#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4tf4 s PRO 2 N 0.00 2.76 0.28 3.49 0.04 -1.25 -4.93 135.00 135.38 4tf4 s PRO 2 Ca 0.00 1.90 -0.02 0.00 0.04 0.00 0.00 61.00 62.91 4tf4 s PRO 2 Cb 0.00 -1.89 0.38 0.00 0.04 0.00 0.00 34.50 33.03 4tf4 s PRO 2 CO 0.00 -1.39 1.84 0.00 0.04 0.00 0.00 177.00 177.49 4tf4 h ALA 3 N 0.66 1.23 -3.12 8.56 0.00 -1.99 -3.43 119.26 121.16 4tf4 h ALA 3 Ca -0.50 -0.18 -0.29 0.00 0.00 0.00 0.00 54.91 53.94 4tf4 h ALA 3 Cb 1.31 -0.25 -0.21 0.00 0.00 0.00 0.00 17.79 18.65 4tf4 h ALA 3 CO 0.54 0.55 -0.74 -0.06 0.00 0.00 0.00 179.25 179.55 4tf4 s PHE 4 N -5.36 0.78 -0.99 0.00 0.08 -1.26 -5.07 117.98 106.15 4tf4 s PHE 4 Ca -0.10 -0.53 -0.23 0.00 0.12 0.00 0.00 56.93 56.19 4tf4 s PHE 4 Cb 0.16 -0.46 0.03 0.00 -0.57 0.00 0.00 43.02 42.18 4tf4 s PHE 4 CO 0.80 -0.06 1.57 1.21 -0.10 0.00 0.00 175.22 178.64 4tf4 s ASN 5 N -1.73 6.17 0.39 1.36 3.84 -1.26 -4.82 114.94 118.89 4tf4 s ASN 5 Ca -0.07 -1.27 0.05 0.00 0.21 0.00 0.00 52.86 51.78 4tf4 s ASN 5 Cb -0.09 -2.57 0.78 0.00 -0.55 0.00 0.00 41.25 38.82 4tf4 s ASN 5 CO 0.00 -1.81 2.03 1.88 -2.79 0.00 0.00 177.10 176.42 4tf4 h TYR 6 N 10.14 0.60 -0.87 0.43 0.05 -1.95 -2.46 116.97 122.91 4tf4 h TYR 6 Ca 0.18 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.95 4tf4 h TYR 6 Cb 1.01 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 38.51 4tf4 h TYR 6 CO 1.27 0.39 0.49 0.00 -1.05 0.00 0.00 178.16 179.26 4tf4 h ALA 7 N 1.69 1.12 -0.06 3.88 0.00 -1.86 -0.31 119.26 123.71 4tf4 h ALA 7 Ca 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 4tf4 h ALA 7 Cb -0.04 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 4tf4 h ALA 7 CO -0.03 0.62 -0.01 1.49 0.00 0.00 0.00 179.25 181.31 4tf4 h GLU 8 N 1.22 0.12 -0.46 0.00 4.81 -1.63 -1.24 114.58 117.39 4tf4 h GLU 8 Ca 0.31 -0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.57 4tf4 h GLU 8 Cb 0.01 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 4tf4 h GLU 8 CO -0.05 0.44 0.09 0.00 -0.73 0.00 0.00 179.01 178.76 4tf4 h ALA 9 N 0.68 0.51 -0.27 2.92 0.00 -1.22 -0.37 119.26 121.52 4tf4 h ALA 9 Ca 0.02 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.03 4tf4 h ALA 9 Cb 0.39 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 4tf4 h ALA 9 CO 0.01 -0.31 0.16 1.25 0.00 0.00 0.00 179.25 180.36 4tf4 h LEU 10 N 0.23 0.27 -1.05 0.00 5.85 -1.02 0.16 115.31 119.75 4tf4 h LEU 10 Ca 0.23 -0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.08 4tf4 h LEU 10 Cb 0.30 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.18 4tf4 h LEU 10 CO -0.30 0.20 0.62 -0.61 -0.34 0.00 0.00 178.44 178.01 4tf4 h GLN 11 N 0.34 0.89 0.02 1.25 4.15 -0.23 -1.24 115.11 120.28 4tf4 h GLN 11 Ca 0.10 -0.05 -0.24 0.00 0.77 0.00 0.00 58.65 59.23 4tf4 h GLN 11 Cb -0.02 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.48 4tf4 h GLN 11 CO -0.04 0.59 -0.99 0.87 -1.93 0.00 0.00 178.83 177.33 4tf4 h LYS 12 N 0.92 0.42 -0.52 1.69 1.57 -0.55 -3.13 116.57 116.96 4tf4 h LYS 12 Ca 0.50 -0.48 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 4tf4 h LYS 12 Cb 0.59 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.98 4tf4 h LYS 12 CO -0.28 1.14 0.17 1.03 -0.57 0.00 0.00 179.45 180.95 4tf4 h SER 13 N 0.22 0.16 -0.69 0.86 0.87 0.19 0.32 113.55 115.48 4tf4 h SER 13 Ca -0.09 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.52 4tf4 h SER 13 Cb 1.64 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 63.62 4tf4 h SER 13 CO 0.17 0.12 0.38 0.24 -0.53 0.00 0.00 176.83 177.21 4tf4 h MET 14 N 0.34 0.98 -0.57 2.24 2.86 -1.44 -2.33 114.93 117.02 4tf4 h MET 14 Ca 0.25 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 4tf4 h MET 14 Cb 0.29 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 4tf4 h MET 14 CO -0.27 0.73 0.25 0.35 1.06 0.00 0.00 176.91 179.03 4tf4 h PHE 15 N 0.99 0.85 -0.19 -0.22 3.57 -0.94 -2.53 116.94 118.47 4tf4 h PHE 15 Ca 0.25 -0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.75 4tf4 h PHE 15 Cb 0.03 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.45 4tf4 h PHE 15 CO 0.01 0.68 -0.25 0.35 -2.23 0.00 0.00 178.31 176.86 4tf4 h PHE 16 N 0.78 -0.66 -0.74 0.41 3.57 -0.66 -0.46 116.94 119.19 4tf4 h PHE 16 Ca 0.19 0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.86 4tf4 h PHE 16 Cb 0.17 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 4tf4 h PHE 16 CO 0.00 -0.33 0.49 1.88 -2.23 0.00 0.00 178.31 178.13 4tf4 h TYR 17 N -0.28 0.51 -0.08 0.41 0.05 -1.15 0.18 116.97 116.61 4tf4 h TYR 17 Ca 0.12 0.01 -0.13 0.00 0.05 0.00 0.00 58.73 58.79 4tf4 h TYR 17 Cb 0.46 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 4tf4 h TYR 17 CO -0.38 0.21 -0.52 1.49 -1.05 0.00 0.00 178.16 177.91 4tf4 h GLU 18 N 0.45 0.23 0.00 4.88 4.81 -0.72 -2.83 114.58 121.39 4tf4 h GLU 18 Ca 0.36 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 4tf4 h GLU 18 Cb 0.76 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 4tf4 h GLU 18 CO -0.12 0.69 -0.03 0.00 -0.73 0.00 0.00 179.01 178.83 4tf4 h ALA 19 N 1.28 1.00 -0.01 2.92 0.00 0.52 -2.83 119.26 122.15 4tf4 h ALA 19 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 4tf4 h ALA 19 Cb 0.98 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 4tf4 h ALA 19 CO 0.08 0.03 -0.09 1.04 0.00 0.00 0.00 179.25 180.32 4tf4 n GLN 20 N -3.12 1.08 -1.83 0.00 1.13 -0.80 -4.95 117.38 108.89 4tf4 n GLN 20 Ca 0.01 -0.49 -0.36 0.00 -1.94 0.00 0.00 57.00 54.23 4tf4 n GLN 20 Cb 0.36 -1.49 0.05 0.00 0.11 0.00 0.00 30.24 29.27 4tf4 n GLN 20 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 4tf4 s ARG 21 N -2.25 2.71 0.19 -1.09 0.52 -1.07 -0.19 118.95 117.77 4tf4 s ARG 21 Ca 0.34 1.84 0.06 0.00 -0.52 0.00 0.00 55.73 57.45 4tf4 s ARG 21 Cb 0.20 -1.89 -0.05 0.00 0.52 0.00 0.00 34.95 33.73 4tf4 s ARG 21 CO 0.42 -1.42 -0.10 0.45 0.02 0.00 0.00 175.30 174.67 4tf4 s SER 22 N -1.69 2.17 0.00 0.23 0.15 -0.79 -4.77 113.70 109.00 4tf4 s SER 22 Ca 0.77 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 56.37 4tf4 s SER 22 Cb -0.31 -0.07 0.00 0.00 -1.71 0.00 0.00 66.02 63.93 4tf4 s SER 22 CO 0.37 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.13 4tf4 n GLY 23 N -0.32 -1.77 3.59 9.45 0.00 -0.22 -3.38 105.19 112.55 4tf4 n GLY 23 Ca -0.08 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 4tf4 n GLY 23 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 4tf4 s LYS 24 N 0.00 3.60 0.42 1.61 2.20 -1.26 -2.95 119.74 123.37 4tf4 s LYS 24 Ca 0.00 0.58 -0.25 0.00 -0.36 0.00 0.00 55.97 55.94 4tf4 s LYS 24 Cb 0.00 -3.98 -0.08 0.00 -1.51 0.00 0.00 37.83 32.26 4tf4 s LYS 24 CO 0.00 -1.55 1.20 -0.51 -0.36 0.00 0.00 175.35 174.13 4tf4 s LEU 25 N 4.96 4.13 1.05 5.43 1.43 -1.26 -5.03 118.68 129.40 4tf4 s LEU 25 Ca 0.51 2.40 -0.12 0.00 -1.03 0.00 0.00 54.13 55.88 4tf4 s LEU 25 Cb -0.09 -4.07 0.22 0.00 0.03 0.00 0.00 46.19 42.28 4tf4 s LEU 25 CO 0.30 -0.80 1.07 -2.84 0.23 0.00 0.00 176.35 174.31 4tf4 s PRO 26 N -2.42 -0.01 0.29 1.29 0.02 -1.26 -4.96 135.00 127.95 4tf4 s PRO 26 Ca 0.59 0.66 0.04 0.00 0.02 0.00 0.00 61.00 62.31 4tf4 s PRO 26 Cb -0.32 -1.67 0.44 0.00 0.02 0.00 0.00 34.50 32.97 4tf4 s PRO 26 CO 0.39 -3.06 1.72 0.93 -0.33 0.00 0.00 177.00 176.65 4tf4 h GLU 27 N -2.14 0.40 0.00 5.54 4.39 -2.06 -2.93 114.58 117.78 4tf4 h GLU 27 Ca -0.57 -0.16 0.00 0.00 0.34 0.00 0.00 59.36 58.98 4tf4 h GLU 27 Cb 1.33 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 4tf4 h GLU 27 CO 0.55 0.66 0.00 0.27 -1.16 0.00 0.00 179.01 179.33 4tf4 n ASN 28 N -4.10 0.00 -4.65 1.42 0.23 -1.26 -4.93 115.26 101.97 4tf4 n ASN 28 Ca -0.01 -1.39 -0.62 0.00 -0.53 0.00 0.00 54.58 52.04 4tf4 n ASN 28 Cb 0.43 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.04 4tf4 n ASN 28 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 4tf4 n ASN 29 N -0.70 1.11 0.13 0.53 5.15 -1.11 -4.87 115.26 115.50 4tf4 n ASN 29 Ca 0.09 1.15 0.12 0.00 -0.60 0.00 0.00 54.58 55.33 4tf4 n ASN 29 Cb 0.04 -0.97 0.05 0.00 -0.53 0.00 0.00 39.78 38.37 4tf4 n ASN 29 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 4tf4 h ARG 30 N 4.76 0.00 -4.70 1.20 3.08 -1.93 -3.43 114.38 113.37 4tf4 h ARG 30 Ca -0.47 0.00 -0.71 0.00 0.07 0.00 0.00 59.98 58.88 4tf4 h ARG 30 Cb 1.37 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.23 4tf4 h ARG 30 CO 0.86 0.00 0.27 0.08 -1.07 0.00 0.00 179.97 180.11 4tf4 s VAL 31 N -3.32 4.86 0.60 2.04 1.01 -1.26 -4.86 120.40 119.48 4tf4 s VAL 31 Ca 0.02 -1.23 0.33 0.00 0.00 0.00 0.00 61.98 61.09 4tf4 s VAL 31 Cb 0.08 -4.55 0.37 0.00 0.00 0.00 0.00 36.38 32.28 4tf4 s VAL 31 CO 0.76 -1.21 2.28 0.77 0.00 0.00 0.00 175.10 177.69 4tf4 h SER 32 N 8.98 0.00 -0.44 3.32 4.64 -1.95 -1.97 113.55 126.13 4tf4 h SER 32 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 4tf4 h SER 32 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 4tf4 h SER 32 CO 1.07 0.00 0.00 -2.67 -0.87 0.00 0.00 176.83 174.36 4tf4 n TRP 33 N -3.70 0.58 -4.77 4.77 4.27 -1.26 -3.84 117.44 113.50 4tf4 n TRP 33 Ca -0.03 -0.29 -0.33 0.00 -3.89 0.00 0.00 57.50 52.96 4tf4 n TRP 33 Cb 0.08 0.00 -0.14 0.00 -1.36 0.00 0.00 31.31 29.89 4tf4 n TRP 33 CO 0.00 0.00 0.00 1.03 -2.29 0.00 0.00 177.69 176.43 4tf4 s ARG 34 N -1.42 3.25 0.24 -2.67 1.81 -0.74 -4.46 118.95 114.96 4tf4 s ARG 34 Ca 0.29 -0.67 0.01 0.00 -1.72 0.00 0.00 55.73 53.64 4tf4 s ARG 34 Cb 0.15 -2.61 -0.00 0.00 -0.45 0.00 0.00 34.95 32.04 4tf4 s ARG 34 CO 0.20 0.29 0.03 0.41 -0.68 0.00 0.00 175.30 175.55 4tf4 n GLY 35 N 3.29 3.80 3.76 -3.53 0.00 -1.26 -4.85 105.19 106.40 4tf4 n GLY 35 Ca -0.18 -2.18 -0.37 0.00 0.00 0.00 0.00 46.02 43.29 4tf4 n GLY 35 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4tf4 s ASP 36 N -2.36 5.68 0.17 1.61 1.01 -1.26 -4.79 116.67 116.73 4tf4 s ASP 36 Ca 0.04 2.45 -0.23 0.00 0.71 0.00 0.00 52.55 55.52 4tf4 s ASP 36 Cb 0.00 -2.61 0.07 0.00 1.01 0.00 0.00 42.92 41.39 4tf4 s ASP 36 CO 0.03 -1.27 0.63 -0.94 0.21 0.00 0.00 175.17 173.84 4tf4 s SER 37 N -1.31 -0.52 -1.50 0.27 1.04 -1.15 -4.45 113.70 106.08 4tf4 s SER 37 Ca 0.69 -0.08 -0.12 0.00 0.48 0.00 0.00 55.95 56.92 4tf4 s SER 37 Cb -0.32 0.60 0.07 0.00 0.10 0.00 0.00 66.02 66.47 4tf4 s SER 37 CO 0.38 -1.00 0.96 0.61 0.98 0.00 0.00 173.24 175.17 4tf4 n GLY 38 N -0.38 -0.47 0.17 7.32 0.00 -1.26 -1.05 105.19 109.51 4tf4 n GLY 38 Ca -0.15 0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.19 4tf4 n GLY 38 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 4tf4 h LEU 39 N -2.09 0.00 -3.37 0.99 3.38 -1.92 -3.02 115.31 109.28 4tf4 h LEU 39 Ca -0.58 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 4tf4 h LEU 39 Cb 1.37 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.09 4tf4 h LEU 39 CO 0.66 0.00 0.03 0.59 0.09 0.00 0.00 178.44 179.80 4tf4 n ASN 40 N -2.49 3.95 -4.68 -0.43 4.13 -1.26 -4.93 115.26 109.56 4tf4 n ASN 40 Ca 0.02 -3.16 -0.42 0.00 1.68 0.00 0.00 54.58 52.70 4tf4 n ASN 40 Cb 0.29 -0.60 -0.03 0.00 -1.54 0.00 0.00 39.78 37.90 4tf4 n ASN 40 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 4tf4 s ASP 41 N -1.81 6.68 0.00 6.41 1.11 -1.14 -2.15 116.67 125.76 4tf4 s ASP 41 Ca 0.45 2.33 0.00 0.00 0.18 0.00 0.00 52.55 55.52 4tf4 s ASP 41 Cb 0.37 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.81 4tf4 s ASP 41 CO 0.09 -0.86 0.00 0.61 1.18 0.00 0.00 175.17 176.19 4tf4 n GLY 42 N 3.94 2.05 0.30 0.21 0.00 -1.26 -1.03 105.19 109.40 4tf4 n GLY 42 Ca 0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 4tf4 n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4tf4 h ALA 43 N 0.00 1.28 -0.15 4.61 0.00 -1.36 0.21 119.26 123.85 4tf4 h ALA 43 Ca 0.00 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 4tf4 h ALA 43 Cb 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 4tf4 h ALA 43 CO 0.00 -0.20 0.24 0.38 0.00 0.00 0.00 179.25 179.67 4tf4 h ASP 44 N 0.51 0.00 -0.07 0.00 2.03 -1.89 0.16 116.42 117.16 4tf4 h ASP 44 Ca 0.48 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.78 4tf4 h ASP 44 Cb 0.78 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.28 4tf4 h ASP 44 CO -0.43 0.00 -0.00 1.33 -1.03 0.00 0.00 179.24 179.11 4tf4 n VAL 45 N -3.50 2.01 -2.40 4.15 0.24 -0.06 -4.98 118.33 113.79 4tf4 n VAL 45 Ca 0.01 -2.16 -0.18 0.00 -2.04 0.00 0.00 64.34 59.97 4tf4 n VAL 45 Cb 0.35 -0.25 -0.01 0.00 -1.47 0.00 0.00 33.84 32.46 4tf4 n VAL 45 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 4tf4 n GLY 46 N -1.17 -0.46 3.38 7.63 0.00 0.54 -4.98 105.19 110.14 4tf4 n GLY 46 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 4tf4 n GLY 46 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4tf4 s LEU 47 N -5.89 2.55 -0.44 0.99 1.43 -0.46 -4.97 118.68 111.89 4tf4 s LEU 47 Ca 0.00 -1.06 -0.16 0.00 -1.03 0.00 0.00 54.13 51.88 4tf4 s LEU 47 Cb 0.00 -0.75 0.04 0.00 0.03 0.00 0.00 46.19 45.51 4tf4 s LEU 47 CO 0.00 -0.17 0.40 -0.62 0.23 0.00 0.00 176.35 176.20 4tf4 s ASP 48 N -3.38 6.16 -0.24 2.29 2.15 -1.26 -3.08 116.67 119.31 4tf4 s ASP 48 Ca 0.25 -0.96 0.10 0.00 0.43 0.00 0.00 52.55 52.37 4tf4 s ASP 48 Cb -0.01 -2.20 0.44 0.00 -0.30 0.00 0.00 42.92 40.85 4tf4 s ASP 48 CO 0.09 -0.60 1.20 0.18 -0.17 0.00 0.00 175.17 175.88 4tf4 n LEU 49 N 5.41 3.52 -4.84 -1.34 4.77 -0.20 -4.76 117.00 119.56 4tf4 n LEU 49 Ca -0.10 -4.16 -0.32 0.00 -0.03 0.00 0.00 56.01 51.40 4tf4 n LEU 49 Cb 0.46 -0.41 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 4tf4 n LEU 49 CO 0.46 1.65 0.58 0.42 -1.33 0.00 0.00 177.39 179.17 4tf4 s THR 50 N -3.69 4.56 0.00 -5.08 -4.23 -1.25 -4.69 115.64 101.26 4tf4 s THR 50 Ca 0.43 1.14 0.00 0.00 -1.18 0.00 0.00 61.69 62.08 4tf4 s THR 50 Cb 0.39 -3.67 0.00 0.00 1.34 0.00 0.00 72.50 70.56 4tf4 s THR 50 CO -0.03 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 4tf4 n GLY 51 N -1.03 -0.62 7.00 3.99 0.00 -1.22 -4.86 105.19 108.45 4tf4 n GLY 51 Ca 0.05 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.91 4tf4 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4tf4 n GLY 52 N 0.00 -1.61 3.23 -0.02 0.00 -1.26 -4.43 105.19 101.10 4tf4 n GLY 52 Ca 0.00 -1.33 -0.25 0.00 0.00 0.00 0.00 46.02 44.44 4tf4 n GLY 52 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 4tf4 s TRP 53 N 0.00 1.76 0.14 1.61 0.51 -1.26 -1.89 118.94 119.81 4tf4 s TRP 53 Ca 0.00 -0.36 -0.30 0.00 -2.12 0.00 0.00 56.10 53.32 4tf4 s TRP 53 Cb 0.00 -1.07 -0.07 0.00 -0.81 0.00 0.00 33.47 31.52 4tf4 s TRP 53 CO 0.00 0.05 1.09 0.71 -0.51 0.00 0.00 176.95 178.30 4tf4 s TYR 54 N -0.70 3.60 0.09 -1.98 2.02 0.74 -4.66 117.35 116.46 4tf4 s TYR 54 Ca 0.07 1.58 -0.31 0.00 -0.37 0.00 0.00 57.07 58.04 4tf4 s TYR 54 Cb -0.08 -3.27 -0.15 0.00 -0.40 0.00 0.00 41.96 38.06 4tf4 s TYR 54 CO 0.01 -0.60 1.63 0.22 -1.57 0.00 0.00 175.55 175.24 4tf4 h ASP 55 N 5.50 -0.80 0.00 2.29 3.58 -1.77 -3.43 116.42 121.80 4tf4 h ASP 55 Ca -0.44 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.07 4tf4 h ASP 55 Cb 1.21 0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.51 4tf4 h ASP 55 CO 0.74 -0.47 0.00 0.00 -2.88 0.00 0.00 179.24 176.63 4tf4 n ALA 56 N -2.55 0.00 1.02 -0.78 0.00 -1.26 -1.45 120.51 115.49 4tf4 n ALA 56 Ca -0.11 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.46 4tf4 n ALA 56 Cb 0.34 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.15 4tf4 n ALA 56 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4tf4 n GLY 57 N 0.43 -1.29 2.32 0.00 0.00 -1.24 -4.81 105.19 100.61 4tf4 n GLY 57 Ca 0.00 -0.28 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 4tf4 n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 4tf4 n ASP 58 N -1.46 0.85 -0.15 1.61 5.75 -1.26 -2.09 116.55 119.80 4tf4 n ASP 58 Ca 0.06 -1.70 0.02 0.00 -0.01 0.00 0.00 54.79 53.15 4tf4 n ASP 58 Cb 0.33 -0.37 0.03 0.00 -1.03 0.00 0.00 41.12 40.08 4tf4 n ASP 58 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 4tf4 n HIS 59 N -2.21 0.07 -2.57 2.11 8.25 -1.26 -4.45 115.22 115.16 4tf4 n HIS 59 Ca 0.10 -0.27 -0.41 0.00 -0.26 0.00 0.00 57.72 56.87 4tf4 n HIS 59 Cb 0.35 -0.02 -0.04 0.00 1.12 0.00 0.00 29.99 31.40 4tf4 n HIS 59 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 4tf4 s VAL 60 N -0.66 4.01 -0.95 1.59 1.01 -1.26 -4.84 120.40 119.29 4tf4 s VAL 60 Ca 0.05 1.73 -0.16 0.00 0.00 0.00 0.00 61.98 63.60 4tf4 s VAL 60 Cb 0.03 -4.10 0.17 0.00 0.00 0.00 0.00 36.38 32.47 4tf4 s VAL 60 CO 0.04 0.29 1.06 -0.54 0.00 0.00 0.00 175.10 175.96 4tf4 s LYS 61 N -0.32 3.70 -0.36 2.72 1.02 -0.81 -3.25 119.74 122.44 4tf4 s LYS 61 Ca 0.49 -2.14 -0.28 0.00 0.02 0.00 0.00 55.97 54.06 4tf4 s LYS 61 Cb -0.28 -4.78 0.02 0.00 -0.52 0.00 0.00 37.83 32.27 4tf4 s LYS 61 CO 0.34 -1.61 1.01 -0.06 -0.92 0.00 0.00 175.35 174.11 4tf4 s PHE 62 N 1.63 3.08 0.26 3.18 0.08 -1.26 -2.89 117.98 122.06 4tf4 s PHE 62 Ca 0.30 0.95 -0.03 0.00 0.12 0.00 0.00 56.93 58.28 4tf4 s PHE 62 Cb -0.06 -3.75 0.34 0.00 -0.57 0.00 0.00 43.02 38.98 4tf4 s PHE 62 CO -0.08 -0.84 1.80 0.78 -0.10 0.00 0.00 175.22 176.78 4tf4 h GLY 63 N 10.20 0.96 0.60 4.36 0.00 -0.81 -2.75 103.07 115.62 4tf4 h GLY 63 Ca -0.22 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.52 4tf4 h GLY 63 CO 1.02 0.53 -0.41 -2.75 0.00 0.00 0.00 176.54 174.92 4tf4 h PHE 64 N 0.86 -1.12 0.00 5.60 3.57 -1.92 -1.20 116.94 122.73 4tf4 h PHE 64 Ca 0.19 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 4tf4 h PHE 64 Cb 0.31 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 4tf4 h PHE 64 CO 0.02 -0.60 -0.23 -1.00 -2.23 0.00 0.00 178.31 174.27 4tf4 h PRO 65 N -0.96 0.00 -0.41 6.41 0.13 -1.86 -2.28 132.00 133.02 4tf4 h PRO 65 Ca -0.08 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.94 4tf4 h PRO 65 Cb 0.79 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 4tf4 h PRO 65 CO 0.05 0.23 -0.21 1.98 -0.23 0.00 0.00 178.00 179.82 4tf4 h MET 66 N 0.00 0.82 -0.20 0.86 4.05 -1.36 -1.01 114.93 118.08 4tf4 h MET 66 Ca -0.00 -0.33 -0.10 0.00 -0.28 0.00 0.00 59.70 59.00 4tf4 h MET 66 Cb 0.63 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.38 4tf4 h MET 66 CO 0.03 0.95 -0.25 0.00 0.23 0.00 0.00 176.91 177.88 4tf4 h ALA 67 N 1.05 0.30 -0.19 0.39 0.00 -0.90 -2.82 119.26 117.09 4tf4 h ALA 67 Ca 0.10 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.65 4tf4 h ALA 67 Cb 0.73 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 4tf4 h ALA 67 CO 0.06 0.27 0.06 0.35 0.00 0.00 0.00 179.25 179.99 4tf4 h PHE 68 N 0.19 0.11 -0.50 0.00 3.57 -1.30 -1.71 116.94 117.30 4tf4 h PHE 68 Ca 0.03 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.63 4tf4 h PHE 68 Cb 0.81 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.44 4tf4 h PHE 68 CO 0.08 0.06 0.01 1.15 -2.23 0.00 0.00 178.31 177.38 4tf4 h THR 69 N 0.15 0.61 -0.50 4.41 2.02 -1.21 -0.77 112.91 117.63 4tf4 h THR 69 Ca 0.08 -0.04 0.07 0.00 0.77 0.00 0.00 66.41 67.29 4tf4 h THR 69 Cb 0.05 0.48 -0.06 0.00 -1.74 0.00 0.00 68.15 66.87 4tf4 h THR 69 CO -0.08 0.02 0.15 0.00 0.37 0.00 0.00 175.52 175.98 4tf4 h ALA 70 N 1.45 0.59 -0.45 6.16 0.00 -1.14 0.28 119.26 126.14 4tf4 h ALA 70 Ca 0.26 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 4tf4 h ALA 70 Cb 0.38 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 4tf4 h ALA 70 CO -0.42 -0.25 0.18 1.15 0.00 0.00 0.00 179.25 179.92 4tf4 h THR 71 N 0.31 1.20 -0.71 0.00 2.02 -0.39 -0.52 112.91 114.81 4tf4 h THR 71 Ca 0.24 -0.63 -0.07 0.00 0.77 0.00 0.00 66.41 66.73 4tf4 h THR 71 Cb 0.28 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 4tf4 h THR 71 CO -0.27 0.23 0.17 0.24 0.37 0.00 0.00 175.52 176.27 4tf4 h MET 72 N 0.59 1.14 -0.32 6.66 2.86 -0.61 0.15 114.93 125.40 4tf4 h MET 72 Ca 0.15 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 4tf4 h MET 72 Cb 0.19 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 4tf4 h MET 72 CO -0.01 1.00 0.08 -0.07 1.06 0.00 0.00 176.91 178.97 4tf4 h LEU 73 N 1.08 0.49 -0.05 1.22 3.38 -0.76 -1.78 115.31 118.88 4tf4 h LEU 73 Ca 0.22 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 4tf4 h LEU 73 Cb 0.37 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 4tf4 h LEU 73 CO 0.00 0.59 0.02 0.00 0.09 0.00 0.00 178.44 179.14 4tf4 h ALA 74 N 0.91 0.07 -0.48 1.53 0.00 -0.89 -2.86 119.26 117.55 4tf4 h ALA 74 Ca 0.10 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.01 4tf4 h ALA 74 Cb 0.29 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.96 4tf4 h ALA 74 CO 0.00 -0.35 -0.36 2.35 0.00 0.00 0.00 179.25 180.89 4tf4 h TRP 75 N -0.06 -1.01 -0.55 0.00 7.01 -0.49 0.13 115.95 120.97 4tf4 h TRP 75 Ca 0.02 0.07 0.08 0.00 2.11 0.00 0.00 58.89 61.16 4tf4 h TRP 75 Cb 0.15 0.51 -0.03 0.00 -2.10 0.00 0.00 29.16 27.69 4tf4 h TRP 75 CO -0.02 -0.40 0.37 0.78 -2.79 0.00 0.00 178.44 176.38 4tf4 h GLY 76 N -0.23 0.56 2.00 2.65 0.00 -1.28 0.50 103.07 107.26 4tf4 h GLY 76 Ca 0.19 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 4tf4 h GLY 76 CO -0.60 0.12 -0.51 0.00 0.00 0.00 0.00 176.54 175.54 4tf4 h ALA 77 N 1.71 0.89 0.16 3.60 0.00 -0.58 -0.17 119.26 124.88 4tf4 h ALA 77 Ca 0.25 -0.46 -0.31 0.00 0.00 0.00 0.00 54.91 54.39 4tf4 h ALA 77 Cb 0.43 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.17 4tf4 h ALA 77 CO -0.07 0.64 -1.31 0.82 0.00 0.00 0.00 179.25 179.33 4tf4 h ILE 78 N 0.00 1.32 0.05 0.00 2.04 0.40 -2.61 117.51 118.71 4tf4 h ILE 78 Ca -0.01 -2.63 -0.00 0.00 1.00 0.00 0.00 64.86 63.22 4tf4 h ILE 78 Cb 1.09 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 40.01 4tf4 h ILE 78 CO 0.07 0.79 -0.02 -0.33 0.00 0.00 0.00 178.15 178.65 4tf4 h GLU 79 N 0.20 -0.06 -2.24 2.37 4.39 -0.86 -3.38 114.58 115.00 4tf4 h GLU 79 Ca -0.20 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.92 4tf4 h GLU 79 Cb 1.99 0.01 -0.41 0.00 -0.10 0.00 0.00 28.75 30.25 4tf4 h GLU 79 CO 0.24 0.32 -0.80 0.45 -1.16 0.00 0.00 179.01 178.06 4tf4 n SER 80 N -4.93 2.08 0.19 1.42 2.88 -0.09 -4.89 113.62 110.28 4tf4 n SER 80 Ca -0.08 -3.07 0.06 0.00 -1.33 0.00 0.00 58.87 54.45 4tf4 n SER 80 Cb 0.22 -0.66 0.56 0.00 -0.75 0.00 0.00 64.21 63.58 4tf4 n SER 80 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 4tf4 h PRO 81 N 4.37 0.13 -0.81 -1.46 0.13 -1.65 -2.36 132.00 130.35 4tf4 h PRO 81 Ca 0.16 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 4tf4 h PRO 81 Cb 0.77 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.83 4tf4 h PRO 81 CO 0.65 0.13 0.44 0.93 -0.23 0.00 0.00 178.00 179.92 4tf4 h GLU 82 N 0.13 1.12 -0.83 0.86 4.39 -1.90 -1.03 114.58 117.33 4tf4 h GLU 82 Ca 0.03 -0.13 0.02 0.00 0.34 0.00 0.00 59.36 59.62 4tf4 h GLU 82 Cb 0.06 -0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 28.45 4tf4 h GLU 82 CO -0.00 0.83 0.54 0.78 -1.16 0.00 0.00 179.01 180.00 4tf4 h GLY 83 N 1.16 1.18 1.82 -3.84 0.00 -1.56 0.14 103.07 101.96 4tf4 h GLY 83 Ca 0.28 -0.42 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 4tf4 h GLY 83 CO -0.05 0.39 -0.60 -0.97 0.00 0.00 0.00 176.54 175.32 4tf4 h TYR 84 N 1.08 0.24 0.19 5.60 0.05 -1.43 -2.65 116.97 120.04 4tf4 h TYR 84 Ca 0.31 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 59.00 4tf4 h TYR 84 Cb -0.07 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.63 4tf4 h TYR 84 CO -0.02 0.74 -0.09 0.82 -1.05 0.00 0.00 178.16 178.56 4tf4 h ILE 85 N 0.14 0.90 -0.23 -2.88 2.04 -0.51 0.21 117.51 117.18 4tf4 h ILE 85 Ca -0.01 -0.88 0.05 0.00 1.00 0.00 0.00 64.86 65.03 4tf4 h ILE 85 Cb 1.09 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 4tf4 h ILE 85 CO 0.09 0.19 -0.12 0.03 0.00 0.00 0.00 178.15 178.34 4tf4 h ARG 86 N -0.72 -0.09 0.00 2.37 3.08 -0.78 -0.31 114.38 117.93 4tf4 h ARG 86 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 4tf4 h ARG 86 Cb 0.50 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.57 4tf4 h ARG 86 CO 0.04 -0.06 0.00 -1.13 -1.07 0.00 0.00 179.97 177.75 4tf4 n SER 87 N -5.28 0.00 -1.18 7.04 3.41 -1.00 -4.84 113.62 111.76 4tf4 n SER 87 Ca -0.01 -0.28 -0.13 0.00 -0.26 0.00 0.00 58.87 58.19 4tf4 n SER 87 Cb 0.20 -0.14 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 4tf4 n SER 87 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4tf4 n GLY 88 N 0.19 0.83 0.28 5.00 0.00 -0.13 -4.53 105.19 106.83 4tf4 n GLY 88 Ca 0.11 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.85 4tf4 n GLY 88 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4tf4 n GLN 89 N -2.49 1.06 -0.30 1.61 1.13 0.20 -4.54 117.38 114.06 4tf4 n GLN 89 Ca -0.14 -0.58 0.11 0.00 -1.94 0.00 0.00 57.00 54.45 4tf4 n GLN 89 Cb 0.50 -1.42 0.28 0.00 0.11 0.00 0.00 30.24 29.71 4tf4 n GLN 89 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 4tf4 h MET 90 N 1.38 0.41 -0.18 -1.09 1.85 -1.02 0.13 114.93 116.41 4tf4 h MET 90 Ca 0.00 -0.02 -0.06 0.00 -0.61 0.00 0.00 59.70 59.00 4tf4 h MET 90 Cb 0.60 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 32.53 4tf4 h MET 90 CO 0.00 0.27 -0.17 -1.00 -0.40 0.00 0.00 176.91 175.60 4tf4 h PRO 91 N 0.42 0.30 -0.04 0.39 0.13 -1.87 -2.13 132.00 129.20 4tf4 h PRO 91 Ca 0.53 -0.08 -0.24 0.00 -0.87 0.00 0.00 66.00 65.34 4tf4 h PRO 91 Cb 0.95 -0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.06 4tf4 h PRO 91 CO -0.50 0.47 -0.92 1.88 -0.23 0.00 0.00 178.00 178.70 4tf4 h TYR 92 N 0.28 0.87 0.09 1.56 0.05 -1.34 -1.64 116.97 116.85 4tf4 h TYR 92 Ca 0.05 -0.44 -0.00 0.00 0.05 0.00 0.00 58.73 58.38 4tf4 h TYR 92 Cb 0.48 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.11 4tf4 h TYR 92 CO 0.01 1.27 -0.04 1.25 -1.05 0.00 0.00 178.16 179.59 4tf4 h LEU 93 N 0.37 -0.10 -1.23 3.88 5.85 -0.96 0.14 115.31 123.26 4tf4 h LEU 93 Ca -0.09 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.61 4tf4 h LEU 93 Cb 1.55 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 42.57 4tf4 h LEU 93 CO 0.17 -0.02 0.53 0.11 -0.34 0.00 0.00 178.44 178.89 4tf4 h LYS 94 N -0.17 1.00 -0.39 1.25 1.57 -1.42 0.42 116.57 118.83 4tf4 h LYS 94 Ca -0.01 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 4tf4 h LYS 94 Cb 0.14 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 4tf4 h LYS 94 CO 0.02 0.66 0.08 0.22 -0.57 0.00 0.00 179.45 179.86 4tf4 h ASP 95 N 1.03 0.61 -0.14 0.86 3.58 -0.81 0.66 116.42 122.22 4tf4 h ASP 95 Ca 0.31 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.48 4tf4 h ASP 95 Cb -0.03 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 40.85 4tf4 h ASP 95 CO -0.08 0.70 -0.03 0.78 -2.88 0.00 0.00 179.24 177.73 4tf4 h ASN 96 N 0.49 0.28 -0.61 2.28 2.35 -0.18 -1.80 115.58 118.39 4tf4 h ASN 96 Ca 0.12 -0.37 -0.02 0.00 -0.55 0.00 0.00 56.30 55.48 4tf4 h ASN 96 Cb 0.34 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.61 4tf4 h ASN 96 CO 0.01 0.58 0.32 -0.07 -1.65 0.00 0.00 177.43 176.61 4tf4 h LEU 97 N -0.03 0.80 -0.69 1.61 3.38 -0.89 -1.66 115.31 117.83 4tf4 h LEU 97 Ca 0.04 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 4tf4 h LEU 97 Cb 0.46 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 4tf4 h LEU 97 CO 0.01 0.67 0.16 -0.09 0.09 0.00 0.00 178.44 179.29 4tf4 h ARG 98 N 0.89 1.11 0.35 1.13 2.43 -0.69 -1.29 114.38 118.31 4tf4 h ARG 98 Ca 0.22 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 4tf4 h ARG 98 Cb 0.07 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 4tf4 h ARG 98 CO -0.03 0.99 -0.36 2.35 -1.51 0.00 0.00 179.97 181.41 4tf4 h TRP 99 N 1.04 -0.97 -0.14 2.20 2.91 -0.42 -0.61 115.95 119.97 4tf4 h TRP 99 Ca 0.22 0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.16 4tf4 h TRP 99 Cb 0.38 0.38 -0.01 0.00 -0.51 0.00 0.00 29.16 29.40 4tf4 h TRP 99 CO 0.03 -0.50 -0.26 -0.24 -1.03 0.00 0.00 178.44 176.43 4tf4 h VAL 100 N -0.73 1.25 -0.02 2.65 3.04 -1.43 -2.90 116.25 118.10 4tf4 h VAL 100 Ca -0.02 -1.16 -0.14 0.00 -1.01 0.00 0.00 66.70 64.37 4tf4 h VAL 100 Cb 0.66 1.43 -0.02 0.00 -2.01 0.00 0.00 31.29 31.36 4tf4 h VAL 100 CO -0.07 0.35 -0.63 0.78 -1.01 0.00 0.00 177.57 177.00 4tf4 h ASN 101 N 0.24 0.11 -0.61 3.17 2.35 -0.98 -2.25 115.58 117.61 4tf4 h ASN 101 Ca 0.04 -0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 4tf4 h ASN 101 Cb 0.60 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.91 4tf4 h ASN 101 CO 0.04 0.71 0.17 0.44 -1.65 0.00 0.00 177.43 177.14 4tf4 h ASP 102 N 0.07 0.90 -0.59 5.81 3.32 -0.91 -2.35 116.42 122.67 4tf4 h ASP 102 Ca -0.01 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 4tf4 h ASP 102 Cb 1.12 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 4tf4 h ASP 102 CO 0.09 0.88 0.33 0.22 -1.72 0.00 0.00 179.24 179.04 4tf4 h TYR 103 N 0.87 0.81 -0.25 4.55 3.20 -1.37 -1.60 116.97 123.18 4tf4 h TYR 103 Ca 0.19 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.07 4tf4 h TYR 103 Cb 0.32 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 4tf4 h TYR 103 CO 0.02 0.58 0.17 0.74 -1.64 0.00 0.00 178.16 178.03 4tf4 h PHE 104 N 0.80 0.24 -0.12 -3.82 0.04 -1.05 0.15 116.94 113.18 4tf4 h PHE 104 Ca 0.21 0.01 -0.16 0.00 2.80 0.00 0.00 57.97 60.83 4tf4 h PHE 104 Cb 0.04 -0.08 0.01 0.00 2.20 0.00 0.00 35.95 38.12 4tf4 h PHE 104 CO -0.01 0.14 -0.54 0.82 -0.60 0.00 0.00 178.31 178.12 4tf4 h ILE 105 N 0.25 1.35 -0.96 -0.55 2.04 -0.88 -2.75 117.51 116.01 4tf4 h ILE 105 Ca 0.10 -1.83 0.03 0.00 1.00 0.00 0.00 64.86 64.16 4tf4 h ILE 105 Cb 0.10 2.13 -0.05 0.00 -0.74 0.00 0.00 36.82 38.25 4tf4 h ILE 105 CO -0.02 0.56 0.63 0.11 0.00 0.00 0.00 178.15 179.43 4tf4 h LYS 106 N 0.21 1.19 0.00 2.37 1.57 -0.24 -1.98 116.57 119.69 4tf4 h LYS 106 Ca -0.03 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 4tf4 h LYS 106 Cb 1.18 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 33.22 4tf4 h LYS 106 CO 0.11 0.78 0.00 0.00 -0.57 0.00 0.00 179.45 179.78 4tf4 n ALA 107 N -2.38 2.46 -3.62 3.86 0.00 0.40 -4.28 120.51 116.95 4tf4 n ALA 107 Ca 0.13 -0.15 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 4tf4 n ALA 107 Cb 0.09 -1.47 -0.09 0.00 0.00 0.00 0.00 19.45 17.98 4tf4 n ALA 107 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 4tf4 n HIS 108 N -1.23 3.51 0.50 0.00 -0.00 -0.75 -0.81 115.22 116.44 4tf4 n HIS 108 Ca 0.15 -4.13 0.10 0.00 -0.00 0.00 0.00 57.72 53.85 4tf4 n HIS 108 Cb 0.20 -0.70 0.43 0.00 -0.00 0.00 0.00 29.99 29.92 4tf4 n HIS 108 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 4tf4 n PRO 109 N 1.49 0.12 -3.47 1.57 -0.04 -1.25 -4.79 135.00 128.62 4tf4 n PRO 109 Ca 0.25 0.31 -0.12 0.00 -0.04 0.00 0.00 63.50 63.90 4tf4 n PRO 109 Cb 0.38 -1.71 -0.03 0.00 -0.04 0.00 0.00 33.50 32.09 4tf4 n PRO 109 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 4tf4 s SER 110 N -3.76 -0.52 0.28 3.54 1.04 -1.26 -5.05 113.70 107.96 4tf4 s SER 110 Ca 0.06 0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.67 4tf4 s SER 110 Cb 0.10 0.51 0.66 0.00 0.10 0.00 0.00 66.02 67.40 4tf4 s SER 110 CO 0.38 -0.77 1.68 1.55 0.98 0.00 0.00 173.24 177.05 4tf4 h PRO 111 N 2.22 0.30 -0.71 4.02 0.13 -1.95 -2.36 132.00 133.64 4tf4 h PRO 111 Ca -0.29 -0.02 -0.34 0.00 -0.87 0.00 0.00 66.00 64.49 4tf4 h PRO 111 Cb 1.25 -0.07 -0.20 0.00 0.13 0.00 0.00 31.00 32.11 4tf4 h PRO 111 CO 0.36 0.20 0.33 0.09 -0.23 0.00 0.00 178.00 178.74 4tf4 n ASN 112 N -5.13 3.51 -3.80 1.44 3.02 -1.26 -4.35 115.26 108.68 4tf4 n ASN 112 Ca 0.20 -3.58 -0.22 0.00 -0.03 0.00 0.00 54.58 50.95 4tf4 n ASN 112 Cb 0.62 -0.75 -0.17 0.00 -0.61 0.00 0.00 39.78 38.87 4tf4 n ASN 112 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 4tf4 s VAL 113 N -3.22 0.40 -0.07 2.41 1.01 -0.89 -3.80 120.40 116.24 4tf4 s VAL 113 Ca 0.52 0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 4tf4 s VAL 113 Cb 0.44 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 36.33 4tf4 s VAL 113 CO 0.08 0.24 -0.03 -0.22 0.00 0.00 0.00 175.10 175.17 4tf4 s LEU 114 N 1.67 1.01 -0.22 3.92 2.96 -0.70 -3.95 118.68 123.36 4tf4 s LEU 114 Ca 0.00 -0.15 -0.27 0.00 -0.22 0.00 0.00 54.13 53.50 4tf4 s LEU 114 Cb -0.13 -0.53 0.00 0.00 0.50 0.00 0.00 46.19 46.04 4tf4 s LEU 114 CO -0.04 -0.12 0.93 -0.31 -1.32 0.00 0.00 176.35 175.50 4tf4 s TYR 115 N 1.48 3.34 -1.44 5.38 1.51 0.01 -1.55 117.35 126.09 4tf4 s TYR 115 Ca -0.02 1.32 0.15 0.00 -1.01 0.00 0.00 57.07 57.51 4tf4 s TYR 115 Cb -0.13 -3.15 0.01 0.00 -0.11 0.00 0.00 41.96 38.58 4tf4 s TYR 115 CO -0.03 -0.41 0.83 1.33 -1.11 0.00 0.00 175.55 176.16 4tf4 n VAL 116 N 5.20 0.00 -3.63 0.71 0.24 -0.82 -4.90 118.33 115.13 4tf4 n VAL 116 Ca 0.09 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.34 61.90 4tf4 n VAL 116 Cb 0.47 1.20 -0.07 0.00 -1.47 0.00 0.00 33.84 33.97 4tf4 n VAL 116 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 4tf4 s GLN 117 N -1.71 0.70 -0.19 7.34 0.74 -1.13 -0.03 119.66 125.37 4tf4 s GLN 117 Ca 0.13 0.86 -0.02 0.00 0.05 0.00 0.00 55.36 56.39 4tf4 s GLN 117 Cb 0.12 0.33 0.06 0.00 1.10 0.00 0.00 33.01 34.61 4tf4 s GLN 117 CO 0.35 -0.09 0.01 0.08 -0.55 0.00 0.00 175.29 175.09 4tf4 s VAL 118 N 0.43 0.72 0.00 1.34 1.01 -1.14 -0.02 120.40 122.74 4tf4 s VAL 118 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.38 4tf4 s VAL 118 Cb -0.05 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.20 4tf4 s VAL 118 CO -0.03 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.56 4tf4 n GLY 119 N 4.98 3.33 3.57 4.51 0.00 0.44 -1.92 105.19 120.10 4tf4 n GLY 119 Ca -0.10 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 4tf4 n GLY 119 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4tf4 s ASP 120 N 0.00 5.47 0.19 1.61 2.15 -1.26 -4.74 116.67 120.09 4tf4 s ASP 120 Ca 0.00 -0.03 -0.12 0.00 0.43 0.00 0.00 52.55 52.83 4tf4 s ASP 120 Cb 0.00 -1.96 0.21 0.00 -0.30 0.00 0.00 42.92 40.88 4tf4 s ASP 120 CO 0.00 0.09 1.72 1.23 -0.17 0.00 0.00 175.17 178.04 4tf4 h GLY 121 N 7.31 0.64 0.53 2.66 0.00 -1.97 -0.96 103.07 111.29 4tf4 h GLY 121 Ca -0.37 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 4tf4 h GLY 121 CO 0.65 -0.07 -0.08 -0.55 0.00 0.00 0.00 176.54 176.49 4tf4 h ASP 122 N 0.25 -0.18 -0.58 0.19 3.32 -1.95 -1.93 116.42 115.54 4tf4 h ASP 122 Ca 0.26 -0.33 0.04 0.00 0.02 0.00 0.00 57.03 57.03 4tf4 h ASP 122 Cb 0.36 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 4tf4 h ASP 122 CO -0.34 0.28 0.33 0.00 -1.72 0.00 0.00 179.24 177.79 4tf4 h ALA 123 N 0.02 0.76 -0.50 3.45 0.00 -1.97 -1.63 119.26 119.39 4tf4 h ALA 123 Ca -0.02 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 4tf4 h ALA 123 Cb 0.50 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 4tf4 h ALA 123 CO 0.04 0.02 0.15 0.22 0.00 0.00 0.00 179.25 179.67 4tf4 h ASP 124 N 0.63 0.68 1.39 0.00 3.58 -1.22 -2.41 116.42 119.06 4tf4 h ASP 124 Ca 0.25 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.60 4tf4 h ASP 124 Cb 0.11 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 40.98 4tf4 h ASP 124 CO -0.14 0.65 0.00 1.41 -2.88 0.00 0.00 179.24 178.27 4tf4 n HIS 125 N -4.31 0.77 0.48 0.28 8.25 -0.73 -3.53 115.22 116.43 4tf4 n HIS 125 Ca 0.04 0.22 0.13 0.00 -0.26 0.00 0.00 57.72 57.85 4tf4 n HIS 125 Cb 0.19 -0.87 0.38 0.00 1.12 0.00 0.00 29.99 30.82 4tf4 n HIS 125 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 4tf4 h LYS 126 N 0.00 0.00 -6.27 -0.41 1.57 -0.79 -3.44 116.57 107.23 4tf4 h LYS 126 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 4tf4 h LYS 126 Cb 0.69 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.81 4tf4 h LYS 126 CO 0.00 0.00 -0.72 -0.46 -0.57 0.00 0.00 179.45 177.70 4tf4 s TRP 127 N -3.19 2.84 -0.34 -1.35 -0.00 -1.23 -5.10 118.94 110.57 4tf4 s TRP 127 Ca 0.08 -0.06 0.02 0.00 -0.00 0.00 0.00 56.10 56.14 4tf4 s TRP 127 Cb 0.10 -1.63 0.10 0.00 -0.00 0.00 0.00 33.47 32.04 4tf4 s TRP 127 CO 0.58 0.31 0.09 -0.46 -0.00 0.00 0.00 176.95 177.48 4tf4 s TRP 128 N -0.88 2.69 0.06 5.86 -0.11 -1.26 -4.99 118.94 120.32 4tf4 s TRP 128 Ca 0.14 -2.41 -0.27 0.00 1.22 0.00 0.00 56.10 54.79 4tf4 s TRP 128 Cb -0.11 -2.31 0.09 0.00 -1.50 0.00 0.00 33.47 29.64 4tf4 s TRP 128 CO 0.04 -0.90 1.18 0.20 -4.62 0.00 0.00 176.95 172.85 4tf4 s GLY 129 N 1.13 -0.14 0.51 5.86 0.00 -1.26 -3.76 107.32 109.65 4tf4 s GLY 129 Ca 0.11 0.10 -0.23 0.00 0.00 0.00 0.00 44.72 44.70 4tf4 s GLY 129 CO -0.15 2.71 1.37 -1.05 0.00 0.00 0.00 173.10 175.98 4tf4 n PRO 130 N -0.69 1.89 -0.20 2.90 -0.02 -1.26 -4.34 135.00 133.27 4tf4 n PRO 130 Ca -0.02 0.68 -0.01 0.00 -2.02 0.00 0.00 63.50 62.13 4tf4 n PRO 130 Cb 0.60 -2.57 0.20 0.00 -0.02 0.00 0.00 33.50 31.71 4tf4 n PRO 130 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4tf4 h ALA 131 N 1.76 1.33 0.00 3.55 0.00 -1.93 -2.86 119.26 121.10 4tf4 h ALA 131 Ca -0.51 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.28 4tf4 h ALA 131 Cb 1.29 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.80 4tf4 h ALA 131 CO 0.58 0.54 0.12 0.93 0.00 0.00 0.00 179.25 181.42 4tf4 h GLU 132 N 0.98 0.00 0.00 0.00 3.07 -1.86 -2.77 114.58 113.99 4tf4 h GLU 132 Ca 0.24 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.10 4tf4 h GLU 132 Cb 0.06 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 4tf4 h GLU 132 CO -0.04 0.00 -0.20 1.33 -1.40 0.00 0.00 179.01 178.70 4tf4 n VAL 133 N -3.01 1.70 -1.63 3.13 0.24 -1.08 -4.84 118.33 112.85 4tf4 n VAL 133 Ca -0.03 -2.22 -0.50 0.00 -2.04 0.00 0.00 64.34 59.55 4tf4 n VAL 133 Cb 0.18 -0.12 -0.05 0.00 -1.47 0.00 0.00 33.84 32.38 4tf4 n VAL 133 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 4tf4 n MET 134 N -1.15 1.51 0.00 7.34 2.81 -1.05 -4.88 117.12 121.70 4tf4 n MET 134 Ca 0.15 0.54 0.11 0.00 -1.81 0.00 0.00 57.70 56.69 4tf4 n MET 134 Cb 0.68 -2.24 0.03 0.00 -0.71 0.00 0.00 33.22 30.98 4tf4 n MET 134 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 4tf4 n PRO 135 N 3.21 1.16 -3.00 0.03 -0.04 -1.26 -5.00 135.00 130.09 4tf4 n PRO 135 Ca 0.19 -0.94 -0.25 0.00 -0.04 0.00 0.00 63.50 62.46 4tf4 n PRO 135 Cb 0.22 -1.48 -0.00 0.00 -0.04 0.00 0.00 33.50 32.20 4tf4 n PRO 135 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4tf4 s MET 136 N -2.49 3.43 0.39 0.54 0.23 -1.26 -5.08 119.30 115.06 4tf4 s MET 136 Ca 0.19 -0.14 -0.23 0.00 -1.03 0.00 0.00 55.69 54.48 4tf4 s MET 136 Cb 0.18 -2.52 -0.10 0.00 -1.53 0.00 0.00 34.83 30.86 4tf4 s MET 136 CO 0.57 -0.08 0.97 -1.21 -2.03 0.00 0.00 175.02 173.25 4tf4 s GLU 137 N -4.54 4.31 -0.45 3.16 0.41 -1.26 -5.04 118.70 115.29 4tf4 s GLU 137 Ca 0.44 1.28 0.03 0.00 -0.41 0.00 0.00 54.97 56.31 4tf4 s GLU 137 Cb -0.10 -2.45 0.13 0.00 -1.78 0.00 0.00 34.13 29.93 4tf4 s GLU 137 CO 0.40 0.03 0.21 1.03 -0.49 0.00 0.00 175.26 176.44 4tf4 s ARG 138 N -2.68 1.56 0.51 1.61 0.52 -1.26 -4.65 118.95 114.56 4tf4 s ARG 138 Ca 0.58 -2.18 -0.22 0.00 -0.52 0.00 0.00 55.73 53.39 4tf4 s ARG 138 Cb -0.15 -2.83 -0.06 0.00 0.52 0.00 0.00 34.95 32.43 4tf4 s ARG 138 CO 0.20 -1.10 1.23 -2.14 0.02 0.00 0.00 175.30 173.51 4tf4 s PRO 139 N 0.24 3.44 -0.17 3.54 0.02 -1.26 -4.37 135.00 136.45 4tf4 s PRO 139 Ca 0.16 1.93 -0.06 0.00 0.02 0.00 0.00 61.00 63.05 4tf4 s PRO 139 Cb -0.24 -2.28 -0.03 0.00 0.02 0.00 0.00 34.50 31.96 4tf4 s PRO 139 CO -0.03 -0.86 0.01 -1.12 -0.33 0.00 0.00 177.00 174.68 4tf4 s SER 140 N -1.27 5.22 0.10 2.53 0.01 -1.26 -0.42 113.70 118.61 4tf4 s SER 140 Ca 0.68 -0.02 0.08 0.00 1.31 0.00 0.00 55.95 58.00 4tf4 s SER 140 Cb -0.33 -1.88 -0.04 0.00 0.21 0.00 0.00 66.02 63.99 4tf4 s SER 140 CO 0.39 0.17 -0.17 -0.36 0.41 0.00 0.00 173.24 173.68 4tf4 s PHE 141 N 0.37 2.58 0.29 2.43 0.40 0.97 -4.99 117.98 120.03 4tf4 s PHE 141 Ca -0.00 -0.24 0.04 0.00 -0.60 0.00 0.00 56.93 56.13 4tf4 s PHE 141 Cb -0.13 -1.39 -0.03 0.00 0.51 0.00 0.00 43.02 41.98 4tf4 s PHE 141 CO 0.01 0.36 0.25 -1.59 0.70 0.00 0.00 175.22 174.95 4tf4 s LYS 142 N -1.98 1.60 -0.02 0.44 -2.85 -1.26 -1.94 119.74 113.73 4tf4 s LYS 142 Ca 0.18 -1.89 0.01 0.00 -1.00 0.00 0.00 55.97 53.27 4tf4 s LYS 142 Cb -0.11 0.32 0.01 0.00 -2.06 0.00 0.00 37.83 35.99 4tf4 s LYS 142 CO 0.09 -0.58 -0.04 0.14 0.10 0.00 0.00 175.35 175.07 4tf4 s VAL 143 N -3.63 0.37 0.21 1.79 -7.23 -0.59 -4.81 120.40 106.51 4tf4 s VAL 143 Ca 0.40 -0.11 0.03 0.00 -1.81 0.00 0.00 61.98 60.48 4tf4 s VAL 143 Cb 0.04 -0.37 -0.01 0.00 0.56 0.00 0.00 36.38 36.60 4tf4 s VAL 143 CO 0.23 0.15 0.23 -0.90 -0.31 0.00 0.00 175.10 174.49 4tf4 n ASP 144 N 3.52 -0.60 0.14 4.85 5.68 -1.06 -1.73 116.55 127.35 4tf4 n ASP 144 Ca -0.20 -2.32 0.18 0.00 -0.50 0.00 0.00 54.79 51.96 4tf4 n ASP 144 Cb 0.54 1.27 0.78 0.00 -1.14 0.00 0.00 41.12 42.57 4tf4 n ASP 144 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 4tf4 h PRO 145 N 0.00 0.00 0.00 0.11 0.11 -1.97 -0.77 132.00 129.48 4tf4 h PRO 145 Ca -0.16 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.93 4tf4 h PRO 145 Cb 0.76 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.86 4tf4 h PRO 145 CO 0.22 0.00 -0.11 0.77 -0.21 0.00 0.00 178.00 178.67 4tf4 h SER 146 N 0.00 0.00 -0.85 -2.05 0.02 -1.96 -3.38 113.55 105.34 4tf4 h SER 146 Ca 0.14 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.02 4tf4 h SER 146 Cb 0.74 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.11 4tf4 h SER 146 CO -0.00 0.11 -0.40 0.00 -1.14 0.00 0.00 176.83 175.39 4tf4 n PRO 148 N 3.51 -3.16 -2.72 0.00 -0.04 -0.59 -2.58 135.00 129.42 4tf4 n PRO 148 Ca 0.14 -1.63 -0.07 0.00 -0.04 0.00 0.00 63.50 61.90 4tf4 n PRO 148 Cb 0.58 -1.56 0.05 0.00 -0.04 0.00 0.00 33.50 32.53 4tf4 n PRO 148 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4tf4 n GLY 149 N -4.44 -0.60 0.38 0.55 0.00 -1.26 -4.18 105.19 95.64 4tf4 n GLY 149 Ca 0.14 0.46 0.16 0.00 0.00 0.00 0.00 46.02 46.78 4tf4 n GLY 149 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 4tf4 h SER 150 N 3.81 0.44 0.72 1.61 0.02 -1.45 -1.03 113.55 117.67 4tf4 h SER 150 Ca -0.16 0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 4tf4 h SER 150 Cb 1.09 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.58 4tf4 h SER 150 CO 0.14 0.22 -0.34 -2.24 -1.14 0.00 0.00 176.83 173.46 4tf4 h ASP 151 N 0.47 -0.81 -0.72 3.07 3.04 -1.87 -1.11 116.42 118.48 4tf4 h ASP 151 Ca 0.41 0.03 -0.02 0.00 -3.24 0.00 0.00 57.03 54.20 4tf4 h ASP 151 Cb 0.91 0.21 -0.03 0.00 -1.04 0.00 0.00 39.33 39.37 4tf4 h ASP 151 CO -0.15 -0.44 0.37 1.62 -2.04 0.00 0.00 179.24 178.59 4tf4 h VAL 152 N -1.24 1.23 0.09 4.15 3.04 -1.90 -0.83 116.25 120.79 4tf4 h VAL 152 Ca -0.10 -0.63 -0.00 0.00 -1.01 0.00 0.00 66.70 64.96 4tf4 h VAL 152 Cb 0.74 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 4tf4 h VAL 152 CO 0.16 0.27 -0.04 0.00 -1.01 0.00 0.00 177.57 176.95 4tf4 h ALA 153 N 1.36 -0.12 -0.29 3.17 0.00 -1.24 -0.80 119.26 121.34 4tf4 h ALA 153 Ca 0.26 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 4tf4 h ALA 153 Cb 0.09 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 4tf4 h ALA 153 CO -0.04 -0.45 0.01 0.00 0.00 0.00 0.00 179.25 178.77 4tf4 h ALA 154 N 0.54 1.49 -0.21 0.00 0.00 -1.02 -1.13 119.26 118.94 4tf4 h ALA 154 Ca -0.01 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 4tf4 h ALA 154 Cb 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 4tf4 h ALA 154 CO 0.02 0.37 -0.12 1.49 0.00 0.00 0.00 179.25 181.01 4tf4 h GLU 155 N 0.42 0.45 -0.21 0.00 4.57 -0.99 -0.64 114.58 118.18 4tf4 h GLU 155 Ca 0.09 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 4tf4 h GLU 155 Cb 0.26 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 4tf4 h GLU 155 CO 0.01 0.75 0.05 1.15 -1.18 0.00 0.00 179.01 179.78 4tf4 h THR 156 N 0.15 1.11 -0.26 0.32 2.02 -0.65 0.22 112.91 115.81 4tf4 h THR 156 Ca 0.04 -0.37 -0.07 0.00 0.77 0.00 0.00 66.41 66.79 4tf4 h THR 156 Cb 0.62 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 4tf4 h THR 156 CO 0.03 0.13 -0.11 0.00 0.37 0.00 0.00 175.52 175.94 4tf4 h ALA 157 N 1.77 0.36 -0.57 6.16 0.00 -0.89 -1.48 119.26 124.61 4tf4 h ALA 157 Ca 0.07 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.68 4tf4 h ALA 157 Cb 0.12 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 4tf4 h ALA 157 CO -0.00 0.21 0.38 0.00 0.00 0.00 0.00 179.25 179.84 4tf4 h ALA 158 N 0.74 0.73 0.17 0.00 0.00 -0.09 0.16 119.26 120.97 4tf4 h ALA 158 Ca 0.06 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.93 4tf4 h ALA 158 Cb 0.61 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 4tf4 h ALA 158 CO 0.04 0.16 -0.18 0.00 0.00 0.00 0.00 179.25 179.27 4tf4 h ALA 159 N 1.21 -0.35 -0.35 0.00 0.00 -0.40 0.68 119.26 120.05 4tf4 h ALA 159 Ca 0.21 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 4tf4 h ALA 159 Cb -0.09 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 4tf4 h ALA 159 CO -0.05 -0.72 -0.10 0.52 0.00 0.00 0.00 179.25 178.90 4tf4 h MET 160 N -0.38 0.60 0.54 0.00 2.86 -1.11 -2.30 114.93 115.13 4tf4 h MET 160 Ca 0.01 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 4tf4 h MET 160 Cb 0.37 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 31.97 4tf4 h MET 160 CO -0.06 0.69 -0.26 0.00 1.06 0.00 0.00 176.91 178.35 4tf4 h ALA 161 N 1.34 -0.73 -0.94 6.32 0.00 -0.64 -1.92 119.26 122.69 4tf4 h ALA 161 Ca 0.10 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 54.97 4tf4 h ALA 161 Cb 0.51 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.50 4tf4 h ALA 161 CO 0.03 -0.76 0.60 0.00 0.00 0.00 0.00 179.25 179.12 4tf4 h ALA 162 N -0.82 1.77 -0.09 0.00 0.00 -0.85 -0.79 119.26 118.48 4tf4 h ALA 162 Ca -0.07 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 4tf4 h ALA 162 Cb 0.63 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 4tf4 h ALA 162 CO 0.12 -0.05 -0.62 0.77 0.00 0.00 0.00 179.25 179.48 4tf4 h SER 163 N 0.75 0.35 -0.60 0.00 0.02 -1.40 -3.08 113.55 109.59 4tf4 h SER 163 Ca 0.49 -0.21 0.06 0.00 -0.84 0.00 0.00 61.79 61.30 4tf4 h SER 163 Cb 0.76 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 4tf4 h SER 163 CO -0.25 0.88 0.40 0.77 -1.14 0.00 0.00 176.83 177.49 4tf4 h SER 164 N 0.23 0.51 -0.49 3.07 4.64 -0.30 0.12 113.55 121.32 4tf4 h SER 164 Ca -0.01 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.23 4tf4 h SER 164 Cb 1.14 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.10 4tf4 h SER 164 CO 0.10 0.33 -0.00 0.40 -0.87 0.00 0.00 176.83 176.79 4tf4 h ILE 165 N 0.58 1.26 -0.39 0.95 2.04 -1.46 0.30 117.51 120.78 4tf4 h ILE 165 Ca 0.26 -1.08 -0.06 0.00 1.00 0.00 0.00 64.86 64.97 4tf4 h ILE 165 Cb 0.29 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 4tf4 h ILE 165 CO -0.08 0.39 -0.01 0.58 0.00 0.00 0.00 178.15 179.03 4tf4 h VAL 166 N 0.85 1.26 0.00 1.67 2.07 -0.85 -3.14 116.25 118.11 4tf4 h VAL 166 Ca 0.16 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.66 4tf4 h VAL 166 Cb 0.50 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 4tf4 h VAL 166 CO 0.02 0.34 -0.28 -0.26 0.02 0.00 0.00 177.57 177.42 4tf4 h PHE 167 N 0.52 0.00 -0.52 1.57 0.04 -1.05 -3.40 116.94 114.09 4tf4 h PHE 167 Ca 0.11 0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.98 4tf4 h PHE 167 Cb 0.49 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 38.54 4tf4 h PHE 167 CO 0.04 0.00 -0.15 0.00 -0.60 0.00 0.00 178.31 177.60 4tf4 n ALA 168 N -1.95 0.07 0.10 2.45 0.00 0.10 -0.00 120.51 121.28 4tf4 n ALA 168 Ca 0.04 0.56 -0.20 0.00 0.00 0.00 0.00 53.44 53.83 4tf4 n ALA 168 Cb 0.48 -0.31 -0.15 0.00 0.00 0.00 0.00 19.45 19.47 4tf4 n ALA 168 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 4tf4 h ASP 169 N 0.00 0.59 0.03 0.00 3.32 -1.81 -3.23 116.42 115.32 4tf4 h ASP 169 Ca 0.23 -0.73 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 4tf4 h ASP 169 Cb 0.36 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.72 4tf4 h ASP 169 CO -0.53 1.59 -0.01 0.44 -1.72 0.00 0.00 179.24 179.00 4tf4 h ASP 170 N 0.10 -0.03 -2.45 6.45 5.19 -1.08 -3.41 116.42 121.20 4tf4 h ASP 170 Ca -0.25 -0.59 -0.59 0.00 -0.62 0.00 0.00 57.03 54.98 4tf4 h ASP 170 Cb 2.08 0.01 -0.39 0.00 0.18 0.00 0.00 39.33 41.20 4tf4 h ASP 170 CO 0.21 0.59 -0.89 -0.67 -3.12 0.00 0.00 179.24 175.35 4tf4 n ASP 171 N -4.81 0.55 -0.21 6.45 -0.08 1.00 -4.97 116.55 114.48 4tf4 n ASP 171 Ca -0.09 -2.65 0.18 0.00 -1.51 0.00 0.00 54.79 50.72 4tf4 n ASP 171 Cb 0.31 -0.61 0.51 0.00 2.34 0.00 0.00 41.12 43.67 4tf4 n ASP 171 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 4tf4 h PRO 172 N 5.26 0.39 0.55 -0.67 0.13 -1.69 -0.31 132.00 135.66 4tf4 h PRO 172 Ca 0.21 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.29 4tf4 h PRO 172 Cb 0.86 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.91 4tf4 h PRO 172 CO 0.48 0.26 -0.27 0.00 -0.23 0.00 0.00 178.00 178.24 4tf4 h ALA 173 N 1.62 -0.75 -0.16 -0.56 0.00 -1.93 -0.92 119.26 116.56 4tf4 h ALA 173 Ca 0.43 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.20 4tf4 h ALA 173 Cb 1.06 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 4tf4 h ALA 173 CO -0.15 -0.86 -0.15 -0.92 0.00 0.00 0.00 179.25 177.17 4tf4 h TYR 174 N -0.86 -0.37 -0.51 0.00 3.20 -1.66 -1.72 116.97 115.04 4tf4 h TYR 174 Ca -0.08 0.02 0.10 0.00 3.14 0.00 0.00 58.73 61.92 4tf4 h TYR 174 Cb 0.61 0.19 -0.09 0.00 1.54 0.00 0.00 36.73 38.98 4tf4 h TYR 174 CO -0.02 -0.21 -0.07 0.00 -1.64 0.00 0.00 178.16 176.22 4tf4 h ALA 175 N 0.92 0.41 -0.68 1.82 0.00 -1.03 -0.49 119.26 120.21 4tf4 h ALA 175 Ca 0.10 0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.24 4tf4 h ALA 175 Cb 0.32 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 4tf4 h ALA 175 CO -0.26 -0.42 0.40 0.00 0.00 0.00 0.00 179.25 178.97 4tf4 h ALA 176 N 1.49 0.91 -0.62 0.00 0.00 -0.41 -1.41 119.26 119.21 4tf4 h ALA 176 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 4tf4 h ALA 176 Cb 0.39 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 4tf4 h ALA 176 CO -0.49 0.10 0.27 1.15 0.00 0.00 0.00 179.25 180.28 4tf4 h THR 177 N 0.74 1.21 -0.26 0.00 2.02 -0.29 -0.09 112.91 116.25 4tf4 h THR 177 Ca 0.30 -0.64 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 4tf4 h THR 177 Cb 0.14 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 4tf4 h THR 177 CO -0.16 0.26 -0.13 -0.07 0.37 0.00 0.00 175.52 175.79 4tf4 h LEU 178 N 0.88 0.56 -0.32 2.58 3.38 -0.66 -2.09 115.31 119.65 4tf4 h LEU 178 Ca 0.21 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.79 4tf4 h LEU 178 Cb 0.14 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 4tf4 h LEU 178 CO -0.02 0.85 0.17 0.58 0.09 0.00 0.00 178.44 180.10 4tf4 h VAL 179 N 0.27 1.00 -0.31 1.22 2.07 -0.82 0.72 116.25 120.41 4tf4 h VAL 179 Ca 0.06 -0.12 0.04 0.00 0.82 0.00 0.00 66.70 67.50 4tf4 h VAL 179 Cb 0.64 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 4tf4 h VAL 179 CO 0.04 0.06 0.08 -0.61 0.02 0.00 0.00 177.57 177.16 4tf4 h GLN 180 N 0.34 0.20 -0.53 1.57 4.15 -0.95 -1.63 115.11 118.26 4tf4 h GLN 180 Ca 0.13 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.53 4tf4 h GLN 180 Cb 0.03 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 4tf4 h GLN 180 CO -0.08 0.13 0.29 0.45 -1.93 0.00 0.00 178.83 177.69 4tf4 h HIS 181 N 0.20 0.74 -0.85 3.99 3.86 -1.02 -2.97 115.15 119.10 4tf4 h HIS 181 Ca 0.14 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.41 4tf4 h HIS 181 Cb 0.14 -0.23 -0.07 0.00 1.06 0.00 0.00 27.41 28.31 4tf4 h HIS 181 CO -0.16 0.55 0.51 0.00 0.86 0.00 0.00 177.93 179.69 4tf4 h ALA 182 N 1.12 1.18 -0.19 2.45 0.00 -0.31 -1.23 119.26 122.29 4tf4 h ALA 182 Ca 0.19 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 4tf4 h ALA 182 Cb 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 4tf4 h ALA 182 CO -0.03 0.21 0.08 0.87 0.00 0.00 0.00 179.25 180.39 4tf4 h LYS 183 N 0.91 0.28 -0.21 0.00 1.57 -1.16 -0.82 116.57 117.13 4tf4 h LYS 183 Ca 0.38 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.13 4tf4 h LYS 183 Cb 0.24 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 4tf4 h LYS 183 CO -0.20 0.33 0.09 1.96 -0.57 0.00 0.00 179.45 181.06 4tf4 h GLN 184 N 0.16 0.19 -0.87 3.15 4.20 -1.35 -0.48 115.11 120.10 4tf4 h GLN 184 Ca 0.06 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 4tf4 h GLN 184 Cb 0.16 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 4tf4 h GLN 184 CO -0.01 0.12 0.49 -0.07 -0.67 0.00 0.00 178.83 178.70 4tf4 h LEU 185 N 0.19 1.08 -0.45 1.46 3.38 -1.12 0.73 115.31 120.58 4tf4 h LEU 185 Ca 0.09 -0.09 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 4tf4 h LEU 185 Cb 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 4tf4 h LEU 185 CO -0.08 0.86 -0.23 0.22 0.09 0.00 0.00 178.44 179.30 4tf4 h TYR 186 N 1.22 1.10 -0.01 1.13 5.03 -0.82 -0.94 116.97 123.68 4tf4 h TYR 186 Ca 0.31 -0.28 -0.00 0.00 2.58 0.00 0.00 58.73 61.34 4tf4 h TYR 186 Cb 0.01 -0.25 -0.00 0.00 1.55 0.00 0.00 36.73 38.04 4tf4 h TYR 186 CO 0.01 1.09 0.00 1.15 -1.32 0.00 0.00 178.16 179.09 4tf4 h THR 187 N 0.80 1.05 -0.61 1.81 2.02 -0.66 0.30 112.91 117.62 4tf4 h THR 187 Ca 0.10 -0.14 0.09 0.00 0.77 0.00 0.00 66.41 67.23 4tf4 h THR 187 Cb 0.81 1.13 -0.07 0.00 -1.74 0.00 0.00 68.15 68.27 4tf4 h THR 187 CO 0.07 0.04 0.24 0.15 0.37 0.00 0.00 175.52 176.38 4tf4 h PHE 188 N -0.05 0.41 -0.60 3.16 3.57 -0.77 0.14 116.94 122.81 4tf4 h PHE 188 Ca 0.00 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 4tf4 h PHE 188 Cb 0.06 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 4tf4 h PHE 188 CO -0.06 0.12 0.00 0.00 -2.23 0.00 0.00 178.31 176.14 4tf4 h ALA 189 N 1.41 0.81 -0.02 2.41 0.00 -0.83 -1.53 119.26 121.52 4tf4 h ALA 189 Ca 0.30 -0.31 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 4tf4 h ALA 189 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 4tf4 h ALA 189 CO -0.29 0.65 -0.75 0.22 0.00 0.00 0.00 179.25 179.08 4tf4 h ASP 190 N 0.96 0.16 0.08 0.00 3.58 -0.28 -3.35 116.42 117.57 4tf4 h ASP 190 Ca 0.17 -0.11 -0.11 0.00 0.42 0.00 0.00 57.03 57.40 4tf4 h ASP 190 Cb 0.55 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.57 4tf4 h ASP 190 CO 0.03 0.84 -0.51 0.74 -2.88 0.00 0.00 179.24 177.46 4tf4 h THR 191 N 0.08 1.60 -3.47 2.25 2.02 -0.69 -3.41 112.91 111.29 4tf4 h THR 191 Ca -0.02 -2.45 -0.73 0.00 0.77 0.00 0.00 66.41 63.98 4tf4 h THR 191 Cb 1.31 3.25 -0.30 0.00 -1.74 0.00 0.00 68.15 70.67 4tf4 h THR 191 CO 0.11 0.67 -0.29 -0.31 0.37 0.00 0.00 175.52 176.07 4tf4 s TYR 192 N -2.34 3.49 0.33 3.16 2.02 -0.58 -5.07 117.35 118.35 4tf4 s TYR 192 Ca -0.16 -2.12 -0.27 0.00 -0.37 0.00 0.00 57.07 54.15 4tf4 s TYR 192 Cb -0.01 -3.49 -0.09 0.00 -0.40 0.00 0.00 41.96 37.97 4tf4 s TYR 192 CO 0.77 -0.95 1.04 1.03 -1.57 0.00 0.00 175.55 175.87 4tf4 s ARG 193 N 0.75 4.47 0.00 -0.62 1.81 -1.26 -4.37 118.95 119.73 4tf4 s ARG 193 Ca 0.11 1.60 0.00 0.00 -1.72 0.00 0.00 55.73 55.72 4tf4 s ARG 193 Cb -0.21 -2.90 0.00 0.00 -0.45 0.00 0.00 34.95 31.39 4tf4 s ARG 193 CO -0.03 0.12 0.00 0.41 -0.68 0.00 0.00 175.30 175.12 4tf4 n GLY 194 N 0.82 2.86 3.63 -3.53 0.00 -1.26 -4.79 105.19 102.92 4tf4 n GLY 194 Ca 0.02 -0.80 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 4tf4 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4tf4 s VAL 195 N -2.00 5.06 0.54 1.61 1.01 -1.26 -1.45 120.40 123.91 4tf4 s VAL 195 Ca 0.00 0.93 0.23 0.00 0.00 0.00 0.00 61.98 63.14 4tf4 s VAL 195 Cb 0.00 -3.85 0.34 0.00 0.00 0.00 0.00 36.38 32.87 4tf4 s VAL 195 CO 0.00 0.09 2.09 0.10 0.00 0.00 0.00 175.10 177.38 4tf4 h TYR 196 N 7.91 0.00 0.00 5.22 -0.00 -1.85 -1.21 116.97 127.04 4tf4 h TYR 196 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.44 4tf4 h TYR 196 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.87 4tf4 h TYR 196 CO 0.75 0.00 0.00 -1.13 -0.00 0.00 0.00 178.16 177.78 4tf4 n SER 197 N -4.29 0.00 0.06 0.10 3.41 -1.26 -1.43 113.62 110.20 4tf4 n SER 197 Ca 0.02 -0.54 0.12 0.00 -0.26 0.00 0.00 58.87 58.21 4tf4 n SER 197 Cb 0.32 -0.06 0.06 0.00 -0.26 0.00 0.00 64.21 64.28 4tf4 n SER 197 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 4tf4 n ASP 198 N -1.06 0.68 -0.06 4.04 8.00 -0.46 -4.38 116.55 123.32 4tf4 n ASP 198 Ca 0.15 0.06 -0.08 0.00 0.71 0.00 0.00 54.79 55.63 4tf4 n ASP 198 Cb 0.09 0.51 -0.08 0.00 -0.02 0.00 0.00 41.12 41.63 4tf4 n ASP 198 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4tf4 s VAL 200 N -2.28 2.74 -0.99 0.00 -7.23 -0.51 -4.97 120.40 107.16 4tf4 s VAL 200 Ca -0.12 -1.24 -0.07 0.00 -1.81 0.00 0.00 61.98 58.73 4tf4 s VAL 200 Cb 0.04 -2.16 -0.10 0.00 0.56 0.00 0.00 36.38 34.72 4tf4 s VAL 200 CO 0.39 0.31 2.63 -0.81 -0.31 0.00 0.00 175.10 177.31 4tf4 n PRO 201 N 1.48 2.61 0.00 4.82 -0.04 -1.26 -4.13 135.00 138.47 4tf4 n PRO 201 Ca -0.16 -1.60 0.04 0.00 -0.04 0.00 0.00 63.50 61.74 4tf4 n PRO 201 Cb 0.52 -2.46 0.01 0.00 -0.04 0.00 0.00 33.50 31.53 4tf4 n PRO 201 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4tf4 n ALA 202 N 3.60 2.70 -0.25 0.55 0.00 -1.26 -4.73 120.51 121.12 4tf4 n ALA 202 Ca 0.56 -0.44 0.32 0.00 0.00 0.00 0.00 53.44 53.88 4tf4 n ALA 202 Cb 0.30 -0.30 0.74 0.00 0.00 0.00 0.00 19.45 20.19 4tf4 n ALA 202 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 4tf4 h GLY 203 N 1.82 0.00 0.87 0.00 0.00 -1.80 0.21 103.07 104.16 4tf4 h GLY 203 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 4tf4 h GLY 203 CO 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 176.54 176.45 4tf4 n ALA 204 N -2.73 2.73 0.04 3.60 0.00 -1.26 -3.44 120.51 119.45 4tf4 n ALA 204 Ca 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.39 4tf4 n ALA 204 Cb 1.11 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 19.21 4tf4 n ALA 204 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 4tf4 n PHE 205 N -0.91 -0.25 -3.20 0.00 3.72 0.26 -4.92 117.46 112.15 4tf4 n PHE 205 Ca 0.15 0.04 -0.24 0.00 -0.05 0.00 0.00 57.45 57.36 4tf4 n PHE 205 Cb 0.27 0.09 -0.06 0.00 -0.94 0.00 0.00 39.48 38.84 4tf4 n PHE 205 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 4tf4 n TYR 206 N -3.24 1.83 -2.26 1.38 4.01 0.47 -5.10 117.16 114.25 4tf4 n TYR 206 Ca 0.00 -3.88 -0.37 0.00 -0.16 0.00 0.00 57.90 53.49 4tf4 n TYR 206 Cb 0.18 -0.45 -0.01 0.00 -0.31 0.00 0.00 39.34 38.75 4tf4 n TYR 206 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 4tf4 s ASN 207 N -2.31 6.23 -1.33 7.72 2.47 -1.22 -4.59 114.94 121.91 4tf4 s ASN 207 Ca 0.40 2.32 -0.16 0.00 0.42 0.00 0.00 52.86 55.85 4tf4 s ASN 207 Cb 0.23 -2.60 0.09 0.00 -1.45 0.00 0.00 41.25 37.51 4tf4 s ASN 207 CO -0.08 -0.88 1.83 -0.24 -3.72 0.00 0.00 177.10 174.01 4tf4 n SER 208 N -0.39 4.72 0.26 -4.21 2.88 -1.26 -4.79 113.62 110.83 4tf4 n SER 208 Ca 0.07 -2.92 0.11 0.00 -1.33 0.00 0.00 58.87 54.80 4tf4 n SER 208 Cb 0.48 -1.68 0.70 0.00 -0.75 0.00 0.00 64.21 62.96 4tf4 n SER 208 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 4tf4 h TRP 209 N 6.95 0.00 0.00 0.66 4.06 -1.92 -3.17 115.95 122.53 4tf4 h TRP 209 Ca 0.46 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.41 4tf4 h TRP 209 Cb 0.79 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.95 4tf4 h TRP 209 CO 1.37 0.12 -0.85 -1.13 -3.56 0.00 0.00 178.44 174.39 4tf4 n SER 210 N -3.84 0.81 0.00 -3.49 3.41 -1.26 -5.11 113.62 104.14 4tf4 n SER 210 Ca -0.02 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 4tf4 n SER 210 Cb 0.21 1.05 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 4tf4 n SER 210 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4tf4 n GLY 211 N 1.40 -2.22 0.24 5.00 0.00 -1.20 -4.64 105.19 103.78 4tf4 n GLY 211 Ca 0.03 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.33 4tf4 n GLY 211 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 4tf4 n TYR 212 N -0.09 0.00 -0.23 1.61 0.18 -1.26 -4.54 117.16 112.84 4tf4 n TYR 212 Ca 0.00 0.00 0.02 0.00 1.88 0.00 0.00 57.90 59.80 4tf4 n TYR 212 Cb 0.00 -0.01 0.14 0.00 -0.38 0.00 0.00 39.34 39.09 4tf4 n TYR 212 CO 0.00 0.00 0.00 0.37 -2.08 0.00 0.00 176.86 175.15 4tf4 h GLN 213 N 1.20 0.44 -0.58 -3.48 5.75 -1.94 -1.04 115.11 115.45 4tf4 h GLN 213 Ca 0.00 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 4tf4 h GLN 213 Cb 0.62 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.05 4tf4 h GLN 213 CO 0.00 0.29 0.21 0.38 -2.65 0.00 0.00 178.83 177.06 4tf4 h ASP 214 N 0.45 0.79 0.35 -0.69 2.03 -1.88 -2.54 116.42 114.93 4tf4 h ASP 214 Ca 0.35 -0.11 -0.11 0.00 -0.73 0.00 0.00 57.03 56.42 4tf4 h ASP 214 Cb 0.45 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.73 4tf4 h ASP 214 CO -0.33 0.72 -0.47 -0.33 -1.03 0.00 0.00 179.24 177.80 4tf4 h GLU 215 N 0.84 0.15 -0.36 4.15 3.07 -1.51 -1.13 114.58 119.79 4tf4 h GLU 215 Ca 0.20 -0.08 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 4tf4 h GLU 215 Cb 0.20 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 4tf4 h GLU 215 CO -0.01 0.59 -0.14 -0.07 -1.40 0.00 0.00 179.01 177.98 4tf4 h LEU 216 N 0.12 0.62 -0.02 1.33 3.38 -0.87 0.38 115.31 120.25 4tf4 h LEU 216 Ca 0.01 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 4tf4 h LEU 216 Cb 0.88 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.46 4tf4 h LEU 216 CO 0.07 0.78 -0.09 0.58 0.09 0.00 0.00 178.44 179.87 4tf4 h VAL 217 N 0.58 1.52 0.38 1.22 2.07 -1.38 -2.55 116.25 118.09 4tf4 h VAL 217 Ca 0.10 -1.67 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 4tf4 h VAL 217 Cb 0.57 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.91 4tf4 h VAL 217 CO 0.04 0.45 -0.32 -0.25 0.02 0.00 0.00 177.57 177.50 4tf4 h TRP 218 N -0.55 -0.86 -0.30 1.57 2.91 -1.07 -1.55 115.95 116.10 4tf4 h TRP 218 Ca -0.01 0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.05 4tf4 h TRP 218 Cb 0.78 0.33 -0.04 0.00 -0.51 0.00 0.00 29.16 29.72 4tf4 h TRP 218 CO 0.16 -0.47 0.07 0.78 -1.03 0.00 0.00 178.44 177.96 4tf4 h GLY 219 N -0.71 0.35 0.29 2.65 0.00 -0.36 -2.51 103.07 102.78 4tf4 h GLY 219 Ca -0.03 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.31 4tf4 h GLY 219 CO -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 176.54 176.27 4tf4 h ALA 220 N 1.21 -0.26 -0.63 3.60 0.00 -1.26 -1.16 119.26 120.76 4tf4 h ALA 220 Ca 0.14 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.19 4tf4 h ALA 220 Cb 0.13 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 4tf4 h ALA 220 CO -0.16 -0.72 0.20 -0.92 0.00 0.00 0.00 179.25 177.64 4tf4 h TYR 221 N -0.33 0.34 -0.27 0.00 5.03 -1.04 -0.68 116.97 120.01 4tf4 h TYR 221 Ca 0.09 0.03 -0.13 0.00 2.58 0.00 0.00 58.73 61.30 4tf4 h TYR 221 Cb 0.47 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.69 4tf4 h TYR 221 CO -0.34 0.04 -0.38 -1.49 -1.32 0.00 0.00 178.16 174.66 4tf4 h TRP 222 N 0.35 0.74 -0.43 -3.82 4.06 -1.01 -2.18 115.95 113.67 4tf4 h TRP 222 Ca 0.33 -0.21 -0.07 0.00 2.06 0.00 0.00 58.89 61.00 4tf4 h TRP 222 Cb 0.46 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.44 4tf4 h TRP 222 CO -0.20 0.91 -0.04 -0.07 -3.56 0.00 0.00 178.44 175.48 4tf4 h LEU 223 N 0.52 0.69 -0.22 -4.49 3.38 -0.54 -1.68 115.31 112.96 4tf4 h LEU 223 Ca 0.05 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 57.89 4tf4 h LEU 223 Cb 0.89 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 4tf4 h LEU 223 CO 0.08 0.78 -0.03 0.22 0.09 0.00 0.00 178.44 179.58 4tf4 h TYR 224 N 0.66 -0.07 -0.65 1.13 3.20 -0.79 0.71 116.97 121.16 4tf4 h TYR 224 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 4tf4 h TYR 224 Cb 0.47 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 4tf4 h TYR 224 CO 0.02 -0.07 0.40 0.87 -1.64 0.00 0.00 178.16 177.75 4tf4 h LYS 225 N 0.03 0.88 -0.17 1.82 1.79 -0.90 1.13 116.57 121.15 4tf4 h LYS 225 Ca 0.11 -0.07 -0.19 0.00 -2.18 0.00 0.00 60.65 58.31 4tf4 h LYS 225 Cb 0.15 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 4tf4 h LYS 225 CO -0.21 0.62 -0.67 0.00 -1.08 0.00 0.00 179.45 178.11 4tf4 h ALA 226 N 1.21 0.49 0.04 3.86 0.00 -0.97 -3.36 119.26 120.53 4tf4 h ALA 226 Ca 0.24 -0.57 -0.29 0.00 0.00 0.00 0.00 54.91 54.29 4tf4 h ALA 226 Cb -0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 4tf4 h ALA 226 CO -0.05 0.70 -1.57 0.25 0.00 0.00 0.00 179.25 178.58 4tf4 n THR 227 N -3.93 1.61 -0.30 0.00 -2.24 0.21 -4.98 114.28 104.65 4tf4 n THR 227 Ca -0.05 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 4tf4 n THR 227 Cb 0.69 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 66.99 4tf4 n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4tf4 n GLY 228 N 1.61 0.77 3.61 3.38 0.00 0.39 -5.02 105.19 109.94 4tf4 n GLY 228 Ca -0.33 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 4tf4 n GLY 228 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4tf4 s ASP 229 N -2.39 6.28 0.54 1.61 -1.08 -1.25 -4.89 116.67 115.50 4tf4 s ASP 229 Ca 0.00 1.01 0.24 0.00 -0.52 0.00 0.00 52.55 53.28 4tf4 s ASP 229 Cb 0.00 -2.54 1.42 0.00 -1.46 0.00 0.00 42.92 40.34 4tf4 s ASP 229 CO 0.00 -1.44 2.04 0.44 0.52 0.00 0.00 175.17 176.73 4tf4 h ASP 230 N 10.99 0.00 -0.68 -0.34 3.32 -1.95 -1.43 116.42 126.33 4tf4 h ASP 230 Ca -0.29 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.81 4tf4 h ASP 230 Cb 1.12 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.63 4tf4 h ASP 230 CO 1.06 0.00 0.45 0.77 -1.72 0.00 0.00 179.24 179.80 4tf4 h SER 231 N 0.00 0.65 -0.71 6.45 4.64 -2.00 -1.94 113.55 120.64 4tf4 h SER 231 Ca 0.17 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 4tf4 h SER 231 Cb 0.71 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.63 4tf4 h SER 231 CO -0.00 0.43 0.22 1.88 -0.87 0.00 0.00 176.83 178.49 4tf4 h TYR 232 N 0.74 1.16 -0.60 4.77 0.05 -1.60 0.89 116.97 122.39 4tf4 h TYR 232 Ca 0.29 -0.11 -0.07 0.00 0.05 0.00 0.00 58.73 58.89 4tf4 h TYR 232 Cb 0.19 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 37.57 4tf4 h TYR 232 CO -0.00 0.92 0.12 1.25 -1.05 0.00 0.00 178.16 179.40 4tf4 h LEU 233 N 1.07 0.94 -0.41 3.88 5.85 -1.48 -1.10 115.31 124.06 4tf4 h LEU 233 Ca 0.23 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.75 4tf4 h LEU 233 Cb 0.31 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 4tf4 h LEU 233 CO -0.01 0.94 0.16 0.00 -0.34 0.00 0.00 178.44 179.20 4tf4 h ALA 234 N 1.03 0.49 -0.30 1.25 0.00 -0.69 -1.05 119.26 119.99 4tf4 h ALA 234 Ca 0.19 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.17 4tf4 h ALA 234 Cb 0.39 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 4tf4 h ALA 234 CO 0.01 -0.22 0.07 -0.22 0.00 0.00 0.00 179.25 178.89 4tf4 h LYS 235 N 0.34 0.18 0.31 0.00 1.63 -0.38 -1.48 116.57 117.18 4tf4 h LYS 235 Ca 0.18 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.97 4tf4 h LYS 235 Cb 0.15 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 4tf4 h LYS 235 CO -0.17 0.12 -0.25 0.00 -3.45 0.00 0.00 179.45 175.70 4tf4 h ALA 236 N 1.21 -0.57 -0.96 5.00 0.00 -0.66 -1.31 119.26 121.98 4tf4 h ALA 236 Ca 0.14 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.00 4tf4 h ALA 236 Cb 0.13 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 4tf4 h ALA 236 CO -0.17 -0.84 0.62 0.93 0.00 0.00 0.00 179.25 179.79 4tf4 h GLU 237 N -0.58 1.15 0.71 0.00 5.08 -1.06 -0.31 114.58 119.57 4tf4 h GLU 237 Ca -0.02 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 4tf4 h GLU 237 Cb 0.51 -0.26 0.01 0.00 0.50 0.00 0.00 28.75 29.50 4tf4 h GLU 237 CO -0.02 0.76 -0.34 -0.92 -1.00 0.00 0.00 179.01 177.49 4tf4 h TYR 238 N 1.18 -0.88 -0.14 4.33 3.20 -1.01 -2.91 116.97 120.74 4tf4 h TYR 238 Ca 0.39 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.28 4tf4 h TYR 238 Cb 0.05 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 4tf4 h TYR 238 CO -0.01 -0.53 0.13 0.93 -1.64 0.00 0.00 178.16 177.04 4tf4 h GLU 239 N -1.02 0.00 -0.93 1.82 4.39 -1.03 -2.72 114.58 115.10 4tf4 h GLU 239 Ca -0.10 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.78 4tf4 h GLU 239 Cb 0.74 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.32 4tf4 h GLU 239 CO 0.16 0.00 0.59 -0.92 -1.16 0.00 0.00 179.01 177.68 4tf4 h TYR 240 N 0.00 0.79 0.00 4.33 5.03 -0.84 -0.94 116.97 125.34 4tf4 h TYR 240 Ca 0.07 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.40 4tf4 h TYR 240 Cb 0.33 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.36 4tf4 h TYR 240 CO 0.00 0.24 0.00 -0.25 -1.32 0.00 0.00 178.16 176.83 4tf4 n ASP 241 N -4.59 0.49 -1.49 -2.11 8.00 -1.03 -2.70 116.55 113.12 4tf4 n ASP 241 Ca 0.19 0.63 0.08 0.00 0.71 0.00 0.00 54.79 56.40 4tf4 n ASP 241 Cb 0.57 -0.73 0.32 0.00 -0.02 0.00 0.00 41.12 41.27 4tf4 n ASP 241 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 4tf4 n PHE 242 N -2.04 1.40 -1.58 1.24 3.72 -0.36 -4.97 117.46 114.88 4tf4 n PHE 242 Ca 0.02 -0.54 -0.31 0.00 -0.05 0.00 0.00 57.45 56.57 4tf4 n PHE 242 Cb 0.20 -0.26 0.06 0.00 -0.94 0.00 0.00 39.48 38.53 4tf4 n PHE 242 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 4tf4 s LEU 243 N -1.79 3.05 0.14 4.37 1.43 -1.10 -4.97 118.68 119.81 4tf4 s LEU 243 Ca 0.46 1.56 -0.31 0.00 -1.03 0.00 0.00 54.13 54.81 4tf4 s LEU 243 Cb 0.30 -4.40 -0.09 0.00 0.03 0.00 0.00 46.19 42.03 4tf4 s LEU 243 CO 0.21 -1.51 1.49 -0.44 0.23 0.00 0.00 176.35 176.32 4tf4 s SER 244 N -3.82 6.70 0.70 2.29 0.01 -1.26 -4.97 113.70 113.34 4tf4 s SER 244 Ca 0.58 2.47 -0.02 0.00 1.31 0.00 0.00 55.95 60.30 4tf4 s SER 244 Cb -0.14 -2.59 0.12 0.00 0.21 0.00 0.00 66.02 63.62 4tf4 s SER 244 CO 0.55 -0.75 0.79 0.35 0.41 0.00 0.00 173.24 174.59 4tf4 n THR 245 N 3.99 0.00 -4.81 1.44 -2.24 -1.26 -1.46 114.28 109.95 4tf4 n THR 245 Ca 0.13 -1.14 -0.33 0.00 -2.27 0.00 0.00 64.05 60.44 4tf4 n THR 245 Cb 0.40 -1.09 -0.13 0.00 -2.10 0.00 0.00 70.33 67.41 4tf4 n THR 245 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 4tf4 s GLU 246 N -4.55 2.87 0.00 -0.78 2.12 0.64 -4.27 118.70 114.72 4tf4 s GLU 246 Ca 0.51 -0.67 0.00 0.00 0.36 0.00 0.00 54.97 55.17 4tf4 s GLU 246 Cb -0.03 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.86 4tf4 s GLU 246 CO 0.34 0.48 0.00 0.00 -0.54 0.00 0.00 175.26 175.54 4tf4 n GLN 247 N 2.75 0.00 0.00 4.30 10.64 -1.26 -1.39 117.38 132.42 4tf4 n GLN 247 Ca -0.18 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.99 4tf4 n GLN 247 Cb 0.52 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.90 4tf4 n GLN 247 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17 4tf4 n GLN 248 N 0.00 2.44 -1.54 2.61 -0.06 -1.26 -5.09 117.38 114.49 4tf4 n GLN 248 Ca 0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.70 4tf4 n GLN 248 Cb 0.00 -0.82 0.09 0.00 -4.06 0.00 0.00 30.24 25.45 4tf4 n GLN 248 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 4tf4 s THR 249 N -1.53 3.10 -2.02 1.69 -4.23 -0.49 -4.94 115.64 107.22 4tf4 s THR 249 Ca 0.00 0.36 0.11 0.00 -1.18 0.00 0.00 61.69 60.98 4tf4 s THR 249 Cb 0.00 -3.09 0.31 0.00 1.34 0.00 0.00 72.50 71.06 4tf4 s THR 249 CO 0.00 -0.47 1.27 -0.90 -0.54 0.00 0.00 174.62 173.99 4tf4 n ASP 250 N -3.43 1.82 -4.75 3.99 5.68 -1.26 -3.89 116.55 114.71 4tf4 n ASP 250 Ca 0.07 -1.98 -0.40 0.00 -0.50 0.00 0.00 54.79 51.98 4tf4 n ASP 250 Cb 0.56 -0.22 -0.06 0.00 -1.14 0.00 0.00 41.12 40.26 4tf4 n ASP 250 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 4tf4 s LEU 251 N -1.04 4.60 0.44 -2.12 1.43 -1.26 -4.89 118.68 115.84 4tf4 s LEU 251 Ca 0.24 1.88 -0.23 0.00 -1.03 0.00 0.00 54.13 54.99 4tf4 s LEU 251 Cb 0.12 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.68 4tf4 s LEU 251 CO 0.16 0.10 1.08 -0.13 0.23 0.00 0.00 176.35 177.79 4tf4 s ARG 252 N -0.82 3.93 0.04 1.70 0.52 -1.26 -0.26 118.95 122.80 4tf4 s ARG 252 Ca 0.42 1.56 -0.36 0.00 -0.52 0.00 0.00 55.73 56.83 4tf4 s ARG 252 Cb -0.25 -2.38 -0.19 0.00 0.52 0.00 0.00 34.95 32.65 4tf4 s ARG 252 CO 0.31 -0.35 0.93 0.43 0.02 0.00 0.00 175.30 176.64 4tf4 n SER 253 N -0.44 -0.23 0.00 0.23 7.64 -0.53 -4.66 113.62 115.62 4tf4 n SER 253 Ca 0.07 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.06 4tf4 n SER 253 Cb 0.50 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 4tf4 n SER 253 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4tf4 n TYR 254 N 1.18 0.00 1.31 1.43 0.18 -1.26 -4.91 117.16 115.09 4tf4 n TYR 254 Ca 0.19 0.00 0.13 0.00 1.88 0.00 0.00 57.90 60.10 4tf4 n TYR 254 Cb 0.11 0.01 0.36 0.00 -0.38 0.00 0.00 39.34 39.44 4tf4 n TYR 254 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 4tf4 n ARG 255 N 0.00 1.78 0.00 -3.48 1.74 -1.26 -4.57 116.66 110.87 4tf4 n ARG 255 Ca 0.00 -1.22 0.00 0.00 -0.77 0.00 0.00 57.85 55.86 4tf4 n ARG 255 Cb 0.27 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 4tf4 n ARG 255 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 4tf4 n TRP 256 N 0.45 0.00 -3.83 -1.55 -0.00 -1.26 -5.02 117.44 106.24 4tf4 n TRP 256 Ca 0.17 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.60 4tf4 n TRP 256 Cb 0.43 0.00 -0.00 0.00 -0.00 0.00 0.00 31.31 31.74 4tf4 n TRP 256 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 4tf4 s THR 257 N 3.48 0.00 0.10 5.87 -1.32 -1.26 -5.05 115.64 117.46 4tf4 s THR 257 Ca 0.00 -0.90 -0.30 0.00 -1.21 0.00 0.00 61.69 59.27 4tf4 s THR 257 Cb 0.00 -2.37 -0.06 0.00 -1.51 0.00 0.00 72.50 68.56 4tf4 s THR 257 CO 0.00 0.00 1.18 -0.51 -2.21 0.00 0.00 174.62 173.08 4tf4 s ILE 258 N -3.12 3.94 0.36 5.08 2.07 -1.26 -4.75 121.20 123.52 4tf4 s ILE 258 Ca 0.14 1.48 -0.14 0.00 -1.41 0.00 0.00 60.65 60.71 4tf4 s ILE 258 Cb -0.05 -3.95 0.04 0.00 0.13 0.00 0.00 42.46 38.64 4tf4 s ILE 258 CO 0.07 0.16 0.72 0.00 -1.91 0.00 0.00 174.94 173.99 4tf4 s ALA 259 N 0.63 -0.55 0.65 1.50 0.00 -1.13 -4.80 121.76 118.06 4tf4 s ALA 259 Ca 0.56 -0.81 0.15 0.00 0.00 0.00 0.00 51.96 51.85 4tf4 s ALA 259 Cb -0.30 0.79 0.74 0.00 0.00 0.00 0.00 23.12 24.35 4tf4 s ALA 259 CO 0.31 -0.96 1.39 0.11 0.00 0.00 0.00 175.76 176.62 4tf4 h TRP 260 N 2.03 0.00 0.00 0.00 5.08 -1.95 -2.43 115.95 118.67 4tf4 h TRP 260 Ca -0.30 0.00 -0.43 0.00 1.08 0.00 0.00 58.89 59.25 4tf4 h TRP 260 Cb 1.25 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 27.34 4tf4 h TRP 260 CO 1.23 0.00 -2.52 -3.47 -1.28 0.00 0.00 178.44 172.40 4tf4 n ASP 261 N -2.82 1.97 -4.21 0.11 2.03 -1.26 -4.77 116.55 107.60 4tf4 n ASP 261 Ca 0.03 0.07 -0.36 0.00 0.52 0.00 0.00 54.79 55.06 4tf4 n ASP 261 Cb 0.85 -0.59 -0.13 0.00 -0.72 0.00 0.00 41.12 40.53 4tf4 n ASP 261 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 4tf4 s ASP 262 N -6.96 4.93 0.00 1.67 -1.08 -0.92 -4.69 116.67 109.62 4tf4 s ASP 262 Ca -0.37 -1.16 0.23 0.00 -0.52 0.00 0.00 52.55 50.74 4tf4 s ASP 262 Cb 0.12 -1.75 0.56 0.00 -1.46 0.00 0.00 42.92 40.38 4tf4 s ASP 262 CO 0.55 -0.25 1.49 0.29 0.52 0.00 0.00 175.17 177.76 4tf4 n LYS 263 N 4.69 2.64 -0.15 4.34 4.01 -1.26 -2.84 118.16 129.58 4tf4 n LYS 263 Ca -0.14 -2.52 -0.03 0.00 -0.51 0.00 0.00 58.31 55.12 4tf4 n LYS 263 Cb 0.44 -1.55 0.06 0.00 -0.51 0.00 0.00 35.03 33.47 4tf4 n LYS 263 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 4tf4 h SER 264 N 4.43 -0.14 -0.93 4.39 0.02 -1.93 -1.91 113.55 117.48 4tf4 h SER 264 Ca 0.00 0.11 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 4tf4 h SER 264 Cb 1.00 0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.67 4tf4 h SER 264 CO 0.00 -0.04 0.61 1.88 -1.14 0.00 0.00 176.83 178.14 4tf4 h TYR 265 N 0.15 1.19 -0.37 3.45 -1.99 -1.91 -2.26 116.97 115.22 4tf4 h TYR 265 Ca 0.24 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.96 4tf4 h TYR 265 Cb 0.35 -0.40 -0.02 0.00 2.00 0.00 0.00 36.73 38.67 4tf4 h TYR 265 CO -0.28 0.76 0.11 0.78 -0.00 0.00 0.00 178.16 179.53 4tf4 h GLY 266 N 1.27 0.62 1.47 3.88 0.00 -1.67 -2.92 103.07 105.72 4tf4 h GLY 266 Ca 0.34 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 4tf4 h GLY 266 CO -0.07 0.35 0.33 -0.91 0.00 0.00 0.00 176.54 176.24 4tf4 h THR 267 N 0.45 1.15 -0.29 4.70 1.35 -0.98 0.07 112.91 119.35 4tf4 h THR 267 Ca 0.12 -0.31 0.06 0.00 -0.55 0.00 0.00 66.41 65.73 4tf4 h THR 267 Cb 0.26 0.38 -0.06 0.00 -1.73 0.00 0.00 68.15 67.00 4tf4 h THR 267 CO -0.00 0.15 -0.11 1.88 -0.25 0.00 0.00 175.52 177.19 4tf4 h TYR 268 N 0.73 -0.26 -0.08 4.73 0.05 -1.22 -0.06 116.97 120.86 4tf4 h TYR 268 Ca 0.19 0.03 -0.17 0.00 0.05 0.00 0.00 58.73 58.83 4tf4 h TYR 268 Cb -0.05 0.16 0.01 0.00 1.01 0.00 0.00 36.73 37.87 4tf4 h TYR 268 CO 0.00 -0.18 -0.61 0.28 -1.05 0.00 0.00 178.16 176.60 4tf4 h VAL 269 N -0.06 1.36 -0.20 -2.88 2.07 -1.43 -2.65 116.25 112.46 4tf4 h VAL 269 Ca 0.15 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.73 4tf4 h VAL 269 Cb 0.28 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.32 4tf4 h VAL 269 CO -0.34 0.59 0.13 -0.07 0.02 0.00 0.00 177.57 177.90 4tf4 h LEU 270 N 0.15 0.23 -0.80 2.57 3.38 -0.78 0.72 115.31 120.78 4tf4 h LEU 270 Ca -0.06 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 4tf4 h LEU 270 Cb 1.27 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 4tf4 h LEU 270 CO 0.12 0.18 -0.52 -0.07 0.09 0.00 0.00 178.44 178.25 4tf4 h LEU 271 N 0.26 0.23 -0.66 1.67 3.38 -1.12 -0.42 115.31 118.65 4tf4 h LEU 271 Ca 0.07 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 4tf4 h LEU 271 Cb -0.02 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 4tf4 h LEU 271 CO -0.01 0.71 0.14 0.00 0.09 0.00 0.00 178.44 179.36 4tf4 h ALA 272 N 1.30 0.88 -0.52 1.53 0.00 -1.15 0.20 119.26 121.50 4tf4 h ALA 272 Ca 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 4tf4 h ALA 272 Cb 0.97 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 4tf4 h ALA 272 CO 0.08 0.61 -0.14 -0.22 0.00 0.00 0.00 179.25 179.58 4tf4 h LYS 273 N 1.00 0.99 0.09 0.00 3.64 -0.57 -0.86 116.57 120.87 4tf4 h LYS 273 Ca 0.21 -0.38 -0.00 0.00 -1.27 0.00 0.00 60.65 59.20 4tf4 h LYS 273 Cb 0.39 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 4tf4 h LYS 273 CO 0.01 1.06 -0.04 1.49 -2.27 0.00 0.00 179.45 179.69 4tf4 h GLU 274 N 0.88 -0.11 0.09 1.90 4.57 -0.73 -3.41 114.58 117.77 4tf4 h GLU 274 Ca 0.13 0.01 -0.29 0.00 -1.18 0.00 0.00 59.36 58.03 4tf4 h GLU 274 Cb 0.70 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.31 4tf4 h GLU 274 CO 0.05 0.36 -1.54 1.79 -1.18 0.00 0.00 179.01 178.49 4tf4 h THR 275 N -0.94 0.89 0.00 0.32 1.35 -0.72 -3.49 112.91 110.33 4tf4 h THR 275 Ca -0.01 -2.34 0.00 0.00 -0.55 0.00 0.00 66.41 63.51 4tf4 h THR 275 Cb 0.52 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 4tf4 h THR 275 CO 0.02 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 4tf4 n GLY 276 N 1.75 0.71 3.75 5.82 0.00 -0.33 -5.03 105.19 111.85 4tf4 n GLY 276 Ca -0.28 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 4tf4 n GLY 276 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4tf4 s LYS 277 N -0.61 4.47 0.30 1.61 1.02 -1.26 -4.92 119.74 120.34 4tf4 s LYS 277 Ca 0.00 1.97 0.03 0.00 0.02 0.00 0.00 55.97 57.99 4tf4 s LYS 277 Cb 0.00 -3.19 0.62 0.00 -0.52 0.00 0.00 37.83 34.74 4tf4 s LYS 277 CO 0.00 -0.10 1.83 0.37 -0.92 0.00 0.00 175.35 176.53 4tf4 h GLN 278 N 4.72 0.89 -0.66 1.68 5.75 -1.97 -2.06 115.11 123.47 4tf4 h GLN 278 Ca -0.46 -0.05 0.13 0.00 -0.15 0.00 0.00 58.65 58.12 4tf4 h GLN 278 Cb 1.22 -0.20 -0.12 0.00 1.07 0.00 0.00 27.48 29.44 4tf4 h GLN 278 CO 0.72 0.59 -0.12 -0.22 -2.65 0.00 0.00 178.83 177.15 4tf4 h LYS 279 N 0.92 0.03 -0.12 1.69 3.64 -2.00 0.44 116.57 121.16 4tf4 h LYS 279 Ca 0.50 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.76 4tf4 h LYS 279 Cb 0.59 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 4tf4 h LYS 279 CO -0.27 0.02 -0.41 1.88 -2.27 0.00 0.00 179.45 178.40 4tf4 h TYR 280 N 0.03 0.64 -0.99 1.91 0.05 -1.71 -3.18 116.97 113.72 4tf4 h TYR 280 Ca 0.33 -0.26 0.11 0.00 0.05 0.00 0.00 58.73 58.96 4tf4 h TYR 280 Cb 0.51 -0.11 -0.08 0.00 1.01 0.00 0.00 36.73 38.06 4tf4 h TYR 280 CO -0.49 1.02 0.62 0.82 -1.05 0.00 0.00 178.16 179.07 4tf4 h ILE 281 N 0.08 0.93 -0.01 -2.88 2.04 -0.97 -0.40 117.51 116.30 4tf4 h ILE 281 Ca -0.02 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 4tf4 h ILE 281 Cb 1.04 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 4tf4 h ILE 281 CO 0.09 0.18 0.00 0.44 0.00 0.00 0.00 178.15 178.86 4tf4 h ASP 282 N 0.99 0.01 -0.00 1.72 3.32 -0.97 0.85 116.42 122.35 4tf4 h ASP 282 Ca 0.48 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.40 4tf4 h ASP 282 Cb 0.45 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 4tf4 h ASP 282 CO -0.26 0.16 -0.07 0.44 -1.72 0.00 0.00 179.24 177.79 4tf4 h ASP 283 N -0.13 -0.21 -0.96 6.45 3.32 -1.37 -0.33 116.42 123.18 4tf4 h ASP 283 Ca 0.00 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.12 4tf4 h ASP 283 Cb 0.15 0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.74 4tf4 h ASP 283 CO -0.00 -0.11 0.63 0.00 -1.72 0.00 0.00 179.24 178.04 4tf4 h ALA 284 N 0.86 1.27 -0.05 3.45 0.00 -1.01 -1.87 119.26 121.91 4tf4 h ALA 284 Ca 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 4tf4 h ALA 284 Cb 0.17 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 4tf4 h ALA 284 CO -0.08 0.51 0.02 -0.91 0.00 0.00 0.00 179.25 178.79 4tf4 h ASN 285 N 1.22 0.07 -0.80 0.00 -0.26 -0.38 -1.88 115.58 113.54 4tf4 h ASN 285 Ca 0.38 -0.18 0.03 0.00 -0.56 0.00 0.00 56.30 55.97 4tf4 h ASN 285 Cb -0.01 -0.02 -0.05 0.00 -1.06 0.00 0.00 38.32 37.19 4tf4 h ASN 285 CO -0.12 0.23 0.51 -0.09 -1.06 0.00 0.00 177.43 176.90 4tf4 h ARG 286 N -0.10 0.96 0.61 0.81 2.43 -0.75 0.11 114.38 118.45 4tf4 h ARG 286 Ca 0.02 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 4tf4 h ARG 286 Cb 0.19 -0.22 0.01 0.00 -0.42 0.00 0.00 29.97 29.53 4tf4 h ARG 286 CO -0.00 0.64 -0.29 2.35 -1.51 0.00 0.00 179.97 181.15 4tf4 h TRP 287 N 0.99 -0.76 0.00 2.20 7.01 -1.28 -1.99 115.95 122.11 4tf4 h TRP 287 Ca 0.32 -0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.28 4tf4 h TRP 287 Cb 0.02 0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 27.33 4tf4 h TRP 287 CO -0.03 -0.42 -0.09 -0.07 -2.79 0.00 0.00 178.44 175.04 4tf4 h LEU 288 N -1.03 0.00 -0.07 0.65 3.38 -1.27 -1.89 115.31 115.09 4tf4 h LEU 288 Ca -0.08 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.70 4tf4 h LEU 288 Cb 0.68 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.44 4tf4 h LEU 288 CO 0.14 0.09 -0.67 0.44 0.09 0.00 0.00 178.44 178.53 4tf4 h ASP 289 N 0.00 0.71 -0.40 -0.43 3.32 -0.91 -2.57 116.42 116.13 4tf4 h ASP 289 Ca -0.00 -0.69 0.10 0.00 0.02 0.00 0.00 57.03 56.47 4tf4 h ASP 289 Cb 0.25 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 4tf4 h ASP 289 CO 0.01 1.29 0.28 0.22 -1.72 0.00 0.00 179.24 179.32 4tf4 h TYR 290 N 0.19 0.07 0.00 4.55 3.20 -0.56 0.55 116.97 124.97 4tf4 h TYR 290 Ca -0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.81 4tf4 h TYR 290 Cb 1.33 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.58 4tf4 h TYR 290 CO 0.12 0.03 -0.31 0.91 -1.64 0.00 0.00 178.16 177.27 4tf4 n TRP 291 N -4.44 0.66 0.00 -3.82 7.02 -1.05 -1.60 117.44 114.21 4tf4 n TRP 291 Ca 0.06 0.19 0.00 0.00 -1.02 0.00 0.00 57.50 56.73 4tf4 n TRP 291 Cb 0.43 -0.75 0.00 0.00 -2.42 0.00 0.00 31.31 28.57 4tf4 n TRP 291 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 4tf4 n THR 292 N -2.11 0.00 0.05 -0.99 -2.24 0.31 -4.82 114.28 104.49 4tf4 n THR 292 Ca 0.05 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.78 4tf4 n THR 292 Cb 0.42 -0.46 -0.09 0.00 -2.10 0.00 0.00 70.33 68.11 4tf4 n THR 292 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 4tf4 h VAL 293 N 0.00 1.14 0.00 2.28 -1.51 -1.58 -3.48 116.25 113.10 4tf4 h VAL 293 Ca 0.00 -2.77 0.00 0.00 -1.23 0.00 0.00 66.70 62.70 4tf4 h VAL 293 Cb 0.00 2.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.69 4tf4 h VAL 293 CO 0.00 0.65 0.00 0.61 -1.23 0.00 0.00 177.57 177.60 4tf4 n GLY 294 N 1.38 2.38 2.86 5.19 0.00 0.17 -4.93 105.19 112.24 4tf4 n GLY 294 Ca -0.05 -1.92 -0.21 0.00 0.00 0.00 0.00 46.02 43.83 4tf4 n GLY 294 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 4tf4 s VAL 295 N -2.93 0.52 -1.74 1.61 -7.23 0.11 -4.55 120.40 106.20 4tf4 s VAL 295 Ca 0.00 -0.06 0.00 0.00 -1.81 0.00 0.00 61.98 60.11 4tf4 s VAL 295 Cb 0.00 -0.58 0.00 0.00 0.56 0.00 0.00 36.38 36.36 4tf4 s VAL 295 CO 0.00 0.24 0.00 0.59 -0.31 0.00 0.00 175.10 175.62 4tf4 n ASN 296 N 4.42 -5.46 0.00 4.85 4.13 -1.26 -1.48 115.26 120.45 4tf4 n ASN 296 Ca -0.19 0.11 0.00 0.00 1.68 0.00 0.00 54.58 56.18 4tf4 n ASN 296 Cb 0.51 -4.54 0.00 0.00 -1.54 0.00 0.00 39.78 34.20 4tf4 n ASN 296 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 4tf4 n GLY 297 N -0.92 2.28 3.85 7.41 0.00 -1.26 -5.04 105.19 111.51 4tf4 n GLY 297 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 4tf4 n GLY 297 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4tf4 s GLN 298 N -0.60 3.92 -0.11 1.61 -0.21 -0.55 -5.05 119.66 118.67 4tf4 s GLN 298 Ca 0.00 0.40 -0.23 0.00 0.02 0.00 0.00 55.36 55.55 4tf4 s GLN 298 Cb 0.00 -2.94 0.05 0.00 1.00 0.00 0.00 33.01 31.12 4tf4 s GLN 298 CO 0.00 0.50 0.55 0.50 -2.12 0.00 0.00 175.29 174.72 4tf4 s ARG 299 N -1.96 0.82 0.40 2.91 3.52 -1.26 0.09 118.95 123.46 4tf4 s ARG 299 Ca 0.37 0.36 -0.27 0.00 -0.13 0.00 0.00 55.73 56.06 4tf4 s ARG 299 Cb -0.15 0.39 -0.10 0.00 -1.56 0.00 0.00 34.95 33.53 4tf4 s ARG 299 CO 0.19 -0.20 1.48 1.55 -0.81 0.00 0.00 175.30 177.51 4tf4 n VAL 300 N 1.72 2.19 -1.70 7.11 3.14 -0.63 -4.89 118.33 125.28 4tf4 n VAL 300 Ca -0.18 -0.50 -0.43 0.00 -2.96 0.00 0.00 64.34 60.28 4tf4 n VAL 300 Cb 0.56 -1.96 -0.01 0.00 -1.06 0.00 0.00 33.84 31.37 4tf4 n VAL 300 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 4tf4 n PRO 301 N 0.28 2.17 -4.86 1.45 -0.02 -1.26 -4.88 135.00 127.88 4tf4 n PRO 301 Ca 0.02 0.76 -0.25 0.00 -2.02 0.00 0.00 63.50 62.01 4tf4 n PRO 301 Cb 0.40 -2.38 -0.15 0.00 -0.02 0.00 0.00 33.50 31.34 4tf4 n PRO 301 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 4tf4 s TYR 302 N -0.78 1.68 0.48 6.00 1.51 -1.26 -0.98 117.35 124.01 4tf4 s TYR 302 Ca 0.59 -0.32 -0.04 0.00 -1.01 0.00 0.00 57.07 56.29 4tf4 s TYR 302 Cb -0.58 -1.07 -0.02 0.00 -0.11 0.00 0.00 41.96 40.18 4tf4 s TYR 302 CO 0.58 -0.01 0.76 -1.54 -1.11 0.00 0.00 175.55 174.23 4tf4 s SER 303 N -0.54 6.03 0.50 2.29 1.04 -0.21 -4.91 113.70 117.90 4tf4 s SER 303 Ca 0.07 0.70 0.18 0.00 0.48 0.00 0.00 55.95 57.38 4tf4 s SER 303 Cb -0.07 -1.97 1.23 0.00 0.10 0.00 0.00 66.02 65.31 4tf4 s SER 303 CO -0.00 -0.68 2.07 -0.65 0.98 0.00 0.00 173.24 174.96 4tf4 h PRO 304 N 0.23 0.12 0.00 4.02 0.11 -1.91 -0.95 132.00 133.62 4tf4 h PRO 304 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 4tf4 h PRO 304 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 4tf4 h PRO 304 CO 0.61 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.88 4tf4 n GLY 305 N -1.56 -0.88 0.57 -0.55 0.00 -1.26 -4.88 105.19 96.63 4tf4 n GLY 305 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.94 4tf4 n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4tf4 n GLY 306 N 0.48 0.74 3.75 -0.02 0.00 -0.36 -4.79 105.19 104.99 4tf4 n GLY 306 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 4tf4 n GLY 306 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 4tf4 s MET 307 N -0.77 4.36 -0.42 1.61 -2.45 -1.26 -4.82 119.30 115.54 4tf4 s MET 307 Ca 0.00 0.77 -0.25 0.00 -1.25 0.00 0.00 55.69 54.96 4tf4 s MET 307 Cb 0.00 -3.37 0.02 0.00 1.25 0.00 0.00 34.83 32.73 4tf4 s MET 307 CO 0.00 0.29 0.89 0.00 1.05 0.00 0.00 175.02 177.25 4tf4 s ALA 308 N 0.06 3.32 -0.49 4.11 0.00 -1.26 -1.04 121.76 126.46 4tf4 s ALA 308 Ca 0.32 -0.69 -0.12 0.00 0.00 0.00 0.00 51.96 51.47 4tf4 s ALA 308 Cb -0.18 -3.55 0.11 0.00 0.00 0.00 0.00 23.12 19.50 4tf4 s ALA 308 CO 0.17 -1.83 0.39 0.08 0.00 0.00 0.00 175.76 174.58 4tf4 s VAL 309 N 3.53 4.70 0.05 0.00 1.01 -0.15 -4.60 120.40 124.94 4tf4 s VAL 309 Ca 0.36 -1.52 -0.00 0.00 0.00 0.00 0.00 61.98 60.82 4tf4 s VAL 309 Cb -0.11 -3.99 -0.26 0.00 0.00 0.00 0.00 36.38 32.02 4tf4 s VAL 309 CO 0.22 -0.73 1.02 0.25 0.00 0.00 0.00 175.10 175.86 4tf4 h LEU 310 N 8.64 0.29 -8.03 3.92 5.85 -1.85 -3.36 115.31 120.77 4tf4 h LEU 310 Ca -0.25 -0.36 0.05 0.00 0.84 0.00 0.00 57.88 58.15 4tf4 h LEU 310 Cb 1.09 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.98 4tf4 h LEU 310 CO 0.91 1.29 0.20 -0.62 -0.34 0.00 0.00 178.44 179.88 4tf4 s ASP 311 N -6.91 -0.21 0.13 1.25 2.15 -1.26 -5.01 116.67 106.81 4tf4 s ASP 311 Ca -0.05 -0.70 -0.08 0.00 0.43 0.00 0.00 52.55 52.15 4tf4 s ASP 311 Cb 0.08 0.73 -0.09 0.00 -0.30 0.00 0.00 42.92 43.33 4tf4 s ASP 311 CO 0.85 -1.36 1.33 0.74 -0.17 0.00 0.00 175.17 176.56 4tf4 h THR 312 N 2.02 1.32 -3.56 1.71 2.02 -1.93 -3.36 112.91 111.13 4tf4 h THR 312 Ca -0.21 -2.12 -0.63 0.00 0.77 0.00 0.00 66.41 64.22 4tf4 h THR 312 Cb 1.25 2.13 -0.13 0.00 -1.74 0.00 0.00 68.15 69.66 4tf4 h THR 312 CO 0.26 0.66 0.09 0.86 0.37 0.00 0.00 175.52 177.75 4tf4 s TRP 313 N -3.59 3.20 -1.21 3.16 -0.11 -1.26 -4.30 118.94 114.83 4tf4 s TRP 313 Ca -0.08 0.46 -0.05 0.00 1.22 0.00 0.00 56.10 57.66 4tf4 s TRP 313 Cb 0.09 -2.98 0.01 0.00 -1.50 0.00 0.00 33.47 29.09 4tf4 s TRP 313 CO 0.88 -0.50 1.04 0.41 -4.62 0.00 0.00 176.95 174.16 4tf4 n GLY 314 N 4.54 -0.39 0.18 5.86 0.00 -1.16 -4.92 105.19 109.30 4tf4 n GLY 314 Ca -0.02 0.14 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 4tf4 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4tf4 h ALA 315 N 0.91 0.36 -0.23 4.61 0.00 -1.68 -1.31 119.26 121.91 4tf4 h ALA 315 Ca -0.55 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 4tf4 h ALA 315 Cb 1.34 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 4tf4 h ALA 315 CO 0.50 -0.42 0.11 -0.07 0.00 0.00 0.00 179.25 179.37 4tf4 h LEU 316 N 0.05 0.28 -0.39 0.00 3.38 -1.35 -2.43 115.31 114.86 4tf4 h LEU 316 Ca 0.22 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 4tf4 h LEU 316 Cb 0.33 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 4tf4 h LEU 316 CO -0.41 0.25 0.20 -0.09 0.09 0.00 0.00 178.44 178.48 4tf4 h ARG 317 N 0.32 0.54 0.44 1.13 1.12 -1.48 0.10 114.38 116.56 4tf4 h ARG 317 Ca 0.08 -0.07 -0.02 0.00 -1.11 0.00 0.00 59.98 58.86 4tf4 h ARG 317 Cb 0.04 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 29.90 4tf4 h ARG 317 CO -0.01 0.46 -0.21 1.88 -3.11 0.00 0.00 179.97 178.97 4tf4 h TYR 318 N 0.49 -0.55 -0.84 2.20 0.05 -1.28 0.15 116.97 117.19 4tf4 h TYR 318 Ca 0.13 -0.01 0.10 0.00 0.05 0.00 0.00 58.73 59.00 4tf4 h TYR 318 Cb 0.08 0.18 -0.06 0.00 1.01 0.00 0.00 36.73 37.94 4tf4 h TYR 318 CO -0.02 -0.30 0.54 0.00 -1.05 0.00 0.00 178.16 177.33 4tf4 h ALA 319 N -0.14 1.72 -0.39 3.88 0.00 -1.38 -1.22 119.26 121.73 4tf4 h ALA 319 Ca -0.06 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 4tf4 h ALA 319 Cb 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 4tf4 h ALA 319 CO 0.10 0.11 -0.36 0.00 0.00 0.00 0.00 179.25 179.09 4tf4 h ALA 320 N 1.58 0.61 -0.58 0.00 0.00 -0.57 -0.41 119.26 119.89 4tf4 h ALA 320 Ca 0.39 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 4tf4 h ALA 320 Cb 0.45 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 4tf4 h ALA 320 CO -0.16 0.68 0.22 -0.91 0.00 0.00 0.00 179.25 179.08 4tf4 h ASN 321 N 0.77 0.80 -0.23 0.00 2.35 -0.10 -1.92 115.58 117.25 4tf4 h ASN 321 Ca 0.07 -0.18 -0.11 0.00 -0.55 0.00 0.00 56.30 55.53 4tf4 h ASN 321 Cb 0.95 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 4tf4 h ASN 321 CO 0.09 0.76 -0.23 0.74 -1.65 0.00 0.00 177.43 177.14 4tf4 h THR 322 N 0.79 1.27 -0.81 2.81 2.02 -1.15 -2.63 112.91 115.22 4tf4 h THR 322 Ca 0.19 -1.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.03 4tf4 h THR 322 Cb 0.21 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 4tf4 h THR 322 CO -0.01 0.44 0.45 0.00 0.37 0.00 0.00 175.52 176.76 4tf4 h ALA 323 N 1.13 1.03 0.61 6.16 0.00 -0.68 0.38 119.26 127.89 4tf4 h ALA 323 Ca 0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 4tf4 h ALA 323 Cb 0.72 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.19 4tf4 h ALA 323 CO 0.06 0.53 -0.29 0.35 0.00 0.00 0.00 179.25 179.90 4tf4 h PHE 324 N 1.12 -0.76 -0.99 0.00 3.57 -1.23 -2.39 116.94 116.25 4tf4 h PHE 324 Ca 0.28 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.95 4tf4 h PHE 324 Cb 0.02 0.25 -0.10 0.00 2.79 0.00 0.00 35.95 38.91 4tf4 h PHE 324 CO 0.00 -0.47 0.61 0.28 -2.23 0.00 0.00 178.31 176.51 4tf4 h VAL 325 N -0.95 0.74 -0.40 1.41 2.07 -1.42 0.41 116.25 118.10 4tf4 h VAL 325 Ca -0.08 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.22 4tf4 h VAL 325 Cb 0.63 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 4tf4 h VAL 325 CO 0.14 0.14 0.17 0.00 0.02 0.00 0.00 177.57 178.04 4tf4 h ALA 326 N 1.62 0.49 -0.80 1.67 0.00 -0.89 -0.10 119.26 121.26 4tf4 h ALA 326 Ca 0.55 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.48 4tf4 h ALA 326 Cb 0.88 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 4tf4 h ALA 326 CO -0.33 -0.20 0.44 -0.07 0.00 0.00 0.00 179.25 179.09 4tf4 h LEU 327 N 0.36 1.00 0.07 0.00 3.38 -0.40 0.13 115.31 119.85 4tf4 h LEU 327 Ca 0.18 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 4tf4 h LEU 327 Cb 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.62 4tf4 h LEU 327 CO -0.16 0.81 -0.03 0.58 0.09 0.00 0.00 178.44 179.73 4tf4 h VAL 328 N 1.11 0.97 -0.52 1.22 2.07 -0.67 -2.89 116.25 117.54 4tf4 h VAL 328 Ca 0.28 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.64 4tf4 h VAL 328 Cb 0.03 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 4tf4 h VAL 328 CO -0.05 0.03 0.21 0.22 0.02 0.00 0.00 177.57 178.00 4tf4 h TYR 329 N -0.16 0.76 -0.13 1.57 3.20 -0.74 -2.40 116.97 119.07 4tf4 h TYR 329 Ca -0.01 -0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.86 4tf4 h TYR 329 Cb 0.13 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 4tf4 h TYR 329 CO -0.05 0.59 0.19 0.00 -1.64 0.00 0.00 178.16 177.25 4tf4 h ALA 330 N 1.48 1.62 0.00 1.82 0.00 -0.53 -1.37 119.26 122.28 4tf4 h ALA 330 Ca 0.18 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 4tf4 h ALA 330 Cb 0.16 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 4tf4 h ALA 330 CO -0.02 -0.26 -1.14 0.87 0.00 0.00 0.00 179.25 178.70 4tf4 h LYS 331 N 0.00 0.00 0.08 0.00 1.57 -1.39 -3.39 116.57 113.44 4tf4 h LYS 331 Ca 0.06 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.51 4tf4 h LYS 331 Cb 0.45 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 4tf4 h LYS 331 CO -0.00 0.42 -1.87 1.33 -0.57 0.00 0.00 179.45 178.75 4tf4 n VAL 332 N -3.03 1.72 -2.35 0.50 0.24 -0.58 -4.90 118.33 109.93 4tf4 n VAL 332 Ca -0.06 -0.71 -0.41 0.00 -2.04 0.00 0.00 64.34 61.12 4tf4 n VAL 332 Cb 0.83 -1.47 -0.04 0.00 -1.47 0.00 0.00 33.84 31.69 4tf4 n VAL 332 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 4tf4 s ILE 333 N -2.58 3.27 -0.05 1.34 2.07 -0.80 -4.94 121.20 119.51 4tf4 s ILE 333 Ca -0.15 1.24 0.13 0.00 -1.41 0.00 0.00 60.65 60.45 4tf4 s ILE 333 Cb 0.07 -3.79 -0.14 0.00 0.13 0.00 0.00 42.46 38.74 4tf4 s ILE 333 CO 0.79 0.28 1.03 0.44 -1.91 0.00 0.00 174.94 175.57 4tf4 h ASP 334 N 3.93 0.00 -1.42 4.50 3.32 -1.92 -3.46 116.42 121.38 4tf4 h ASP 334 Ca -0.47 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 55.94 4tf4 h ASP 334 Cb 1.22 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 4tf4 h ASP 334 CO 0.68 0.78 1.41 -0.67 -1.72 0.00 0.00 179.24 179.71 4tf4 n ASP 335 N -3.12 2.56 -0.32 6.45 -0.08 -1.26 -4.85 116.55 115.94 4tf4 n ASP 335 Ca -0.07 0.41 0.01 0.00 -1.51 0.00 0.00 54.79 53.63 4tf4 n ASP 335 Cb 0.90 -1.35 0.15 0.00 2.34 0.00 0.00 41.12 43.15 4tf4 n ASP 335 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 4tf4 h PRO 336 N 12.83 0.96 0.34 -0.67 0.11 -1.99 0.10 132.00 143.68 4tf4 h PRO 336 Ca -0.33 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.70 4tf4 h PRO 336 Cb 1.29 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.19 4tf4 h PRO 336 CO 1.00 0.63 -0.16 0.28 -0.21 0.00 0.00 178.00 179.53 4tf4 h VAL 337 N 0.99 0.67 -0.59 3.15 2.07 -2.00 -2.13 116.25 118.41 4tf4 h VAL 337 Ca 0.38 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.52 4tf4 h VAL 337 Cb 0.18 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 4tf4 h VAL 337 CO -0.18 0.08 0.38 0.03 0.02 0.00 0.00 177.57 177.89 4tf4 h ARG 338 N -0.68 0.79 -0.79 1.57 3.08 -1.90 -1.20 114.38 115.24 4tf4 h ARG 338 Ca -0.05 -0.06 0.09 0.00 0.07 0.00 0.00 59.98 60.03 4tf4 h ARG 338 Cb 0.48 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 4tf4 h ARG 338 CO 0.08 0.54 0.45 -0.22 -1.07 0.00 0.00 179.97 179.75 4tf4 h LYS 339 N 0.80 0.75 0.04 0.04 3.64 -0.80 -0.79 116.57 120.25 4tf4 h LYS 339 Ca 0.21 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 4tf4 h LYS 339 Cb -0.06 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 4tf4 h LYS 339 CO -0.04 0.49 -0.02 0.37 -2.27 0.00 0.00 179.45 177.98 4tf4 h GLN 340 N 0.77 -0.05 -0.20 1.90 4.15 -0.98 -2.32 115.11 118.38 4tf4 h GLN 340 Ca 0.38 0.00 0.05 0.00 0.77 0.00 0.00 58.65 59.86 4tf4 h GLN 340 Cb 0.33 0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.96 4tf4 h GLN 340 CO -0.24 0.34 -0.34 -0.09 -1.93 0.00 0.00 178.83 176.58 4tf4 h ARG 341 N -0.46 -0.36 -0.04 1.69 2.43 -0.80 0.16 114.38 116.98 4tf4 h ARG 341 Ca -0.01 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 4tf4 h ARG 341 Cb 0.42 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.05 4tf4 h ARG 341 CO 0.01 -0.24 0.02 1.88 -1.51 0.00 0.00 179.97 180.12 4tf4 h TYR 342 N -0.38 0.07 -0.26 2.20 0.05 -1.23 -1.00 116.97 116.43 4tf4 h TYR 342 Ca 0.11 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.90 4tf4 h TYR 342 Cb 0.56 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.26 4tf4 h TYR 342 CO -0.45 0.22 0.12 1.25 -1.05 0.00 0.00 178.16 178.25 4tf4 h HIS 343 N -0.11 0.22 -0.51 4.88 2.76 -1.16 -1.60 115.15 119.63 4tf4 h HIS 343 Ca 0.01 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.12 4tf4 h HIS 343 Cb 0.18 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 4tf4 h HIS 343 CO -0.01 0.12 0.03 -0.44 -1.30 0.00 0.00 177.93 176.33 4tf4 h ASP 344 N 0.26 0.81 -0.37 3.26 5.19 -0.67 -2.34 116.42 122.56 4tf4 h ASP 344 Ca 0.11 -0.19 0.01 0.00 -0.62 0.00 0.00 57.03 56.33 4tf4 h ASP 344 Cb 0.04 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.32 4tf4 h ASP 344 CO -0.08 0.85 0.24 0.15 -3.12 0.00 0.00 179.24 177.28 4tf4 h PHE 345 N 0.79 0.46 0.25 4.55 3.57 -0.82 -1.90 116.94 123.84 4tf4 h PHE 345 Ca 0.16 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 4tf4 h PHE 345 Cb 0.43 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.02 4tf4 h PHE 345 CO 0.02 0.28 -0.12 0.00 -2.23 0.00 0.00 178.31 176.27 4tf4 h ALA 346 N 1.14 -0.33 -0.96 2.41 0.00 -1.02 -1.60 119.26 118.90 4tf4 h ALA 346 Ca 0.14 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.03 4tf4 h ALA 346 Cb -0.05 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 4tf4 h ALA 346 CO -0.04 -0.67 0.61 0.28 0.00 0.00 0.00 179.25 179.44 4tf4 h VAL 347 N -0.38 1.05 0.07 0.00 2.07 -1.38 -1.23 116.25 116.45 4tf4 h VAL 347 Ca -0.03 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 4tf4 h VAL 347 Cb 0.29 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 4tf4 h VAL 347 CO 0.06 0.20 -0.03 -0.09 0.02 0.00 0.00 177.57 177.72 4tf4 h ARG 348 N 1.09 -0.09 -0.91 1.57 9.65 -1.10 0.80 114.38 125.39 4tf4 h ARG 348 Ca 0.42 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.33 4tf4 h ARG 348 Cb 0.21 0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.76 4tf4 h ARG 348 CO -0.19 0.02 0.60 1.96 2.80 0.00 0.00 179.97 185.16 4tf4 h GLN 349 N -0.18 1.15 -0.19 0.20 1.08 -0.90 0.97 115.11 117.23 4tf4 h GLN 349 Ca -0.01 -0.07 -0.09 0.00 -1.45 0.00 0.00 58.65 57.04 4tf4 h GLN 349 Cb 0.15 -0.26 -0.00 0.00 -0.05 0.00 0.00 27.48 27.32 4tf4 h GLN 349 CO 0.02 0.76 -0.21 0.82 -0.95 0.00 0.00 178.83 179.26 4tf4 h ILE 350 N 1.18 1.33 -0.95 2.54 1.08 -1.06 -2.66 117.51 118.98 4tf4 h ILE 350 Ca 0.35 -1.39 0.03 0.00 -0.39 0.00 0.00 64.86 63.46 4tf4 h ILE 350 Cb -0.06 1.79 -0.05 0.00 -3.07 0.00 0.00 36.82 35.43 4tf4 h ILE 350 CO -0.10 0.42 0.62 0.78 -0.69 0.00 0.00 178.15 179.19 4tf4 h ASN 351 N 0.15 1.04 -0.36 1.72 4.21 -0.52 -0.39 115.58 121.44 4tf4 h ASN 351 Ca 0.03 -0.02 0.03 0.00 1.21 0.00 0.00 56.30 57.55 4tf4 h ASN 351 Cb 0.76 -0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 37.69 4tf4 h ASN 351 CO 0.05 0.73 0.17 0.22 -1.29 0.00 0.00 177.43 177.31 4tf4 h TYR 352 N 1.22 0.32 -0.26 1.19 5.03 -0.70 0.02 116.97 123.79 4tf4 h TYR 352 Ca 0.37 0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.64 4tf4 h TYR 352 Cb -0.04 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.14 4tf4 h TYR 352 CO -0.00 0.17 -0.08 0.00 -1.32 0.00 0.00 178.16 176.92 4tf4 h ALA 353 N 1.19 1.38 -0.00 1.82 0.00 -0.93 -2.70 119.26 120.02 4tf4 h ALA 353 Ca 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.84 4tf4 h ALA 353 Cb 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.74 4tf4 h ALA 353 CO -0.11 0.42 -0.03 1.28 0.00 0.00 0.00 179.25 180.81 4tf4 n LEU 354 N -4.25 0.39 0.00 0.00 4.77 -0.26 -1.38 117.00 116.27 4tf4 n LEU 354 Ca 0.00 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 4tf4 n LEU 354 Cb 0.28 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 4tf4 n LEU 354 CO 0.39 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 4tf4 n GLY 355 N 1.14 1.08 3.25 -0.72 0.00 -0.65 -4.50 105.19 104.79 4tf4 n GLY 355 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 4tf4 n GLY 355 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 4tf4 n ASP 356 N 0.00 4.45 -3.56 1.61 2.03 -0.10 -3.47 116.55 117.51 4tf4 n ASP 356 Ca 0.00 -2.88 -0.13 0.00 0.52 0.00 0.00 54.79 52.30 4tf4 n ASP 356 Cb 0.00 -1.70 -0.05 0.00 -0.72 0.00 0.00 41.12 38.64 4tf4 n ASP 356 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 4tf4 s ASN 357 N 3.90 0.63 0.54 1.67 2.20 -1.26 -4.10 114.94 118.51 4tf4 s ASN 357 Ca 0.52 -1.36 0.23 0.00 -0.94 0.00 0.00 52.86 51.30 4tf4 s ASN 357 Cb 0.08 0.60 1.39 0.00 -2.00 0.00 0.00 41.25 41.32 4tf4 s ASN 357 CO 0.02 -1.18 2.06 -0.65 -2.94 0.00 0.00 177.10 174.40 4tf4 h PRO 358 N 2.22 0.00 0.00 3.55 0.11 -1.89 0.06 132.00 136.04 4tf4 h PRO 358 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 4tf4 h PRO 358 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 4tf4 h PRO 358 CO 0.40 0.00 -0.38 0.54 -0.21 0.00 0.00 178.00 178.35 4tf4 n ARG 359 N -4.34 0.09 -2.83 1.05 1.74 -1.26 -4.92 116.66 106.19 4tf4 n ARG 359 Ca 0.05 0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 56.97 4tf4 n ARG 359 Cb 0.41 -1.57 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 4tf4 n ARG 359 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 4tf4 n ASN 360 N -1.71 -4.76 -4.29 0.55 2.85 0.01 -4.94 115.26 102.96 4tf4 n ASN 360 Ca 0.05 -0.12 -0.24 0.00 -0.11 0.00 0.00 54.58 54.17 4tf4 n ASN 360 Cb 0.37 -3.94 -0.12 0.00 1.24 0.00 0.00 39.78 37.33 4tf4 n ASN 360 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 4tf4 s SER 361 N -2.39 2.56 0.59 1.20 0.01 -1.23 -4.74 113.70 109.71 4tf4 s SER 361 Ca 0.18 -0.69 -0.14 0.00 1.31 0.00 0.00 55.95 56.61 4tf4 s SER 361 Cb -0.09 -0.14 -0.04 0.00 0.21 0.00 0.00 66.02 65.96 4tf4 s SER 361 CO 0.23 0.06 1.03 -0.55 0.41 0.00 0.00 173.24 174.41 4tf4 s SER 362 N -1.93 6.05 0.00 2.44 0.15 0.25 -3.89 113.70 116.75 4tf4 s SER 362 Ca 0.07 1.64 0.02 0.00 0.70 0.00 0.00 55.95 58.37 4tf4 s SER 362 Cb -0.10 -2.51 0.04 0.00 -1.71 0.00 0.00 66.02 61.75 4tf4 s SER 362 CO 0.04 -0.99 1.01 -1.22 1.20 0.00 0.00 173.24 173.29 4tf4 n TYR 363 N -2.22 0.07 -3.69 3.44 4.01 -0.48 -4.11 117.16 114.18 4tf4 n TYR 363 Ca 0.07 -0.47 -0.39 0.00 -0.16 0.00 0.00 57.90 56.95 4tf4 n TYR 363 Cb 0.54 -0.04 -0.12 0.00 -0.31 0.00 0.00 39.34 39.40 4tf4 n TYR 363 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 4tf4 s VAL 364 N -0.95 4.08 0.27 -0.72 1.01 -1.26 -1.38 120.40 121.45 4tf4 s VAL 364 Ca 0.03 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 4tf4 s VAL 364 Cb 0.02 -3.30 -0.14 0.00 0.00 0.00 0.00 36.38 32.96 4tf4 s VAL 364 CO 0.02 -0.21 1.20 0.52 0.00 0.00 0.00 175.10 176.64 4tf4 n VAL 365 N 4.88 1.54 -0.95 2.92 0.31 0.69 -1.56 118.33 126.16 4tf4 n VAL 365 Ca -0.12 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 4tf4 n VAL 365 Cb 0.45 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.15 4tf4 n VAL 365 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 4tf4 n GLY 366 N 1.49 0.32 3.10 2.92 0.00 -1.26 -1.04 105.19 110.72 4tf4 n GLY 366 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 4tf4 n GLY 366 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 4tf4 s PHE 367 N -1.76 1.07 0.00 1.61 5.36 -0.60 -4.83 117.98 118.83 4tf4 s PHE 367 Ca 0.00 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 4tf4 s PHE 367 Cb 0.00 -0.65 0.00 0.00 -0.34 0.00 0.00 43.02 42.03 4tf4 s PHE 367 CO 0.00 0.01 0.00 0.41 -1.46 0.00 0.00 175.22 174.18 4tf4 n GLY 368 N 2.17 -0.54 3.76 13.12 0.00 -1.26 -4.43 105.19 118.01 4tf4 n GLY 368 Ca -0.17 -1.11 -0.38 0.00 0.00 0.00 0.00 46.02 44.36 4tf4 n GLY 368 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 4tf4 s ASN 369 N -4.00 6.74 -1.28 1.61 2.47 -1.26 -4.46 114.94 114.75 4tf4 s ASN 369 Ca 0.00 0.88 -0.10 0.00 0.42 0.00 0.00 52.86 54.06 4tf4 s ASN 369 Cb 0.00 -2.28 -0.00 0.00 -1.45 0.00 0.00 41.25 37.52 4tf4 s ASN 369 CO 0.00 0.10 0.60 -3.20 -3.72 0.00 0.00 177.10 170.89 4tf4 n ASN 370 N 3.06 -2.57 -4.79 -4.21 4.05 -1.26 -0.59 115.26 108.95 4tf4 n ASN 370 Ca -0.09 -1.01 -0.30 0.00 0.45 0.00 0.00 54.58 53.62 4tf4 n ASN 370 Cb 0.52 -3.19 0.09 0.00 1.23 0.00 0.00 39.78 38.43 4tf4 n ASN 370 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 4tf4 s PRO 371 N -6.32 2.13 0.47 1.20 0.04 -1.26 -3.89 135.00 127.37 4tf4 s PRO 371 Ca 0.22 0.77 -0.24 0.00 0.04 0.00 0.00 61.00 61.79 4tf4 s PRO 371 Cb -0.08 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.48 4tf4 s PRO 371 CO 0.88 -1.62 1.30 -2.14 0.04 0.00 0.00 177.00 175.45 4tf4 s PRO 372 N -5.08 3.61 -0.02 0.56 0.02 -1.26 -4.92 135.00 127.92 4tf4 s PRO 372 Ca 0.61 2.11 0.05 0.00 0.02 0.00 0.00 61.00 63.79 4tf4 s PRO 372 Cb -0.15 -2.49 -0.08 0.00 0.02 0.00 0.00 34.50 31.80 4tf4 s PRO 372 CO 0.55 -0.77 0.10 0.54 -0.33 0.00 0.00 177.00 177.09 4tf4 n ARG 373 N -0.44 0.81 -2.95 5.54 1.74 -1.26 -4.28 116.66 115.82 4tf4 n ARG 373 Ca 0.07 -0.04 -0.25 0.00 -0.77 0.00 0.00 57.85 56.86 4tf4 n ARG 373 Cb 0.45 -1.13 -0.03 0.00 -1.02 0.00 0.00 32.46 30.73 4tf4 n ARG 373 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 4tf4 n ASN 374 N -1.80 3.82 -4.72 0.55 3.02 -1.26 -4.29 115.26 110.58 4tf4 n ASN 374 Ca -0.03 -3.56 -0.31 0.00 -0.03 0.00 0.00 54.58 50.66 4tf4 n ASN 374 Cb 0.25 -0.56 0.13 0.00 -0.61 0.00 0.00 39.78 38.99 4tf4 n ASN 374 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 4tf4 s PRO 375 N -3.29 1.68 -1.01 3.52 0.04 -1.26 -2.84 135.00 131.84 4tf4 s PRO 375 Ca 0.47 1.39 -0.23 0.00 0.04 0.00 0.00 61.00 62.67 4tf4 s PRO 375 Cb 0.30 -1.82 -0.01 0.00 0.04 0.00 0.00 34.50 33.02 4tf4 s PRO 375 CO -0.13 -2.11 1.75 -1.58 0.04 0.00 0.00 177.00 174.97 4tf4 s HIS 376 N -2.71 2.17 -0.18 0.56 2.46 0.79 -4.82 115.29 113.56 4tf4 s HIS 376 Ca 0.65 -0.12 -0.04 0.00 0.47 0.00 0.00 55.06 56.02 4tf4 s HIS 376 Cb -0.21 -4.34 0.09 0.00 -0.13 0.00 0.00 32.58 28.00 4tf4 s HIS 376 CO 0.56 -1.76 0.30 -1.58 -2.47 0.00 0.00 174.74 169.79 4tf4 s HIS 377 N 7.84 -0.53 0.09 3.88 5.04 -1.26 -4.14 115.29 126.21 4tf4 s HIS 377 Ca 0.60 0.85 -0.32 0.00 -1.54 0.00 0.00 55.06 54.65 4tf4 s HIS 377 Cb -0.03 -0.05 -0.14 0.00 0.04 0.00 0.00 32.58 32.40 4tf4 s HIS 377 CO -0.02 -0.51 1.51 0.00 -2.34 0.00 0.00 174.74 173.39 4tf4 h ARG 378 N 8.26 -0.74 -0.08 2.88 3.08 -1.74 -1.33 114.38 124.71 4tf4 h ARG 378 Ca -0.16 0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 4tf4 h ARG 378 Cb 1.13 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 4tf4 h ARG 378 CO 0.19 -0.49 -0.27 1.15 -1.07 0.00 0.00 179.97 179.48 4tf4 h THR 379 N -0.77 1.23 -0.44 2.04 2.02 -1.83 -2.27 112.91 112.90 4tf4 h THR 379 Ca -0.02 -1.07 -0.13 0.00 0.77 0.00 0.00 66.41 65.96 4tf4 h THR 379 Cb 0.73 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.60 4tf4 h THR 379 CO -0.20 0.32 -0.25 0.00 0.37 0.00 0.00 175.52 175.76 4tf4 h ALA 380 N 1.61 0.62 0.25 6.16 0.00 -1.88 -3.12 119.26 122.90 4tf4 h ALA 380 Ca 0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 4tf4 h ALA 380 Cb 0.55 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.19 4tf4 h ALA 380 CO 0.04 0.63 -0.12 1.25 0.00 0.00 0.00 179.25 181.04 4tf4 h HIS 381 N 0.77 -0.31 -0.54 0.00 6.17 -0.96 -1.24 115.15 119.04 4tf4 h HIS 381 Ca 0.09 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.16 4tf4 h HIS 381 Cb 0.83 0.10 0.00 0.00 2.52 0.00 0.00 27.41 30.86 4tf4 h HIS 381 CO 0.06 -0.11 0.00 0.41 0.71 0.00 0.00 177.93 179.00 4tf4 n GLY 382 N -0.90 0.69 3.77 5.26 0.00 -0.88 -0.56 105.19 112.58 4tf4 n GLY 382 Ca -0.09 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 4tf4 n GLY 382 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 4tf4 s SER 383 N -3.00 6.04 0.00 1.61 0.15 -1.26 -4.85 113.70 112.39 4tf4 s SER 383 Ca 0.00 2.50 0.02 0.00 0.70 0.00 0.00 55.95 59.17 4tf4 s SER 383 Cb 0.00 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 4tf4 s SER 383 CO 0.00 -1.02 0.41 -2.67 1.20 0.00 0.00 173.24 171.16 4tf4 n TRP 384 N -0.40 0.00 -1.05 3.44 2.14 -1.26 -4.34 117.44 115.97 4tf4 n TRP 384 Ca 0.07 0.00 0.09 0.00 2.07 0.00 0.00 57.50 59.73 4tf4 n TRP 384 Cb 0.46 0.00 0.20 0.00 -0.81 0.00 0.00 31.31 31.17 4tf4 n TRP 384 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 4tf4 n THR 385 N -0.27 2.12 -3.66 -1.67 -2.24 -1.26 -1.29 114.28 106.01 4tf4 n THR 385 Ca 0.01 -2.10 -0.21 0.00 -2.27 0.00 0.00 64.05 59.48 4tf4 n THR 385 Cb 0.05 -0.25 0.04 0.00 -2.10 0.00 0.00 70.33 68.07 4tf4 n THR 385 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 4tf4 n ASP 386 N -0.95 -1.65 -3.79 3.42 2.03 -1.25 -3.82 116.55 110.55 4tf4 n ASP 386 Ca 0.19 -0.81 -0.14 0.00 0.52 0.00 0.00 54.79 54.55 4tf4 n ASP 386 Cb 0.78 -4.15 -0.15 0.00 -0.72 0.00 0.00 41.12 36.89 4tf4 n ASP 386 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 4tf4 s SER 387 N -4.28 -0.01 0.41 1.67 0.15 -1.25 -4.76 113.70 105.63 4tf4 s SER 387 Ca 0.04 0.12 0.25 0.00 0.70 0.00 0.00 55.95 57.07 4tf4 s SER 387 Cb -0.01 0.04 0.60 0.00 -1.71 0.00 0.00 66.02 64.93 4tf4 s SER 387 CO 0.81 -0.11 1.70 -0.29 1.20 0.00 0.00 173.24 176.55 4tf4 h ILE 388 N 5.94 0.00 0.00 6.45 2.10 -1.94 -3.26 117.51 126.79 4tf4 h ILE 388 Ca -0.40 -0.81 -0.15 0.00 1.08 0.00 0.00 64.86 64.59 4tf4 h ILE 388 Cb 1.15 1.80 -0.02 0.00 -1.09 0.00 0.00 36.82 38.65 4tf4 h ILE 388 CO 0.47 0.00 -1.01 0.00 -1.08 0.00 0.00 178.15 176.52 4tf4 h ALA 389 N 2.10 0.64 -3.52 0.18 0.00 -1.97 -3.46 119.26 113.24 4tf4 h ALA 389 Ca 0.00 -0.71 -0.67 0.00 0.00 0.00 0.00 54.91 53.53 4tf4 h ALA 389 Cb 0.86 0.10 -0.33 0.00 0.00 0.00 0.00 17.79 18.42 4tf4 h ALA 389 CO 0.00 0.84 -0.88 -1.12 0.00 0.00 0.00 179.25 178.09 4tf4 s SER 390 N -6.14 2.99 0.87 0.00 0.01 -1.23 -3.57 113.70 106.62 4tf4 s SER 390 Ca 0.00 -0.53 -0.12 0.00 1.31 0.00 0.00 55.95 56.61 4tf4 s SER 390 Cb 0.08 -1.22 0.11 0.00 0.21 0.00 0.00 66.02 65.20 4tf4 s SER 390 CO 0.79 0.17 1.11 -2.16 0.41 0.00 0.00 173.24 173.56 4tf4 s PRO 391 N 0.23 1.50 0.12 12.44 0.04 -1.26 -4.53 135.00 143.54 4tf4 s PRO 391 Ca -0.15 0.50 -0.23 0.00 0.04 0.00 0.00 61.00 61.16 4tf4 s PRO 391 Cb -0.17 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.46 4tf4 s PRO 391 CO 0.07 -1.99 1.67 0.00 0.04 0.00 0.00 177.00 176.79 4tf4 h ALA 392 N -1.36 -0.15 -3.04 8.56 0.00 -1.94 -3.42 119.26 117.92 4tf4 h ALA 392 Ca -0.49 0.03 -0.66 0.00 0.00 0.00 0.00 54.91 53.78 4tf4 h ALA 392 Cb 1.30 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 19.29 4tf4 h ALA 392 CO 0.60 -0.64 -0.56 -1.21 0.00 0.00 0.00 179.25 177.44 4tf4 s GLU 393 N -6.13 3.15 0.21 0.00 0.41 -1.26 -5.04 118.70 110.03 4tf4 s GLU 393 Ca -0.15 -0.38 -0.32 0.00 -0.41 0.00 0.00 54.97 53.71 4tf4 s GLU 393 Cb 0.09 -2.93 -0.13 0.00 -1.78 0.00 0.00 34.13 29.39 4tf4 s GLU 393 CO 0.67 0.69 1.59 0.09 -0.49 0.00 0.00 175.26 177.81 4tf4 n ASN 394 N 1.59 3.40 0.00 -0.19 4.13 -1.26 -4.85 115.26 118.07 4tf4 n ASN 394 Ca -0.16 1.10 0.10 0.00 1.68 0.00 0.00 54.58 57.29 4tf4 n ASN 394 Cb 0.53 -1.49 0.47 0.00 -1.54 0.00 0.00 39.78 37.75 4tf4 n ASN 394 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 4tf4 n ARG 395 N 3.16 0.20 -4.19 3.52 1.74 0.28 -4.79 116.66 116.57 4tf4 n ARG 395 Ca 0.15 0.12 -0.14 0.00 -0.77 0.00 0.00 57.85 57.21 4tf4 n ARG 395 Cb 0.32 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.16 4tf4 n ARG 395 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 4tf4 s HIS 396 N -2.70 1.08 -0.39 -1.55 3.76 -0.49 -4.99 115.29 110.01 4tf4 s HIS 396 Ca 0.16 -0.73 -0.11 0.00 -0.15 0.00 0.00 55.06 54.22 4tf4 s HIS 396 Cb 0.13 -0.58 0.04 0.00 1.11 0.00 0.00 32.58 33.28 4tf4 s HIS 396 CO 0.32 -0.01 0.23 0.08 -0.85 0.00 0.00 174.74 174.51 4tf4 s VAL 397 N -2.90 4.60 -1.47 -0.90 1.01 -1.26 -4.80 120.40 114.67 4tf4 s VAL 397 Ca 0.10 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 4tf4 s VAL 397 Cb 0.00 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.80 4tf4 s VAL 397 CO -0.01 -0.30 2.34 -0.11 0.00 0.00 0.00 175.10 177.02 4tf4 n LEU 398 N 5.01 7.26 -4.54 3.92 7.94 -1.26 -4.96 117.00 130.37 4tf4 n LEU 398 Ca -0.12 -4.27 -0.52 0.00 -1.11 0.00 0.00 56.01 50.00 4tf4 n LEU 398 Cb 0.45 -1.61 -0.05 0.00 0.53 0.00 0.00 43.42 42.74 4tf4 n LEU 398 CO 0.38 1.37 0.63 -1.22 -1.11 0.00 0.00 177.39 177.43 4tf4 n TYR 399 N 5.19 0.97 0.00 1.96 4.01 -1.26 -2.44 117.16 125.58 4tf4 n TYR 399 Ca 0.56 0.80 0.00 0.00 -0.16 0.00 0.00 57.90 59.10 4tf4 n TYR 399 Cb 0.35 -2.21 0.00 0.00 -0.31 0.00 0.00 39.34 37.18 4tf4 n TYR 399 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4tf4 n GLY 400 N 1.98 2.59 3.68 2.72 0.00 -0.21 -3.15 105.19 112.81 4tf4 n GLY 400 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 4tf4 n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4tf4 s ALA 401 N -2.15 3.59 -0.30 4.61 0.00 -1.02 -4.36 121.76 122.12 4tf4 s ALA 401 Ca 0.00 0.82 -0.21 0.00 0.00 0.00 0.00 51.96 52.57 4tf4 s ALA 401 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 4tf4 s ALA 401 CO 0.00 -0.98 0.66 -1.17 0.00 0.00 0.00 175.76 174.26 4tf4 s LEU 402 N 2.68 4.13 0.87 0.00 2.96 -1.26 -0.22 118.68 127.83 4tf4 s LEU 402 Ca 0.63 0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 54.91 4tf4 s LEU 402 Cb -0.30 -2.86 0.11 0.00 0.50 0.00 0.00 46.19 43.64 4tf4 s LEU 402 CO 0.25 -0.49 1.14 0.68 -1.32 0.00 0.00 176.35 176.61 4tf4 s VAL 403 N 2.66 2.22 0.15 1.68 -7.23 -0.48 -4.59 120.40 114.82 4tf4 s VAL 403 Ca 0.26 0.07 -0.15 0.00 -1.81 0.00 0.00 61.98 60.36 4tf4 s VAL 403 Cb -0.15 -2.88 0.03 0.00 0.56 0.00 0.00 36.38 33.94 4tf4 s VAL 403 CO 0.12 -0.09 1.73 1.23 -0.31 0.00 0.00 175.10 177.78 4tf4 h GLY 404 N -1.32 0.73 0.00 2.32 0.00 -1.12 -3.42 103.07 100.25 4tf4 h GLY 404 Ca -0.49 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.48 4tf4 h GLY 404 CO 0.62 0.34 0.00 0.61 0.00 0.00 0.00 176.54 178.11 4tf4 n GLY 405 N -0.91 -1.96 3.68 4.60 0.00 0.16 -1.05 105.19 109.70 4tf4 n GLY 405 Ca 0.01 -1.49 -0.48 0.00 0.00 0.00 0.00 46.02 44.06 4tf4 n GLY 405 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 4tf4 n PRO 406 N 0.00 2.17 0.01 1.61 -0.02 -1.26 -4.68 135.00 132.83 4tf4 n PRO 406 Ca 0.00 0.80 0.12 0.00 -2.02 0.00 0.00 63.50 62.40 4tf4 n PRO 406 Cb 0.00 -2.63 0.29 0.00 -0.02 0.00 0.00 33.50 31.14 4tf4 n PRO 406 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4tf4 n GLY 407 N 4.32 -1.31 3.29 -1.23 0.00 -1.26 -4.65 105.19 104.34 4tf4 n GLY 407 Ca 0.22 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 4tf4 n GLY 407 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4tf4 s SER 408 N -3.19 2.54 -0.97 1.61 0.01 -1.26 -3.79 113.70 108.65 4tf4 s SER 408 Ca 0.11 -0.73 -0.08 0.00 1.31 0.00 0.00 55.95 56.55 4tf4 s SER 408 Cb 0.17 -0.14 -0.07 0.00 0.21 0.00 0.00 66.02 66.20 4tf4 s SER 408 CO 0.68 0.03 2.16 -0.81 0.41 0.00 0.00 173.24 175.70 4tf4 n PRO 409 N 0.88 2.16 -0.08 12.44 -0.04 -1.26 -3.73 135.00 145.37 4tf4 n PRO 409 Ca -0.18 -1.60 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 4tf4 n PRO 409 Cb 0.54 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 4tf4 n PRO 409 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 4tf4 n ASN 410 N 4.63 0.00 -1.59 3.54 0.23 -1.26 -4.51 115.26 116.29 4tf4 n ASN 410 Ca 0.48 -1.13 -0.16 0.00 -0.53 0.00 0.00 54.58 53.25 4tf4 n ASN 410 Cb 0.18 -0.03 -0.06 0.00 -2.08 0.00 0.00 39.78 37.80 4tf4 n ASN 410 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 4tf4 n ASP 411 N 0.00 -4.21 -4.86 0.53 8.00 -1.24 -4.95 116.55 109.81 4tf4 n ASP 411 Ca 0.00 0.35 -0.33 0.00 0.71 0.00 0.00 54.79 55.52 4tf4 n ASP 411 Cb 0.53 -3.80 -0.06 0.00 -0.02 0.00 0.00 41.12 37.77 4tf4 n ASP 411 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4tf4 s ALA 412 N -2.39 3.51 -0.18 2.24 0.00 -1.26 -4.80 121.76 118.88 4tf4 s ALA 412 Ca 0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 4tf4 s ALA 412 Cb 0.00 -2.53 0.13 0.00 0.00 0.00 0.00 23.12 20.72 4tf4 s ALA 412 CO 0.00 0.46 1.02 -0.47 0.00 0.00 0.00 175.76 176.77 4tf4 s TYR 413 N -1.79 -0.35 -0.04 0.00 6.14 -1.26 -4.05 117.35 116.00 4tf4 s TYR 413 Ca 0.47 0.63 -0.02 0.00 0.64 0.00 0.00 57.07 58.79 4tf4 s TYR 413 Cb -0.12 0.45 0.03 0.00 0.42 0.00 0.00 41.96 42.74 4tf4 s TYR 413 CO 0.20 -0.31 0.07 0.99 0.64 0.00 0.00 175.55 177.13 4tf4 s THR 414 N -1.00 -0.12 -0.48 4.34 2.01 -1.26 -5.05 115.64 114.07 4tf4 s THR 414 Ca -0.01 0.42 -0.26 0.00 0.31 0.00 0.00 61.69 62.16 4tf4 s THR 414 Cb -0.01 -0.16 -0.25 0.00 0.01 0.00 0.00 72.50 72.09 4tf4 s THR 414 CO 0.00 0.18 1.79 -0.67 -0.69 0.00 0.00 174.62 175.23 4tf4 n ASP 415 N 5.29 1.88 -4.38 3.53 2.03 -1.26 -4.86 116.55 118.78 4tf4 n ASP 415 Ca -0.03 -2.60 -0.37 0.00 0.52 0.00 0.00 54.79 52.31 4tf4 n ASP 415 Cb 0.50 -0.90 -0.13 0.00 -0.72 0.00 0.00 41.12 39.87 4tf4 n ASP 415 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 4tf4 s ASP 416 N 5.98 4.98 0.51 1.67 2.15 -1.26 -4.69 116.67 126.01 4tf4 s ASP 416 Ca 0.63 -0.45 0.16 0.00 0.43 0.00 0.00 52.55 53.33 4tf4 s ASP 416 Cb 0.14 -1.87 1.26 0.00 -0.30 0.00 0.00 42.92 42.15 4tf4 s ASP 416 CO 0.22 -0.10 2.14 -0.09 -0.17 0.00 0.00 175.17 177.16 4tf4 h ARG 417 N 8.22 0.00 0.00 4.34 2.43 -1.84 -1.76 114.38 125.76 4tf4 h ARG 417 Ca -0.36 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 4tf4 h ARG 417 Cb 1.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 4tf4 h ARG 417 CO 0.59 0.02 0.00 1.04 -1.51 0.00 0.00 179.97 180.12 4tf4 n GLN 418 N -4.48 0.96 -3.43 0.20 6.02 -1.26 -4.03 117.38 111.36 4tf4 n GLN 418 Ca -0.03 0.00 -0.44 0.00 -0.01 0.00 0.00 57.00 56.53 4tf4 n GLN 418 Cb 0.11 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 4tf4 n GLN 418 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 4tf4 s ASP 419 N -1.81 6.58 0.22 1.08 -1.08 -0.66 -4.88 116.67 116.11 4tf4 s ASP 419 Ca 0.37 -3.08 0.24 0.00 -0.52 0.00 0.00 52.55 49.56 4tf4 s ASP 419 Cb 0.17 -2.12 0.92 0.00 -1.46 0.00 0.00 42.92 40.43 4tf4 s ASP 419 CO 0.29 -0.42 1.72 0.00 0.52 0.00 0.00 175.17 177.28 4tf4 n TYR 420 N 3.36 0.75 0.08 -5.34 0.18 -1.26 0.38 117.16 115.31 4tf4 n TYR 420 Ca 0.17 0.27 -0.08 0.00 1.88 0.00 0.00 57.90 60.13 4tf4 n TYR 420 Cb 0.42 -0.94 -0.07 0.00 -0.38 0.00 0.00 39.34 38.38 4tf4 n TYR 420 CO 0.00 0.00 0.00 0.28 -2.08 0.00 0.00 176.86 175.06 4tf4 h VAL 421 N 0.00 1.61 0.00 -3.48 2.07 -1.93 -3.27 116.25 111.25 4tf4 h VAL 421 Ca 0.00 -3.06 -0.01 0.00 0.82 0.00 0.00 66.70 64.45 4tf4 h VAL 421 Cb 0.46 2.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.94 4tf4 h VAL 421 CO 0.00 0.88 -1.09 0.00 0.02 0.00 0.00 177.57 177.38 4tf4 n ALA 422 N -2.41 2.03 -1.06 1.67 0.00 -1.16 -2.99 120.51 116.58 4tf4 n ALA 422 Ca -0.02 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.44 4tf4 n ALA 422 Cb 0.89 0.03 0.21 0.00 0.00 0.00 0.00 19.45 20.58 4tf4 n ALA 422 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 4tf4 n ASN 423 N -1.74 3.16 -4.94 0.00 5.15 0.16 -0.67 115.26 116.38 4tf4 n ASN 423 Ca -0.01 -3.10 -0.24 0.00 -0.60 0.00 0.00 54.58 50.63 4tf4 n ASN 423 Cb 0.22 -0.50 0.01 0.00 -0.53 0.00 0.00 39.78 38.98 4tf4 n ASN 423 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 4tf4 s GLU 424 N -2.88 3.18 0.31 1.20 2.12 -1.23 -0.15 118.70 121.24 4tf4 s GLU 424 Ca 0.38 -0.34 0.08 0.00 0.36 0.00 0.00 54.97 55.44 4tf4 s GLU 424 Cb 0.32 -2.53 -0.06 0.00 0.26 0.00 0.00 34.13 32.12 4tf4 s GLU 424 CO 0.06 -0.23 -0.06 0.14 -0.54 0.00 0.00 175.26 174.62 4tf4 s VAL 425 N -2.57 1.85 -0.06 3.70 -7.23 -1.26 -2.86 120.40 111.96 4tf4 s VAL 425 Ca 0.47 -2.14 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 4tf4 s VAL 425 Cb -0.10 -2.55 0.11 0.00 0.56 0.00 0.00 36.38 34.40 4tf4 s VAL 425 CO 0.39 -0.24 0.94 0.00 -0.31 0.00 0.00 175.10 175.88 4tf4 s ALA 426 N -2.87 -1.88 0.23 1.32 0.00 -1.26 -3.61 121.76 113.69 4tf4 s ALA 426 Ca 0.31 1.23 -0.08 0.00 0.00 0.00 0.00 51.96 53.42 4tf4 s ALA 426 Cb 0.04 0.07 0.22 0.00 0.00 0.00 0.00 23.12 23.44 4tf4 s ALA 426 CO 0.14 -0.58 1.91 1.79 0.00 0.00 0.00 175.76 179.02 4tf4 h THR 427 N 2.16 1.22 0.00 0.00 1.35 -1.51 -1.67 112.91 114.46 4tf4 h THR 427 Ca -0.20 -0.41 -0.04 0.00 -0.55 0.00 0.00 66.41 65.21 4tf4 h THR 427 Cb 1.21 -0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.54 4tf4 h THR 427 CO 0.30 0.22 -0.18 -2.24 -0.25 0.00 0.00 175.52 173.38 4tf4 h ASP 428 N 1.21 0.00 -0.07 5.36 2.03 -1.84 -3.04 116.42 120.06 4tf4 h ASP 428 Ca 0.33 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.59 4tf4 h ASP 428 Cb -0.13 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.36 4tf4 h ASP 428 CO -0.08 0.18 -0.06 1.88 -1.03 0.00 0.00 179.24 180.13 4tf4 h TYR 429 N 0.00 0.33 -0.01 4.15 -1.99 -1.67 -2.54 116.97 115.24 4tf4 h TYR 429 Ca -0.00 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.70 4tf4 h TYR 429 Cb 0.82 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 39.46 4tf4 h TYR 429 CO 0.00 0.39 -0.52 0.09 -0.00 0.00 0.00 178.16 178.12 4tf4 n ASN 430 N -4.30 1.37 0.28 3.88 4.13 -1.17 -4.31 115.26 115.13 4tf4 n ASN 430 Ca -0.00 -1.09 -0.11 0.00 1.68 0.00 0.00 54.58 55.06 4tf4 n ASN 430 Cb 0.24 0.45 -0.05 0.00 -1.54 0.00 0.00 39.78 38.88 4tf4 n ASN 430 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 4tf4 h ALA 431 N 3.56 -1.01 -0.38 5.41 0.00 -1.34 0.58 119.26 126.08 4tf4 h ALA 431 Ca 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 4tf4 h ALA 431 Cb 0.61 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 4tf4 h ALA 431 CO 0.00 -0.96 -0.09 0.78 0.00 0.00 0.00 179.25 178.99 4tf4 h GLY 432 N -0.83 0.70 0.99 0.00 0.00 -1.82 -2.80 103.07 99.31 4tf4 h GLY 432 Ca -0.07 -0.49 0.01 0.00 0.00 0.00 0.00 47.33 46.77 4tf4 h GLY 432 CO 0.12 0.45 0.31 -2.75 0.00 0.00 0.00 176.54 174.68 4tf4 h PHE 433 N 0.60 0.59 -0.60 5.60 3.57 -1.74 -1.70 116.94 123.26 4tf4 h PHE 433 Ca 0.11 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 4tf4 h PHE 433 Cb 0.51 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 4tf4 h PHE 433 CO 0.02 0.37 0.01 0.77 -2.23 0.00 0.00 178.31 177.25 4tf4 h SER 434 N 0.64 1.02 -0.65 0.41 0.02 -0.66 -0.93 113.55 113.41 4tf4 h SER 434 Ca 0.18 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 4tf4 h SER 434 Cb -0.06 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.18 4tf4 h SER 434 CO -0.05 1.07 0.22 0.28 -1.14 0.00 0.00 176.83 177.22 4tf4 h SER 435 N 0.94 0.92 -0.58 3.07 0.02 -1.35 -1.12 113.55 115.46 4tf4 h SER 435 Ca 0.17 -0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 4tf4 h SER 435 Cb 0.54 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 4tf4 h SER 435 CO 0.03 0.87 0.24 0.00 -1.14 0.00 0.00 176.83 176.82 4tf4 h ALA 436 N 1.09 0.75 -0.76 3.77 0.00 -1.01 -2.49 119.26 120.61 4tf4 h ALA 436 Ca 0.21 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.99 4tf4 h ALA 436 Cb 0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 4tf4 h ALA 436 CO -0.01 0.36 0.48 -0.07 0.00 0.00 0.00 179.25 180.01 4tf4 h LEU 437 N 0.80 0.78 -1.04 0.00 3.38 -0.71 -1.35 115.31 117.16 4tf4 h LEU 437 Ca 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 4tf4 h LEU 437 Cb 0.19 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 4tf4 h LEU 437 CO -0.02 0.53 0.30 0.00 0.09 0.00 0.00 178.44 179.35 4tf4 h ALA 438 N 1.33 1.25 -0.56 1.53 0.00 -0.88 -0.30 119.26 121.63 4tf4 h ALA 438 Ca 0.31 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 4tf4 h ALA 438 Cb 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 4tf4 h ALA 438 CO -0.12 0.57 0.08 0.52 0.00 0.00 0.00 179.25 180.29 4tf4 h MET 439 N 0.97 0.94 0.00 0.00 2.86 -0.94 -2.61 114.93 116.15 4tf4 h MET 439 Ca 0.23 -0.26 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 4tf4 h MET 439 Cb 0.14 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 4tf4 h MET 439 CO -0.03 0.91 -0.52 -0.07 1.06 0.00 0.00 176.91 178.26 4tf4 h LEU 440 N 0.83 0.00 -0.27 1.22 3.38 -0.67 -2.58 115.31 117.21 4tf4 h LEU 440 Ca 0.17 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 4tf4 h LEU 440 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 4tf4 h LEU 440 CO 0.01 0.52 -0.09 0.58 0.09 0.00 0.00 178.44 179.56 4tf4 h VAL 441 N 0.00 1.29 -0.91 1.22 2.07 -0.91 0.25 116.25 119.26 4tf4 h VAL 441 Ca -0.01 -1.13 0.03 0.00 0.82 0.00 0.00 66.70 66.42 4tf4 h VAL 441 Cb 0.98 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 32.16 4tf4 h VAL 441 CO 0.07 0.36 0.60 -0.08 0.02 0.00 0.00 177.57 178.53 4tf4 h GLU 442 N 0.28 1.12 0.00 1.57 4.81 -1.32 0.12 114.58 121.16 4tf4 h GLU 442 Ca 0.07 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 4tf4 h GLU 442 Cb 0.57 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 4tf4 h GLU 442 CO 0.03 0.74 -0.76 1.49 -0.73 0.00 0.00 179.01 179.78 4tf4 h GLU 443 N 1.15 0.00 -0.01 1.92 4.81 -1.32 -3.41 114.58 117.72 4tf4 h GLU 443 Ca 0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 4tf4 h GLU 443 Cb -0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 4tf4 h GLU 443 CO -0.10 0.80 -0.63 0.66 -0.73 0.00 0.00 179.01 179.01 4tf4 n TYR 444 N -4.53 0.00 -4.01 0.92 4.01 0.85 -5.08 117.16 109.33 4tf4 n TYR 444 Ca -0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.53 4tf4 n TYR 444 Cb 0.53 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 4tf4 n TYR 444 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4tf4 n GLY 445 N 1.45 -1.48 0.00 2.72 0.00 0.43 -3.93 105.19 104.37 4tf4 n GLY 445 Ca 0.07 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.79 4tf4 n GLY 445 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4tf4 n GLY 446 N 0.00 3.74 2.84 -0.02 0.00 -1.26 -4.30 105.19 106.19 4tf4 n GLY 446 Ca 0.00 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.16 4tf4 n GLY 446 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4tf4 s THR 447 N -2.10 0.33 0.75 2.61 -4.23 -1.26 -4.77 115.64 106.97 4tf4 s THR 447 Ca 0.00 0.01 -0.11 0.00 -1.18 0.00 0.00 61.69 60.41 4tf4 s THR 447 Cb 0.00 -0.40 0.04 0.00 1.34 0.00 0.00 72.50 73.48 4tf4 s THR 447 CO 0.00 0.18 1.09 -2.16 -0.54 0.00 0.00 174.62 173.19 4tf4 s PRO 448 N 1.04 2.41 -0.04 3.99 0.04 -1.26 -4.26 135.00 136.91 4tf4 s PRO 448 Ca -0.09 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.83 4tf4 s PRO 448 Cb -0.14 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 4tf4 s PRO 448 CO -0.01 -1.53 1.05 -0.51 0.04 0.00 0.00 177.00 176.04 4tf4 s LEU 449 N -5.72 4.31 0.09 -3.56 1.43 -1.26 -4.96 118.68 109.00 4tf4 s LEU 449 Ca 0.62 1.68 -0.28 0.00 -1.03 0.00 0.00 54.13 55.11 4tf4 s LEU 449 Cb -0.17 -3.56 -0.14 0.00 0.03 0.00 0.00 46.19 42.34 4tf4 s LEU 449 CO 0.54 -0.41 1.66 0.00 0.23 0.00 0.00 176.35 178.36 4tf4 h ALA 450 N 7.02 -0.52 -2.54 4.21 0.00 -2.03 -3.34 119.26 122.06 4tf4 h ALA 450 Ca -0.36 -0.09 -0.77 0.00 0.00 0.00 0.00 54.91 53.69 4tf4 h ALA 450 Cb 1.18 0.29 -0.24 0.00 0.00 0.00 0.00 17.79 19.02 4tf4 h ALA 450 CO 0.82 -0.81 0.15 0.16 0.00 0.00 0.00 179.25 179.57 4tf4 s ASP 451 N -4.74 6.63 -0.14 0.00 -4.77 -1.26 -4.97 116.67 107.42 4tf4 s ASP 451 Ca -0.16 -2.39 -0.12 0.00 -3.30 0.00 0.00 52.55 46.58 4tf4 s ASP 451 Cb 0.06 -2.24 0.04 0.00 -1.09 0.00 0.00 42.92 39.68 4tf4 s ASP 451 CO 0.64 -0.72 0.36 0.12 0.70 0.00 0.00 175.17 176.28 4tf4 s PHE 452 N 0.88 -0.42 0.46 2.11 5.36 -1.26 -4.56 117.98 120.55 4tf4 s PHE 452 Ca 0.17 1.00 -0.15 0.00 -0.96 0.00 0.00 56.93 56.99 4tf4 s PHE 452 Cb -0.13 0.15 -0.08 0.00 -0.34 0.00 0.00 43.02 42.62 4tf4 s PHE 452 CO -0.06 -0.21 0.90 -2.14 -1.46 0.00 0.00 175.22 172.24 4tf4 s PRO 453 N 0.43 3.94 0.62 10.12 0.02 -1.26 -5.10 135.00 143.76 4tf4 s PRO 453 Ca -0.02 0.81 -0.17 0.00 0.02 0.00 0.00 61.00 61.64 4tf4 s PRO 453 Cb -0.04 -2.24 -0.02 0.00 0.02 0.00 0.00 34.50 32.22 4tf4 s PRO 453 CO -0.02 -0.14 1.12 -2.14 -0.33 0.00 0.00 177.00 175.50 4tf4 s PRO 454 N -3.81 2.96 -0.45 5.54 0.02 -1.26 -4.98 135.00 133.03 4tf4 s PRO 454 Ca 0.57 1.49 -0.19 0.00 0.02 0.00 0.00 61.00 62.89 4tf4 s PRO 454 Cb -0.10 -1.96 0.03 0.00 0.02 0.00 0.00 34.50 32.49 4tf4 s PRO 454 CO 0.28 -1.14 0.55 0.99 -0.33 0.00 0.00 177.00 177.35 4tf4 s THR 455 N -2.11 4.95 0.59 0.99 2.01 -1.26 -5.00 115.64 115.81 4tf4 s THR 455 Ca 0.69 -0.26 -0.18 0.00 0.31 0.00 0.00 61.69 62.25 4tf4 s THR 455 Cb -0.22 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.09 4tf4 s THR 455 CO 0.37 -0.58 1.16 -1.61 -0.69 0.00 0.00 174.62 173.27 4tf4 s GLU 456 N 2.47 3.04 0.04 4.92 2.02 -1.26 -5.04 118.70 124.88 4tf4 s GLU 456 Ca 0.16 1.67 0.07 0.00 0.02 0.00 0.00 54.97 56.89 4tf4 s GLU 456 Cb -0.17 -1.96 -0.03 0.00 0.10 0.00 0.00 34.13 32.07 4tf4 s GLU 456 CO 0.15 -1.12 -0.17 -1.83 0.02 0.00 0.00 175.26 172.31 4tf4 s GLU 457 N -3.48 2.09 0.49 1.61 -1.05 -1.26 -5.04 118.70 112.06 4tf4 s GLU 457 Ca 0.74 -0.98 -0.22 0.00 -0.15 0.00 0.00 54.97 54.36 4tf4 s GLU 457 Cb -0.26 -2.20 -0.09 0.00 -0.44 0.00 0.00 34.13 31.14 4tf4 s GLU 457 CO 0.33 0.54 0.97 -2.30 0.95 0.00 0.00 175.26 175.75 4tf4 n PRO 458 N 1.50 1.18 0.00 -4.83 -0.02 -1.26 -4.86 135.00 126.71 4tf4 n PRO 458 Ca -0.16 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 4tf4 n PRO 458 Cb 0.52 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 4tf4 n PRO 458 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 4tf4 n ASP 459 N 0.10 1.04 0.00 2.55 5.68 -1.26 -4.92 116.55 119.73 4tf4 n ASP 459 Ca 0.11 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.44 4tf4 n ASP 459 Cb 0.42 -0.49 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 4tf4 n ASP 459 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4tf4 n GLY 460 N 0.02 -0.01 3.77 6.12 0.00 -1.26 -5.09 105.19 108.75 4tf4 n GLY 460 Ca 0.00 -1.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.01 4tf4 n GLY 460 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 4tf4 s PRO 461 N -2.00 3.93 -0.21 1.61 0.02 -1.26 -4.95 135.00 132.13 4tf4 s PRO 461 Ca 0.00 2.32 -0.16 0.00 0.02 0.00 0.00 61.00 63.18 4tf4 s PRO 461 Cb 0.00 -2.79 -0.11 0.00 0.02 0.00 0.00 34.50 31.62 4tf4 s PRO 461 CO 0.00 -0.58 -0.15 0.39 -0.33 0.00 0.00 177.00 176.33 4tf4 n GLU 462 N 0.14 0.54 -4.08 5.54 1.02 -1.26 -4.83 120.64 117.72 4tf4 n GLU 462 Ca 0.03 0.40 -0.33 0.00 -0.02 0.00 0.00 57.16 57.24 4tf4 n GLU 462 Cb 0.42 -1.60 -0.15 0.00 -0.02 0.00 0.00 31.44 30.09 4tf4 n GLU 462 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 4tf4 s ILE 463 N -2.49 2.27 0.29 -3.67 1.01 -1.26 0.18 121.20 117.53 4tf4 s ILE 463 Ca -0.29 -1.04 -0.03 0.00 0.00 0.00 0.00 60.65 59.29 4tf4 s ILE 463 Cb 0.08 -2.05 0.01 0.00 0.01 0.00 0.00 42.46 40.51 4tf4 s ILE 463 CO 0.46 0.39 0.43 2.22 0.00 0.00 0.00 174.94 178.44 4tf4 n PHE 464 N 4.61 -1.38 -4.50 3.97 -1.74 -0.74 -4.63 117.46 113.04 4tf4 n PHE 464 Ca -0.19 -1.86 -0.25 0.00 -0.56 0.00 0.00 57.45 54.59 4tf4 n PHE 464 Cb 0.48 0.49 -0.17 0.00 1.52 0.00 0.00 39.48 41.81 4tf4 n PHE 464 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 4tf4 s VAL 465 N -2.68 1.13 0.15 1.97 1.01 -1.26 -0.86 120.40 119.85 4tf4 s VAL 465 Ca 0.22 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.80 4tf4 s VAL 465 Cb -0.01 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 4tf4 s VAL 465 CO 0.16 0.36 0.06 -1.61 0.00 0.00 0.00 175.10 174.06 4tf4 s GLU 466 N 0.79 2.66 0.17 2.72 2.02 -0.27 -0.69 118.70 126.09 4tf4 s GLU 466 Ca -0.12 -0.93 -0.17 0.00 0.02 0.00 0.00 54.97 53.77 4tf4 s GLU 466 Cb -0.15 -2.53 0.03 0.00 0.10 0.00 0.00 34.13 31.58 4tf4 s GLU 466 CO 0.02 0.49 0.46 0.00 0.02 0.00 0.00 175.26 176.26 4tf4 s ALA 467 N -1.63 -0.89 -0.01 5.21 0.00 0.15 0.31 121.76 124.90 4tf4 s ALA 467 Ca 0.29 -0.18 -0.28 0.00 0.00 0.00 0.00 51.96 51.79 4tf4 s ALA 467 Cb -0.10 0.80 0.09 0.00 0.00 0.00 0.00 23.12 23.90 4tf4 s ALA 467 CO 0.21 -0.73 0.78 1.14 0.00 0.00 0.00 175.76 177.15 4tf4 s GLN 468 N -3.85 0.95 -0.11 0.00 -2.07 -0.70 -2.29 119.66 111.60 4tf4 s GLN 468 Ca 0.07 -0.07 -0.30 0.00 -1.82 0.00 0.00 55.36 53.25 4tf4 s GLN 468 Cb 0.00 0.45 -0.03 0.00 -1.09 0.00 0.00 33.01 32.34 4tf4 s GLN 468 CO -0.06 -0.36 1.36 0.42 -1.32 0.00 0.00 175.29 175.33 4tf4 s ILE 469 N -2.23 4.04 -0.09 3.63 1.01 -0.38 -1.14 121.20 126.03 4tf4 s ILE 469 Ca -0.02 1.30 -0.22 0.00 0.00 0.00 0.00 60.65 61.70 4tf4 s ILE 469 Cb -0.01 -3.84 -0.19 0.00 0.01 0.00 0.00 42.46 38.44 4tf4 s ILE 469 CO -0.02 -0.09 0.75 -1.13 0.00 0.00 0.00 174.94 174.46 4tf4 h ASN 470 N 8.37 -0.05 -3.43 3.58 -1.24 -1.54 -3.45 115.58 117.82 4tf4 h ASN 470 Ca -0.32 -0.61 -0.42 0.00 0.71 0.00 0.00 56.30 55.66 4tf4 h ASN 470 Cb 1.14 0.01 -0.34 0.00 0.73 0.00 0.00 38.32 39.85 4tf4 h ASN 470 CO 0.95 0.69 -0.77 -0.89 -1.29 0.00 0.00 177.43 176.12 4tf4 s THR 471 N -2.71 0.53 0.32 -3.57 2.01 -1.25 -5.06 115.64 105.90 4tf4 s THR 471 Ca -0.14 -0.10 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 4tf4 s THR 471 Cb -0.01 -0.57 -0.10 0.00 0.01 0.00 0.00 72.50 71.83 4tf4 s THR 471 CO 0.53 0.23 1.30 -2.16 -0.69 0.00 0.00 174.62 173.83 4tf4 s PRO 472 N 1.05 4.37 0.12 4.92 0.04 -1.26 -4.14 135.00 140.10 4tf4 s PRO 472 Ca -0.09 2.19 -0.19 0.00 0.04 0.00 0.00 61.00 62.94 4tf4 s PRO 472 Cb -0.14 -3.08 0.05 0.00 0.04 0.00 0.00 34.50 31.36 4tf4 s PRO 472 CO -0.01 -0.17 0.49 0.20 0.04 0.00 0.00 177.00 177.55 4tf4 s GLY 473 N -0.44 -0.41 -0.01 0.56 0.00 -1.26 -5.03 107.32 100.72 4tf4 s GLY 473 Ca 0.49 0.23 0.09 0.00 0.00 0.00 0.00 44.72 45.54 4tf4 s GLY 473 CO 0.51 -0.06 0.26 -1.30 0.00 0.00 0.00 173.10 172.51 4tf4 n THR 474 N -0.18 0.00 -0.24 0.90 -2.24 -1.26 -4.50 114.28 106.76 4tf4 n THR 474 Ca -0.17 -0.24 0.05 0.00 -2.27 0.00 0.00 64.05 61.43 4tf4 n THR 474 Cb 0.64 0.51 0.15 0.00 -2.10 0.00 0.00 70.33 69.52 4tf4 n THR 474 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 4tf4 n THR 475 N -1.63 1.12 -3.60 4.28 -2.24 -1.26 -4.56 114.28 106.39 4tf4 n THR 475 Ca -0.01 -1.09 -0.08 0.00 -2.27 0.00 0.00 64.05 60.61 4tf4 n THR 475 Cb 0.21 0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 4tf4 n THR 475 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 4tf4 s PHE 476 N -1.18 -0.32 -0.21 4.78 -0.12 -1.26 -1.00 117.98 118.68 4tf4 s PHE 476 Ca 0.23 0.07 -0.00 0.00 -0.05 0.00 0.00 56.93 57.18 4tf4 s PHE 476 Cb 0.13 0.60 0.05 0.00 -0.63 0.00 0.00 43.02 43.17 4tf4 s PHE 476 CO 0.14 -0.81 -0.05 0.99 -0.05 0.00 0.00 175.22 175.44 4tf4 s THR 477 N -3.47 1.29 -0.26 -4.49 2.01 -0.80 -4.29 115.64 105.63 4tf4 s THR 477 Ca 0.07 -0.95 -0.11 0.00 0.31 0.00 0.00 61.69 61.00 4tf4 s THR 477 Cb -0.02 -1.55 -0.05 0.00 0.01 0.00 0.00 72.50 70.90 4tf4 s THR 477 CO -0.05 -0.03 0.20 -0.70 -0.69 0.00 0.00 174.62 173.36 4tf4 s GLU 478 N 1.52 4.00 0.13 4.92 2.12 -1.26 -1.67 118.70 128.47 4tf4 s GLU 478 Ca -0.03 -0.25 0.07 0.00 0.36 0.00 0.00 54.97 55.12 4tf4 s GLU 478 Cb -0.17 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 30.56 4tf4 s GLU 478 CO -0.07 -0.10 -0.06 0.42 -0.54 0.00 0.00 175.26 174.90 4tf4 s ILE 479 N 1.54 3.52 -0.33 -3.70 -1.09 0.01 -1.48 121.20 119.67 4tf4 s ILE 479 Ca 0.08 -1.32 0.03 0.00 -2.23 0.00 0.00 60.65 57.21 4tf4 s ILE 479 Cb -0.15 -2.69 0.10 0.00 -1.58 0.00 0.00 42.46 38.13 4tf4 s ILE 479 CO 0.09 0.03 0.04 -0.75 -1.23 0.00 0.00 174.94 173.12 4tf4 s LYS 480 N -2.48 1.42 0.00 2.79 2.20 -0.29 -1.21 119.74 122.18 4tf4 s LYS 480 Ca 0.24 -1.68 -0.01 0.00 -0.36 0.00 0.00 55.97 54.16 4tf4 s LYS 480 Cb -0.10 -2.97 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 4tf4 s LYS 480 CO 0.16 -0.91 0.13 0.00 -0.36 0.00 0.00 175.35 174.38 4tf4 s ALA 481 N 1.05 3.78 -0.21 3.13 0.00 0.06 -1.73 121.76 127.83 4tf4 s ALA 481 Ca 0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 4tf4 s ALA 481 Cb -0.19 -1.72 0.06 0.00 0.00 0.00 0.00 23.12 21.28 4tf4 s ALA 481 CO -0.10 0.73 0.02 1.41 0.00 0.00 0.00 175.76 177.81 4tf4 s MET 482 N -1.92 0.91 0.19 0.00 1.75 0.15 -1.34 119.30 119.05 4tf4 s MET 482 Ca 0.26 -0.63 -0.30 0.00 -1.25 0.00 0.00 55.69 53.77 4tf4 s MET 482 Cb -0.12 -2.23 -0.08 0.00 2.84 0.00 0.00 34.83 35.24 4tf4 s MET 482 CO 0.17 -0.66 1.01 0.42 -0.65 0.00 0.00 175.02 175.31 4tf4 s ILE 483 N 1.72 4.06 0.03 10.11 1.01 -0.39 -1.12 121.20 136.62 4tf4 s ILE 483 Ca -0.01 1.88 0.05 0.00 0.00 0.00 0.00 60.65 62.57 4tf4 s ILE 483 Cb -0.18 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.08 4tf4 s ILE 483 CO -0.09 0.37 -0.16 -0.13 0.00 0.00 0.00 174.94 174.94 4tf4 s ARG 484 N -0.68 1.07 -0.35 2.79 1.81 -0.04 -2.18 118.95 121.37 4tf4 s ARG 484 Ca 0.45 -0.76 -0.01 0.00 -1.72 0.00 0.00 55.73 53.70 4tf4 s ARG 484 Cb -0.27 -1.09 0.12 0.00 -0.45 0.00 0.00 34.95 33.26 4tf4 s ARG 484 CO 0.33 0.28 0.18 1.21 -0.68 0.00 0.00 175.30 176.62 4tf4 s ASN 485 N -1.02 3.34 -0.26 0.23 3.84 -0.15 -1.80 114.94 119.12 4tf4 s ASN 485 Ca 0.03 -1.98 0.10 0.00 0.21 0.00 0.00 52.86 51.22 4tf4 s ASN 485 Cb -0.08 -0.55 0.48 0.00 -0.55 0.00 0.00 41.25 40.55 4tf4 s ASN 485 CO 0.01 -0.35 1.39 0.00 -2.79 0.00 0.00 177.10 175.36 4tf4 n GLN 486 N 4.34 1.77 -1.46 0.43 6.02 0.13 -3.44 117.38 125.17 4tf4 n GLN 486 Ca 0.05 -3.22 -0.36 0.00 -0.01 0.00 0.00 57.00 53.47 4tf4 n GLN 486 Cb 0.38 -1.75 0.08 0.00 1.02 0.00 0.00 30.24 29.97 4tf4 n GLN 486 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 4tf4 n SER 487 N -1.12 0.91 0.00 1.08 3.41 -1.19 -4.81 113.62 111.90 4tf4 n SER 487 Ca 0.29 0.72 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 4tf4 n SER 487 Cb 0.92 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 4tf4 n SER 487 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4tf4 n GLY 488 N 1.05 0.98 2.67 5.00 0.00 -1.26 -4.32 105.19 109.30 4tf4 n GLY 488 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 4tf4 n GLY 488 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 4tf4 n TRP 489 N 0.00 2.78 -3.03 1.61 8.01 -1.26 -4.18 117.44 121.37 4tf4 n TRP 489 Ca 0.00 -3.77 -0.08 0.00 -1.31 0.00 0.00 57.50 52.35 4tf4 n TRP 489 Cb 0.27 -0.41 0.03 0.00 -2.01 0.00 0.00 31.31 29.18 4tf4 n TRP 489 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.69 176.33 4tf4 n PRO 490 N -0.13 0.85 -2.20 -0.99 -0.04 -1.25 -4.82 135.00 126.42 4tf4 n PRO 490 Ca 0.29 -1.24 -0.41 0.00 -0.04 0.00 0.00 63.50 62.10 4tf4 n PRO 490 Cb 0.52 -0.09 -0.03 0.00 -0.04 0.00 0.00 33.50 33.86 4tf4 n PRO 490 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4tf4 s ALA 491 N -2.28 3.53 0.03 0.55 0.00 -1.26 -4.87 121.76 117.46 4tf4 s ALA 491 Ca 0.24 1.13 -0.01 0.00 0.00 0.00 0.00 51.96 53.32 4tf4 s ALA 491 Cb -0.02 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 4tf4 s ALA 491 CO 0.15 -0.55 -0.02 -0.98 0.00 0.00 0.00 175.76 174.36 4tf4 s ARG 492 N -0.23 0.45 0.51 0.00 1.70 -1.26 -4.72 118.95 115.40 4tf4 s ARG 492 Ca 0.56 -0.86 -0.17 0.00 -0.47 0.00 0.00 55.73 54.78 4tf4 s ARG 492 Cb -0.37 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.09 4tf4 s ARG 492 CO 0.39 -0.08 0.99 1.41 -1.08 0.00 0.00 175.30 176.94 4tf4 s MET 493 N -2.52 3.89 -0.46 3.89 -2.45 -1.26 -4.56 119.30 115.82 4tf4 s MET 493 Ca -0.06 1.05 0.04 0.00 -1.25 0.00 0.00 55.69 55.47 4tf4 s MET 493 Cb -0.02 -2.12 0.17 0.00 1.25 0.00 0.00 34.83 34.10 4tf4 s MET 493 CO -0.05 -0.32 0.36 -1.17 1.05 0.00 0.00 175.02 174.89 4tf4 s LEU 494 N -3.94 2.07 0.00 4.11 2.96 -0.67 -4.97 118.68 118.23 4tf4 s LEU 494 Ca 0.61 -3.15 0.21 0.00 -0.22 0.00 0.00 54.13 51.57 4tf4 s LEU 494 Cb -0.11 -0.68 0.10 0.00 0.50 0.00 0.00 46.19 46.00 4tf4 s LEU 494 CO 0.28 -0.17 1.11 -0.90 -1.32 0.00 0.00 176.35 175.35 4tf4 n ASP 495 N 2.77 2.44 -2.50 3.68 5.68 -1.26 -2.45 116.55 124.92 4tf4 n ASP 495 Ca 0.26 -1.72 -0.19 0.00 -0.50 0.00 0.00 54.79 52.64 4tf4 n ASP 495 Cb 0.44 0.18 0.02 0.00 -1.14 0.00 0.00 41.12 40.62 4tf4 n ASP 495 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 4tf4 n LYS 496 N 0.73 2.67 -3.35 0.11 5.02 -1.26 -0.82 118.16 121.27 4tf4 n LYS 496 Ca 0.11 -4.03 -0.33 0.00 -2.02 0.00 0.00 58.31 52.04 4tf4 n LYS 496 Cb 0.49 -1.92 -0.06 0.00 -0.02 0.00 0.00 35.03 33.53 4tf4 n LYS 496 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 4tf4 s GLY 497 N -3.45 2.36 -0.01 0.72 0.00 -1.26 -0.44 107.32 105.24 4tf4 s GLY 497 Ca 0.41 -0.17 -0.17 0.00 0.00 0.00 0.00 44.72 44.79 4tf4 s GLY 497 CO -0.08 0.03 0.36 -0.51 0.00 0.00 0.00 173.10 172.90 4tf4 s THR 498 N -1.71 0.05 0.04 0.90 -4.23 -0.88 -0.48 115.64 109.33 4tf4 s THR 498 Ca 0.45 -0.43 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 4tf4 s THR 498 Cb -0.13 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 72.98 4tf4 s THR 498 CO 0.20 -0.24 -0.06 0.72 -0.54 0.00 0.00 174.62 174.70 4tf4 s PHE 499 N -1.47 0.54 -0.03 3.99 -0.12 -0.70 -0.22 117.98 119.97 4tf4 s PHE 499 Ca -0.12 -0.59 0.04 0.00 -0.05 0.00 0.00 56.93 56.21 4tf4 s PHE 499 Cb -0.04 -0.34 -0.03 0.00 -0.63 0.00 0.00 43.02 41.98 4tf4 s PHE 499 CO 0.04 -0.15 -0.15 1.03 -0.05 0.00 0.00 175.22 175.95 4tf4 s ARG 500 N -1.93 2.43 -0.31 1.99 0.52 -0.49 -1.58 118.95 119.58 4tf4 s ARG 500 Ca -0.09 -0.75 0.03 0.00 -0.52 0.00 0.00 55.73 54.40 4tf4 s ARG 500 Cb -0.07 -2.34 0.09 0.00 0.52 0.00 0.00 34.95 33.14 4tf4 s ARG 500 CO -0.01 0.61 0.01 -0.47 0.02 0.00 0.00 175.30 175.45 4tf4 s TYR 501 N -0.77 3.27 0.15 -0.53 6.14 -0.63 -3.01 117.35 121.97 4tf4 s TYR 501 Ca 0.12 -2.58 -0.21 0.00 0.64 0.00 0.00 57.07 55.04 4tf4 s TYR 501 Cb -0.11 -2.43 -0.08 0.00 0.42 0.00 0.00 41.96 39.77 4tf4 s TYR 501 CO 0.02 -0.91 0.69 -1.58 0.64 0.00 0.00 175.55 174.40 4tf4 s TRP 502 N 1.08 3.80 0.06 4.97 0.51 -1.26 -1.11 118.94 126.99 4tf4 s TRP 502 Ca 0.05 1.43 -0.06 0.00 -2.12 0.00 0.00 56.10 55.40 4tf4 s TRP 502 Cb -0.19 -2.63 -0.01 0.00 -0.81 0.00 0.00 33.47 29.83 4tf4 s TRP 502 CO -0.09 0.49 0.12 -0.59 -0.51 0.00 0.00 176.95 176.37 4tf4 s PHE 503 N -1.24 0.23 -0.17 -1.98 -0.12 -0.38 -1.66 117.98 112.65 4tf4 s PHE 503 Ca 0.35 -0.63 -0.07 0.00 -0.05 0.00 0.00 56.93 56.54 4tf4 s PHE 503 Cb -0.20 -0.15 -0.04 0.00 -0.63 0.00 0.00 43.02 42.00 4tf4 s PHE 503 CO 0.22 -0.45 0.06 0.99 -0.05 0.00 0.00 175.22 175.99 4tf4 s THR 504 N -3.41 4.74 0.24 -4.49 2.01 -1.26 -1.93 115.64 111.54 4tf4 s THR 504 Ca 0.02 -0.06 -0.30 0.00 0.31 0.00 0.00 61.69 61.66 4tf4 s THR 504 Cb 0.03 -3.12 -0.11 0.00 0.01 0.00 0.00 72.50 69.32 4tf4 s THR 504 CO -0.08 0.48 1.52 -0.22 -0.69 0.00 0.00 174.62 175.63 4tf4 s LEU 505 N 0.22 4.37 0.24 4.42 2.96 0.92 -4.85 118.68 126.96 4tf4 s LEU 505 Ca 0.04 2.75 0.05 0.00 -0.22 0.00 0.00 54.13 56.74 4tf4 s LEU 505 Cb -0.12 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 42.92 4tf4 s LEU 505 CO 0.01 -0.80 0.36 -1.81 -1.32 0.00 0.00 176.35 172.78 4tf4 s ASP 506 N 0.60 6.27 -0.09 3.68 1.01 -1.26 -4.94 116.67 121.94 4tf4 s ASP 506 Ca 0.63 0.05 -0.29 0.00 0.71 0.00 0.00 52.55 53.65 4tf4 s ASP 506 Cb -0.44 -1.82 -0.05 0.00 1.01 0.00 0.00 42.92 41.61 4tf4 s ASP 506 CO 0.41 -0.08 1.71 -0.70 0.21 0.00 0.00 175.17 176.73 4tf4 s GLU 507 N -3.98 4.03 0.00 8.23 2.56 -1.26 -1.69 118.70 126.58 4tf4 s GLU 507 Ca 0.34 2.10 0.00 0.00 0.00 0.00 0.00 54.97 57.41 4tf4 s GLU 507 Cb -0.09 -4.04 0.00 0.00 2.00 0.00 0.00 34.13 32.00 4tf4 s GLU 507 CO 0.29 -1.04 0.00 0.41 -0.56 0.00 0.00 175.26 174.36 4tf4 n GLY 508 N 4.39 0.28 3.43 -1.50 0.00 -1.26 -4.79 105.19 105.73 4tf4 n GLY 508 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 4tf4 n GLY 508 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4tf4 s VAL 509 N -2.00 4.86 -0.29 1.61 1.01 -0.68 -4.88 120.40 120.03 4tf4 s VAL 509 Ca 0.00 -0.68 -0.24 0.00 0.00 0.00 0.00 61.98 61.06 4tf4 s VAL 509 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.72 4tf4 s VAL 509 CO 0.00 -0.20 0.82 -0.62 0.00 0.00 0.00 175.10 175.10 4tf4 s ASP 510 N 1.62 6.71 0.48 3.32 2.15 -1.26 -4.64 116.67 125.05 4tf4 s ASP 510 Ca 0.04 0.76 0.24 0.00 0.43 0.00 0.00 52.55 54.02 4tf4 s ASP 510 Cb -0.19 -2.42 1.28 0.00 -0.30 0.00 0.00 42.92 41.29 4tf4 s ASP 510 CO 0.08 -0.62 1.89 1.55 -0.17 0.00 0.00 175.17 177.91 4tf4 h PRO 511 N 8.03 0.19 -0.30 4.34 0.13 -1.97 0.26 132.00 142.69 4tf4 h PRO 511 Ca -0.24 -0.01 0.03 0.00 -0.87 0.00 0.00 66.00 64.91 4tf4 h PRO 511 Cb 1.09 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 4tf4 h PRO 511 CO 0.89 0.12 0.20 0.00 -0.23 0.00 0.00 178.00 178.99 4tf4 h ALA 512 N 1.61 1.96 -0.01 -0.56 0.00 -2.02 -1.62 119.26 118.62 4tf4 h ALA 512 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.31 4tf4 h ALA 512 Cb 1.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 4tf4 h ALA 512 CO -0.09 -0.00 -0.16 -0.25 0.00 0.00 0.00 179.25 178.76 4tf4 n ASP 513 N -4.49 0.85 -4.71 0.00 9.92 0.90 -4.89 116.55 114.13 4tf4 n ASP 513 Ca 0.03 -0.86 -0.42 0.00 -0.53 0.00 0.00 54.79 53.00 4tf4 n ASP 513 Cb 0.18 0.03 -0.03 0.00 -0.64 0.00 0.00 41.12 40.66 4tf4 n ASP 513 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 4tf4 s ILE 514 N -2.40 4.47 0.12 0.53 1.01 -0.61 -4.79 121.20 119.53 4tf4 s ILE 514 Ca 0.29 1.80 0.10 0.00 0.00 0.00 0.00 60.65 62.84 4tf4 s ILE 514 Cb 0.20 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 4tf4 s ILE 514 CO 0.47 0.15 -0.25 0.42 0.00 0.00 0.00 174.94 175.73 4tf4 s THR 515 N 0.93 2.11 -0.26 2.92 -4.23 -0.66 -4.88 115.64 111.57 4tf4 s THR 515 Ca 0.54 -1.71 0.01 0.00 -1.18 0.00 0.00 61.69 59.35 4tf4 s THR 515 Cb -0.25 -1.88 0.07 0.00 1.34 0.00 0.00 72.50 71.78 4tf4 s THR 515 CO 0.29 0.04 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.69 4tf4 s VAL 516 N -1.12 1.63 0.43 2.29 1.01 -1.26 -0.89 120.40 122.50 4tf4 s VAL 516 Ca 0.12 -1.44 0.04 0.00 0.00 0.00 0.00 61.98 60.70 4tf4 s VAL 516 Cb -0.10 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 4tf4 s VAL 516 CO 0.06 -0.23 0.03 -0.94 0.00 0.00 0.00 175.10 174.02 4tf4 s SER 517 N 1.32 3.58 -0.04 3.32 1.04 -0.66 -4.66 113.70 117.60 4tf4 s SER 517 Ca -0.02 -1.52 -0.27 0.00 0.48 0.00 0.00 55.95 54.62 4tf4 s SER 517 Cb -0.19 0.12 0.06 0.00 0.10 0.00 0.00 66.02 66.11 4tf4 s SER 517 CO -0.08 -0.69 0.60 -0.55 0.98 0.00 0.00 173.24 173.49 4tf4 s SER 518 N -3.72 -0.55 -0.01 7.02 0.15 -1.26 -0.23 113.70 115.09 4tf4 s SER 518 Ca 0.23 0.57 0.16 0.00 0.70 0.00 0.00 55.95 57.61 4tf4 s SER 518 Cb 0.06 0.49 -0.20 0.00 -1.71 0.00 0.00 66.02 64.65 4tf4 s SER 518 CO 0.12 -0.58 0.54 0.00 1.20 0.00 0.00 173.24 174.52 4tf4 n ALA 519 N 0.98 3.48 -3.57 5.45 0.00 -1.26 -4.91 120.51 120.68 4tf4 n ALA 519 Ca -0.20 -0.42 -0.02 0.00 0.00 0.00 0.00 53.44 52.81 4tf4 n ALA 519 Cb 0.57 -0.57 -0.05 0.00 0.00 0.00 0.00 19.45 19.41 4tf4 n ALA 519 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 4tf4 s TYR 520 N -2.74 -1.28 -0.22 0.00 5.04 -1.26 -5.12 117.35 111.76 4tf4 s TYR 520 Ca 0.01 2.07 -0.05 0.00 -2.44 0.00 0.00 57.07 56.66 4tf4 s TYR 520 Cb 0.11 0.67 0.11 0.00 0.35 0.00 0.00 41.96 43.20 4tf4 s TYR 520 CO 0.66 -0.67 0.41 1.21 -1.34 0.00 0.00 175.55 175.82 4tf4 s ASN 521 N 2.84 -0.10 0.00 4.32 2.47 -1.26 -1.57 114.94 121.63 4tf4 s ASN 521 Ca -0.01 0.66 0.26 0.00 0.42 0.00 0.00 52.86 54.20 4tf4 s ASN 521 Cb -0.13 1.29 1.15 0.00 -1.45 0.00 0.00 41.25 42.12 4tf4 s ASN 521 CO -0.18 -0.26 1.85 0.00 -3.72 0.00 0.00 177.10 174.79 4tf4 n GLN 522 N 5.38 0.05 -2.72 0.43 6.02 -0.49 -4.79 117.38 121.26 4tf4 n GLN 522 Ca -0.06 0.05 -0.11 0.00 -0.01 0.00 0.00 57.00 56.86 4tf4 n GLN 522 Cb 0.50 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.24 4tf4 n GLN 522 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 4tf4 s ALA 524 N -2.32 2.81 -0.29 0.00 0.00 -0.71 -5.00 121.76 116.25 4tf4 s ALA 524 Ca 0.06 0.41 -0.05 0.00 0.00 0.00 0.00 51.96 52.38 4tf4 s ALA 524 Cb -0.00 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.92 4tf4 s ALA 524 CO 0.04 -0.63 0.03 0.99 0.00 0.00 0.00 175.76 176.19 4tf4 s THR 525 N -2.38 3.51 0.49 0.00 2.01 -1.26 -4.26 115.64 113.74 4tf4 s THR 525 Ca 0.64 -0.93 -0.20 0.00 0.31 0.00 0.00 61.69 61.51 4tf4 s THR 525 Cb -0.15 -2.85 -0.09 0.00 0.01 0.00 0.00 72.50 69.42 4tf4 s THR 525 CO 0.33 0.06 1.02 -2.16 -0.69 0.00 0.00 174.62 173.18 4tf4 s PRO 526 N 1.41 3.85 -0.10 4.92 0.04 -1.26 -5.01 135.00 138.84 4tf4 s PRO 526 Ca 0.00 1.29 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 4tf4 s PRO 526 Cb -0.18 -2.11 -0.27 0.00 0.04 0.00 0.00 34.50 31.98 4tf4 s PRO 526 CO 0.00 -0.38 0.49 1.49 0.04 0.00 0.00 177.00 178.64 4tf4 h GLU 527 N 1.51 0.28 -5.43 4.56 4.81 -1.96 -3.41 114.58 114.93 4tf4 h GLU 527 Ca -0.49 -0.48 -0.64 0.00 -0.13 0.00 0.00 59.36 57.62 4tf4 h GLU 527 Cb 1.21 0.18 -0.13 0.00 0.63 0.00 0.00 28.75 30.64 4tf4 h GLU 527 CO 0.59 1.23 -0.56 0.16 -0.73 0.00 0.00 179.01 179.70 4tf4 s ASP 528 N -7.10 3.90 0.47 1.04 1.47 -1.26 -4.51 116.67 110.68 4tf4 s ASP 528 Ca -0.20 -1.50 0.07 0.00 1.18 0.00 0.00 52.55 52.10 4tf4 s ASP 528 Cb 0.06 0.02 0.00 0.00 -0.34 0.00 0.00 42.92 42.66 4tf4 s ASP 528 CO 0.78 -0.64 0.40 0.68 0.68 0.00 0.00 175.17 177.07 4tf4 s VAL 529 N -2.81 2.29 -0.16 2.11 -7.23 -1.26 -4.80 120.40 108.53 4tf4 s VAL 529 Ca 0.22 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 4tf4 s VAL 529 Cb 0.06 -2.68 0.03 0.00 0.56 0.00 0.00 36.38 34.35 4tf4 s VAL 529 CO 0.11 0.00 -0.13 -1.00 -0.31 0.00 0.00 175.10 173.78 4tf4 s HIS 530 N -2.59 2.22 -0.02 2.82 0.09 -0.28 -4.96 115.29 112.57 4tf4 s HIS 530 Ca 0.44 -1.32 -0.30 0.00 -0.00 0.00 0.00 55.06 53.88 4tf4 s HIS 530 Cb -0.02 -1.59 -0.03 0.00 -0.00 0.00 0.00 32.58 30.93 4tf4 s HIS 530 CO 0.26 -0.69 1.00 -1.58 -0.00 0.00 0.00 174.74 173.73 4tf4 s HIS 531 N 1.47 3.61 -0.05 1.40 5.04 -1.26 -0.59 115.29 124.92 4tf4 s HIS 531 Ca 0.03 1.66 -0.04 0.00 -1.54 0.00 0.00 55.06 55.16 4tf4 s HIS 531 Cb -0.14 -3.15 -0.01 0.00 0.04 0.00 0.00 32.58 29.32 4tf4 s HIS 531 CO -0.10 -0.12 -0.08 0.28 -2.34 0.00 0.00 174.74 172.38 4tf4 n VAL 532 N 4.06 0.42 -3.59 0.89 0.31 0.18 -4.98 118.33 115.62 4tf4 n VAL 532 Ca 0.07 0.41 -0.12 0.00 -0.01 0.00 0.00 64.34 64.69 4tf4 n VAL 532 Cb 0.50 -1.75 -0.06 0.00 -0.91 0.00 0.00 33.84 31.62 4tf4 n VAL 532 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 4tf4 s SER 533 N -4.36 -0.47 1.65 4.52 1.04 -1.19 -5.03 113.70 109.85 4tf4 s SER 533 Ca -0.06 0.66 0.00 0.00 0.48 0.00 0.00 55.95 57.03 4tf4 s SER 533 Cb 0.01 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.71 4tf4 s SER 533 CO 0.10 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.59 4tf4 n GLY 534 N 1.29 3.73 1.07 7.32 0.00 -1.26 -0.79 105.19 116.55 4tf4 n GLY 534 Ca -0.13 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.06 4tf4 n GLY 534 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 4tf4 n ASP 535 N 6.08 3.13 -4.68 1.61 8.00 -1.26 -4.92 116.55 124.51 4tf4 n ASP 535 Ca 0.00 -1.96 -0.40 0.00 0.71 0.00 0.00 54.79 53.14 4tf4 n ASP 535 Cb 0.00 -0.32 -0.05 0.00 -0.02 0.00 0.00 41.12 40.72 4tf4 n ASP 535 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 4tf4 s LEU 536 N -1.22 4.20 0.17 0.64 2.96 0.03 -0.05 118.68 125.41 4tf4 s LEU 536 Ca 0.39 0.95 0.01 0.00 -0.22 0.00 0.00 54.13 55.27 4tf4 s LEU 536 Cb 0.21 -2.95 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 4tf4 s LEU 536 CO 0.29 -0.22 0.03 -0.31 -1.32 0.00 0.00 176.35 174.82 4tf4 s TYR 537 N 1.53 1.15 -0.03 5.38 1.51 -0.81 -0.65 117.35 125.43 4tf4 s TYR 537 Ca 0.32 -1.11 -0.14 0.00 -1.01 0.00 0.00 57.07 55.12 4tf4 s TYR 537 Cb -0.16 -0.65 0.02 0.00 -0.11 0.00 0.00 41.96 41.06 4tf4 s TYR 537 CO 0.12 -0.32 0.31 1.52 -1.11 0.00 0.00 175.55 176.07 4tf4 s TYR 538 N -3.79 -0.21 -0.18 2.71 -0.85 0.25 -1.25 117.35 114.02 4tf4 s TYR 538 Ca 0.26 0.36 -0.09 0.00 -0.52 0.00 0.00 57.07 57.08 4tf4 s TYR 538 Cb 0.07 0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.46 4tf4 s TYR 538 CO 0.05 -0.36 0.10 0.08 -1.52 0.00 0.00 175.55 173.90 4tf4 s VAL 539 N -1.10 5.16 -0.23 -3.49 1.01 -0.27 -1.12 120.40 120.35 4tf4 s VAL 539 Ca -0.12 0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 4tf4 s VAL 539 Cb -0.05 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.01 4tf4 s VAL 539 CO 0.04 0.46 -0.06 -0.70 0.00 0.00 0.00 175.10 174.84 4tf4 s GLU 540 N 0.23 3.12 -0.17 2.72 2.12 -1.26 -1.60 118.70 123.86 4tf4 s GLU 540 Ca 0.07 -0.79 -0.15 0.00 0.36 0.00 0.00 54.97 54.46 4tf4 s GLU 540 Cb -0.12 -2.96 -0.04 0.00 0.26 0.00 0.00 34.13 31.27 4tf4 s GLU 540 CO -0.01 -0.28 0.34 0.42 -0.54 0.00 0.00 175.26 175.19 4tf4 s ILE 541 N 1.40 5.27 -0.31 -3.70 -1.09 -0.61 -4.67 121.20 117.48 4tf4 s ILE 541 Ca 0.04 0.62 -0.10 0.00 -2.23 0.00 0.00 60.65 58.98 4tf4 s ILE 541 Cb -0.15 -3.67 -0.01 0.00 -1.58 0.00 0.00 42.46 37.05 4tf4 s ILE 541 CO -0.05 0.34 0.15 -0.62 -1.23 0.00 0.00 174.94 173.54 4tf4 s ASP 542 N 0.68 5.57 -0.07 3.58 -1.08 -1.26 -1.72 116.67 122.37 4tf4 s ASP 542 Ca 0.18 -0.50 0.11 0.00 -0.52 0.00 0.00 52.55 51.82 4tf4 s ASP 542 Cb -0.14 -2.01 0.27 0.00 -1.46 0.00 0.00 42.92 39.58 4tf4 s ASP 542 CO 0.06 -0.19 1.20 0.00 0.52 0.00 0.00 175.17 176.76 4tf4 s THR 544 N -1.88 2.23 0.00 0.00 -4.23 -1.01 -1.77 115.64 108.98 4tf4 s THR 544 Ca 0.23 0.21 0.00 0.00 -1.18 0.00 0.00 61.69 60.95 4tf4 s THR 544 Cb 0.18 -3.13 0.00 0.00 1.34 0.00 0.00 72.50 70.88 4tf4 s THR 544 CO 0.07 0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 4tf4 n GLY 545 N 1.46 2.70 3.70 3.99 0.00 0.00 -4.98 105.19 112.07 4tf4 n GLY 545 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 4tf4 n GLY 545 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4tf4 s GLU 546 N -0.16 4.48 -0.63 1.61 0.41 -0.73 -4.98 118.70 118.70 4tf4 s GLU 546 Ca 0.00 1.47 -0.19 0.00 -0.41 0.00 0.00 54.97 55.84 4tf4 s GLU 546 Cb 0.00 -3.48 0.11 0.00 -1.78 0.00 0.00 34.13 28.98 4tf4 s GLU 546 CO 0.00 -0.19 0.74 0.15 -0.49 0.00 0.00 175.26 175.47 4tf4 s LYS 547 N 1.45 3.11 -0.41 1.61 1.02 -1.26 -4.08 119.74 121.18 4tf4 s LYS 547 Ca 0.52 -1.39 -0.16 0.00 0.02 0.00 0.00 55.97 54.96 4tf4 s LYS 547 Cb -0.21 -4.31 0.02 0.00 -0.52 0.00 0.00 37.83 32.80 4tf4 s LYS 547 CO 0.24 -1.56 0.35 0.42 -0.92 0.00 0.00 175.35 173.89 4tf4 s ILE 548 N 2.60 5.19 0.02 2.17 1.01 -1.03 -4.82 121.20 126.35 4tf4 s ILE 548 Ca 0.13 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.22 4tf4 s ILE 548 Cb -0.22 -3.96 -0.00 0.00 0.01 0.00 0.00 42.46 38.29 4tf4 s ILE 548 CO 0.05 -0.33 0.15 0.72 0.00 0.00 0.00 174.94 175.53 4tf4 s PHE 549 N 1.88 0.08 -0.93 3.97 -0.71 -0.39 -1.67 117.98 120.21 4tf4 s PHE 549 Ca 0.08 -0.28 -0.21 0.00 -1.04 0.00 0.00 56.93 55.49 4tf4 s PHE 549 Cb -0.18 -0.06 -0.11 0.00 -1.21 0.00 0.00 43.02 41.45 4tf4 s PHE 549 CO 0.12 -0.36 1.97 -0.35 -1.34 0.00 0.00 175.22 175.26 4tf4 n PRO 550 N 0.99 1.78 -1.38 1.99 -0.04 -1.22 -2.20 135.00 134.93 4tf4 n PRO 550 Ca -0.20 -2.06 -0.02 0.00 -0.04 0.00 0.00 63.50 61.17 4tf4 n PRO 550 Cb 0.57 -3.06 -0.02 0.00 -0.04 0.00 0.00 33.50 30.95 4tf4 n PRO 550 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4tf4 n GLY 551 N 4.59 0.85 0.00 0.55 0.00 -1.11 -4.39 105.19 105.68 4tf4 n GLY 551 Ca 0.50 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.12 4tf4 n GLY 551 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4tf4 n GLY 552 N 0.09 2.36 0.15 -0.02 0.00 -0.41 -4.42 105.19 102.94 4tf4 n GLY 552 Ca -0.12 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 44.84 4tf4 n GLY 552 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 4tf4 h GLN 553 N 0.00 -0.29 0.00 1.61 5.75 -1.78 -2.69 115.11 117.71 4tf4 h GLN 553 Ca 0.00 0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.49 4tf4 h GLN 553 Cb 0.00 0.07 -0.00 0.00 1.07 0.00 0.00 27.48 28.61 4tf4 h GLN 553 CO 0.00 -0.08 -0.63 0.77 -2.65 0.00 0.00 178.83 176.24 4tf4 h SER 554 N -0.46 0.00 -0.10 -0.69 0.02 -1.94 -3.37 113.55 107.02 4tf4 h SER 554 Ca -0.03 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.73 4tf4 h SER 554 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 4tf4 h SER 554 CO 0.05 0.11 -0.62 -0.33 -1.14 0.00 0.00 176.83 174.90 4tf4 h GLU 555 N 0.00 0.71 0.00 3.45 3.07 -1.83 -3.27 114.58 116.71 4tf4 h GLU 555 Ca -0.02 -0.49 0.00 0.00 -0.50 0.00 0.00 59.36 58.35 4tf4 h GLU 555 Cb 1.10 0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.08 4tf4 h GLU 555 CO 0.01 1.11 0.00 -2.39 -1.40 0.00 0.00 179.01 176.34 4tf4 n HIS 556 N -3.96 0.00 -3.97 4.33 1.44 -0.93 -1.26 115.22 110.87 4tf4 n HIS 556 Ca -0.05 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.58 4tf4 n HIS 556 Cb 0.66 -0.34 -0.10 0.00 0.12 0.00 0.00 29.99 30.33 4tf4 n HIS 556 CO 0.00 0.00 0.00 -0.98 -2.81 0.00 0.00 176.34 172.55 4tf4 s ARG 557 N -2.69 0.55 -0.07 -1.40 1.70 -1.23 -0.98 118.95 114.83 4tf4 s ARG 557 Ca 0.25 -0.84 0.00 0.00 -0.47 0.00 0.00 55.73 54.67 4tf4 s ARG 557 Cb 0.20 0.21 0.02 0.00 -0.57 0.00 0.00 34.95 34.81 4tf4 s ARG 557 CO 0.48 -0.12 -0.05 1.03 -1.08 0.00 0.00 175.30 175.55 4tf4 s ARG 558 N -2.74 1.11 -0.09 3.89 1.81 -0.93 -4.87 118.95 117.13 4tf4 s ARG 558 Ca -0.04 -0.14 -0.17 0.00 -1.72 0.00 0.00 55.73 53.66 4tf4 s ARG 558 Cb -0.00 -1.17 -0.05 0.00 -0.45 0.00 0.00 34.95 33.28 4tf4 s ARG 558 CO -0.05 -0.17 0.45 -2.00 -0.68 0.00 0.00 175.30 172.84 4tf4 s GLU 559 N 1.37 4.25 -0.19 3.54 2.12 -1.26 -1.26 118.70 127.27 4tf4 s GLU 559 Ca -0.03 0.41 -0.03 0.00 0.36 0.00 0.00 54.97 55.69 4tf4 s GLU 559 Cb -0.14 -3.39 0.06 0.00 0.26 0.00 0.00 34.13 30.93 4tf4 s GLU 559 CO -0.03 0.28 0.03 0.08 -0.54 0.00 0.00 175.26 175.09 4tf4 s VAL 560 N 0.22 0.54 -0.12 3.70 1.01 -0.45 -1.39 120.40 123.91 4tf4 s VAL 560 Ca 0.25 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 4tf4 s VAL 560 Cb -0.15 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 4tf4 s VAL 560 CO 0.10 -0.18 0.11 -1.10 0.00 0.00 0.00 175.10 174.03 4tf4 s GLN 561 N 1.85 3.39 -0.18 2.72 -0.21 -0.61 -0.76 119.66 125.86 4tf4 s GLN 561 Ca -0.01 -0.20 -0.10 0.00 0.02 0.00 0.00 55.36 55.08 4tf4 s GLN 561 Cb -0.17 -3.12 0.06 0.00 1.00 0.00 0.00 33.01 30.79 4tf4 s GLN 561 CO -0.08 0.73 0.43 -0.59 -2.12 0.00 0.00 175.29 173.66 4tf4 s PHE 562 N -0.91 -0.64 -0.18 0.91 -0.71 -0.35 -4.60 117.98 111.50 4tf4 s PHE 562 Ca 0.14 1.35 -0.04 0.00 -1.04 0.00 0.00 56.93 57.33 4tf4 s PHE 562 Cb -0.12 0.29 -0.03 0.00 -1.21 0.00 0.00 43.02 41.96 4tf4 s PHE 562 CO 0.03 -0.36 -0.02 0.50 -1.34 0.00 0.00 175.22 174.04 4tf4 s ARG 563 N 1.45 3.65 -0.47 1.99 3.52 0.68 -0.81 118.95 128.95 4tf4 s ARG 563 Ca -0.09 -0.52 -0.10 0.00 -0.13 0.00 0.00 55.73 54.89 4tf4 s ARG 563 Cb -0.08 -3.00 0.11 0.00 -1.56 0.00 0.00 34.95 30.42 4tf4 s ARG 563 CO -0.13 0.13 0.34 0.42 -0.81 0.00 0.00 175.30 175.25 4tf4 s ILE 564 N 0.68 4.26 -0.29 4.11 1.01 -0.67 -1.66 121.20 128.65 4tf4 s ILE 564 Ca -0.01 -1.72 -0.18 0.00 0.00 0.00 0.00 60.65 58.73 4tf4 s ILE 564 Cb -0.14 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.53 4tf4 s ILE 564 CO 0.02 -0.75 0.53 0.00 0.00 0.00 0.00 174.94 174.75 4tf4 s ALA 565 N 1.38 3.55 -0.81 9.38 0.00 -0.06 -1.91 121.76 133.29 4tf4 s ALA 565 Ca 0.05 -0.71 0.08 0.00 0.00 0.00 0.00 51.96 51.39 4tf4 s ALA 565 Cb -0.26 -2.96 0.01 0.00 0.00 0.00 0.00 23.12 19.91 4tf4 s ALA 565 CO -0.00 -0.92 0.60 0.41 0.00 0.00 0.00 175.76 175.85 4tf4 n GLY 566 N 4.50 -0.25 2.49 0.00 0.00 -0.17 -1.65 105.19 110.12 4tf4 n GLY 566 Ca -0.04 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.74 4tf4 n GLY 566 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4tf4 n GLY 567 N 0.77 -2.36 3.72 -0.02 0.00 -0.69 -4.62 105.19 101.99 4tf4 n GLY 567 Ca 0.04 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 4tf4 n GLY 567 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 4tf4 s PRO 568 N -0.59 4.19 0.00 1.61 0.04 -1.26 -2.14 135.00 136.85 4tf4 s PRO 568 Ca 0.00 2.44 0.00 0.00 0.04 0.00 0.00 61.00 63.48 4tf4 s PRO 568 Cb 0.00 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.42 4tf4 s PRO 568 CO 0.00 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.81 4tf4 n GLY 569 N 3.58 2.18 3.69 0.56 0.00 -1.26 -4.65 105.19 109.29 4tf4 n GLY 569 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 4tf4 n GLY 569 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 4tf4 n TRP 570 N -0.35 2.51 -3.63 1.61 -0.00 -0.91 -4.62 117.44 112.05 4tf4 n TRP 570 Ca 0.00 0.07 -0.27 0.00 -0.00 0.00 0.00 57.50 57.30 4tf4 n TRP 570 Cb 0.00 -2.64 -0.17 0.00 -0.00 0.00 0.00 31.31 28.50 4tf4 n TRP 570 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 4tf4 s ASP 571 N 1.75 2.63 0.04 5.87 2.15 -1.26 -4.76 116.67 123.08 4tf4 s ASP 571 Ca 0.80 -0.75 0.27 0.00 0.43 0.00 0.00 52.55 53.30 4tf4 s ASP 571 Cb -0.58 -0.34 1.13 0.00 -0.30 0.00 0.00 42.92 42.83 4tf4 s ASP 571 CO 0.37 -0.35 1.87 -0.81 -0.17 0.00 0.00 175.17 176.08 4tf4 n PRO 572 N 5.22 0.04 0.28 4.34 -0.04 -1.26 -3.89 135.00 139.70 4tf4 n PRO 572 Ca -0.07 0.06 0.16 0.00 -0.04 0.00 0.00 63.50 63.60 4tf4 n PRO 572 Cb 0.48 -1.55 0.82 0.00 -0.04 0.00 0.00 33.50 33.20 4tf4 n PRO 572 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 4tf4 h SER 573 N 0.00 0.00 -0.58 3.54 4.64 -1.99 -1.85 113.55 117.31 4tf4 h SER 573 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 4tf4 h SER 573 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 4tf4 h SER 573 CO 0.00 0.07 0.00 -0.46 -0.87 0.00 0.00 176.83 175.57 4tf4 n ASN 574 N -3.38 4.14 -4.73 4.97 0.23 -1.25 -4.95 115.26 110.29 4tf4 n ASN 574 Ca -0.01 -2.30 -0.39 0.00 -0.53 0.00 0.00 54.58 51.35 4tf4 n ASN 574 Cb 0.22 -0.49 -0.05 0.00 -2.08 0.00 0.00 39.78 37.38 4tf4 n ASN 574 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 4tf4 s ASP 575 N -1.04 6.86 0.07 0.53 1.01 -0.70 -4.32 116.67 119.09 4tf4 s ASP 575 Ca 0.45 1.03 -0.34 0.00 0.71 0.00 0.00 52.55 54.40 4tf4 s ASP 575 Cb 0.27 -2.35 -0.17 0.00 1.01 0.00 0.00 42.92 41.68 4tf4 s ASP 575 CO 0.24 -0.02 1.53 -0.25 0.21 0.00 0.00 175.17 176.88 4tf4 h TRP 576 N 6.48 -1.29 0.00 4.23 2.91 -1.88 -2.60 115.95 123.80 4tf4 h TRP 576 Ca -0.42 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.60 4tf4 h TRP 576 Cb 1.19 0.48 0.00 0.00 -0.51 0.00 0.00 29.16 30.32 4tf4 h TRP 576 CO 0.64 -0.67 0.00 0.43 -1.03 0.00 0.00 178.44 177.81 4tf4 n SER 577 N -5.38 0.43 0.21 2.65 7.64 -0.67 -2.41 113.62 116.08 4tf4 n SER 577 Ca -0.13 0.65 0.11 0.00 1.01 0.00 0.00 58.87 60.51 4tf4 n SER 577 Cb 0.46 -0.72 0.19 0.00 -1.01 0.00 0.00 64.21 63.13 4tf4 n SER 577 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 4tf4 h PHE 578 N 0.00 0.00 -2.04 1.43 3.57 -1.68 -3.44 116.94 114.78 4tf4 h PHE 578 Ca 0.00 0.00 -0.62 0.00 3.53 0.00 0.00 57.97 60.88 4tf4 h PHE 578 Cb 0.15 0.00 0.02 0.00 2.79 0.00 0.00 35.95 38.91 4tf4 h PHE 578 CO 0.00 0.08 1.07 1.04 -2.23 0.00 0.00 178.31 178.27 4tf4 n GLN 579 N -3.12 2.15 0.00 1.11 6.02 -1.01 -2.26 117.38 120.26 4tf4 n GLN 579 Ca 0.03 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.81 4tf4 n GLN 579 Cb 0.54 -2.62 0.00 0.00 1.02 0.00 0.00 30.24 29.18 4tf4 n GLN 579 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4tf4 n GLY 580 N 4.32 2.33 3.63 1.08 0.00 -1.26 -4.76 105.19 110.52 4tf4 n GLY 580 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 4tf4 n GLY 580 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4tf4 s ILE 581 N -2.28 3.97 0.00 -0.61 1.01 -0.96 -4.98 121.20 117.36 4tf4 s ILE 581 Ca 0.00 1.10 0.00 0.00 0.00 0.00 0.00 60.65 61.75 4tf4 s ILE 581 Cb 0.00 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.49 4tf4 s ILE 581 CO 0.00 -0.40 0.00 0.61 0.00 0.00 0.00 174.94 175.15 4tf4 n GLY 582 N 4.43 3.70 0.42 6.18 0.00 -1.26 -4.77 105.19 113.90 4tf4 n GLY 582 Ca 0.16 -1.92 0.13 0.00 0.00 0.00 0.00 46.02 44.39 4tf4 n GLY 582 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4tf4 n ASN 583 N 0.00 1.56 -4.54 1.61 5.03 -1.26 -1.25 115.26 116.41 4tf4 n ASN 583 Ca 0.00 -1.27 -0.33 0.00 0.87 0.00 0.00 54.58 53.86 4tf4 n ASN 583 Cb 0.00 0.19 -0.12 0.00 -1.02 0.00 0.00 39.78 38.84 4tf4 n ASN 583 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 4tf4 s GLU 584 N -2.36 2.54 0.05 3.52 0.41 -1.26 -4.79 118.70 116.80 4tf4 s GLU 584 Ca 0.25 -0.69 -0.30 0.00 -0.41 0.00 0.00 54.97 53.82 4tf4 s GLU 584 Cb 0.19 -2.46 -0.08 0.00 -1.78 0.00 0.00 34.13 30.01 4tf4 s GLU 584 CO 0.48 0.62 1.67 -1.17 -0.49 0.00 0.00 175.26 176.37 4tf4 s LEU 585 N -1.05 4.36 0.09 1.80 2.96 -1.26 -4.54 118.68 121.04 4tf4 s LEU 585 Ca 0.14 2.47 -0.20 0.00 -0.22 0.00 0.00 54.13 56.32 4tf4 s LEU 585 Cb -0.11 -3.56 0.05 0.00 0.50 0.00 0.00 46.19 43.07 4tf4 s LEU 585 CO 0.03 -0.90 0.49 0.00 -1.32 0.00 0.00 176.35 174.65 4tf4 s ALA 586 N 2.92 -1.22 0.21 5.97 0.00 -0.97 -4.90 121.76 123.78 4tf4 s ALA 586 Ca 0.75 0.34 -0.32 0.00 0.00 0.00 0.00 51.96 52.72 4tf4 s ALA 586 Cb -0.39 0.57 -0.14 0.00 0.00 0.00 0.00 23.12 23.16 4tf4 s ALA 586 CO 0.32 -0.59 1.39 -2.30 0.00 0.00 0.00 175.76 174.58 4tf4 n PRO 587 N 0.06 1.87 -3.58 0.00 -0.02 -1.26 -0.68 135.00 131.39 4tf4 n PRO 587 Ca -0.17 0.67 -0.40 0.00 -2.02 0.00 0.00 63.50 61.57 4tf4 n PRO 587 Cb 0.62 -2.31 -0.08 0.00 -0.02 0.00 0.00 33.50 31.71 4tf4 n PRO 587 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4tf4 s ALA 588 N 0.09 3.58 0.59 3.55 0.00 0.14 -4.80 121.76 124.92 4tf4 s ALA 588 Ca 0.71 -2.95 0.38 0.00 0.00 0.00 0.00 51.96 50.10 4tf4 s ALA 588 Cb -0.70 -2.88 2.10 0.00 0.00 0.00 0.00 23.12 21.64 4tf4 s ALA 588 CO 0.48 -2.04 2.29 -1.35 0.00 0.00 0.00 175.76 175.14 4tf4 h PRO 589 N 7.79 0.00 -0.67 0.00 0.11 -1.89 -2.88 132.00 134.46 4tf4 h PRO 589 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 4tf4 h PRO 589 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 4tf4 h PRO 589 CO 0.78 0.01 0.00 0.66 -0.21 0.00 0.00 178.00 179.24 4tf4 n TYR 590 N -3.40 0.93 -3.80 0.65 4.01 -1.26 -1.37 117.16 112.91 4tf4 n TYR 590 Ca -0.03 -0.45 -0.36 0.00 -0.16 0.00 0.00 57.90 56.90 4tf4 n TYR 590 Cb 0.10 -0.01 -0.13 0.00 -0.31 0.00 0.00 39.34 38.99 4tf4 n TYR 590 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 4tf4 s ILE 591 N -1.15 3.89 -0.12 -0.72 1.01 -1.09 -4.27 121.20 118.76 4tf4 s ILE 591 Ca 0.45 -0.46 -0.20 0.00 0.00 0.00 0.00 60.65 60.44 4tf4 s ILE 591 Cb 0.24 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 4tf4 s ILE 591 CO 0.30 0.27 0.56 -0.69 0.00 0.00 0.00 174.94 175.38 4tf4 s VAL 592 N 1.53 5.13 -0.20 2.92 1.01 -1.16 -4.16 120.40 125.46 4tf4 s VAL 592 Ca 0.05 1.11 -0.08 0.00 0.00 0.00 0.00 61.98 63.06 4tf4 s VAL 592 Cb -0.16 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 4tf4 s VAL 592 CO 0.01 0.27 0.07 -0.22 0.00 0.00 0.00 175.10 175.23 4tf4 s LEU 593 N 0.91 3.77 -0.09 3.92 2.96 -0.62 -1.40 118.68 128.13 4tf4 s LEU 593 Ca 0.29 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.26 4tf4 s LEU 593 Cb -0.16 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 4tf4 s LEU 593 CO 0.12 0.13 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.77 4tf4 s TYR 594 N 0.65 2.62 -0.53 5.38 1.51 0.69 0.03 117.35 127.70 4tf4 s TYR 594 Ca 0.04 -0.74 -0.16 0.00 -1.01 0.00 0.00 57.07 55.20 4tf4 s TYR 594 Cb -0.13 -1.71 0.12 0.00 -0.11 0.00 0.00 41.96 40.13 4tf4 s TYR 594 CO 0.02 -0.23 0.49 0.34 -1.11 0.00 0.00 175.55 175.05 4tf4 s ASP 595 N 0.08 6.18 -1.21 2.29 2.15 0.20 -2.08 116.67 124.28 4tf4 s ASP 595 Ca -0.09 -1.73 -0.07 0.00 0.43 0.00 0.00 52.55 51.09 4tf4 s ASP 595 Cb -0.15 -2.21 0.01 0.00 -0.30 0.00 0.00 42.92 40.27 4tf4 s ASP 595 CO 0.06 -0.83 1.06 -0.67 -0.17 0.00 0.00 175.17 174.61 4tf4 n ASP 596 N 5.25 -5.53 0.00 -0.34 2.03 0.42 -1.80 116.55 116.58 4tf4 n ASP 596 Ca -0.14 -0.50 0.00 0.00 0.52 0.00 0.00 54.79 54.68 4tf4 n ASP 596 Cb 0.40 -4.62 0.00 0.00 -0.72 0.00 0.00 41.12 36.19 4tf4 n ASP 596 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 4tf4 n GLY 597 N -1.79 1.82 3.67 0.27 0.00 -1.26 -5.03 105.19 102.87 4tf4 n GLY 597 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 4tf4 n GLY 597 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4tf4 s VAL 598 N -2.44 5.32 0.12 1.61 1.01 -0.74 -4.99 120.40 120.29 4tf4 s VAL 598 Ca 0.00 0.31 -0.31 0.00 0.00 0.00 0.00 61.98 61.98 4tf4 s VAL 598 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.72 4tf4 s VAL 598 CO 0.00 0.33 1.80 -2.84 0.00 0.00 0.00 175.10 174.39 4tf4 s PRO 599 N 1.09 4.14 -0.04 2.72 0.02 -1.26 0.58 135.00 142.26 4tf4 s PRO 599 Ca 0.10 2.56 0.07 0.00 0.02 0.00 0.00 61.00 63.76 4tf4 s PRO 599 Cb -0.14 -3.57 -0.11 0.00 0.02 0.00 0.00 34.50 30.71 4tf4 s PRO 599 CO 0.05 -0.82 0.10 0.28 -0.33 0.00 0.00 177.00 176.28 4tf4 n VAL 600 N 4.69 0.24 -3.71 3.83 0.31 0.10 -4.88 118.33 118.92 4tf4 n VAL 600 Ca 0.17 -0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 64.14 4tf4 n VAL 600 Cb 0.38 -0.21 -0.07 0.00 -0.91 0.00 0.00 33.84 33.03 4tf4 n VAL 600 CO 0.00 0.00 0.00 0.86 -1.32 0.00 0.00 176.83 176.37 4tf4 s TRP 601 N -2.37 -0.19 0.00 3.52 -0.11 -1.15 -4.94 118.94 113.69 4tf4 s TRP 601 Ca -0.03 0.12 0.00 0.00 1.22 0.00 0.00 56.10 57.41 4tf4 s TRP 601 Cb 0.04 0.16 0.00 0.00 -1.50 0.00 0.00 33.47 32.17 4tf4 s TRP 601 CO 0.31 -0.53 0.00 0.41 -4.62 0.00 0.00 176.95 172.52 4tf4 n GLY 602 N 0.57 -1.76 3.18 5.86 0.00 -1.26 -1.59 105.19 110.19 4tf4 n GLY 602 Ca -0.19 -1.53 -0.28 0.00 0.00 0.00 0.00 46.02 44.02 4tf4 n GLY 602 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4tf4 s THR 603 N -2.08 1.65 0.55 2.61 -4.23 -0.47 -4.88 115.64 108.79 4tf4 s THR 603 Ca 0.00 -0.84 -0.06 0.00 -1.18 0.00 0.00 61.69 59.61 4tf4 s THR 603 Cb 0.00 -1.42 -0.01 0.00 1.34 0.00 0.00 72.50 72.41 4tf4 s THR 603 CO 0.00 0.47 0.87 0.00 -0.54 0.00 0.00 174.62 175.41 4tf4 s ALA 604 N 0.02 3.32 -2.00 3.99 0.00 -1.26 -4.64 121.76 121.19 4tf4 s ALA 604 Ca -0.05 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.41 4tf4 s ALA 604 Cb -0.13 -2.63 0.43 0.00 0.00 0.00 0.00 23.12 20.78 4tf4 s ALA 604 CO 0.03 -0.62 0.89 -2.30 0.00 0.00 0.00 175.76 173.76