3fhi s ILE 163 Cb -0.14 -3.14 -0.12 0.00 0.13 0.00 0.00 42.46 39.19 3fhi s ILE 163 CO 0.04 0.41 -0.13 0.00 -1.91 0.00 0.00 174.94 173.34 3fhi n TYR 164 N 1.37 0.51 -0.92 3.50 9.36 -1.26 -1.78 117.16 127.94 3fhi n TYR 164 Ca -0.14 0.22 0.00 0.00 3.32 0.00 0.00 57.90 61.30 3fhi n TYR 164 Cb 0.53 -0.91 0.00 0.00 -0.63 0.00 0.00 39.34 38.33 3fhi n TYR 164 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3fhi n ARG 165 N -4.41 -0.90 -2.72 2.98 1.74 -1.26 -3.25 116.66 108.84 3fhi n ARG 165 Ca -0.32 0.22 -0.06 0.00 -0.77 0.00 0.00 57.85 56.93 3fhi n ARG 165 Cb 0.65 -4.07 0.05 0.00 -1.02 0.00 0.00 32.46 28.07 3fhi n ARG 165 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3fhi n ASP 166 N -0.45 0.93 -4.69 0.55 4.64 -1.26 -4.14 116.55 112.14 3fhi n ASP 166 Ca 0.00 -2.44 -0.42 0.00 -1.38 0.00 0.00 54.79 50.54 3fhi n ASP 166 Cb 0.22 -0.27 -0.03 0.00 -1.04 0.00 0.00 41.12 40.01 3fhi n ASP 166 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 3fhi s LEU 167 N -3.40 4.34 -0.10 -2.67 2.96 -1.26 -4.79 118.68 113.76 3fhi s LEU 167 Ca 0.25 2.31 -0.30 0.00 -0.22 0.00 0.00 54.13 56.17 3fhi s LEU 167 Cb 0.41 -3.56 0.12 0.00 0.50 0.00 0.00 46.19 43.66 3fhi s LEU 167 CO -0.01 -0.82 0.98 -1.59 -1.32 0.00 0.00 176.35 173.59 3fhi s LYS 168 N 2.66 0.65 0.57 1.98 -2.85 -1.26 -4.90 119.74 116.59 3fhi s LYS 168 Ca 0.70 -0.05 0.27 0.00 -1.00 0.00 0.00 55.97 55.89 3fhi s LYS 168 Cb -0.36 0.30 1.51 0.00 -2.06 0.00 0.00 37.83 37.22 3fhi s LYS 168 CO 0.30 -0.25 2.01 -1.35 0.10 0.00 0.00 175.35 176.16 3fhi h PRO 169 N 2.29 0.00 0.00 1.78 0.11 -1.93 -0.83 132.00 133.42 3fhi h PRO 169 Ca -0.19 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.90 3fhi h PRO 169 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3fhi h PRO 169 CO 0.30 0.00 -0.12 0.93 -0.21 0.00 0.00 178.00 178.91 3fhi h GLU 170 N 0.00 0.00 -0.54 1.05 3.07 -1.95 -2.66 114.58 113.55 3fhi h GLU 170 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3fhi h GLU 170 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 3fhi h GLU 170 CO -0.00 0.12 0.00 0.09 -1.40 0.00 0.00 179.01 177.81 3fhi n ASN 171 N -3.29 3.57 -4.21 1.42 3.02 -0.32 -4.88 115.26 110.56 3fhi n ASN 171 Ca 0.00 -1.98 -0.34 0.00 -0.03 0.00 0.00 54.58 52.24 3fhi n ASN 171 Cb 0.35 -0.36 -0.15 0.00 -0.61 0.00 0.00 39.78 39.01 3fhi n ASN 171 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fhi s LEU 172 N -1.14 2.44 0.00 3.41 1.43 -1.07 -1.29 118.68 122.46 3fhi s LEU 172 Ca 0.40 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 52.98 3fhi s LEU 172 Cb 0.22 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 3fhi s LEU 172 CO 0.29 0.01 0.03 -0.76 0.23 0.00 0.00 176.35 176.15 3fhi s LEU 173 N 1.24 3.63 -0.22 1.79 1.43 0.07 0.09 118.68 126.71 3fhi s LEU 173 Ca 0.03 0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.07 3fhi s LEU 173 Cb -0.14 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.93 3fhi s LEU 173 CO -0.07 0.27 0.12 -0.63 0.23 0.00 0.00 176.35 176.27 3fhi s ILE 174 N -1.13 5.11 0.66 -0.59 -1.09 0.23 0.37 121.20 124.76 3fhi s ILE 174 Ca 0.21 0.09 0.01 0.00 -2.23 0.00 0.00 60.65 58.73 3fhi s ILE 174 Cb -0.12 -3.35 0.10 0.00 -1.58 0.00 0.00 42.46 37.51 3fhi s ILE 174 CO 0.12 0.40 0.91 1.51 -1.23 0.00 0.00 174.94 176.65 3fhi s ASP 175 N 0.77 4.66 0.66 3.58 1.47 0.11 -1.53 116.67 126.40 3fhi s ASP 175 Ca 0.06 -0.37 0.37 0.00 1.18 0.00 0.00 52.55 53.79 3fhi s ASP 175 Cb -0.13 -0.15 2.00 0.00 -0.34 0.00 0.00 42.92 44.31 3fhi s ASP 175 CO 0.02 -1.63 2.14 0.06 0.68 0.00 0.00 175.17 176.44 3fhi h GLN 176 N -0.29 0.00 -0.61 2.11 -0.00 -1.94 0.29 115.11 114.68 3fhi h GLN 176 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.28 3fhi h GLN 176 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 3fhi h GLN 176 CO 0.43 0.00 0.00 1.04 -0.00 0.00 0.00 178.83 180.30 3fhi n GLN 177 N -3.02 2.60 -0.99 0.06 3.00 -1.26 -4.76 117.38 113.02 3fhi n GLN 177 Ca -0.02 -2.47 0.00 0.00 -0.01 0.00 0.00 57.00 54.49 3fhi n GLN 177 Cb 0.24 -1.54 0.00 0.00 0.00 0.00 0.00 30.24 28.93 3fhi n GLN 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3fhi n GLY 178 N 1.60 0.52 3.92 1.08 0.00 0.10 -4.54 105.19 107.87 3fhi n GLY 178 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 3fhi n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fhi s TYR 179 N -2.19 3.52 0.21 1.61 2.02 -1.26 -4.73 117.35 116.53 3fhi s TYR 179 Ca 0.00 0.55 -0.30 0.00 -0.37 0.00 0.00 57.07 56.95 3fhi s TYR 179 Cb 0.00 -2.06 -0.08 0.00 -0.40 0.00 0.00 41.96 39.42 3fhi s TYR 179 CO 0.00 0.00 0.94 0.42 -1.57 0.00 0.00 175.55 175.35 3fhi s ILE 180 N -2.42 4.15 -0.18 2.71 -1.09 -1.26 0.10 121.20 123.21 3fhi s ILE 180 Ca 0.43 2.09 0.01 0.00 -2.23 0.00 0.00 60.65 60.94 3fhi s ILE 180 Cb -0.10 -4.33 0.03 0.00 -1.58 0.00 0.00 42.46 36.48 3fhi s ILE 180 CO 0.38 0.46 -0.14 -1.10 -1.23 0.00 0.00 174.94 173.31 3fhi s GLN 181 N -0.94 2.37 -0.13 2.79 -1.52 0.16 -4.51 119.66 117.88 3fhi s GLN 181 Ca 0.42 -0.79 -0.27 0.00 -1.95 0.00 0.00 55.36 52.77 3fhi s GLN 181 Cb -0.25 -2.40 -0.01 0.00 -0.22 0.00 0.00 33.01 30.13 3fhi s GLN 181 CO 0.32 -0.32 0.91 0.08 -0.25 0.00 0.00 175.29 176.02 3fhi s VAL 182 N 1.37 4.84 0.51 1.09 1.01 0.12 -0.75 120.40 128.59 3fhi s VAL 182 Ca 0.02 1.83 0.01 0.00 0.00 0.00 0.00 61.98 63.84 3fhi s VAL 182 Cb -0.15 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.02 3fhi s VAL 182 CO -0.10 0.03 0.08 1.07 0.00 0.00 0.00 175.10 176.18 3fhi n THR 183 N 4.56 0.00 -2.65 3.92 5.66 -0.41 -1.26 114.28 124.10 3fhi n THR 183 Ca 0.06 -2.32 -0.04 0.00 -3.05 0.00 0.00 64.05 58.71 3fhi n THR 183 Cb 0.49 0.37 0.00 0.00 -1.55 0.00 0.00 70.33 69.65 3fhi n THR 183 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 3fhi n ASP 184 N -1.41 -6.71 -1.11 1.09 4.64 -1.26 -4.83 116.55 106.96 3fhi n ASP 184 Ca -0.17 0.22 -0.02 0.00 -1.38 0.00 0.00 54.79 53.44 3fhi n ASP 184 Cb 0.63 -4.49 0.10 0.00 -1.04 0.00 0.00 41.12 36.32 3fhi n ASP 184 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 3fhi n PHE 185 N -0.89 0.76 0.12 -0.67 0.99 -1.26 -4.56 117.46 111.96 3fhi n PHE 185 Ca 0.05 -0.51 0.06 0.00 -0.00 0.00 0.00 57.45 57.06 3fhi n PHE 185 Cb 0.42 -0.32 0.53 0.00 -1.00 0.00 0.00 39.48 39.11 3fhi n PHE 185 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3fhi h GLY 186 N 4.04 0.29 -1.22 1.37 0.00 -1.89 -1.22 103.07 104.44 3fhi h GLY 186 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.30 3fhi h GLY 186 CO 0.23 0.10 0.00 0.69 0.00 0.00 0.00 176.54 177.56 3fhi n PHE 187 N -4.50 0.38 -1.88 5.60 3.72 -1.26 -4.53 117.46 114.99 3fhi n PHE 187 Ca 0.00 -0.41 -0.39 0.00 -0.05 0.00 0.00 57.45 56.61 3fhi n PHE 187 Cb 0.09 -0.02 0.02 0.00 -0.94 0.00 0.00 39.48 38.63 3fhi n PHE 187 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fhi s ALA 188 N -0.99 3.06 -0.18 4.37 0.00 -0.46 -4.64 121.76 122.91 3fhi s ALA 188 Ca 0.21 1.32 -0.23 0.00 0.00 0.00 0.00 51.96 53.27 3fhi s ALA 188 Cb 0.12 -3.54 0.06 0.00 0.00 0.00 0.00 23.12 19.75 3fhi s ALA 188 CO 0.16 -1.15 0.61 0.21 0.00 0.00 0.00 175.76 175.59 3fhi s LYS 189 N -2.61 0.78 -0.23 0.00 2.20 -0.73 -4.53 119.74 114.62 3fhi s LYS 189 Ca 0.64 0.67 -0.29 0.00 -0.36 0.00 0.00 55.97 56.64 3fhi s LYS 189 Cb -0.40 0.37 -0.02 0.00 -1.51 0.00 0.00 37.83 36.28 3fhi s LYS 189 CO 0.50 -0.14 1.44 1.03 -0.36 0.00 0.00 175.35 177.82 3fhi s ARG 190 N -0.07 3.95 -0.20 4.03 0.52 -1.26 -0.81 118.95 125.12 3fhi s ARG 190 Ca -0.03 1.55 -0.04 0.00 -0.52 0.00 0.00 55.73 56.69 3fhi s ARG 190 Cb -0.04 -3.92 0.09 0.00 0.52 0.00 0.00 34.95 31.61 3fhi s ARG 190 CO 0.03 -1.08 0.23 0.08 0.02 0.00 0.00 175.30 174.57 3fhi s VAL 191 N 4.47 -0.33 -0.12 3.52 1.01 0.12 -4.96 120.40 124.11 3fhi s VAL 191 Ca 0.63 -0.10 -0.25 0.00 0.00 0.00 0.00 61.98 62.26 3fhi s VAL 191 Cb -0.22 -0.67 -0.27 0.00 0.00 0.00 0.00 36.38 35.22 3fhi s VAL 191 CO 0.24 -0.19 0.73 0.07 0.00 0.00 0.00 175.10 175.95 3fhi h LYS 192 N 8.31 0.11 0.00 2.72 -0.00 -1.94 -3.38 116.57 122.38 3fhi h LYS 192 Ca -0.17 -0.18 0.00 0.00 -0.00 0.00 0.00 60.65 60.30 3fhi h LYS 192 Cb 1.15 0.07 0.00 0.00 -0.00 0.00 0.00 32.23 33.45 3fhi h LYS 192 CO 0.27 1.09 0.00 0.41 -0.00 0.00 0.00 179.45 181.22 3fhi n GLY 193 N 1.62 0.43 3.61 0.07 0.00 -1.26 -4.98 105.19 104.68 3fhi n GLY 193 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 3fhi n GLY 193 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fhi s ARG 194 N 0.76 2.21 0.23 1.61 3.52 -1.26 -4.39 118.95 121.63 3fhi s ARG 194 Ca 0.00 -1.12 -0.03 0.00 -0.13 0.00 0.00 55.73 54.44 3fhi s ARG 194 Cb 0.00 -2.28 -0.03 0.00 -1.56 0.00 0.00 34.95 31.08 3fhi s ARG 194 CO 0.00 0.47 0.24 -0.08 -0.81 0.00 0.00 175.30 175.11 3fhi s THR 195 N -1.54 0.00 -0.54 4.11 -1.32 0.11 -4.95 115.64 111.51 3fhi s THR 195 Ca 0.25 -1.84 0.05 0.00 -1.21 0.00 0.00 61.69 58.93 3fhi s THR 195 Cb -0.10 -2.44 0.17 0.00 -1.51 0.00 0.00 72.50 68.63 3fhi s THR 195 CO 0.16 0.00 0.42 0.79 -2.21 0.00 0.00 174.62 173.78 3fhi n TRP 196 N -0.33 0.87 -3.89 9.09 7.02 -1.26 -1.14 117.44 127.80 3fhi n TRP 196 Ca 0.01 -3.74 -0.30 0.00 -1.02 0.00 0.00 57.50 52.46 3fhi n TRP 196 Cb 0.65 -0.13 -0.16 0.00 -2.42 0.00 0.00 31.31 29.25 3fhi n TRP 196 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 3fhi s LEU 198 N -0.66 2.19 -0.14 -0.99 0.20 -1.26 -4.83 118.68 113.20 3fhi s LEU 198 Ca 0.30 -1.05 -0.11 0.00 0.69 0.00 0.00 54.13 53.96 3fhi s LEU 198 Cb 0.01 -1.04 0.04 0.00 -0.43 0.00 0.00 46.19 44.78 3fhi s LEU 198 CO -0.18 -0.24 0.35 0.00 -0.29 0.00 0.00 176.35 175.98 3fhi s ALA 199 N 1.51 -0.86 0.00 5.97 0.00 -1.26 -5.13 121.76 121.98 3fhi s ALA 199 Ca -0.04 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.01 3fhi s ALA 199 Cb -0.18 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 22.29 3fhi s ALA 199 CO -0.07 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 175.91 3fhi n GLY 200 N 3.32 -0.26 3.11 0.00 0.00 -1.26 -4.95 105.19 105.15 3fhi n GLY 200 Ca -0.16 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.40 3fhi n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fhi s THR 201 N -3.15 1.42 0.26 2.61 2.01 -1.26 -5.04 115.64 112.49 3fhi s THR 201 Ca 0.00 -0.68 -0.10 0.00 0.31 0.00 0.00 61.69 61.22 3fhi s THR 201 Cb 0.00 -1.24 0.38 0.00 0.01 0.00 0.00 72.50 71.65 3fhi s THR 201 CO 0.00 0.41 1.58 -0.65 -0.69 0.00 0.00 174.62 175.28 3fhi h PRO 202 N 6.55 -0.00 0.00 4.92 0.11 -1.98 -0.18 132.00 141.41 3fhi h PRO 202 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3fhi h PRO 202 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3fhi h PRO 202 CO 0.48 -0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.20 3fhi h GLU 203 N -0.00 0.00 -0.02 1.05 3.07 -1.98 -2.98 114.58 113.72 3fhi h GLU 203 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 3fhi h GLU 203 Cb 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 3fhi h GLU 203 CO -0.90 0.00 -0.03 0.66 -1.40 0.00 0.00 179.01 177.35 3fhi n TYR 204 N -3.07 0.00 -2.31 4.33 4.01 -0.11 -4.79 117.16 115.23 3fhi n TYR 204 Ca -0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 3fhi n TYR 204 Cb 0.23 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.23 3fhi n TYR 204 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3fhi s LEU 205 N -1.52 4.39 0.58 7.72 1.43 -1.03 -4.44 118.68 125.80 3fhi s LEU 205 Ca 0.20 2.19 -0.16 0.00 -1.03 0.00 0.00 54.13 55.33 3fhi s LEU 205 Cb 0.15 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.74 3fhi s LEU 205 CO 0.24 -0.52 1.06 0.00 0.23 0.00 0.00 176.35 177.35 3fhi s ALA 206 N 0.83 2.74 0.25 4.21 0.00 -1.26 -4.93 121.76 123.60 3fhi s ALA 206 Ca 0.60 0.45 -0.03 0.00 0.00 0.00 0.00 51.96 52.98 3fhi s ALA 206 Cb -0.33 -3.25 0.45 0.00 0.00 0.00 0.00 23.12 19.99 3fhi s ALA 206 CO 0.31 -0.77 1.81 -1.35 0.00 0.00 0.00 175.76 175.76 3fhi h PRO 207 N 0.59 0.77 0.00 0.00 0.11 -1.89 -1.73 132.00 129.85 3fhi h PRO 207 Ca -0.47 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 3fhi h PRO 207 Cb 1.22 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3fhi h PRO 207 CO 0.57 0.51 -0.15 1.05 -0.21 0.00 0.00 178.00 179.78 3fhi h GLU 208 N 0.80 0.00 -0.20 1.05 9.09 -1.92 -0.54 114.58 122.85 3fhi h GLU 208 Ca 0.42 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.78 3fhi h GLU 208 Cb 0.43 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.53 3fhi h GLU 208 CO -0.27 0.15 -0.07 0.82 0.05 0.00 0.00 179.01 179.69 3fhi h ILE 209 N 0.00 1.30 -0.88 -1.06 2.04 -1.63 -3.06 117.51 114.22 3fhi h ILE 209 Ca -0.00 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 64.77 3fhi h ILE 209 Cb 0.44 1.60 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 3fhi h ILE 209 CO 0.02 0.33 0.57 0.40 0.00 0.00 0.00 178.15 179.47 3fhi h ILE 210 N 0.11 1.23 0.00 -0.67 2.04 -1.26 -2.85 117.51 116.11 3fhi h ILE 210 Ca 0.05 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3fhi h ILE 210 Cb 0.54 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 3fhi h ILE 210 CO 0.02 0.23 0.00 0.18 0.00 0.00 0.00 178.15 178.58 3fhi n LEU 211 N -4.46 0.00 -2.80 1.44 4.77 -0.27 -4.90 117.00 110.79 3fhi n LEU 211 Ca 0.09 0.43 -0.21 0.00 -0.03 0.00 0.00 56.01 56.30 3fhi n LEU 211 Cb 0.03 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.70 3fhi n LEU 211 CO 0.37 -0.17 -0.11 -1.20 -1.33 0.00 0.00 177.39 174.95 3fhi n SER 212 N -1.43 -5.47 -0.42 -1.43 7.64 -1.08 -4.86 113.62 106.56 3fhi n SER 212 Ca 0.06 -0.15 0.07 0.00 1.01 0.00 0.00 58.87 59.85 3fhi n SER 212 Cb 0.19 -4.50 0.18 0.00 -1.01 0.00 0.00 64.21 59.07 3fhi n SER 212 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3fhi n LYS 213 N -3.53 1.55 0.00 1.43 5.02 -1.26 -5.09 118.16 116.28 3fhi n LYS 213 Ca -0.15 -2.94 0.00 0.00 -2.02 0.00 0.00 58.31 53.21 3fhi n LYS 213 Cb 0.63 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 3fhi n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fhi n GLY 214 N -1.23 -0.32 3.69 0.72 0.00 -1.26 -5.11 105.19 101.69 3fhi n GLY 214 Ca 0.19 -1.59 -0.10 0.00 0.00 0.00 0.00 46.02 44.52 3fhi n GLY 214 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fhi s TYR 215 N -3.01 0.33 0.00 1.61 1.13 -0.29 -4.82 117.35 112.29 3fhi s TYR 215 Ca 0.00 -0.78 0.00 0.00 -1.41 0.00 0.00 57.07 54.88 3fhi s TYR 215 Cb 0.00 0.44 0.00 0.00 -1.10 0.00 0.00 41.96 41.30 3fhi s TYR 215 CO 0.00 -1.25 0.00 0.27 -2.51 0.00 0.00 175.55 172.06 3fhi n ASN 216 N -0.93 0.23 0.07 -0.18 0.23 -1.26 0.08 115.26 113.50 3fhi n ASN 216 Ca -0.04 -0.82 0.09 0.00 -0.53 0.00 0.00 54.58 53.29 3fhi n ASN 216 Cb 0.61 0.00 0.38 0.00 -2.08 0.00 0.00 39.78 38.69 3fhi n ASN 216 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3fhi n LYS 217 N 0.00 0.10 0.21 -3.83 5.02 -1.26 -2.25 118.16 116.15 3fhi n LYS 217 Ca 0.00 0.40 0.14 0.00 -2.02 0.00 0.00 58.31 56.83 3fhi n LYS 217 Cb 0.00 -1.71 0.76 0.00 -0.02 0.00 0.00 35.03 34.06 3fhi n LYS 217 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fhi h ALA 218 N 2.29 1.00 0.00 7.82 0.00 -1.96 -1.06 119.26 127.35 3fhi h ALA 218 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3fhi h ALA 218 Cb 0.24 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3fhi h ALA 218 CO 0.00 0.00 -0.09 -0.39 0.00 0.00 0.00 179.25 178.77 3fhi h VAL 219 N 0.00 0.85 -0.11 0.00 -1.51 -1.88 -2.36 116.25 111.25 3fhi h VAL 219 Ca 0.00 -0.33 -0.11 0.00 -1.23 0.00 0.00 66.70 65.03 3fhi h VAL 219 Cb 0.03 1.19 -0.01 0.00 -2.13 0.00 0.00 31.29 30.36 3fhi h VAL 219 CO 0.00 0.09 -0.42 0.44 -1.23 0.00 0.00 177.57 176.44 3fhi h ASP 220 N 0.00 0.25 0.53 4.19 3.32 -1.45 -1.36 116.42 121.91 3fhi h ASP 220 Ca -0.00 -0.11 -0.20 0.00 0.02 0.00 0.00 57.03 56.74 3fhi h ASP 220 Cb 0.18 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3fhi h ASP 220 CO 0.01 0.65 -0.88 -0.50 -1.72 0.00 0.00 179.24 176.81 3fhi h TRP 221 N 0.20 0.35 0.15 4.55 -0.00 -1.58 -1.08 115.95 118.54 3fhi h TRP 221 Ca 0.02 -0.19 0.00 0.00 -0.00 0.00 0.00 58.89 58.72 3fhi h TRP 221 Cb 0.83 -0.04 -0.01 0.00 -0.00 0.00 0.00 29.16 29.94 3fhi h TRP 221 CO 0.01 1.00 -0.15 2.35 -0.00 0.00 0.00 178.44 181.66 3fhi h TRP 222 N 0.13 -0.38 -0.83 0.49 2.91 -1.29 -2.43 115.95 114.55 3fhi h TRP 222 Ca -0.05 0.00 0.12 0.00 1.13 0.00 0.00 58.89 60.09 3fhi h TRP 222 Cb 1.50 0.15 -0.08 0.00 -0.51 0.00 0.00 29.16 30.22 3fhi h TRP 222 CO 0.03 -0.22 0.45 0.00 -1.03 0.00 0.00 178.44 177.67 3fhi h ALA 223 N 0.49 1.22 -0.61 2.65 0.00 -1.09 -0.90 119.26 121.02 3fhi h ALA 223 Ca 0.00 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.04 3fhi h ALA 223 Cb 0.31 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 3fhi h ALA 223 CO -0.03 0.01 0.28 1.25 0.00 0.00 0.00 179.25 180.77 3fhi h LEU 224 N 0.72 0.37 -0.99 0.00 6.46 -1.06 0.45 115.31 121.25 3fhi h LEU 224 Ca 0.42 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 58.26 3fhi h LEU 224 Cb 0.49 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.36 3fhi h LEU 224 CO -0.30 0.23 0.65 1.23 -0.62 0.00 0.00 178.44 179.63 3fhi h GLY 225 N 0.52 1.41 0.92 3.75 0.00 -0.69 0.43 103.07 109.41 3fhi h GLY 225 Ca 0.29 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 3fhi h GLY 225 CO -0.24 0.48 0.06 -2.08 0.00 0.00 0.00 176.54 174.76 3fhi h VAL 226 N 1.31 1.24 -0.46 4.60 2.07 -0.58 -1.55 116.25 122.87 3fhi h VAL 226 Ca 0.37 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 3fhi h VAL 226 Cb -0.10 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3fhi h VAL 226 CO -0.09 0.28 0.27 0.25 0.02 0.00 0.00 177.57 178.30 3fhi h LEU 227 N 0.45 0.55 -0.27 2.57 5.85 -0.63 -0.72 115.31 123.11 3fhi h LEU 227 Ca 0.11 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 3fhi h LEU 227 Cb 0.35 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 3fhi h LEU 227 CO 0.01 0.45 -0.03 0.40 -0.34 0.00 0.00 178.44 178.93 3fhi h ILE 228 N 0.61 1.27 -0.18 4.05 2.04 -0.81 -0.61 117.51 123.88 3fhi h ILE 228 Ca 0.16 -0.99 0.05 0.00 1.00 0.00 0.00 64.86 65.09 3fhi h ILE 228 Cb 0.00 1.37 -0.07 0.00 -0.74 0.00 0.00 36.82 37.39 3fhi h ILE 228 CO -0.03 0.31 -0.32 0.22 0.00 0.00 0.00 178.15 178.33 3fhi h TYR 229 N 0.26 -0.89 -0.96 1.37 5.03 -1.21 -1.19 116.97 119.39 3fhi h TYR 229 Ca 0.07 0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.44 3fhi h TYR 229 Cb 0.47 0.42 -0.05 0.00 1.55 0.00 0.00 36.73 39.12 3fhi h TYR 229 CO 0.04 -0.39 0.63 1.49 -1.32 0.00 0.00 178.16 178.61 3fhi h GLU 230 N -0.37 1.24 -0.53 1.82 4.81 -0.89 0.32 114.58 120.97 3fhi h GLU 230 Ca 0.11 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 3fhi h GLU 230 Cb 0.54 -0.28 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3fhi h GLU 230 CO -0.39 0.82 0.24 0.52 -0.73 0.00 0.00 179.01 179.47 3fhi h MET 231 N 1.27 0.78 0.14 1.92 2.86 -0.82 0.38 114.93 121.46 3fhi h MET 231 Ca 0.36 -0.12 -0.28 0.00 -2.06 0.00 0.00 59.70 57.59 3fhi h MET 231 Cb -0.11 -0.14 0.01 0.00 0.06 0.00 0.00 31.60 31.42 3fhi h MET 231 CO -0.09 0.66 -1.27 0.00 1.06 0.00 0.00 176.91 177.27 3fhi h ALA 232 N 1.08 0.08 0.10 6.32 0.00 -0.87 0.28 119.26 126.25 3fhi h ALA 232 Ca 0.18 -0.89 -0.33 0.00 0.00 0.00 0.00 54.91 53.87 3fhi h ALA 232 Cb 0.15 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3fhi h ALA 232 CO -0.02 0.96 -1.80 0.00 0.00 0.00 0.00 179.25 178.40 3fhi h ALA 233 N 0.55 0.47 0.00 0.00 0.00 -0.42 -3.41 119.26 116.44 3fhi h ALA 233 Ca -0.15 -1.33 0.00 0.00 0.00 0.00 0.00 54.91 53.43 3fhi h ALA 233 Cb 1.99 0.53 0.00 0.00 0.00 0.00 0.00 17.79 20.31 3fhi h ALA 233 CO 0.21 1.33 0.00 0.41 0.00 0.00 0.00 179.25 181.19 3fhi n GLY 234 N 1.80 0.40 3.12 0.00 0.00 0.13 -4.76 105.19 105.88 3fhi n GLY 234 Ca -0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 3fhi n GLY 234 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3fhi s TYR 235 N -2.15 0.10 0.73 1.61 1.13 -1.22 -4.94 117.35 112.61 3fhi s TYR 235 Ca 0.00 -0.28 -0.11 0.00 -1.41 0.00 0.00 57.07 55.28 3fhi s TYR 235 Cb 0.00 -0.08 0.03 0.00 -1.10 0.00 0.00 41.96 40.81 3fhi s TYR 235 CO 0.00 -0.33 1.07 -1.25 -2.51 0.00 0.00 175.55 172.53 3fhi s PRO 236 N -1.93 2.68 0.38 -3.49 0.04 -1.26 -3.86 135.00 127.56 3fhi s PRO 236 Ca -0.11 0.91 0.18 0.00 0.04 0.00 0.00 61.00 62.03 3fhi s PRO 236 Cb -0.05 -1.96 0.71 0.00 0.04 0.00 0.00 34.50 33.24 3fhi s PRO 236 CO -0.01 -1.27 1.76 -1.00 0.04 0.00 0.00 177.00 176.51 3fhi h PRO 237 N -0.84 0.00 -4.29 0.56 0.13 -1.91 -3.42 132.00 122.23 3fhi h PRO 237 Ca -0.44 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.12 3fhi h PRO 237 Cb 1.22 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.98 3fhi h PRO 237 CO 0.57 0.37 -0.80 -0.06 -0.23 0.00 0.00 178.00 177.85 3fhi s PHE 238 N -3.69 1.83 -0.12 1.56 0.40 -1.26 -4.80 117.98 111.90 3fhi s PHE 238 Ca -0.00 -1.12 -0.18 0.00 -0.60 0.00 0.00 56.93 55.03 3fhi s PHE 238 Cb 0.11 -1.38 0.04 0.00 0.51 0.00 0.00 43.02 42.31 3fhi s PHE 238 CO 0.69 -0.62 0.46 0.12 0.70 0.00 0.00 175.22 176.56 3fhi s PHE 239 N 1.59 -0.45 0.23 0.36 2.19 -1.26 -4.80 117.98 115.85 3fhi s PHE 239 Ca 0.02 0.98 -0.21 0.00 0.33 0.00 0.00 56.93 58.05 3fhi s PHE 239 Cb -0.15 0.19 0.03 0.00 -1.31 0.00 0.00 43.02 41.79 3fhi s PHE 239 CO -0.08 -0.34 0.65 0.00 1.83 0.00 0.00 175.22 177.28 3fhi s ALA 240 N -0.38 -1.24 0.28 11.12 0.00 -1.26 -4.85 121.76 125.43 3fhi s ALA 240 Ca -0.05 -0.11 0.20 0.00 0.00 0.00 0.00 51.96 52.00 3fhi s ALA 240 Cb -0.03 0.87 0.91 0.00 0.00 0.00 0.00 23.12 24.86 3fhi s ALA 240 CO 0.03 -0.93 1.85 -0.44 0.00 0.00 0.00 175.76 176.27 3fhi h ASP 241 N 2.04 0.00 -3.94 0.00 3.45 -2.02 -3.43 116.42 112.52 3fhi h ASP 241 Ca -0.25 0.00 -0.68 0.00 0.43 0.00 0.00 57.03 56.53 3fhi h ASP 241 Cb 1.27 0.00 -0.26 0.00 -0.56 0.00 0.00 39.33 39.78 3fhi h ASP 241 CO 0.30 0.30 -0.80 -1.10 -1.57 0.00 0.00 179.24 176.36 3fhi s GLN 242 N -3.90 2.65 0.27 3.56 -0.21 -1.26 -5.04 119.66 115.75 3fhi s GLN 242 Ca -0.01 -0.76 0.01 0.00 0.02 0.00 0.00 55.36 54.62 3fhi s GLN 242 Cb 0.12 -2.35 0.63 0.00 1.00 0.00 0.00 33.01 32.41 3fhi s GLN 242 CO 0.66 0.49 1.69 -1.35 -2.12 0.00 0.00 175.29 174.66 3fhi h PRO 243 N 5.77 0.34 -0.43 2.91 0.11 -2.01 -1.34 132.00 137.36 3fhi h PRO 243 Ca -0.39 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.65 3fhi h PRO 243 Cb 1.17 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 3fhi h PRO 243 CO 0.50 0.22 0.08 0.97 -0.21 0.00 0.00 178.00 179.57 3fhi h ILE 244 N 0.35 1.20 -0.01 4.15 6.09 -1.97 -1.24 117.51 126.09 3fhi h ILE 244 Ca 0.51 -0.74 -0.11 0.00 -1.37 0.00 0.00 64.86 63.15 3fhi h ILE 244 Cb 0.94 0.79 -0.01 0.00 0.47 0.00 0.00 36.82 39.00 3fhi h ILE 244 CO -0.53 0.27 -0.49 1.56 -3.07 0.00 0.00 178.15 175.88 3fhi h GLN 245 N 0.63 0.02 -0.26 2.19 4.20 -1.65 -0.52 115.11 119.72 3fhi h GLN 245 Ca 0.14 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 3fhi h GLN 245 Cb 0.28 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 3fhi h GLN 245 CO 0.00 0.51 0.10 0.82 -0.67 0.00 0.00 178.83 179.59 3fhi h ILE 246 N 0.01 1.18 -0.56 2.54 2.04 -0.87 -2.46 117.51 119.39 3fhi h ILE 246 Ca -0.00 -0.55 -0.09 0.00 1.00 0.00 0.00 64.86 65.22 3fhi h ILE 246 Cb 0.88 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 3fhi h ILE 246 CO 0.06 0.18 0.01 1.88 0.00 0.00 0.00 178.15 180.29 3fhi h TYR 247 N 0.27 1.04 -0.64 1.37 0.05 -1.00 0.66 116.97 118.72 3fhi h TYR 247 Ca 0.09 -0.16 0.09 0.00 0.05 0.00 0.00 58.73 58.80 3fhi h TYR 247 Cb 0.19 -0.28 -0.07 0.00 1.01 0.00 0.00 36.73 37.58 3fhi h TYR 247 CO -0.01 0.93 0.27 0.93 -1.05 0.00 0.00 178.16 179.24 3fhi h GLU 248 N 0.89 0.46 -0.22 4.88 5.08 -1.08 -0.69 114.58 123.90 3fhi h GLU 248 Ca 0.17 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 3fhi h GLU 248 Cb 0.51 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3fhi h GLU 248 CO 0.02 0.31 0.02 0.87 -1.00 0.00 0.00 179.01 179.23 3fhi h LYS 249 N 0.48 0.38 -0.15 2.33 1.57 -0.83 -1.92 116.57 118.42 3fhi h LYS 249 Ca 0.32 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 59.01 3fhi h LYS 249 Cb 0.37 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 3fhi h LYS 249 CO -0.29 0.54 0.02 0.82 -0.57 0.00 0.00 179.45 179.98 3fhi h ILE 250 N 0.16 0.92 -0.09 1.86 2.04 -0.64 0.11 117.51 121.86 3fhi h ILE 250 Ca 0.06 -0.03 -0.13 0.00 1.00 0.00 0.00 64.86 65.77 3fhi h ILE 250 Cb 0.36 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 3fhi h ILE 250 CO 0.01 0.01 -0.52 -0.37 0.00 0.00 0.00 178.15 177.28 3fhi h VAL 251 N 0.08 1.35 -0.71 1.67 -1.51 -1.12 -1.36 116.25 114.65 3fhi h VAL 251 Ca 0.07 -1.79 -0.04 0.00 -1.23 0.00 0.00 66.70 63.71 3fhi h VAL 251 Cb 0.07 1.86 -0.03 0.00 -2.13 0.00 0.00 31.29 31.06 3fhi h VAL 251 CO -0.10 0.53 0.29 0.77 -1.23 0.00 0.00 177.57 177.83 3fhi h SER 252 N 0.19 0.98 -0.48 4.19 4.64 -1.23 -3.47 113.55 118.38 3fhi h SER 252 Ca 0.00 -0.17 -0.20 0.00 -0.47 0.00 0.00 61.79 60.95 3fhi h SER 252 Cb 0.98 -0.25 -0.08 0.00 -0.31 0.00 0.00 62.40 62.74 3fhi h SER 252 CO 0.08 0.88 -0.19 0.61 -0.87 0.00 0.00 176.83 177.34 3fhi n GLY 253 N -0.87 1.12 3.27 -0.77 0.00 0.35 -4.92 105.19 103.37 3fhi n GLY 253 Ca 0.06 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 3fhi n GLY 253 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fhi n LYS 254 N -2.32 2.32 -2.81 1.61 5.02 -1.26 -4.94 118.16 115.78 3fhi n LYS 254 Ca -0.10 -2.58 -0.33 0.00 -2.02 0.00 0.00 58.31 53.28 3fhi n LYS 254 Cb 0.38 -3.37 -0.07 0.00 -0.02 0.00 0.00 35.03 31.95 3fhi n LYS 254 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3fhi s VAL 255 N 5.86 4.37 -0.01 -0.18 0.11 -1.26 -5.06 120.40 124.23 3fhi s VAL 255 Ca 0.57 1.51 0.04 0.00 -2.93 0.00 0.00 61.98 61.17 3fhi s VAL 255 Cb 0.08 -3.63 -0.01 0.00 -1.53 0.00 0.00 36.38 31.29 3fhi s VAL 255 CO 0.06 -0.28 -0.14 -0.13 -3.33 0.00 0.00 175.10 171.28 3fhi s ARG 256 N -3.10 1.10 -0.05 1.54 0.52 -1.26 -5.14 118.95 112.56 3fhi s ARG 256 Ca 0.61 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 55.33 3fhi s ARG 256 Cb -0.10 -1.07 -0.03 0.00 0.52 0.00 0.00 34.95 34.27 3fhi s ARG 256 CO 0.14 0.29 -0.04 -0.06 0.02 0.00 0.00 175.30 175.65 3fhi s PHE 257 N -0.33 3.02 0.66 -0.53 0.40 -1.26 -5.01 117.98 114.93 3fhi s PHE 257 Ca 0.05 0.08 -0.17 0.00 -0.60 0.00 0.00 56.93 56.28 3fhi s PHE 257 Cb -0.05 -1.71 -0.00 0.00 0.51 0.00 0.00 43.02 41.76 3fhi s PHE 257 CO -0.00 0.40 1.27 -2.14 0.70 0.00 0.00 175.22 175.44 3fhi s PRO 258 N -1.02 2.49 0.55 0.24 0.02 -1.26 -4.92 135.00 131.11 3fhi s PRO 258 Ca 0.14 1.99 0.33 0.00 0.02 0.00 0.00 61.00 63.48 3fhi s PRO 258 Cb -0.11 -1.85 1.57 0.00 0.02 0.00 0.00 34.50 34.14 3fhi s PRO 258 CO 0.04 -1.62 2.08 0.66 -0.33 0.00 0.00 177.00 177.83 3fhi h SER 259 N 0.40 0.00 1.03 2.53 4.64 -2.03 -2.66 113.55 117.46 3fhi h SER 259 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3fhi h SER 259 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3fhi h SER 259 CO 0.52 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.55 3fhi n HIS 260 N -3.31 0.13 -2.03 4.77 1.44 -1.26 -4.85 115.22 110.11 3fhi n HIS 260 Ca -0.01 0.04 -0.42 0.00 -2.01 0.00 0.00 57.72 55.32 3fhi n HIS 260 Cb 0.25 -0.56 -0.03 0.00 0.12 0.00 0.00 29.99 29.76 3fhi n HIS 260 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 3fhi s PHE 261 N -3.02 3.12 0.81 -1.40 0.40 -1.01 -4.99 117.98 111.89 3fhi s PHE 261 Ca 0.13 0.83 -0.12 0.00 -0.60 0.00 0.00 56.93 57.17 3fhi s PHE 261 Cb 0.17 -3.82 0.08 0.00 0.51 0.00 0.00 43.02 39.97 3fhi s PHE 261 CO 0.52 -2.90 1.15 -1.54 0.70 0.00 0.00 175.22 173.16 3fhi s SER 262 N 0.94 3.82 0.23 1.36 1.04 -1.26 -4.82 113.70 115.01 3fhi s SER 262 Ca 0.66 2.15 -0.06 0.00 0.48 0.00 0.00 55.95 59.17 3fhi s SER 262 Cb -0.41 -2.56 0.37 0.00 0.10 0.00 0.00 66.02 63.52 3fhi s SER 262 CO 0.33 -2.51 1.76 0.28 0.98 0.00 0.00 173.24 174.09 3fhi h SER 263 N -1.08 0.39 -0.28 7.02 0.02 -1.98 -1.63 113.55 116.01 3fhi h SER 263 Ca -0.45 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.57 3fhi h SER 263 Cb 1.27 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 3fhi h SER 263 CO 0.47 0.21 0.16 0.44 -1.14 0.00 0.00 176.83 176.96 3fhi h ASP 264 N 0.54 0.34 -0.24 3.07 3.45 -1.98 -1.28 116.42 120.32 3fhi h ASP 264 Ca 0.37 -0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.78 3fhi h ASP 264 Cb 0.45 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.11 3fhi h ASP 264 CO -0.31 0.32 0.08 0.25 -1.57 0.00 0.00 179.24 178.00 3fhi h LEU 265 N 0.33 0.08 -0.52 1.55 5.85 -1.83 -1.02 115.31 119.76 3fhi h LEU 265 Ca 0.10 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.89 3fhi h LEU 265 Cb 0.05 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3fhi h LEU 265 CO -0.02 0.08 0.26 0.11 -0.34 0.00 0.00 178.44 178.53 3fhi h LYS 266 N 0.19 0.49 -0.55 1.25 1.57 -1.09 -0.19 116.57 118.23 3fhi h LYS 266 Ca 0.11 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 3fhi h LYS 266 Cb 0.08 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 3fhi h LYS 266 CO -0.11 0.32 0.31 0.22 -0.57 0.00 0.00 179.45 179.61 3fhi h ASP 267 N 0.50 0.68 -0.46 0.86 3.58 -0.86 0.24 116.42 120.96 3fhi h ASP 267 Ca 0.23 -0.09 0.03 0.00 0.42 0.00 0.00 57.03 57.63 3fhi h ASP 267 Cb 0.15 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 3fhi h ASP 267 CO -0.17 0.57 0.25 0.25 -2.88 0.00 0.00 179.24 177.26 3fhi h LEU 268 N 0.73 0.39 -0.68 2.28 5.85 -0.85 -2.72 115.31 120.32 3fhi h LEU 268 Ca 0.19 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.80 3fhi h LEU 268 Cb 0.04 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3fhi h LEU 268 CO -0.03 0.28 -0.40 -0.07 -0.34 0.00 0.00 178.44 177.87 3fhi h LEU 269 N 0.51 0.59 -1.29 2.25 3.38 -0.09 -1.40 115.31 119.26 3fhi h LEU 269 Ca 0.19 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3fhi h LEU 269 Cb 0.06 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 3fhi h LEU 269 CO -0.11 0.93 0.51 0.03 0.09 0.00 0.00 178.44 179.88 3fhi h ARG 270 N 0.46 0.87 0.00 1.13 3.08 -0.36 0.19 114.38 119.74 3fhi h ARG 270 Ca 0.04 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 3fhi h ARG 270 Cb 0.90 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.74 3fhi h ARG 270 CO 0.08 0.57 -0.87 -0.91 -1.07 0.00 0.00 179.97 177.77 3fhi h ASN 271 N 0.89 0.00 0.17 7.04 4.21 -1.11 -3.11 115.58 123.68 3fhi h ASN 271 Ca 0.32 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.51 3fhi h ASN 271 Cb 0.14 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.35 3fhi h ASN 271 CO -0.10 0.45 -1.61 -0.07 -1.29 0.00 0.00 177.43 174.81 3fhi h LEU 272 N 0.00 0.57 -3.59 1.61 3.38 -1.04 -0.71 115.31 115.53 3fhi h LEU 272 Ca -0.06 -0.92 -0.31 0.00 0.09 0.00 0.00 57.88 56.68 3fhi h LEU 272 Cb 1.40 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.84 3fhi h LEU 272 CO 0.05 1.73 0.34 0.18 0.09 0.00 0.00 178.44 180.82 3fhi n LEU 273 N -3.71 6.30 -4.62 1.67 4.77 0.64 -4.06 117.00 117.99 3fhi n LEU 273 Ca -0.24 -3.30 -0.41 0.00 -0.03 0.00 0.00 56.01 52.03 3fhi n LEU 273 Cb 1.02 -1.10 -0.05 0.00 -2.33 0.00 0.00 43.42 40.95 3fhi n LEU 273 CO 0.49 1.29 0.51 -1.58 -1.33 0.00 0.00 177.39 176.77 3fhi s GLN 274 N -1.49 4.04 0.42 3.23 2.00 -1.17 -4.90 119.66 121.78 3fhi s GLN 274 Ca 0.33 0.59 0.17 0.00 -2.00 0.00 0.00 55.36 54.45 3fhi s GLN 274 Cb 0.24 -3.69 0.94 0.00 0.80 0.00 0.00 33.01 31.30 3fhi s GLN 274 CO -0.03 -0.55 1.90 -0.39 -0.50 0.00 0.00 175.29 175.72 3fhi h VAL 275 N 5.50 1.04 -3.21 1.34 -1.51 -1.89 -3.37 116.25 114.15 3fhi h VAL 275 Ca -0.25 -1.00 -0.61 0.00 -1.23 0.00 0.00 66.70 63.60 3fhi h VAL 275 Cb 1.11 1.57 -0.12 0.00 -2.13 0.00 0.00 31.29 31.71 3fhi h VAL 275 CO 0.83 0.27 0.53 -0.62 -1.23 0.00 0.00 177.57 177.36 3fhi s ASP 276 N -6.71 6.33 0.55 4.19 -1.08 -1.26 -4.79 116.67 113.90 3fhi s ASP 276 Ca -0.03 -0.38 0.25 0.00 -0.52 0.00 0.00 52.55 51.87 3fhi s ASP 276 Cb 0.14 -2.43 1.47 0.00 -1.46 0.00 0.00 42.92 40.65 3fhi s ASP 276 CO 0.68 -1.21 2.05 0.17 0.52 0.00 0.00 175.17 177.39 3fhi h LEU 277 N 10.89 0.00 -0.36 -1.34 -0.00 -1.97 -0.07 115.31 122.45 3fhi h LEU 277 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 3fhi h LEU 277 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 3fhi h LEU 277 CO 1.08 0.00 0.00 0.35 -0.00 0.00 0.00 178.44 179.87 3fhi n THR 278 N -4.16 0.82 0.10 0.15 -2.24 -1.26 -2.61 114.28 105.09 3fhi n THR 278 Ca 0.05 0.18 0.03 0.00 -2.27 0.00 0.00 64.05 62.04 3fhi n THR 278 Cb 0.44 -1.02 0.05 0.00 -2.10 0.00 0.00 70.33 67.69 3fhi n THR 278 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3fhi n LYS 279 N -1.94 1.05 -3.05 -0.78 5.02 -0.06 -4.80 118.16 113.59 3fhi n LYS 279 Ca 0.03 -1.21 -0.39 0.00 -2.02 0.00 0.00 58.31 54.72 3fhi n LYS 279 Cb 0.23 -1.12 -0.06 0.00 -0.02 0.00 0.00 35.03 34.06 3fhi n LYS 279 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3fhi s ARG 280 N -0.68 4.47 0.32 1.97 3.52 -1.07 -4.98 118.95 122.50 3fhi s ARG 280 Ca 0.09 1.05 -0.29 0.00 -0.13 0.00 0.00 55.73 56.44 3fhi s ARG 280 Cb 0.05 -3.23 -0.12 0.00 -1.56 0.00 0.00 34.95 30.09 3fhi s ARG 280 CO 0.07 0.58 1.53 1.19 -0.81 0.00 0.00 175.30 177.87 3fhi n PHE 281 N 1.57 2.84 0.00 5.12 3.01 -0.27 -1.69 117.46 128.04 3fhi n PHE 281 Ca -0.07 0.34 0.00 0.00 1.01 0.00 0.00 57.45 58.74 3fhi n PHE 281 Cb 0.49 -2.56 0.00 0.00 -0.01 0.00 0.00 39.48 37.40 3fhi n PHE 281 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fhi n GLY 282 N 1.50 3.27 0.15 1.37 0.00 -1.24 -4.79 105.19 105.44 3fhi n GLY 282 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.14 3fhi n GLY 282 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3fhi n ASN 283 N 0.00 2.41 -2.01 1.61 5.15 -0.68 -4.12 115.26 117.62 3fhi n ASN 283 Ca 0.00 -2.68 -0.00 0.00 -0.60 0.00 0.00 54.58 51.30 3fhi n ASN 283 Cb 0.00 -0.29 0.00 0.00 -0.53 0.00 0.00 39.78 38.96 3fhi n ASN 283 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3fhi n LEU 284 N -0.95 0.00 -0.23 1.20 4.77 -1.24 -4.87 117.00 115.68 3fhi n LEU 284 Ca 0.11 -0.01 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 3fhi n LEU 284 Cb 0.53 -0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.77 3fhi n LEU 284 CO 0.02 -0.42 0.92 0.50 -1.33 0.00 0.00 177.39 177.08 3fhi h LYS 285 N 0.00 0.24 -0.67 3.23 3.64 -1.96 -0.99 116.57 120.06 3fhi h LYS 285 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3fhi h LYS 285 Cb 0.00 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3fhi h LYS 285 CO 0.00 0.16 0.00 0.09 -2.27 0.00 0.00 179.45 177.43 3fhi n ASN 286 N -5.17 3.88 0.00 4.20 5.03 -1.26 -5.02 115.26 116.93 3fhi n ASN 286 Ca 0.12 -2.13 0.00 0.00 0.87 0.00 0.00 54.58 53.44 3fhi n ASN 286 Cb 0.41 -0.49 0.00 0.00 -1.02 0.00 0.00 39.78 38.68 3fhi n ASN 286 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3fhi n GLY 287 N 1.43 3.08 0.31 7.41 0.00 -0.38 -1.93 105.19 115.12 3fhi n GLY 287 Ca 0.23 0.01 0.20 0.00 0.00 0.00 0.00 46.02 46.47 3fhi n GLY 287 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3fhi h VAL 288 N 0.00 0.03 0.00 1.61 3.04 -1.91 -2.56 116.25 116.45 3fhi h VAL 288 Ca 0.00 -0.22 -0.03 0.00 -1.01 0.00 0.00 66.70 65.44 3fhi h VAL 288 Cb 0.00 1.21 -0.00 0.00 -2.01 0.00 0.00 31.29 30.49 3fhi h VAL 288 CO 0.00 0.00 -0.15 0.78 -1.01 0.00 0.00 177.57 177.20 3fhi h ASN 289 N 0.00 0.00 -0.12 3.17 2.35 -1.78 -0.42 115.58 118.78 3fhi h ASN 289 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3fhi h ASN 289 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 3fhi h ASN 289 CO 0.00 0.15 -0.03 0.44 -1.65 0.00 0.00 177.43 176.34 3fhi h ASP 290 N 0.00 0.34 0.01 5.81 3.45 -1.58 0.73 116.42 125.19 3fhi h ASP 290 Ca -0.00 -0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.38 3fhi h ASP 290 Cb 0.40 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 3fhi h ASP 290 CO 0.02 0.43 -0.09 0.40 -1.57 0.00 0.00 179.24 178.43 3fhi h ILE 291 N 0.36 1.68 -0.08 0.35 2.04 -1.39 -3.14 117.51 117.33 3fhi h ILE 291 Ca 0.08 -2.13 -0.05 0.00 1.00 0.00 0.00 64.86 63.77 3fhi h ILE 291 Cb 0.29 3.11 -0.01 0.00 -0.74 0.00 0.00 36.82 39.48 3fhi h ILE 291 CO 0.01 0.56 -0.17 0.11 0.00 0.00 0.00 178.15 178.66 3fhi h LYS 292 N -0.81 0.13 -0.30 2.37 1.57 -1.05 -2.36 116.57 116.12 3fhi h LYS 292 Ca -0.01 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3fhi h LYS 292 Cb 0.97 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.26 3fhi h LYS 292 CO 0.02 0.31 0.00 0.09 -0.57 0.00 0.00 179.45 179.29 3fhi n ASN 293 N -4.28 2.08 -4.77 0.86 3.02 0.24 -4.78 115.26 107.65 3fhi n ASN 293 Ca -0.01 -1.87 -0.39 0.00 -0.03 0.00 0.00 54.58 52.28 3fhi n ASN 293 Cb 0.27 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.21 3fhi n ASN 293 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 3fhi s HIS 294 N -1.61 3.33 0.37 3.10 2.46 -0.89 -4.92 115.29 117.13 3fhi s HIS 294 Ca 0.31 1.62 0.19 0.00 0.47 0.00 0.00 55.06 57.64 3fhi s HIS 294 Cb 0.17 -3.33 1.17 0.00 -0.13 0.00 0.00 32.58 30.45 3fhi s HIS 294 CO 0.23 -0.92 1.67 0.87 -2.47 0.00 0.00 174.74 174.12 3fhi h LYS 295 N 3.24 0.27 0.00 2.88 1.57 -1.92 0.65 116.57 123.26 3fhi h LYS 295 Ca -0.48 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 3fhi h LYS 295 Cb 1.22 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.46 3fhi h LYS 295 CO 0.65 0.18 -0.14 2.35 -0.57 0.00 0.00 179.45 181.92 3fhi h TRP 296 N 0.28 0.00 -0.61 -1.35 7.01 -1.92 -1.74 115.95 117.62 3fhi h TRP 296 Ca 0.73 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.73 3fhi h TRP 296 Cb 1.86 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.92 3fhi h TRP 296 CO -0.01 0.14 0.00 1.19 -2.79 0.00 0.00 178.44 176.97 3fhi n PHE 297 N -4.02 1.43 -0.14 2.65 3.72 0.21 -4.59 117.46 116.71 3fhi n PHE 297 Ca -0.02 -0.56 0.04 0.00 -0.05 0.00 0.00 57.45 56.86 3fhi n PHE 297 Cb 0.22 -0.24 0.35 0.00 -0.94 0.00 0.00 39.48 38.87 3fhi n PHE 297 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fhi h ALA 298 N 4.06 1.66 -0.02 4.37 0.00 -1.19 0.22 119.26 128.35 3fhi h ALA 298 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3fhi h ALA 298 Cb 1.40 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3fhi h ALA 298 CO 0.23 0.27 0.00 0.25 0.00 0.00 0.00 179.25 180.00 3fhi n THR 299 N -4.46 0.02 -2.93 0.00 -2.24 -1.26 -4.85 114.28 98.55 3fhi n THR 299 Ca 0.08 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.35 3fhi n THR 299 Cb 0.14 -0.13 -0.05 0.00 -2.10 0.00 0.00 70.33 68.19 3fhi n THR 299 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3fhi s THR 300 N -1.98 4.87 -0.67 4.28 2.01 0.06 -4.99 115.64 119.22 3fhi s THR 300 Ca 0.40 1.49 -0.23 0.00 0.31 0.00 0.00 61.69 63.66 3fhi s THR 300 Cb 0.20 -4.08 0.07 0.00 0.01 0.00 0.00 72.50 68.69 3fhi s THR 300 CO 0.32 -0.05 1.00 -0.62 -0.69 0.00 0.00 174.62 174.58 3fhi s ASP 301 N 1.36 6.17 0.21 3.53 3.68 -1.26 -4.93 116.67 125.44 3fhi s ASP 301 Ca 0.33 -0.94 -0.07 0.00 2.13 0.00 0.00 52.55 54.00 3fhi s ASP 301 Cb -0.15 -2.43 0.16 0.00 -1.45 0.00 0.00 42.92 39.04 3fhi s ASP 301 CO 0.08 -1.48 1.70 -0.50 0.13 0.00 0.00 175.17 175.09 3fhi h TRP 302 N 9.61 1.09 -0.29 -5.34 4.06 -1.96 -1.57 115.95 121.56 3fhi h TRP 302 Ca -0.28 -0.16 -0.10 0.00 2.06 0.00 0.00 58.89 60.40 3fhi h TRP 302 Cb 1.07 -0.30 -0.01 0.00 -1.00 0.00 0.00 29.16 28.93 3fhi h TRP 302 CO 0.99 0.94 -0.21 0.82 -3.56 0.00 0.00 178.44 177.42 3fhi h ILE 303 N 0.95 1.30 -0.16 1.49 2.04 -2.00 -2.19 117.51 118.94 3fhi h ILE 303 Ca 0.18 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.67 3fhi h ILE 303 Cb 0.48 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.08 3fhi h ILE 303 CO 0.02 0.43 0.04 0.00 0.00 0.00 0.00 178.15 178.64 3fhi h ALA 304 N 0.73 1.77 -0.09 1.87 0.00 -1.92 0.01 119.26 121.62 3fhi h ALA 304 Ca 0.06 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3fhi h ALA 304 Cb 0.76 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 3fhi h ALA 304 CO 0.06 0.18 -0.05 0.82 0.00 0.00 0.00 179.25 180.26 3fhi h ILE 305 N 0.23 1.33 -0.91 0.00 1.08 -1.14 0.42 117.51 118.53 3fhi h ILE 305 Ca 0.06 -1.10 0.01 0.00 -0.39 0.00 0.00 64.86 63.44 3fhi h ILE 305 Cb 0.09 1.87 -0.05 0.00 -3.07 0.00 0.00 36.82 35.67 3fhi h ILE 305 CO -0.00 0.31 0.60 0.22 -0.69 0.00 0.00 178.15 178.59 3fhi h TYR 306 N -0.18 1.13 0.00 1.37 5.03 -0.81 -0.69 116.97 122.82 3fhi h TYR 306 Ca 0.02 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.36 3fhi h TYR 306 Cb 0.52 -0.38 0.00 0.00 1.55 0.00 0.00 36.73 38.41 3fhi h TYR 306 CO 0.07 0.71 0.00 1.04 -1.32 0.00 0.00 178.16 178.66 3fhi n GLN 307 N -4.46 0.64 -3.32 1.82 6.02 -0.06 -4.91 117.38 113.11 3fhi n GLN 307 Ca 0.10 0.01 -0.21 0.00 -0.01 0.00 0.00 57.00 56.88 3fhi n GLN 307 Cb 0.02 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 29.84 3fhi n GLN 307 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3fhi n ARG 308 N -1.17 -6.36 0.00 -1.09 1.74 -0.27 -4.91 116.66 104.60 3fhi n ARG 308 Ca 0.18 0.78 0.10 0.00 -0.77 0.00 0.00 57.85 58.14 3fhi n ARG 308 Cb 0.18 -5.57 -0.08 0.00 -1.02 0.00 0.00 32.46 25.97 3fhi n ARG 308 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3fhi n LYS 309 N -4.33 0.70 -2.67 5.56 5.02 0.07 -4.91 118.16 117.61 3fhi n LYS 309 Ca -0.03 -0.26 -0.41 0.00 -2.02 0.00 0.00 58.31 55.59 3fhi n LYS 309 Cb 0.57 -1.43 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 3fhi n LYS 309 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3fhi s VAL 310 N -2.72 4.31 0.14 -0.18 1.01 -1.22 -5.00 120.40 116.74 3fhi s VAL 310 Ca 0.10 1.94 -0.31 0.00 0.00 0.00 0.00 61.98 63.71 3fhi s VAL 310 Cb 0.15 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.19 3fhi s VAL 310 CO 0.74 0.31 1.83 1.21 0.00 0.00 0.00 175.10 179.18 3fhi n GLU 311 N 2.67 2.82 -2.55 2.72 2.13 -1.26 -4.97 120.64 122.19 3fhi n GLU 311 Ca 0.02 1.02 -0.40 0.00 0.66 0.00 0.00 57.16 58.47 3fhi n GLU 311 Cb 0.48 -2.92 -0.05 0.00 0.27 0.00 0.00 31.44 29.23 3fhi n GLU 311 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3fhi s ALA 312 N 2.53 3.39 0.07 4.31 0.00 -1.26 -4.92 121.76 125.87 3fhi s ALA 312 Ca 0.81 0.82 0.33 0.00 0.00 0.00 0.00 51.96 53.92 3fhi s ALA 312 Cb -0.48 -3.30 1.48 0.00 0.00 0.00 0.00 23.12 20.83 3fhi s ALA 312 CO 0.36 -0.07 1.98 -1.00 0.00 0.00 0.00 175.76 177.04 3fhi h PRO 313 N 4.02 0.00 -2.51 0.00 0.13 -1.93 -3.42 132.00 128.28 3fhi h PRO 313 Ca -0.46 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 3fhi h PRO 313 Cb 1.21 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.08 3fhi h PRO 313 CO 0.68 0.00 -0.26 0.12 -0.23 0.00 0.00 178.00 178.31 3fhi s PHE 314 N -3.68 -0.72 -0.20 1.56 5.36 -1.26 -5.11 117.98 113.92 3fhi s PHE 314 Ca 0.00 1.48 -0.02 0.00 -0.96 0.00 0.00 56.93 57.43 3fhi s PHE 314 Cb 0.10 0.34 -0.00 0.00 -0.34 0.00 0.00 43.02 43.11 3fhi s PHE 314 CO 0.47 -0.40 -0.10 0.42 -1.46 0.00 0.00 175.22 174.15 3fhi s ILE 315 N 1.69 2.95 0.45 3.12 1.09 -1.26 -4.32 121.20 124.91 3fhi s ILE 315 Ca -0.08 -0.64 -0.25 0.00 -1.10 0.00 0.00 60.65 58.58 3fhi s ILE 315 Cb -0.09 -2.31 -0.08 0.00 -1.06 0.00 0.00 42.46 38.92 3fhi s ILE 315 CO -0.14 0.46 1.38 -2.16 -0.10 0.00 0.00 174.94 174.38 3fhi s PRO 316 N 1.35 3.71 0.02 2.79 0.04 -1.26 -4.96 135.00 136.69 3fhi s PRO 316 Ca 0.04 2.31 -0.30 0.00 0.04 0.00 0.00 61.00 63.09 3fhi s PRO 316 Cb -0.14 -2.64 -0.05 0.00 0.04 0.00 0.00 34.50 31.72 3fhi s PRO 316 CO -0.06 -0.76 1.16 -1.59 0.04 0.00 0.00 177.00 175.79 3fhi s LYS 317 N -2.45 4.44 -0.06 4.56 0.00 -1.26 -4.99 119.74 119.98 3fhi s LYS 317 Ca 0.61 1.68 0.02 0.00 0.00 0.00 0.00 55.97 58.28 3fhi s LYS 317 Cb -0.41 -3.42 0.01 0.00 0.00 0.00 0.00 37.83 34.01 3fhi s LYS 317 CO 0.53 -0.26 -0.11 -0.06 0.00 0.00 0.00 175.35 175.44 3fhi s PHE 318 N 1.31 1.37 -0.72 1.78 0.40 -1.26 -4.81 117.98 116.04 3fhi s PHE 318 Ca 0.57 -0.48 0.02 0.00 -0.60 0.00 0.00 56.93 56.43 3fhi s PHE 318 Cb -0.27 -1.01 0.36 0.00 0.51 0.00 0.00 43.02 42.61 3fhi s PHE 318 CO 0.27 -0.25 1.49 1.63 0.70 0.00 0.00 175.22 179.06 3fhi n LYS 319 N 3.77 3.69 0.00 0.44 4.76 -1.26 -5.02 118.16 124.54 3fhi n LYS 319 Ca -0.23 -4.36 0.00 0.00 -2.87 0.00 0.00 58.31 50.85 3fhi n LYS 319 Cb 0.52 -2.31 0.00 0.00 -1.84 0.00 0.00 35.03 31.40 3fhi n LYS 319 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fhi n GLY 320 N -0.34 0.98 3.77 0.72 0.00 -1.26 -4.79 105.19 104.27 3fhi n GLY 320 Ca 0.43 -1.82 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 3fhi n GLY 320 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fhi s PRO 321 N -2.74 4.03 0.00 1.61 0.04 -1.26 -2.53 135.00 134.15 3fhi s PRO 321 Ca 0.00 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.02 3fhi s PRO 321 Cb 0.00 -2.72 0.00 0.00 0.04 0.00 0.00 34.50 31.82 3fhi s PRO 321 CO 0.00 -0.38 0.00 0.41 0.04 0.00 0.00 177.00 177.07 3fhi n GLY 322 N 0.67 0.78 3.73 0.56 0.00 -1.26 -5.04 105.19 104.63 3fhi n GLY 322 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3fhi n GLY 322 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3fhi s ASP 323 N -2.69 7.09 -0.14 1.61 -1.08 -1.05 -4.94 116.67 115.47 3fhi s ASP 323 Ca 0.00 2.15 0.15 0.00 -0.52 0.00 0.00 52.55 54.33 3fhi s ASP 323 Cb 0.00 -2.60 0.32 0.00 -1.46 0.00 0.00 42.92 39.19 3fhi s ASP 323 CO 0.00 -0.40 1.17 0.35 0.52 0.00 0.00 175.17 176.81 3fhi n THR 324 N 3.04 1.78 0.30 1.71 -2.24 -1.26 -4.81 114.28 112.80 3fhi n THR 324 Ca 0.06 -2.41 0.19 0.00 -2.27 0.00 0.00 64.05 59.62 3fhi n THR 324 Cb 0.45 -0.13 0.85 0.00 -2.10 0.00 0.00 70.33 69.41 3fhi n THR 324 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3fhi h SER 325 N 0.42 0.00 0.02 3.42 4.64 -1.92 -1.53 113.55 118.60 3fhi h SER 325 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3fhi h SER 325 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3fhi h SER 325 CO 0.00 0.00 -0.00 0.59 -0.87 0.00 0.00 176.83 176.55 3fhi n ASN 326 N -3.06 0.42 -4.49 4.97 3.02 -1.26 -4.82 115.26 110.04 3fhi n ASN 326 Ca -0.01 -1.10 -0.31 0.00 -0.03 0.00 0.00 54.58 53.13 3fhi n ASN 326 Cb 0.23 -0.01 -0.12 0.00 -0.61 0.00 0.00 39.78 39.27 3fhi n ASN 326 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3fhi s PHE 327 N -2.03 2.64 0.86 3.10 0.40 -0.58 -4.34 117.98 118.03 3fhi s PHE 327 Ca 0.44 -0.21 -0.10 0.00 -0.60 0.00 0.00 56.93 56.46 3fhi s PHE 327 Cb 0.22 -1.49 0.11 0.00 0.51 0.00 0.00 43.02 42.36 3fhi s PHE 327 CO 0.37 0.28 1.12 -0.51 0.70 0.00 0.00 175.22 177.18 3fhi s ASP 328 N -1.46 3.56 0.09 1.36 -0.00 -1.26 -5.02 116.67 113.93 3fhi s ASP 328 Ca 0.15 2.00 -0.23 0.00 -0.00 0.00 0.00 52.55 54.47 3fhi s ASP 328 Cb -0.11 -2.53 -0.07 0.00 -0.00 0.00 0.00 42.92 40.22 3fhi s ASP 328 CO 0.06 -2.67 0.71 -1.81 -0.00 0.00 0.00 175.17 171.46 3fhi s ASP 329 N -3.00 7.22 0.13 0.27 1.01 -1.26 -4.86 116.67 116.18 3fhi s ASP 329 Ca 0.64 1.45 0.08 0.00 0.71 0.00 0.00 52.55 55.43 3fhi s ASP 329 Cb -0.20 -2.45 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 3fhi s ASP 329 CO 0.57 0.14 -0.19 -0.31 0.21 0.00 0.00 175.17 175.60 3fhi s TYR 330 N -0.66 1.73 0.08 4.23 1.51 -1.26 -5.12 117.35 117.85 3fhi s TYR 330 Ca 0.35 -0.46 -0.31 0.00 -1.01 0.00 0.00 57.07 55.64 3fhi s TYR 330 Cb -0.21 -0.90 -0.07 0.00 -0.11 0.00 0.00 41.96 40.66 3fhi s TYR 330 CO 0.23 0.25 1.43 -1.83 -1.11 0.00 0.00 175.55 174.51 3fhi s GLU 331 N -2.38 4.29 -0.09 -0.62 1.03 -1.26 -4.87 118.70 114.80 3fhi s GLU 331 Ca 0.10 2.08 -0.23 0.00 0.03 0.00 0.00 54.97 56.96 3fhi s GLU 331 Cb -0.07 -3.39 -0.04 0.00 -0.80 0.00 0.00 34.13 29.83 3fhi s GLU 331 CO 0.05 -0.52 0.67 -1.21 -1.33 0.00 0.00 175.26 172.92 3fhi s GLU 332 N 1.68 4.40 0.19 -4.83 0.41 -1.26 -5.02 118.70 114.28 3fhi s GLU 332 Ca 0.66 0.81 0.06 0.00 -0.41 0.00 0.00 54.97 56.08 3fhi s GLU 332 Cb -0.36 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.50 3fhi s GLU 332 CO 0.29 0.04 0.17 -1.83 -0.49 0.00 0.00 175.26 173.44 3fhi s GLU 333 N 0.91 2.94 -0.61 1.61 -1.05 -1.26 -5.10 118.70 116.15 3fhi s GLU 333 Ca 0.35 -0.92 -0.14 0.00 -0.15 0.00 0.00 54.97 54.12 3fhi s GLU 333 Cb -0.17 -2.64 0.15 0.00 -0.44 0.00 0.00 34.13 31.04 3fhi s GLU 333 CO 0.16 0.46 0.54 -1.21 0.95 0.00 0.00 175.26 176.16 3fhi s GLU 334 N -3.37 3.04 -0.62 -4.83 0.41 -1.26 -4.99 118.70 107.09 3fhi s GLU 334 Ca 0.32 -1.95 -0.07 0.00 -0.41 0.00 0.00 54.97 52.86 3fhi s GLU 334 Cb -0.09 -4.25 -0.20 0.00 -1.78 0.00 0.00 34.13 27.81 3fhi s GLU 334 CO 0.24 -1.29 1.73 -0.89 -0.49 0.00 0.00 175.26 174.56 3fhi n ILE 335 N 4.79 0.00 -3.06 -1.63 5.41 -1.26 -4.87 119.36 118.74 3fhi n ILE 335 Ca -0.05 -0.49 -0.39 0.00 1.00 0.00 0.00 62.75 62.82 3fhi n ILE 335 Cb 0.42 -0.14 -0.05 0.00 -0.71 0.00 0.00 39.64 39.15 3fhi n ILE 335 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3fhi s ARG 336 N 6.37 4.43 0.00 0.38 3.00 -1.26 -5.18 118.95 126.69 3fhi s ARG 336 Ca 0.79 0.94 0.00 0.00 0.00 0.00 0.00 55.73 57.46 3fhi s ARG 336 Cb -0.48 -3.36 0.00 0.00 0.00 0.00 0.00 34.95 31.11 3fhi s ARG 336 CO 0.32 0.29 0.00 0.28 0.00 0.00 0.00 175.30 176.19 3fhi n VAL 337 N 2.87 0.00 0.25 3.52 0.31 -1.26 -4.92 118.33 119.10 3fhi n VAL 337 Ca -0.04 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.32 3fhi n VAL 337 Cb 0.51 -0.19 -0.03 0.00 -0.91 0.00 0.00 33.84 33.21 3fhi n VAL 337 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3fhi n ILE 339 N -0.12 0.00 -4.77 2.52 -0.00 -1.26 -5.02 119.36 110.71 3fhi n ILE 339 Ca 0.00 -0.36 -0.33 0.00 -0.00 0.00 0.00 62.75 62.06 3fhi n ILE 339 Cb 0.00 0.98 -0.13 0.00 -0.00 0.00 0.00 39.64 40.49 3fhi n ILE 339 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.55 176.75 3fhi s ASN 340 N -1.57 4.21 -0.26 7.28 0.01 -1.26 -5.08 114.94 118.27 3fhi s ASN 340 Ca 0.02 -0.18 -0.29 0.00 -0.71 0.00 0.00 52.86 51.70 3fhi s ASN 340 Cb 0.04 -1.15 -0.02 0.00 0.41 0.00 0.00 41.25 40.53 3fhi s ASN 340 CO 0.23 0.30 1.60 -0.70 -1.51 0.00 0.00 177.10 177.02 3fhi s GLU 341 N -0.43 3.71 -0.18 -0.60 2.12 -1.26 -4.71 118.70 117.35 3fhi s GLU 341 Ca 0.06 1.53 -0.14 0.00 0.36 0.00 0.00 54.97 56.78 3fhi s GLU 341 Cb -0.12 -4.05 -0.05 0.00 0.26 0.00 0.00 34.13 30.18 3fhi s GLU 341 CO 0.02 -1.39 0.29 0.15 -0.54 0.00 0.00 175.26 173.79 3fhi s LYS 342 N 4.81 4.21 -1.09 4.30 1.02 0.56 -4.56 119.74 128.98 3fhi s LYS 342 Ca 0.71 0.06 -0.02 0.00 0.02 0.00 0.00 55.97 56.73 3fhi s LYS 342 Cb -0.23 -3.47 -0.03 0.00 -0.52 0.00 0.00 37.83 33.59 3fhi s LYS 342 CO 0.30 0.15 0.93 0.00 -0.92 0.00 0.00 175.35 175.80 3fhi h GLY 344 N -1.52 -0.02 1.39 0.00 0.00 -1.94 -3.22 103.07 97.77 3fhi h GLY 344 Ca -0.57 0.01 -0.08 0.00 0.00 0.00 0.00 47.33 46.68 3fhi h GLY 344 CO 0.46 -0.01 -0.08 0.07 0.00 0.00 0.00 176.54 176.98 3fhi h LYS 345 N -0.64 0.73 -1.00 4.80 5.09 -1.98 -2.53 116.57 121.04 3fhi h LYS 345 Ca -0.00 -0.22 0.12 0.00 0.09 0.00 0.00 60.65 60.64 3fhi h LYS 345 Cb 0.61 -0.07 -0.08 0.00 0.10 0.00 0.00 32.23 32.78 3fhi h LYS 345 CO 0.00 0.80 0.63 0.93 -2.09 0.00 0.00 179.45 179.72 3fhi h GLU 346 N 0.67 0.95 -0.16 0.07 3.07 -1.97 -3.11 114.58 114.10 3fhi h GLU 346 Ca 0.12 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 58.87 3fhi h GLU 346 Cb 0.53 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.19 3fhi h GLU 346 CO 0.03 0.63 -0.14 1.19 -1.40 0.00 0.00 179.01 179.32 3fhi n PHE 347 N -4.62 0.52 -0.21 4.33 3.01 -1.06 -4.76 117.46 114.68 3fhi n PHE 347 Ca 0.19 -1.27 -0.02 0.00 1.01 0.00 0.00 57.45 57.36 3fhi n PHE 347 Cb 0.36 -0.31 0.19 0.00 -0.01 0.00 0.00 39.48 39.71 3fhi n PHE 347 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3fhi h THR 348 N 0.91 1.22 0.00 4.37 1.03 -1.39 -1.41 112.91 117.63 3fhi h THR 348 Ca 0.07 -0.59 0.00 0.00 -0.01 0.00 0.00 66.41 65.88 3fhi h THR 348 Cb 1.29 0.28 0.00 0.00 -1.07 0.00 0.00 68.15 68.65 3fhi h THR 348 CO 0.16 0.25 0.00 -0.33 -0.01 0.00 0.00 175.52 175.60 3fhi h GLU 349 N 1.00 0.00 -0.00 0.00 3.07 -1.86 -3.52 114.58 113.27 3fhi h GLU 349 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.11 3fhi h GLU 349 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 3fhi h GLU 349 CO -0.04 0.00 0.00 0.34 -1.40 0.00 0.00 179.01 177.91