#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfp n LYS 2 N 0.00 2.24 -2.51 3.17 4.76 -1.26 -4.17 118.16 120.38 3cfp n LYS 2 Ca 0.00 0.79 -0.36 0.00 -2.87 0.00 0.00 58.31 55.87 3cfp n LYS 2 Cb 0.00 -2.44 -0.04 0.00 -1.84 0.00 0.00 35.03 30.72 3cfp n LYS 2 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3cfp s GLU 3 N -1.26 4.07 -0.05 1.97 2.02 -1.26 -4.79 118.70 119.40 3cfp s GLU 3 Ca 0.60 1.52 -0.09 0.00 0.02 0.00 0.00 54.97 57.02 3cfp s GLU 3 Cb -0.57 -2.47 0.02 0.00 0.10 0.00 0.00 34.13 31.21 3cfp s GLU 3 CO 0.57 -0.22 0.22 -0.59 0.02 0.00 0.00 175.26 175.25 3cfp s PHE 4 N -1.69 -0.16 0.57 1.61 -0.71 -0.94 -4.88 117.98 111.79 3cfp s PHE 4 Ca 0.60 0.35 -0.16 0.00 -1.04 0.00 0.00 56.93 56.67 3cfp s PHE 4 Cb -0.22 0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.60 3cfp s PHE 4 CO 0.27 -0.22 1.05 1.52 -1.34 0.00 0.00 175.22 176.50 3cfp s TYR 5 N -0.57 3.05 -0.07 3.49 1.13 -1.26 -0.25 117.35 122.87 3cfp s TYR 5 Ca -0.07 1.51 -0.07 0.00 -1.41 0.00 0.00 57.07 57.04 3cfp s TYR 5 Cb -0.04 -2.99 -0.02 0.00 -1.10 0.00 0.00 41.96 37.81 3cfp s TYR 5 CO 0.01 -1.00 -0.13 1.28 -2.51 0.00 0.00 175.55 173.20 3cfp n LEU 6 N -1.88 0.76 -4.01 -3.49 4.32 0.19 -4.78 117.00 108.10 3cfp n LEU 6 Ca 0.09 0.13 -0.11 0.00 -0.02 0.00 0.00 56.01 56.10 3cfp n LEU 6 Cb 0.53 -0.57 -0.11 0.00 -1.62 0.00 0.00 43.42 41.65 3cfp n LEU 6 CO 0.46 -0.42 -0.38 0.42 -1.22 0.00 0.00 177.39 176.26 3cfp s THR 7 N -1.74 0.27 0.02 -5.08 -4.23 -0.87 -4.80 115.64 99.22 3cfp s THR 7 Ca -0.11 -0.97 0.05 0.00 -1.18 0.00 0.00 61.69 59.48 3cfp s THR 7 Cb 0.02 -0.39 -0.02 0.00 1.34 0.00 0.00 72.50 73.45 3cfp s THR 7 CO 0.16 -0.45 -0.14 0.54 -0.54 0.00 0.00 174.62 174.19 3cfp s VAL 8 N -1.42 1.09 0.02 2.29 0.11 -1.26 -1.30 120.40 119.93 3cfp s VAL 8 Ca -0.14 -0.85 -0.04 0.00 -2.93 0.00 0.00 61.98 58.02 3cfp s VAL 8 Cb -0.10 -0.96 -0.01 0.00 -1.53 0.00 0.00 36.38 33.78 3cfp s VAL 8 CO -0.00 0.10 0.07 -1.61 -3.33 0.00 0.00 175.10 170.33 3cfp s GLU 9 N -0.86 0.47 -0.22 1.54 0.41 0.04 -4.81 118.70 115.26 3cfp s GLU 9 Ca 0.03 -0.59 -0.04 0.00 -0.41 0.00 0.00 54.97 53.95 3cfp s GLU 9 Cb -0.07 0.18 -0.01 0.00 -1.78 0.00 0.00 34.13 32.45 3cfp s GLU 9 CO 0.01 -0.10 -0.03 -1.14 -0.49 0.00 0.00 175.26 173.50 3cfp s GLN 10 N -1.85 3.40 -0.19 1.61 0.74 -1.26 -0.34 119.66 121.77 3cfp s GLN 10 Ca -0.12 -0.61 0.01 0.00 0.05 0.00 0.00 55.36 54.69 3cfp s GLN 10 Cb -0.06 -3.05 0.04 0.00 1.10 0.00 0.00 33.01 31.04 3cfp s GLN 10 CO -0.01 -0.20 -0.10 0.42 -0.55 0.00 0.00 175.29 174.85 3cfp s ILE 11 N 1.49 1.52 0.00 -2.34 1.01 0.48 -5.01 121.20 118.36 3cfp s ILE 11 Ca 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.82 3cfp s ILE 11 Cb -0.14 -1.60 0.00 0.00 0.01 0.00 0.00 42.46 40.73 3cfp s ILE 11 CO -0.02 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.72 3cfp n GLY 12 N 4.73 3.32 1.29 6.18 0.00 -1.26 -1.30 105.19 118.15 3cfp n GLY 12 Ca -0.14 -0.06 0.06 0.00 0.00 0.00 0.00 46.02 45.87 3cfp n GLY 12 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cfp n ASP 13 N 3.89 3.75 -4.17 1.61 10.43 -1.26 -4.74 116.55 126.06 3cfp n ASP 13 Ca 0.00 -2.45 -0.23 0.00 2.57 0.00 0.00 54.79 54.68 3cfp n ASP 13 Cb 0.00 -0.54 -0.14 0.00 1.84 0.00 0.00 41.12 42.27 3cfp n ASP 13 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3cfp s SER 14 N -0.66 1.95 -0.25 -2.24 1.04 -0.42 -4.06 113.70 109.06 3cfp s SER 14 Ca 0.36 -0.39 -0.09 0.00 0.48 0.00 0.00 55.95 56.30 3cfp s SER 14 Cb 0.25 -0.18 -0.04 0.00 0.10 0.00 0.00 66.02 66.15 3cfp s SER 14 CO 0.14 0.14 0.13 -0.63 0.98 0.00 0.00 173.24 173.99 3cfp s ILE 15 N -0.62 4.91 -0.25 -1.02 1.01 0.84 -0.39 121.20 125.69 3cfp s ILE 15 Ca 0.05 0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.63 3cfp s ILE 15 Cb -0.07 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 3cfp s ILE 15 CO 0.01 0.33 0.13 -0.36 0.00 0.00 0.00 174.94 175.05 3cfp s PHE 16 N 1.37 3.21 -0.05 3.97 0.08 0.53 0.06 117.98 127.15 3cfp s PHE 16 Ca 0.06 -0.01 0.02 0.00 0.12 0.00 0.00 56.93 57.12 3cfp s PHE 16 Cb -0.15 -2.28 0.02 0.00 -0.57 0.00 0.00 43.02 40.04 3cfp s PHE 16 CO 0.06 -0.13 -0.08 -2.00 -0.10 0.00 0.00 175.22 172.97 3cfp s GLU 17 N 1.39 1.20 -0.10 0.44 2.12 -0.52 -0.78 118.70 122.44 3cfp s GLU 17 Ca 0.06 -0.26 -0.06 0.00 0.36 0.00 0.00 54.97 55.07 3cfp s GLU 17 Cb -0.15 -1.07 -0.04 0.00 0.26 0.00 0.00 34.13 33.13 3cfp s GLU 17 CO 0.06 -0.01 0.14 1.03 -0.54 0.00 0.00 175.26 175.95 3cfp s ARG 18 N 0.70 3.43 0.24 4.30 0.52 -0.42 -1.63 118.95 126.09 3cfp s ARG 18 Ca -0.12 -0.16 -0.17 0.00 -0.52 0.00 0.00 55.73 54.76 3cfp s ARG 18 Cb -0.14 -3.17 0.02 0.00 0.52 0.00 0.00 34.95 32.17 3cfp s ARG 18 CO 0.02 0.76 0.58 1.52 0.02 0.00 0.00 175.30 178.20 3cfp s TYR 19 N -1.07 -0.00 -0.20 -0.53 1.13 -0.22 0.53 117.35 116.99 3cfp s TYR 19 Ca 0.17 -0.39 -0.08 0.00 -1.41 0.00 0.00 57.07 55.36 3cfp s TYR 19 Cb -0.12 0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 41.14 3cfp s TYR 19 CO 0.06 -1.05 0.08 0.42 -2.51 0.00 0.00 175.55 172.55 3cfp s ILE 20 N -3.93 4.79 0.38 -3.49 -1.09 0.65 -0.87 121.20 117.65 3cfp s ILE 20 Ca 0.14 -0.03 -0.03 0.00 -2.23 0.00 0.00 60.65 58.50 3cfp s ILE 20 Cb -0.03 -3.19 0.08 0.00 -1.58 0.00 0.00 42.46 37.75 3cfp s ILE 20 CO 0.04 0.42 0.52 -0.90 -1.23 0.00 0.00 174.94 173.79 3cfp n ASP 21 N 3.91 0.36 0.00 3.58 5.68 -0.61 -2.22 116.55 127.25 3cfp n ASP 21 Ca -0.16 -1.38 0.04 0.00 -0.50 0.00 0.00 54.79 52.79 3cfp n ASP 21 Cb 0.52 -0.37 0.25 0.00 -1.14 0.00 0.00 41.12 40.38 3cfp n ASP 21 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3cfp n SER 22 N -3.15 0.00 -0.01 -1.12 3.41 -1.26 -1.76 113.62 109.72 3cfp n SER 22 Ca 0.08 -0.59 0.01 0.00 -0.26 0.00 0.00 58.87 58.10 3cfp n SER 22 Cb 0.27 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.23 3cfp n SER 22 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3cfp n ASN 23 N -0.81 1.72 -0.53 4.04 3.02 -1.26 -2.39 115.26 119.04 3cfp n ASN 23 Ca 0.06 -1.93 -0.06 0.00 -0.03 0.00 0.00 54.58 52.62 3cfp n ASN 23 Cb 0.03 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 3cfp n ASN 23 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3cfp n GLY 24 N -0.49 0.58 3.72 7.41 0.00 -0.72 -5.04 105.19 110.66 3cfp n GLY 24 Ca 0.01 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 3cfp n GLY 24 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cfp s ARG 25 N -3.14 3.39 -0.00 1.61 6.06 -1.26 -4.84 118.95 120.76 3cfp s ARG 25 Ca 0.00 -0.32 -0.30 0.00 -2.50 0.00 0.00 55.73 52.61 3cfp s ARG 25 Cb 0.00 -3.01 -0.03 0.00 0.06 0.00 0.00 34.95 31.96 3cfp s ARG 25 CO 0.00 0.60 1.04 -2.00 -2.50 0.00 0.00 175.30 172.44 3cfp s GLU 26 N -0.56 4.50 0.05 5.12 2.12 -1.26 -1.57 118.70 127.10 3cfp s GLU 26 Ca 0.10 1.50 0.03 0.00 0.36 0.00 0.00 54.97 56.96 3cfp s GLU 26 Cb -0.12 -3.45 -0.03 0.00 0.26 0.00 0.00 34.13 30.79 3cfp s GLU 26 CO 0.02 -0.15 -0.09 1.03 -0.54 0.00 0.00 175.26 175.53 3cfp s ARG 27 N 1.23 0.61 0.12 4.30 1.81 -0.04 -5.00 118.95 121.97 3cfp s ARG 27 Ca 0.53 -0.85 0.11 0.00 -1.72 0.00 0.00 55.73 53.80 3cfp s ARG 27 Cb -0.23 -0.38 -0.04 0.00 -0.45 0.00 0.00 34.95 33.86 3cfp s ARG 27 CO 0.27 0.07 -0.26 0.99 -0.68 0.00 0.00 175.30 175.68 3cfp s THR 28 N -1.57 2.30 -0.06 0.02 2.01 -1.26 -1.05 115.64 116.03 3cfp s THR 28 Ca -0.07 -1.69 -0.12 0.00 0.31 0.00 0.00 61.69 60.13 3cfp s THR 28 Cb -0.09 -2.00 0.02 0.00 0.01 0.00 0.00 72.50 70.44 3cfp s THR 28 CO 0.00 0.13 0.29 0.00 -0.69 0.00 0.00 174.62 174.35 3cfp s ARG 29 N -1.96 0.51 -0.20 4.92 1.70 -0.65 -5.01 118.95 118.26 3cfp s ARG 29 Ca 0.14 0.06 -0.07 0.00 -0.47 0.00 0.00 55.73 55.38 3cfp s ARG 29 Cb -0.10 0.23 -0.04 0.00 -0.57 0.00 0.00 34.95 34.47 3cfp s ARG 29 CO 0.06 -0.11 0.07 -2.00 -1.08 0.00 0.00 175.30 172.23 3cfp s GLU 30 N -0.67 3.88 -0.10 3.89 2.12 -1.26 -1.44 118.70 125.12 3cfp s GLU 30 Ca -0.08 -0.38 0.03 0.00 0.36 0.00 0.00 54.97 54.90 3cfp s GLU 30 Cb -0.04 -3.25 0.00 0.00 0.26 0.00 0.00 34.13 31.10 3cfp s GLU 30 CO 0.02 0.13 -0.22 0.08 -0.54 0.00 0.00 175.26 174.74 3cfp s VAL 31 N 0.75 1.89 -1.30 3.70 1.01 0.11 -4.93 120.40 121.63 3cfp s VAL 31 Ca 0.03 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 60.93 3cfp s VAL 31 Cb -0.13 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.61 3cfp s VAL 31 CO 0.02 0.52 2.02 -0.62 0.00 0.00 0.00 175.10 177.05 3cfp n GLU 32 N 3.65 2.69 -1.93 2.72 1.02 -1.26 -0.11 120.64 127.42 3cfp n GLU 32 Ca -0.20 -2.70 -0.41 0.00 -0.02 0.00 0.00 57.16 53.83 3cfp n GLU 32 Cb 0.53 -3.34 -0.02 0.00 -0.02 0.00 0.00 31.44 28.59 3cfp n GLU 32 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3cfp s TYR 33 N 4.29 2.89 -0.59 -0.32 5.04 -1.26 -4.95 117.35 122.46 3cfp s TYR 33 Ca 0.52 1.01 -0.08 0.00 -2.44 0.00 0.00 57.07 56.08 3cfp s TYR 33 Cb 0.10 -3.90 0.15 0.00 0.35 0.00 0.00 41.96 38.66 3cfp s TYR 33 CO 0.00 -2.90 0.46 0.15 -1.34 0.00 0.00 175.55 171.92 3cfp s LYS 34 N -0.76 2.72 0.71 4.97 1.02 -1.26 -4.01 119.74 123.13 3cfp s LYS 34 Ca 0.59 -2.13 -0.11 0.00 0.02 0.00 0.00 55.97 54.33 3cfp s LYS 34 Cb -0.44 -3.96 0.02 0.00 -0.52 0.00 0.00 37.83 32.92 3cfp s LYS 34 CO 0.48 -1.21 1.09 -1.25 -0.92 0.00 0.00 175.35 173.55 3cfp s PRO 35 N 0.70 2.81 -0.04 -1.68 0.04 -1.25 -4.76 135.00 130.82 3cfp s PRO 35 Ca 0.11 0.42 -0.02 0.00 0.04 0.00 0.00 61.00 61.56 3cfp s PRO 35 Cb -0.21 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 32.33 3cfp s PRO 35 CO -0.03 -1.05 0.05 0.45 0.04 0.00 0.00 177.00 176.45 3cfp s SER 36 N -4.37 1.13 0.27 6.66 0.15 -1.26 -1.50 113.70 114.78 3cfp s SER 36 Ca 0.58 0.05 0.00 0.00 0.70 0.00 0.00 55.95 57.28 3cfp s SER 36 Cb -0.11 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 3cfp s SER 36 CO 0.51 -0.23 0.02 0.18 1.20 0.00 0.00 173.24 174.92 3cfp n LEU 37 N 5.18 0.00 -3.85 3.45 4.77 -0.74 -4.74 117.00 121.07 3cfp n LEU 37 Ca -0.06 -1.67 -0.12 0.00 -0.03 0.00 0.00 56.01 54.13 3cfp n LEU 37 Cb 0.50 0.17 -0.12 0.00 -2.33 0.00 0.00 43.42 41.64 3cfp n LEU 37 CO 0.08 -0.26 -0.21 -0.36 -1.33 0.00 0.00 177.39 175.32 3cfp s PHE 38 N -1.92 -0.07 0.03 -1.77 0.40 0.11 -0.07 117.98 114.70 3cfp s PHE 38 Ca 0.02 0.16 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 3cfp s PHE 38 Cb -0.00 0.01 -0.02 0.00 0.51 0.00 0.00 43.02 43.52 3cfp s PHE 38 CO 0.01 -0.15 -0.10 0.00 0.70 0.00 0.00 175.22 175.68 3cfp s ALA 39 N -0.48 0.84 0.50 5.36 0.00 -0.78 -0.79 121.76 126.41 3cfp s ALA 39 Ca -0.06 -0.71 -0.23 0.00 0.00 0.00 0.00 51.96 50.96 3cfp s ALA 39 Cb -0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 23.12 22.93 3cfp s ALA 39 CO 0.01 0.12 1.38 -1.01 0.00 0.00 0.00 175.76 176.25 3cfp s HIS 40 N -0.92 2.40 0.17 0.00 3.76 -1.26 0.32 115.29 119.76 3cfp s HIS 40 Ca -0.02 1.33 -0.03 0.00 -0.15 0.00 0.00 55.06 56.19 3cfp s HIS 40 Cb -0.08 -3.83 -0.03 0.00 1.11 0.00 0.00 32.58 29.75 3cfp s HIS 40 CO 0.01 -2.84 0.15 0.00 -0.85 0.00 0.00 174.74 171.20 3cfp n PRO 42 N -0.21 1.37 -0.31 0.00 -0.04 -1.26 -4.59 135.00 129.96 3cfp n PRO 42 Ca -0.02 0.52 0.08 0.00 -0.04 0.00 0.00 63.50 64.04 3cfp n PRO 42 Cb 0.64 -2.50 0.25 0.00 -0.04 0.00 0.00 33.50 31.85 3cfp n PRO 42 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3cfp h GLU 43 N 0.98 0.63 -0.46 0.54 4.39 -2.01 -1.00 114.58 117.66 3cfp h GLU 43 Ca -0.50 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.21 3cfp h GLU 43 Cb 1.33 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 29.78 3cfp h GLU 43 CO 0.55 0.42 0.17 0.77 -1.16 0.00 0.00 179.01 179.76 3cfp h SER 44 N 0.65 0.20 -1.53 1.42 0.02 -2.03 -3.41 113.55 108.87 3cfp h SER 44 Ca 0.49 0.05 -0.63 0.00 -0.84 0.00 0.00 61.79 60.86 3cfp h SER 44 Cb 0.71 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 3cfp h SER 44 CO -0.37 0.15 1.46 1.67 -1.14 0.00 0.00 176.83 178.59 3cfp n GLN 45 N -4.99 1.52 -3.34 3.45 0.00 -0.38 -4.91 117.38 108.74 3cfp n GLN 45 Ca 0.04 0.41 -0.42 0.00 -0.00 0.00 0.00 57.00 57.03 3cfp n GLN 45 Cb 0.16 -2.85 -0.09 0.00 0.00 0.00 0.00 30.24 27.47 3cfp n GLN 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3cfp s ALA 46 N 7.83 3.47 0.00 1.69 0.00 -1.26 -4.87 121.76 128.62 3cfp s ALA 46 Ca 1.05 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.77 3cfp s ALA 46 Cb -0.60 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 19.58 3cfp s ALA 46 CO 0.42 -1.26 0.00 0.25 0.00 0.00 0.00 175.76 175.17 3cfp n THR 47 N 5.35 0.00 -0.05 0.00 -2.24 -1.26 -5.07 114.28 111.00 3cfp n THR 47 Ca -0.07 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.74 3cfp n THR 47 Cb 0.49 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.80 3cfp n THR 47 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3cfp n LYS 48 N 0.00 2.54 -3.83 -0.78 2.85 -1.26 -4.97 118.16 112.71 3cfp n LYS 48 Ca 0.00 -1.70 -0.36 0.00 -1.05 0.00 0.00 58.31 55.20 3cfp n LYS 48 Cb 0.00 -1.15 -0.13 0.00 -0.65 0.00 0.00 35.03 33.10 3cfp n LYS 48 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3cfp s TYR 49 N -0.94 3.03 0.03 5.58 1.51 -1.26 -4.82 117.35 120.48 3cfp s TYR 49 Ca 0.13 -0.76 0.07 0.00 -1.01 0.00 0.00 57.07 55.49 3cfp s TYR 49 Cb 0.07 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 3cfp s TYR 49 CO 0.09 -0.48 -0.20 -0.06 -1.11 0.00 0.00 175.55 173.79 3cfp s PHE 50 N 1.53 1.75 1.20 2.71 0.40 -1.21 -1.23 117.98 123.13 3cfp s PHE 50 Ca 0.06 -0.36 -0.20 0.00 -0.60 0.00 0.00 56.93 55.82 3cfp s PHE 50 Cb -0.15 -1.06 0.29 0.00 0.51 0.00 0.00 43.02 42.61 3cfp s PHE 50 CO -0.00 0.06 1.16 0.16 0.70 0.00 0.00 175.22 177.31 3cfp s ASP 51 N -1.04 1.01 0.51 1.36 1.47 -0.44 -0.17 116.67 119.36 3cfp s ASP 51 Ca 0.07 0.44 0.28 0.00 1.18 0.00 0.00 52.55 54.52 3cfp s ASP 51 Cb -0.08 -0.54 1.29 0.00 -0.34 0.00 0.00 42.92 43.24 3cfp s ASP 51 CO 0.01 -4.05 1.98 0.16 0.68 0.00 0.00 175.17 173.95 3cfp h ILE 52 N -2.53 0.41 0.00 2.11 3.07 -1.87 -2.38 117.51 116.32 3cfp h ILE 52 Ca -0.43 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.25 3cfp h ILE 52 Cb 1.27 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 39.34 3cfp h ILE 52 CO 0.29 0.13 -0.46 1.88 -1.05 0.00 0.00 178.15 178.94 3cfp h TYR 53 N 0.00 0.00 0.00 0.16 -1.99 -1.91 -3.46 116.97 109.76 3cfp h TYR 53 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3cfp h TYR 53 Cb 0.51 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.24 3cfp h TYR 53 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 3cfp n GLY 54 N 1.31 1.02 3.75 3.88 0.00 -0.89 -5.10 105.19 109.16 3cfp n GLY 54 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3cfp n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfp s LYS 55 N -0.64 4.78 0.31 1.61 -0.14 -1.26 -4.82 119.74 119.58 3cfp s LYS 55 Ca 0.00 1.42 -0.28 0.00 -1.36 0.00 0.00 55.97 55.75 3cfp s LYS 55 Cb 0.00 -3.29 -0.09 0.00 -1.68 0.00 0.00 37.83 32.76 3cfp s LYS 55 CO 0.00 0.48 1.07 -2.14 -0.76 0.00 0.00 175.35 173.99 3cfp s PRO 56 N -0.97 4.51 0.16 -1.68 0.02 -1.26 -1.33 135.00 134.44 3cfp s PRO 56 Ca 0.41 1.68 0.09 0.00 0.02 0.00 0.00 61.00 63.20 3cfp s PRO 56 Cb -0.25 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 3cfp s PRO 56 CO 0.31 0.13 -0.19 0.00 -0.33 0.00 0.00 177.00 176.91 3cfp s THR 58 N -1.88 3.85 0.19 0.00 -1.32 0.15 -4.53 115.64 112.10 3cfp s THR 58 Ca 0.15 -0.41 -0.28 0.00 -1.21 0.00 0.00 61.69 59.94 3cfp s THR 58 Cb -0.07 -2.62 -0.08 0.00 -1.51 0.00 0.00 72.50 68.22 3cfp s THR 58 CO 0.06 0.56 0.88 -0.60 -2.21 0.00 0.00 174.62 173.31 3cfp s ARG 59 N -0.40 4.73 -0.18 7.08 3.52 -1.26 -1.86 118.95 130.58 3cfp s ARG 59 Ca 0.06 1.35 -0.00 0.00 -0.13 0.00 0.00 55.73 57.01 3cfp s ARG 59 Cb -0.12 -3.29 0.04 0.00 -1.56 0.00 0.00 34.95 30.02 3cfp s ARG 59 CO 0.02 0.50 -0.07 0.15 -0.81 0.00 0.00 175.30 175.10 3cfp s LYS 60 N -1.01 1.62 0.07 5.12 1.02 0.91 -4.98 119.74 122.49 3cfp s LYS 60 Ca 0.40 -0.65 -0.23 0.00 0.02 0.00 0.00 55.97 55.50 3cfp s LYS 60 Cb -0.25 -2.18 -0.06 0.00 -0.52 0.00 0.00 37.83 34.82 3cfp s LYS 60 CO 0.29 -0.45 0.69 -1.17 -0.92 0.00 0.00 175.35 173.80 3cfp s LEU 61 N 1.55 4.50 -0.04 3.17 1.98 -1.26 -1.80 118.68 126.77 3cfp s LEU 61 Ca -0.00 1.41 0.04 0.00 -2.89 0.00 0.00 54.13 52.68 3cfp s LEU 61 Cb -0.16 -3.12 -0.03 0.00 0.66 0.00 0.00 46.19 43.55 3cfp s LEU 61 CO -0.08 0.14 -0.16 -0.36 -1.89 0.00 0.00 176.35 174.00 3cfp s PHE 62 N -0.59 2.65 0.38 5.38 0.40 -0.56 -5.02 117.98 120.61 3cfp s PHE 62 Ca 0.34 -0.20 0.17 0.00 -0.60 0.00 0.00 56.93 56.64 3cfp s PHE 62 Cb -0.21 -1.61 0.95 0.00 0.51 0.00 0.00 43.02 42.67 3cfp s PHE 62 CO 0.22 0.16 1.92 0.00 0.70 0.00 0.00 175.22 178.21 3cfp h ALA 63 N 5.34 1.41 -2.83 5.36 0.00 -1.93 -3.34 119.26 123.28 3cfp h ALA 63 Ca -0.46 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.12 3cfp h ALA 63 Cb 1.15 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.80 3cfp h ALA 63 CO 0.50 0.33 -0.14 0.54 0.00 0.00 0.00 179.25 180.48 3cfp s ASN 64 N -6.74 0.01 0.27 0.00 2.20 -1.26 -4.79 114.94 104.63 3cfp s ASN 64 Ca -0.03 -1.01 0.10 0.00 -0.94 0.00 0.00 52.86 50.98 3cfp s ASN 64 Cb 0.14 0.59 0.36 0.00 -2.00 0.00 0.00 41.25 40.34 3cfp s ASN 64 CO 0.68 -1.15 1.61 0.24 -2.94 0.00 0.00 177.10 175.54 3cfp h MET 65 N 2.25 0.04 -0.23 3.55 2.86 -1.79 -3.04 114.93 118.57 3cfp h MET 65 Ca -0.27 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3cfp h MET 65 Cb 1.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.90 3cfp h MET 65 CO 0.37 0.63 0.15 -0.09 1.06 0.00 0.00 176.91 179.03 3cfp h ARG 66 N 0.03 0.30 -0.83 1.72 9.65 -1.93 -2.74 114.38 120.58 3cfp h ARG 66 Ca -0.01 -0.02 0.17 0.00 -1.10 0.00 0.00 59.98 59.03 3cfp h ARG 66 Cb 1.07 -0.07 -0.11 0.00 -1.39 0.00 0.00 29.97 29.48 3cfp h ARG 66 CO 0.08 0.20 0.36 -0.44 2.80 0.00 0.00 179.97 182.97 3cfp h ASP 67 N 0.31 0.35 -0.63 -3.80 5.19 -1.95 -0.89 116.42 115.00 3cfp h ASP 67 Ca 0.08 0.12 -0.05 0.00 -0.62 0.00 0.00 57.03 56.57 3cfp h ASP 67 Cb -0.03 0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.54 3cfp h ASP 67 CO -0.02 0.09 0.21 0.00 -3.12 0.00 0.00 179.24 176.41 3cfp h ALA 68 N 1.61 0.82 -0.27 3.45 0.00 -1.46 -2.18 119.26 121.22 3cfp h ALA 68 Ca 0.48 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 3cfp h ALA 68 Cb 0.79 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3cfp h ALA 68 CO -0.44 0.48 -0.04 0.77 0.00 0.00 0.00 179.25 180.02 3cfp h SER 69 N 0.90 0.51 -0.97 0.00 0.02 -1.05 -2.41 113.55 110.55 3cfp h SER 69 Ca 0.21 -0.35 0.09 0.00 -0.84 0.00 0.00 61.79 60.90 3cfp h SER 69 Cb 0.27 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.59 3cfp h SER 69 CO -0.01 0.74 0.61 1.56 -1.14 0.00 0.00 176.83 178.58 3cfp h GLN 70 N 0.28 1.02 -0.06 3.45 4.20 -1.13 -1.36 115.11 121.50 3cfp h GLN 70 Ca 0.07 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 3cfp h GLN 70 Cb 0.50 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 3cfp h GLN 70 CO 0.02 0.67 0.03 2.35 -0.67 0.00 0.00 178.83 181.23 3cfp h TRP 71 N 1.05 0.09 -0.61 2.96 7.01 -1.28 0.12 115.95 125.29 3cfp h TRP 71 Ca 0.44 -0.01 0.13 0.00 2.11 0.00 0.00 58.89 61.56 3cfp h TRP 71 Cb 0.30 -0.03 -0.10 0.00 -2.10 0.00 0.00 29.16 27.22 3cfp h TRP 71 CO -0.01 0.20 -0.02 0.82 -2.79 0.00 0.00 178.44 176.64 3cfp h ILE 72 N -0.04 0.48 0.25 2.65 2.04 -0.89 0.16 117.51 122.16 3cfp h ILE 72 Ca 0.02 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3cfp h ILE 72 Cb 0.14 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 3cfp h ILE 72 CO -0.00 0.02 -0.12 0.50 0.00 0.00 0.00 178.15 178.55 3cfp h LYS 73 N 0.10 -0.32 -0.64 2.37 3.11 -1.02 -1.86 116.57 118.31 3cfp h LYS 73 Ca 0.31 0.02 0.13 0.00 -2.81 0.00 0.00 60.65 58.31 3cfp h LYS 73 Cb 0.51 0.07 -0.04 0.00 -1.00 0.00 0.00 32.23 31.77 3cfp h LYS 73 CO -0.54 -0.18 0.44 0.00 -2.81 0.00 0.00 179.45 176.36 3cfp h ARG 74 N -0.37 0.31 -0.02 1.90 3.08 -0.08 0.20 114.38 119.39 3cfp h ARG 74 Ca -0.03 -0.02 -0.19 0.00 0.07 0.00 0.00 59.98 59.81 3cfp h ARG 74 Cb 0.28 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3cfp h ARG 74 CO 0.06 0.20 -0.80 0.52 -1.07 0.00 0.00 179.97 178.88 3cfp h MET 75 N 0.32 0.25 -0.23 0.04 2.86 -0.29 -2.39 114.93 115.48 3cfp h MET 75 Ca 0.31 -0.23 -0.19 0.00 -2.06 0.00 0.00 59.70 57.53 3cfp h MET 75 Cb 0.77 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.49 3cfp h MET 75 CO -0.08 0.92 -0.58 0.93 1.06 0.00 0.00 176.91 179.16 3cfp h GLU 76 N 0.15 0.80 0.00 1.72 5.08 -0.53 0.32 114.58 122.13 3cfp h GLU 76 Ca -0.04 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.77 3cfp h GLU 76 Cb 1.39 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.72 3cfp h GLU 76 CO 0.12 1.18 0.02 -0.25 -1.00 0.00 0.00 179.01 179.08 3cfp n ASP 77 N -4.04 0.00 -0.03 1.42 8.00 0.62 -2.67 116.55 119.85 3cfp n ASP 77 Ca -0.06 0.30 -0.04 0.00 0.71 0.00 0.00 54.79 55.70 3cfp n ASP 77 Cb 0.64 -0.30 -0.02 0.00 -0.02 0.00 0.00 41.12 41.42 3cfp n ASP 77 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3cfp n ILE 78 N -1.29 0.30 0.00 0.53 5.41 -0.91 -5.03 119.36 118.37 3cfp n ILE 78 Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.64 3cfp n ILE 78 Cb 0.02 -0.87 0.00 0.00 -0.71 0.00 0.00 39.64 38.08 3cfp n ILE 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3cfp n GLY 79 N 3.12 1.38 3.53 7.39 0.00 0.11 -5.09 105.19 115.64 3cfp n GLY 79 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 3cfp n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfp s LEU 80 N 0.00 2.93 0.11 0.99 1.43 -0.97 -5.03 118.68 118.14 3cfp s LEU 80 Ca 0.00 -0.24 -0.34 0.00 -1.03 0.00 0.00 54.13 52.52 3cfp s LEU 80 Cb 0.00 -1.68 -0.13 0.00 0.03 0.00 0.00 46.19 44.40 3cfp s LEU 80 CO 0.00 0.28 1.66 1.21 0.23 0.00 0.00 176.35 179.73 3cfp n GLU 81 N 1.66 2.21 -3.55 1.70 2.13 -1.26 -4.46 120.64 119.07 3cfp n GLU 81 Ca -0.16 0.80 -0.41 0.00 0.66 0.00 0.00 57.16 58.05 3cfp n GLU 81 Cb 0.52 -2.60 -0.09 0.00 0.27 0.00 0.00 31.44 29.55 3cfp n GLU 81 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3cfp s ALA 82 N 1.68 3.36 0.14 4.31 0.00 -1.26 -4.61 121.76 125.38 3cfp s ALA 82 Ca 0.82 -2.22 -0.02 0.00 0.00 0.00 0.00 51.96 50.54 3cfp s ALA 82 Cb -0.66 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 3cfp s ALA 82 CO 0.40 -1.71 0.33 -0.51 0.00 0.00 0.00 175.76 174.27 3cfp s LEU 83 N 1.46 4.28 0.00 0.00 1.02 0.03 -4.29 118.68 121.18 3cfp s LEU 83 Ca 0.04 0.44 0.00 0.00 0.02 0.00 0.00 54.13 54.63 3cfp s LEU 83 Cb -0.24 -3.17 0.00 0.00 0.02 0.00 0.00 46.19 42.80 3cfp s LEU 83 CO 0.02 0.06 0.00 0.61 0.02 0.00 0.00 176.35 177.06 3cfp n GLY 84 N -0.07 2.48 3.59 -3.19 0.00 -1.07 -0.71 105.19 106.22 3cfp n GLY 84 Ca -0.04 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 3cfp n GLY 84 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3cfp s MET 85 N -1.93 3.34 0.25 1.61 1.75 -1.26 -4.84 119.30 118.22 3cfp s MET 85 Ca 0.00 0.94 0.15 0.00 -1.25 0.00 0.00 55.69 55.53 3cfp s MET 85 Cb 0.00 -4.14 0.03 0.00 2.84 0.00 0.00 34.83 33.56 3cfp s MET 85 CO 0.00 -1.86 1.37 0.38 -0.65 0.00 0.00 175.02 174.25 3cfp h ASP 86 N 11.89 0.00 -2.99 1.11 -0.00 -1.96 -3.41 116.42 121.06 3cfp h ASP 86 Ca -0.29 0.00 -0.55 0.00 -0.00 0.00 0.00 57.03 56.19 3cfp h ASP 86 Cb 1.13 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 40.38 3cfp h ASP 86 CO 1.11 0.52 1.01 -0.62 -0.00 0.00 0.00 179.24 181.26 3cfp s ASP 87 N -6.38 6.36 0.47 4.15 -1.08 -1.26 -4.89 116.67 114.04 3cfp s ASP 87 Ca 0.03 0.01 0.27 0.00 -0.52 0.00 0.00 52.55 52.34 3cfp s ASP 87 Cb 0.08 -2.55 0.98 0.00 -1.46 0.00 0.00 42.92 39.96 3cfp s ASP 87 CO 0.76 -1.58 1.84 -0.26 0.52 0.00 0.00 175.17 176.45 3cfp h PHE 88 N 9.77 0.00 -0.46 -5.34 0.04 -2.01 -2.95 116.94 115.99 3cfp h PHE 88 Ca -0.26 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.51 3cfp h PHE 88 Cb 1.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.19 3cfp h PHE 88 CO 1.06 0.13 0.29 0.87 -0.60 0.00 0.00 178.31 180.05 3cfp h LYS 89 N 0.00 0.62 -0.69 1.51 1.57 -1.95 0.03 116.57 117.65 3cfp h LYS 89 Ca -0.00 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 3cfp h LYS 89 Cb 0.72 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 3cfp h LYS 89 CO 0.02 0.44 0.14 -0.07 -0.57 0.00 0.00 179.45 179.41 3cfp h LEU 90 N 0.61 1.07 -0.36 2.94 3.38 -1.84 0.54 115.31 121.65 3cfp h LEU 90 Ca 0.17 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 3cfp h LEU 90 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 3cfp h LEU 90 CO -0.03 1.04 -0.11 0.00 0.09 0.00 0.00 178.44 179.43 3cfp h ALA 91 N 1.09 0.50 -0.10 1.53 0.00 -1.48 0.29 119.26 121.08 3cfp h ALA 91 Ca 0.21 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.83 3cfp h ALA 91 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3cfp h ALA 91 CO 0.01 0.38 -0.02 -0.92 0.00 0.00 0.00 179.25 178.70 3cfp h TYR 92 N 0.51 -0.04 -0.40 0.00 5.03 -0.73 0.25 116.97 121.59 3cfp h TYR 92 Ca 0.09 0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.45 3cfp h TYR 92 Cb 0.63 0.03 -0.04 0.00 1.55 0.00 0.00 36.73 38.90 3cfp h TYR 92 CO 0.05 -0.03 0.16 -0.07 -1.32 0.00 0.00 178.16 176.94 3cfp h LEU 93 N 0.01 0.18 -0.79 2.82 3.38 -0.76 0.30 115.31 120.46 3cfp h LEU 93 Ca 0.05 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.12 3cfp h LEU 93 Cb 0.07 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 3cfp h LEU 93 CO -0.10 0.14 0.47 -1.28 0.09 0.00 0.00 178.44 177.77 3cfp h SER 94 N 0.33 0.73 0.17 -0.43 0.87 -0.61 -0.29 113.55 114.32 3cfp h SER 94 Ca 0.18 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.76 3cfp h SER 94 Cb 0.15 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 3cfp h SER 94 CO -0.17 0.47 -0.08 0.44 -0.53 0.00 0.00 176.83 176.95 3cfp h ASP 95 N 0.86 -0.20 0.78 6.23 3.45 0.07 -3.29 116.42 124.32 3cfp h ASP 95 Ca 0.35 -0.30 0.00 0.00 0.43 0.00 0.00 57.03 57.50 3cfp h ASP 95 Cb 0.18 0.05 0.00 0.00 -0.56 0.00 0.00 39.33 39.00 3cfp h ASP 95 CO -0.18 0.24 0.00 0.74 -1.57 0.00 0.00 179.24 178.47 3cfp h THR 96 N -0.68 0.00 -2.09 0.35 2.02 -0.23 -3.32 112.91 108.96 3cfp h THR 96 Ca -0.02 -0.39 -0.55 0.00 0.77 0.00 0.00 66.41 66.22 3cfp h THR 96 Cb 0.49 1.37 -0.40 0.00 -1.74 0.00 0.00 68.15 67.87 3cfp h THR 96 CO 0.04 0.00 -0.95 -1.22 0.37 0.00 0.00 175.52 173.75 3cfp n TYR 97 N -3.05 1.33 0.36 3.16 4.02 -0.14 -4.97 117.16 117.87 3cfp n TYR 97 Ca -0.00 -3.83 0.00 0.00 -0.01 0.00 0.00 57.90 54.06 3cfp n TYR 97 Cb 0.25 -0.44 0.00 0.00 -0.02 0.00 0.00 39.34 39.13 3cfp n TYR 97 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3cfp n ASN 98 N 0.69 2.09 -3.84 7.72 4.05 -1.24 -4.76 115.26 119.98 3cfp n ASN 98 Ca 0.26 -1.33 -0.11 0.00 0.45 0.00 0.00 54.58 53.85 3cfp n ASN 98 Cb 0.52 -0.38 -0.05 0.00 1.23 0.00 0.00 39.78 41.09 3cfp n ASN 98 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 3cfp s TYR 99 N 0.52 0.62 -0.29 1.20 1.13 -1.26 -5.12 117.35 114.15 3cfp s TYR 99 Ca 0.00 -0.94 -0.29 0.00 -1.41 0.00 0.00 57.07 54.43 3cfp s TYR 99 Cb 0.00 0.05 0.01 0.00 -1.10 0.00 0.00 41.96 40.91 3cfp s TYR 99 CO 0.00 -0.99 1.16 -2.00 -2.51 0.00 0.00 175.55 171.21 3cfp s GLU 100 N -3.79 4.06 -0.06 -3.49 2.12 -1.26 -4.97 118.70 111.31 3cfp s GLU 100 Ca 0.26 1.22 -0.30 0.00 0.36 0.00 0.00 54.97 56.51 3cfp s GLU 100 Cb 0.00 -3.77 -0.04 0.00 0.26 0.00 0.00 34.13 30.58 3cfp s GLU 100 CO 0.12 -0.91 1.37 0.42 -0.54 0.00 0.00 175.26 175.72 3cfp s ILE 101 N 3.79 3.93 -0.32 -3.70 1.01 -1.26 -4.99 121.20 119.66 3cfp s ILE 101 Ca 0.49 1.23 -0.01 0.00 0.00 0.00 0.00 60.65 62.37 3cfp s ILE 101 Cb -0.15 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.60 3cfp s ILE 101 CO 0.17 -0.05 0.04 -0.54 0.00 0.00 0.00 174.94 174.56 3cfp s LYS 102 N 2.94 2.24 0.33 2.79 1.02 -1.26 -4.89 119.74 122.91 3cfp s LYS 102 Ca 0.62 -1.44 0.04 0.00 0.02 0.00 0.00 55.97 55.20 3cfp s LYS 102 Cb -0.28 -3.25 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 3cfp s LYS 102 CO 0.23 -0.74 0.50 1.52 -0.92 0.00 0.00 175.35 175.94 3cfp s TYR 103 N 1.19 3.30 -0.26 3.18 1.13 -1.26 -4.85 117.35 119.78 3cfp s TYR 103 Ca -0.01 0.03 0.00 0.00 -1.41 0.00 0.00 57.07 55.69 3cfp s TYR 103 Cb -0.20 -1.93 0.05 0.00 -1.10 0.00 0.00 41.96 38.78 3cfp s TYR 103 CO -0.03 0.06 -0.07 0.34 -2.51 0.00 0.00 175.55 173.35 3cfp s ASP 104 N -4.10 4.46 0.38 -0.18 -1.08 -1.26 -5.00 116.67 109.89 3cfp s ASP 104 Ca 0.42 -1.19 0.13 0.00 -0.52 0.00 0.00 52.55 51.39 3cfp s ASP 104 Cb -0.09 -1.62 0.75 0.00 -1.46 0.00 0.00 42.92 40.49 3cfp s ASP 104 CO 0.33 -0.19 1.84 1.12 0.52 0.00 0.00 175.17 178.79 3cfp h HIS 105 N 7.91 0.00 0.00 -5.34 2.07 -1.98 -1.56 115.15 116.25 3cfp h HIS 105 Ca -0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.27 3cfp h HIS 105 Cb 1.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.05 3cfp h HIS 105 CO 0.61 0.36 0.00 0.25 -3.07 0.00 0.00 177.93 176.07 3cfp n THR 106 N -4.09 1.21 0.89 6.12 -2.24 -1.26 -0.99 114.28 113.92 3cfp n THR 106 Ca -0.02 0.30 0.10 0.00 -2.27 0.00 0.00 64.05 62.16 3cfp n THR 106 Cb 0.39 -1.15 -0.12 0.00 -2.10 0.00 0.00 70.33 67.36 3cfp n THR 106 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3cfp n LYS 107 N -1.44 0.32 -3.37 -0.78 4.76 -0.59 -4.85 118.16 112.20 3cfp n LYS 107 Ca 0.03 -0.01 -0.38 0.00 -2.87 0.00 0.00 58.31 55.08 3cfp n LYS 107 Cb 0.10 -1.46 -0.07 0.00 -1.84 0.00 0.00 35.03 31.76 3cfp n LYS 107 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3cfp s ILE 108 N -2.96 5.21 -0.62 -0.18 1.01 -0.16 -4.98 121.20 118.52 3cfp s ILE 108 Ca 0.07 0.79 -0.21 0.00 0.00 0.00 0.00 60.65 61.30 3cfp s ILE 108 Cb 0.15 -3.75 0.08 0.00 0.01 0.00 0.00 42.46 38.95 3cfp s ILE 108 CO 0.84 0.30 0.85 -0.60 0.00 0.00 0.00 174.94 176.32 3cfp s ARG 109 N 0.93 3.09 -0.25 2.79 3.52 -1.26 -4.66 118.95 123.11 3cfp s ARG 109 Ca 0.22 -1.00 -0.15 0.00 -0.13 0.00 0.00 55.73 54.67 3cfp s ARG 109 Cb -0.15 -4.23 -0.04 0.00 -1.56 0.00 0.00 34.95 28.98 3cfp s ARG 109 CO 0.08 -1.67 0.36 0.08 -0.81 0.00 0.00 175.30 173.35 3cfp s VAL 110 N 3.45 5.20 -0.12 7.11 1.01 -1.26 -0.51 120.40 135.29 3cfp s VAL 110 Ca 0.18 0.57 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 3cfp s VAL 110 Cb -0.20 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 3cfp s VAL 110 CO 0.09 0.20 -0.02 0.00 0.00 0.00 0.00 175.10 175.36 3cfp s ALA 111 N 1.79 3.13 -0.18 5.51 0.00 0.58 -1.61 121.76 130.97 3cfp s ALA 111 Ca 0.15 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.30 3cfp s ALA 111 Cb -0.15 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.50 3cfp s ALA 111 CO 0.09 0.41 -0.18 1.21 0.00 0.00 0.00 175.76 177.30 3cfp s ASN 112 N -0.31 3.17 0.19 0.00 3.84 -0.62 -0.19 114.94 121.02 3cfp s ASN 112 Ca 0.06 -0.70 -0.09 0.00 0.21 0.00 0.00 52.86 52.34 3cfp s ASN 112 Cb -0.12 -1.42 -0.01 0.00 -0.55 0.00 0.00 41.25 39.14 3cfp s ASN 112 CO 0.02 -0.03 0.31 0.72 -2.79 0.00 0.00 177.10 175.33 3cfp s PHE 113 N 1.31 0.47 -0.03 0.43 -0.71 -0.77 0.32 117.98 119.01 3cfp s PHE 113 Ca 0.04 -0.82 -0.25 0.00 -1.04 0.00 0.00 56.93 54.85 3cfp s PHE 113 Cb -0.14 -0.06 0.05 0.00 -1.21 0.00 0.00 43.02 41.67 3cfp s PHE 113 CO -0.12 -0.77 0.55 0.34 -1.34 0.00 0.00 175.22 173.88 3cfp s ASP 114 N -3.00 -0.50 0.12 1.98 2.15 -0.57 -4.39 116.67 112.47 3cfp s ASP 114 Ca 0.21 0.48 0.04 0.00 0.43 0.00 0.00 52.55 53.71 3cfp s ASP 114 Cb 0.03 0.47 -0.04 0.00 -0.30 0.00 0.00 42.92 43.07 3cfp s ASP 114 CO 0.03 -0.57 -0.11 0.27 -0.17 0.00 0.00 175.17 174.62 3cfp s ILE 115 N -1.35 1.12 -0.03 4.11 -4.36 -1.26 -1.90 121.20 117.53 3cfp s ILE 115 Ca -0.11 -1.84 0.07 0.00 -0.26 0.00 0.00 60.65 58.50 3cfp s ILE 115 Cb -0.02 -1.61 -0.02 0.00 1.25 0.00 0.00 42.46 42.06 3cfp s ILE 115 CO 0.07 -0.62 -0.22 -1.61 0.24 0.00 0.00 174.94 172.80 3cfp s GLU 116 N -3.20 2.25 -0.24 0.37 0.41 -0.07 -4.98 118.70 113.23 3cfp s GLU 116 Ca 0.11 -0.86 -0.01 0.00 -0.41 0.00 0.00 54.97 53.80 3cfp s GLU 116 Cb -0.01 -2.15 0.07 0.00 -1.78 0.00 0.00 34.13 30.26 3cfp s GLU 116 CO 0.01 0.57 0.03 0.08 -0.49 0.00 0.00 175.26 175.46 3cfp s VAL 117 N -0.63 0.96 0.22 2.63 1.01 -1.26 -0.92 120.40 122.40 3cfp s VAL 117 Ca 0.10 -1.04 -0.31 0.00 0.00 0.00 0.00 61.98 60.73 3cfp s VAL 117 Cb -0.10 -1.48 -0.11 0.00 0.00 0.00 0.00 36.38 34.69 3cfp s VAL 117 CO -0.00 -0.33 1.59 -0.89 0.00 0.00 0.00 175.10 175.47 3cfp s THR 118 N 1.63 2.36 -0.27 3.92 2.01 -1.26 -4.92 115.64 119.11 3cfp s THR 118 Ca 0.01 0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.27 3cfp s THR 118 Cb -0.18 -3.17 0.15 0.00 0.01 0.00 0.00 72.50 69.31 3cfp s THR 118 CO -0.13 0.03 0.44 -0.55 -0.69 0.00 0.00 174.62 173.73 3cfp s SER 119 N 0.86 -0.19 -0.12 3.53 0.15 -1.26 -4.67 113.70 112.01 3cfp s SER 119 Ca 0.68 0.25 0.06 0.00 0.70 0.00 0.00 55.95 57.64 3cfp s SER 119 Cb -0.46 1.39 0.38 0.00 -1.71 0.00 0.00 66.02 65.63 3cfp s SER 119 CO 0.37 -0.30 1.10 -0.81 1.20 0.00 0.00 173.24 174.80 3cfp n PRO 120 N 5.38 2.76 -0.23 5.44 -0.04 -1.26 -4.10 135.00 142.95 3cfp n PRO 120 Ca -0.02 -1.46 0.07 0.00 -0.04 0.00 0.00 63.50 62.05 3cfp n PRO 120 Cb 0.50 -1.84 0.20 0.00 -0.04 0.00 0.00 33.50 32.32 3cfp n PRO 120 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3cfp n ASP 121 N 0.26 3.19 0.00 3.54 10.43 -1.26 -4.94 116.55 127.77 3cfp n ASP 121 Ca 0.14 -2.00 0.00 0.00 2.57 0.00 0.00 54.79 55.50 3cfp n ASP 121 Cb 0.71 -0.30 0.00 0.00 1.84 0.00 0.00 41.12 43.37 3cfp n ASP 121 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3cfp n GLY 122 N 0.82 -0.88 3.58 0.44 0.00 -1.26 -4.66 105.19 103.23 3cfp n GLY 122 Ca 0.15 -1.67 -0.55 0.00 0.00 0.00 0.00 46.02 43.95 3cfp n GLY 122 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3cfp n PHE 123 N -0.79 1.32 -2.50 1.61 7.35 -1.26 -4.84 117.46 118.35 3cfp n PHE 123 Ca 0.00 0.76 -0.43 0.00 -0.76 0.00 0.00 57.45 57.02 3cfp n PHE 123 Cb 0.00 -2.27 -0.02 0.00 0.35 0.00 0.00 39.48 37.54 3cfp n PHE 123 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3cfp s PRO 124 N 0.65 3.79 -0.12 -7.13 0.04 -1.26 -4.98 135.00 125.98 3cfp s PRO 124 Ca 0.88 0.91 -0.29 0.00 0.04 0.00 0.00 61.00 62.53 3cfp s PRO 124 Cb -1.07 -3.90 -0.02 0.00 0.04 0.00 0.00 34.50 29.55 3cfp s PRO 124 CO 0.52 -1.29 1.22 -2.00 0.04 0.00 0.00 177.00 175.49 3cfp s GLU 125 N 4.39 4.29 0.27 4.56 2.56 -1.26 -4.94 118.70 128.57 3cfp s GLU 125 Ca 0.53 1.64 -0.01 0.00 0.00 0.00 0.00 54.97 57.13 3cfp s GLU 125 Cb -0.12 -3.67 0.45 0.00 2.00 0.00 0.00 34.13 32.79 3cfp s GLU 125 CO 0.27 -0.59 1.88 -1.35 -0.56 0.00 0.00 175.26 174.92 3cfp h PRO 126 N 7.83 1.10 -0.70 4.30 0.11 -1.90 0.38 132.00 143.12 3cfp h PRO 126 Ca -0.29 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.79 3cfp h PRO 126 Cb 1.13 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 31.95 3cfp h PRO 126 CO 0.93 0.73 0.46 0.66 -0.21 0.00 0.00 178.00 180.57 3cfp h SER 127 N 1.13 0.71 0.02 -2.05 4.64 -1.88 -3.21 113.55 112.91 3cfp h SER 127 Ca 0.44 -0.01 -0.27 0.00 -0.47 0.00 0.00 61.79 61.48 3cfp h SER 127 Cb 0.22 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 62.11 3cfp h SER 127 CO -0.18 0.48 -1.49 0.00 -0.87 0.00 0.00 176.83 174.76 3cfp n GLN 128 N -4.46 0.60 -3.68 4.77 1.13 -0.92 -5.01 117.38 109.81 3cfp n GLN 128 Ca 0.09 0.50 -0.22 0.00 -1.94 0.00 0.00 57.00 55.44 3cfp n GLN 128 Cb 0.15 -1.72 0.04 0.00 0.11 0.00 0.00 30.24 28.82 3cfp n GLN 128 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3cfp n ALA 129 N -3.41 -2.07 0.07 -1.58 0.00 0.13 -4.89 120.51 108.75 3cfp n ALA 129 Ca -0.34 -0.16 -0.07 0.00 0.00 0.00 0.00 53.44 52.87 3cfp n ALA 129 Cb 0.76 -2.24 0.07 0.00 0.00 0.00 0.00 19.45 18.04 3cfp n ALA 129 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3cfp h LYS 130 N -1.84 0.30 -5.94 0.00 1.57 -1.93 -3.44 116.57 105.29 3cfp h LYS 130 Ca -0.61 -0.23 -0.62 0.00 -1.87 0.00 0.00 60.65 57.32 3cfp h LYS 130 Cb 1.36 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.67 3cfp h LYS 130 CO 0.55 0.87 -0.47 -1.01 -0.57 0.00 0.00 179.45 178.82 3cfp s HIS 131 N -3.64 3.52 0.41 -1.35 3.76 -1.26 -5.08 115.29 111.65 3cfp s HIS 131 Ca -0.04 0.30 -0.26 0.00 -0.15 0.00 0.00 55.06 54.90 3cfp s HIS 131 Cb 0.11 -1.80 -0.09 0.00 1.11 0.00 0.00 32.58 31.91 3cfp s HIS 131 CO 0.82 0.57 1.42 -2.14 -0.85 0.00 0.00 174.74 174.55 3cfp s PRO 132 N -2.49 3.91 -0.07 8.40 0.02 -1.26 -5.00 135.00 138.51 3cfp s PRO 132 Ca 0.35 2.41 -0.30 0.00 0.02 0.00 0.00 61.00 63.48 3cfp s PRO 132 Cb -0.13 -2.80 -0.03 0.00 0.02 0.00 0.00 34.50 31.57 3cfp s PRO 132 CO 0.27 -0.63 1.19 0.42 -0.33 0.00 0.00 177.00 177.92 3cfp s ILE 133 N -1.18 4.30 0.00 2.83 1.01 -1.26 -4.16 121.20 122.74 3cfp s ILE 133 Ca 0.57 1.61 0.00 0.00 0.00 0.00 0.00 60.65 62.83 3cfp s ILE 133 Cb -0.43 -4.04 0.00 0.00 0.01 0.00 0.00 42.46 38.00 3cfp s ILE 133 CO 0.57 -0.02 0.67 -0.90 0.00 0.00 0.00 174.94 175.26 3cfp n ASP 134 N 5.36 1.33 -3.63 3.58 5.68 -0.10 -4.85 116.55 123.92 3cfp n ASP 134 Ca 0.11 -1.35 -0.11 0.00 -0.50 0.00 0.00 54.79 52.95 3cfp n ASP 134 Cb 0.46 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.37 3cfp n ASP 134 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3cfp s ALA 135 N -0.35 -1.89 -0.11 2.12 0.00 -1.22 -2.50 121.76 117.82 3cfp s ALA 135 Ca 0.00 2.02 -0.02 0.00 0.00 0.00 0.00 51.96 53.96 3cfp s ALA 135 Cb 0.00 -1.33 0.04 0.00 0.00 0.00 0.00 23.12 21.83 3cfp s ALA 135 CO 0.00 -0.30 0.01 0.42 0.00 0.00 0.00 175.76 175.89 3cfp s ILE 136 N 0.48 0.40 -0.18 0.00 1.01 0.36 -0.89 121.20 122.37 3cfp s ILE 136 Ca -0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 60.65 60.54 3cfp s ILE 136 Cb -0.05 -0.66 -0.03 0.00 0.01 0.00 0.00 42.46 41.73 3cfp s ILE 136 CO -0.04 0.13 0.01 -0.89 0.00 0.00 0.00 174.94 174.14 3cfp s THR 137 N 1.95 4.27 -0.17 2.92 2.01 -0.80 0.27 115.64 126.09 3cfp s THR 137 Ca 0.03 -0.22 -0.04 0.00 0.31 0.00 0.00 61.69 61.78 3cfp s THR 137 Cb -0.14 -2.91 0.06 0.00 0.01 0.00 0.00 72.50 69.52 3cfp s THR 137 CO -0.06 0.46 0.06 -2.28 -0.69 0.00 0.00 174.62 172.11 3cfp s HIS 138 N 0.55 0.54 -0.05 4.92 5.04 0.09 -1.51 115.29 124.86 3cfp s HIS 138 Ca 0.00 -0.51 -0.13 0.00 -1.54 0.00 0.00 55.06 52.88 3cfp s HIS 138 Cb -0.14 -0.82 -0.05 0.00 0.04 0.00 0.00 32.58 31.61 3cfp s HIS 138 CO 0.02 -0.53 0.34 -0.47 -2.34 0.00 0.00 174.74 171.76 3cfp s TYR 139 N 2.02 3.65 -0.20 3.88 6.14 0.15 0.41 117.35 133.40 3cfp s TYR 139 Ca 0.01 0.84 -0.02 0.00 0.64 0.00 0.00 57.07 58.54 3cfp s TYR 139 Cb -0.16 -2.24 0.00 0.00 0.42 0.00 0.00 41.96 39.98 3cfp s TYR 139 CO -0.08 0.57 -0.11 0.34 0.64 0.00 0.00 175.55 176.91 3cfp s ASP 140 N -0.74 3.77 0.43 4.32 -1.08 -0.58 -1.59 116.67 121.21 3cfp s ASP 140 Ca 0.21 -0.51 0.18 0.00 -0.52 0.00 0.00 52.55 51.91 3cfp s ASP 140 Cb -0.15 -1.62 0.99 0.00 -1.46 0.00 0.00 42.92 40.68 3cfp s ASP 140 CO 0.10 -0.01 1.93 0.77 0.52 0.00 0.00 175.17 178.48 3cfp h SER 141 N 8.02 0.00 -0.01 -0.34 4.64 -1.63 -0.07 113.55 124.15 3cfp h SER 141 Ca -0.43 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.84 3cfp h SER 141 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3cfp h SER 141 CO 0.62 0.25 -0.16 0.40 -0.87 0.00 0.00 176.83 177.07 3cfp h ILE 142 N 0.00 1.53 0.00 0.95 1.08 -1.84 -3.29 117.51 115.94 3cfp h ILE 142 Ca -0.00 -1.80 -0.03 0.00 -0.39 0.00 0.00 64.86 62.65 3cfp h ILE 142 Cb 0.49 2.66 -0.00 0.00 -3.07 0.00 0.00 36.82 36.90 3cfp h ILE 142 CO 0.03 0.49 -0.12 0.44 -0.69 0.00 0.00 178.15 178.30 3cfp h ASP 143 N -0.52 0.00 -5.94 1.72 3.32 -1.96 -3.47 116.42 109.57 3cfp h ASP 143 Ca -0.02 0.00 -0.41 0.00 0.02 0.00 0.00 57.03 56.62 3cfp h ASP 143 Cb 0.88 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.54 3cfp h ASP 143 CO 0.03 0.12 -0.70 -0.67 -1.72 0.00 0.00 179.24 176.30 3cfp n ASP 144 N -3.20 -5.80 -4.13 6.45 2.03 -0.05 -5.01 116.55 106.84 3cfp n ASP 144 Ca 0.01 -0.60 -0.21 0.00 0.52 0.00 0.00 54.79 54.52 3cfp n ASP 144 Cb 0.44 -4.79 -0.14 0.00 -0.72 0.00 0.00 41.12 35.91 3cfp n ASP 144 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3cfp s ARG 145 N -6.33 1.03 -0.40 -0.67 1.81 -1.16 -4.85 118.95 108.38 3cfp s ARG 145 Ca 0.57 -0.67 -0.18 0.00 -1.72 0.00 0.00 55.73 53.73 3cfp s ARG 145 Cb -0.26 -1.03 0.01 0.00 -0.45 0.00 0.00 34.95 33.23 3cfp s ARG 145 CO 0.75 0.27 0.47 -0.06 -0.68 0.00 0.00 175.30 176.04 3cfp s PHE 146 N -0.65 3.16 -0.28 -0.53 0.40 0.12 -1.52 117.98 118.68 3cfp s PHE 146 Ca 0.03 -0.19 -0.18 0.00 -0.60 0.00 0.00 56.93 55.99 3cfp s PHE 146 Cb -0.07 -2.93 -0.02 0.00 0.51 0.00 0.00 43.02 40.51 3cfp s PHE 146 CO 0.01 -0.66 0.54 0.71 0.70 0.00 0.00 175.22 176.51 3cfp s TYR 147 N 2.25 3.25 -0.22 0.36 1.51 0.17 0.19 117.35 124.85 3cfp s TYR 147 Ca 0.15 0.57 -0.04 0.00 -1.01 0.00 0.00 57.07 56.73 3cfp s TYR 147 Cb -0.16 -2.79 -0.01 0.00 -0.11 0.00 0.00 41.96 38.88 3cfp s TYR 147 CO 0.14 -0.35 -0.02 0.08 -1.11 0.00 0.00 175.55 174.29 3cfp s VAL 148 N 2.37 3.59 -0.25 0.71 1.01 0.57 -0.73 120.40 127.68 3cfp s VAL 148 Ca 0.22 -0.42 -0.05 0.00 0.00 0.00 0.00 61.98 61.73 3cfp s VAL 148 Cb -0.15 -2.64 -0.00 0.00 0.00 0.00 0.00 36.38 33.58 3cfp s VAL 148 CO 0.10 0.41 0.00 -0.36 0.00 0.00 0.00 175.10 175.25 3cfp s PHE 149 N 1.43 3.04 -0.18 5.22 0.40 0.14 -0.95 117.98 127.09 3cfp s PHE 149 Ca 0.05 -1.00 0.00 0.00 -0.60 0.00 0.00 56.93 55.39 3cfp s PHE 149 Cb -0.14 -2.15 0.04 0.00 0.51 0.00 0.00 43.02 41.27 3cfp s PHE 149 CO -0.01 -0.57 -0.08 0.34 0.70 0.00 0.00 175.22 175.60 3cfp s ASP 150 N 1.47 3.02 -0.06 1.36 2.15 -0.71 -0.49 116.67 123.41 3cfp s ASP 150 Ca 0.04 -0.72 -0.29 0.00 0.43 0.00 0.00 52.55 52.01 3cfp s ASP 150 Cb -0.16 -1.06 -0.02 0.00 -0.30 0.00 0.00 42.92 41.38 3cfp s ASP 150 CO -0.01 -0.16 0.96 -0.22 -0.17 0.00 0.00 175.17 175.57 3cfp s LEU 151 N 1.53 4.30 -0.07 -1.34 2.96 -1.04 -0.38 118.68 124.64 3cfp s LEU 151 Ca 0.00 1.54 0.19 0.00 -0.22 0.00 0.00 54.13 55.65 3cfp s LEU 151 Cb -0.15 -3.51 -0.25 0.00 0.50 0.00 0.00 46.19 42.78 3cfp s LEU 151 CO -0.08 -0.33 0.42 0.18 -1.32 0.00 0.00 176.35 175.21 3cfp n LEU 152 N 4.42 0.22 -4.19 -0.68 4.77 -0.68 -4.90 117.00 115.96 3cfp n LEU 152 Ca 0.06 0.09 -0.31 0.00 -0.03 0.00 0.00 56.01 55.83 3cfp n LEU 152 Cb 0.50 0.20 -0.17 0.00 -2.33 0.00 0.00 43.42 41.62 3cfp n LEU 152 CO 0.51 0.21 -0.55 0.20 -1.33 0.00 0.00 177.39 176.44 3cfp s ASN 153 N -5.19 2.94 0.09 -1.43 0.01 -1.25 -0.61 114.94 109.51 3cfp s ASN 153 Ca -0.07 -0.54 -0.25 0.00 -0.71 0.00 0.00 52.86 51.28 3cfp s ASN 153 Cb 0.10 -1.35 0.07 0.00 0.41 0.00 0.00 41.25 40.48 3cfp s ASN 153 CO 0.85 0.13 0.64 -0.94 -1.51 0.00 0.00 177.10 176.28 3cfp s SER 154 N 0.48 -0.57 0.58 -1.22 1.04 -1.13 -4.54 113.70 108.33 3cfp s SER 154 Ca -0.16 0.18 0.38 0.00 0.48 0.00 0.00 55.95 56.84 3cfp s SER 154 Cb -0.17 0.57 1.35 0.00 0.10 0.00 0.00 66.02 67.87 3cfp s SER 154 CO 0.06 -0.85 1.47 -0.65 0.98 0.00 0.00 173.24 174.25 3cfp h PRO 155 N 2.25 0.00 -1.91 4.02 0.11 -2.02 -2.04 132.00 132.41 3cfp h PRO 155 Ca -0.31 0.00 -0.69 0.00 0.11 0.00 0.00 66.00 65.11 3cfp h PRO 155 Cb 1.26 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 32.03 3cfp h PRO 155 CO 0.38 0.00 0.24 0.66 -0.21 0.00 0.00 178.00 179.07 3cfp n TYR 156 N -3.62 3.24 0.00 0.65 4.01 -1.26 -5.02 117.16 115.15 3cfp n TYR 156 Ca 0.33 -2.84 0.00 0.00 -0.16 0.00 0.00 57.90 55.23 3cfp n TYR 156 Cb 1.73 -0.73 0.00 0.00 -0.31 0.00 0.00 39.34 40.03 3cfp n TYR 156 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3cfp n GLY 157 N -0.41 2.24 3.25 2.72 0.00 -0.77 -4.74 105.19 107.47 3cfp n GLY 157 Ca 0.45 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.33 3cfp n GLY 157 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3cfp s ASN 158 N 0.00 2.80 0.06 1.61 0.02 -1.26 -2.85 114.94 115.32 3cfp s ASN 158 Ca 0.00 -0.45 0.03 0.00 -1.02 0.00 0.00 52.86 51.42 3cfp s ASN 158 Cb 0.00 -0.57 -0.03 0.00 0.02 0.00 0.00 41.25 40.67 3cfp s ASN 158 CO 0.00 0.25 -0.09 0.68 0.02 0.00 0.00 177.10 177.96 3cfp s VAL 159 N -0.30 0.73 0.51 1.60 -7.23 0.22 -5.02 120.40 110.91 3cfp s VAL 159 Ca 0.02 -1.26 -0.19 0.00 -1.81 0.00 0.00 61.98 58.74 3cfp s VAL 159 Cb -0.11 -0.89 -0.07 0.00 0.56 0.00 0.00 36.38 35.87 3cfp s VAL 159 CO 0.01 -0.41 1.03 -1.61 -0.31 0.00 0.00 175.10 173.82 3cfp s GLU 160 N -1.93 3.71 0.69 4.82 2.02 -1.26 -4.76 118.70 121.99 3cfp s GLU 160 Ca -0.05 1.27 -0.17 0.00 0.02 0.00 0.00 54.97 56.05 3cfp s GLU 160 Cb -0.08 -2.09 -0.06 0.00 0.10 0.00 0.00 34.13 32.01 3cfp s GLU 160 CO 0.00 -0.49 0.46 0.39 0.02 0.00 0.00 175.26 175.65 3cfp n GLU 161 N -1.28 0.32 -2.34 1.61 1.02 -1.26 -4.87 120.64 113.85 3cfp n GLU 161 Ca 0.09 0.14 -0.39 0.00 -0.02 0.00 0.00 57.16 56.98 3cfp n GLU 161 Cb 0.53 -1.75 -0.03 0.00 -0.02 0.00 0.00 31.44 30.17 3cfp n GLU 161 CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 3cfp s TRP 162 N -1.88 3.22 -0.26 -0.32 -0.00 -1.26 -4.92 118.94 113.52 3cfp s TRP 162 Ca 0.65 1.58 -0.04 0.00 -0.00 0.00 0.00 56.10 58.30 3cfp s TRP 162 Cb -0.37 -3.38 0.01 0.00 -0.00 0.00 0.00 33.47 29.73 3cfp s TRP 162 CO 0.58 -1.13 -0.02 0.45 -0.00 0.00 0.00 176.95 176.83 3cfp s SER 163 N -1.01 4.53 0.45 5.86 0.15 -1.26 -4.98 113.70 117.44 3cfp s SER 163 Ca 0.53 -0.73 0.24 0.00 0.70 0.00 0.00 55.95 56.69 3cfp s SER 163 Cb -0.32 -1.74 1.00 0.00 -1.71 0.00 0.00 66.02 63.25 3cfp s SER 163 CO 0.40 -0.12 1.86 -0.29 1.20 0.00 0.00 173.24 176.29 3cfp h ILE 164 N 5.97 0.58 -0.45 6.45 2.10 -1.98 0.04 117.51 130.22 3cfp h ILE 164 Ca -0.34 -1.05 -0.10 0.00 1.08 0.00 0.00 64.86 64.45 3cfp h ILE 164 Cb 1.12 1.70 -0.01 0.00 -1.09 0.00 0.00 36.82 38.55 3cfp h ILE 164 CO 0.59 0.21 -0.12 -0.33 -1.08 0.00 0.00 178.15 177.42 3cfp h GLU 165 N 0.00 0.87 -0.01 2.19 3.07 -2.00 -2.61 114.58 116.09 3cfp h GLU 165 Ca -0.00 -0.34 -0.19 0.00 -0.50 0.00 0.00 59.36 58.33 3cfp h GLU 165 Cb 0.69 -0.05 0.02 0.00 -0.84 0.00 0.00 28.75 28.57 3cfp h GLU 165 CO 0.03 0.98 -0.75 0.82 -1.40 0.00 0.00 179.01 178.68 3cfp h ILE 166 N 0.70 1.37 -0.99 3.13 2.04 -1.90 -3.21 117.51 118.64 3cfp h ILE 166 Ca 0.11 -2.12 0.16 0.00 1.00 0.00 0.00 64.86 64.01 3cfp h ILE 166 Cb 0.66 2.48 -0.09 0.00 -0.74 0.00 0.00 36.82 39.13 3cfp h ILE 166 CO 0.05 0.63 0.62 0.00 0.00 0.00 0.00 178.15 179.45 3cfp h ALA 167 N 0.36 1.65 0.00 1.87 0.00 -1.01 -1.73 119.26 120.40 3cfp h ALA 167 Ca -0.09 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3cfp h ALA 167 Cb 1.44 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3cfp h ALA 167 CO 0.15 0.05 -0.47 0.00 0.00 0.00 0.00 179.25 178.98 3cfp h ALA 168 N 1.59 0.98 -2.34 0.00 0.00 -1.49 0.18 119.26 118.18 3cfp h ALA 168 Ca 0.53 -0.42 -0.51 0.00 0.00 0.00 0.00 54.91 54.50 3cfp h ALA 168 Cb 0.72 -0.07 0.13 0.00 0.00 0.00 0.00 17.79 18.57 3cfp h ALA 168 CO -0.31 0.58 0.32 0.15 0.00 0.00 0.00 179.25 179.99 3cfp s LYS 169 N -3.59 2.21 0.61 0.00 1.02 -0.68 -4.36 119.74 114.95 3cfp s LYS 169 Ca -0.00 1.25 -0.18 0.00 0.02 0.00 0.00 55.97 57.05 3cfp s LYS 169 Cb 0.11 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.50 3cfp s LYS 169 CO 0.71 -1.69 1.03 1.28 -0.92 0.00 0.00 175.35 175.77 3cfp n LEU 170 N -3.43 4.14 0.10 3.17 7.99 -1.26 -0.56 117.00 127.16 3cfp n LEU 170 Ca 0.10 0.82 -0.12 0.00 -0.01 0.00 0.00 56.01 56.79 3cfp n LEU 170 Cb 0.53 -1.42 -0.05 0.00 -0.11 0.00 0.00 43.42 42.36 3cfp n LEU 170 CO 0.52 -1.67 0.70 1.56 -1.51 0.00 0.00 177.39 176.99 3cfp h GLN 171 N 0.53 -0.42 0.00 3.23 1.08 -1.86 0.28 115.11 117.96 3cfp h GLN 171 Ca -0.49 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.74 3cfp h GLN 171 Cb 1.36 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.88 3cfp h GLN 171 CO 0.51 -0.28 0.00 0.39 -0.95 0.00 0.00 178.83 178.51 3cfp n GLU 172 N -5.36 0.00 -0.17 1.46 4.71 -1.26 0.33 120.64 120.35 3cfp n GLU 172 Ca -0.06 0.01 0.03 0.00 -0.01 0.00 0.00 57.16 57.13 3cfp n GLU 172 Cb 0.27 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 29.25 3cfp n GLU 172 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 3cfp n GLN 173 N -0.90 1.01 -0.88 3.49 7.27 -0.66 -4.98 117.38 121.73 3cfp n GLN 173 Ca 0.00 -1.51 0.00 0.00 0.07 0.00 0.00 57.00 55.56 3cfp n GLN 173 Cb 0.00 -0.92 0.00 0.00 2.41 0.00 0.00 30.24 31.74 3cfp n GLN 173 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3cfp n GLY 174 N -0.56 0.65 0.00 1.69 0.00 0.15 -4.84 105.19 102.28 3cfp n GLY 174 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3cfp n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfp n GLY 175 N -2.68 1.39 0.00 -0.02 0.00 0.91 -4.98 105.19 99.80 3cfp n GLY 175 Ca 0.00 -2.05 0.05 0.00 0.00 0.00 0.00 46.02 44.03 3cfp n GLY 175 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3cfp n ASP 176 N -2.97 0.95 -2.90 1.61 8.00 -1.05 -3.86 116.55 116.33 3cfp n ASP 176 Ca 0.00 -0.59 -0.18 0.00 0.71 0.00 0.00 54.79 54.73 3cfp n ASP 176 Cb 0.00 1.12 0.06 0.00 -0.02 0.00 0.00 41.12 42.29 3cfp n ASP 176 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3cfp n GLU 177 N -1.41 -6.11 -2.09 -1.24 2.13 0.48 -4.75 120.64 107.65 3cfp n GLU 177 Ca 0.01 0.64 -0.42 0.00 0.66 0.00 0.00 57.16 58.05 3cfp n GLU 177 Cb 0.20 -5.12 -0.03 0.00 0.27 0.00 0.00 31.44 26.76 3cfp n GLU 177 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3cfp s VAL 178 N -3.25 3.40 0.39 6.31 1.01 -0.28 -4.94 120.40 123.04 3cfp s VAL 178 Ca 0.42 0.82 -0.25 0.00 0.00 0.00 0.00 61.98 62.96 3cfp s VAL 178 Cb -0.18 -3.53 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 3cfp s VAL 178 CO 0.57 -0.00 0.99 -2.65 0.00 0.00 0.00 175.10 174.00 3cfp n PRO 179 N 5.47 1.32 -0.03 2.72 -0.02 -1.26 -4.56 135.00 138.64 3cfp n PRO 179 Ca 0.14 0.47 -0.09 0.00 -2.02 0.00 0.00 63.50 62.00 3cfp n PRO 179 Cb 0.42 -1.97 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 3cfp n PRO 179 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3cfp h SER 180 N 1.62 -0.00 0.00 2.55 0.02 -1.93 -2.41 113.55 113.40 3cfp h SER 180 Ca -0.43 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3cfp h SER 180 Cb 1.34 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.92 3cfp h SER 180 CO 0.57 0.03 0.00 -1.84 -1.14 0.00 0.00 176.83 174.45 3cfp n GLU 181 N -5.09 0.00 0.00 3.45 0.00 -1.26 -1.37 120.64 116.37 3cfp n GLU 181 Ca -0.03 0.24 0.00 0.00 0.00 0.00 0.00 57.16 57.37 3cfp n GLU 181 Cb 0.09 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.03 3cfp n GLU 181 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 3cfp n ILE 182 N -1.24 0.00 -0.19 3.84 -5.35 -0.95 -4.78 119.36 110.69 3cfp n ILE 182 Ca 0.00 -0.39 -0.02 0.00 -0.27 0.00 0.00 62.75 62.07 3cfp n ILE 182 Cb 0.00 0.94 0.05 0.00 -1.74 0.00 0.00 39.64 38.89 3cfp n ILE 182 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3cfp h ILE 183 N 0.00 0.38 0.00 7.28 1.08 -0.78 0.10 117.51 125.57 3cfp h ILE 183 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3cfp h ILE 183 Cb 0.00 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 34.13 3cfp h ILE 183 CO 0.00 0.00 0.00 0.47 -0.69 0.00 0.00 178.15 177.93 3cfp n ASP 184 N -5.41 0.00 -0.68 1.72 10.43 -1.26 -3.08 116.55 118.27 3cfp n ASP 184 Ca 0.06 -0.23 0.06 0.00 2.57 0.00 0.00 54.79 57.26 3cfp n ASP 184 Cb 0.31 -0.16 0.14 0.00 1.84 0.00 0.00 41.12 43.26 3cfp n ASP 184 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3cfp n LYS 185 N -1.16 2.27 -3.05 -1.24 5.02 0.35 -4.97 118.16 115.38 3cfp n LYS 185 Ca 0.11 -1.90 -0.40 0.00 -2.02 0.00 0.00 58.31 54.10 3cfp n LYS 185 Cb 0.11 -1.30 -0.05 0.00 -0.02 0.00 0.00 35.03 33.77 3cfp n LYS 185 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3cfp s ILE 186 N -1.02 5.03 -0.34 -0.18 1.01 -1.17 0.12 121.20 124.65 3cfp s ILE 186 Ca 0.24 1.41 -0.07 0.00 0.00 0.00 0.00 60.65 62.23 3cfp s ILE 186 Cb 0.13 -4.03 0.04 0.00 0.01 0.00 0.00 42.46 38.62 3cfp s ILE 186 CO 0.18 0.21 0.11 -0.63 0.00 0.00 0.00 174.94 174.81 3cfp s ILE 187 N 1.09 3.81 -0.16 2.92 -1.09 0.13 -4.92 121.20 122.97 3cfp s ILE 187 Ca 0.36 -1.14 -0.15 0.00 -2.23 0.00 0.00 60.65 57.49 3cfp s ILE 187 Cb -0.17 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.50 3cfp s ILE 187 CO 0.16 -0.19 0.34 -0.47 -1.23 0.00 0.00 174.94 173.55 3cfp s TYR 188 N 1.40 3.45 -0.33 3.97 5.04 -1.26 -0.31 117.35 129.31 3cfp s TYR 188 Ca -0.01 0.64 -0.01 0.00 -2.44 0.00 0.00 57.07 55.25 3cfp s TYR 188 Cb -0.20 -2.41 0.11 0.00 0.35 0.00 0.00 41.96 39.82 3cfp s TYR 188 CO 0.03 0.18 0.14 -1.64 -1.34 0.00 0.00 175.55 172.92 3cfp s MET 189 N 0.66 0.72 0.52 4.97 -1.94 -0.12 -4.98 119.30 119.13 3cfp s MET 189 Ca 0.18 -1.19 -0.19 0.00 -1.71 0.00 0.00 55.69 52.78 3cfp s MET 189 Cb -0.14 -1.86 -0.07 0.00 2.01 0.00 0.00 34.83 34.78 3cfp s MET 189 CO 0.06 -1.05 1.06 -2.14 -0.01 0.00 0.00 175.02 172.93 3cfp s PRO 190 N 1.40 3.62 -0.03 2.03 0.02 -1.26 -1.74 135.00 139.03 3cfp s PRO 190 Ca 0.12 1.36 0.01 0.00 0.02 0.00 0.00 61.00 62.52 3cfp s PRO 190 Cb -0.19 -2.07 0.02 0.00 0.02 0.00 0.00 34.50 32.28 3cfp s PRO 190 CO -0.19 -0.58 -0.05 -0.06 -0.33 0.00 0.00 177.00 175.78 3cfp s PHE 191 N -2.06 0.67 0.17 6.54 0.40 0.48 -4.87 117.98 119.30 3cfp s PHE 191 Ca 0.67 -0.16 -0.12 0.00 -0.60 0.00 0.00 56.93 56.71 3cfp s PHE 191 Cb -0.17 -0.57 0.06 0.00 0.51 0.00 0.00 43.02 42.85 3cfp s PHE 191 CO 0.25 -0.14 1.72 -0.44 0.70 0.00 0.00 175.22 177.31 3cfp h ASP 192 N 6.86 0.78 -5.18 1.36 3.32 -1.96 -1.81 116.42 119.78 3cfp h ASP 192 Ca -0.36 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.40 3cfp h ASP 192 Cb 1.16 -0.20 -0.15 0.00 0.22 0.00 0.00 39.33 40.36 3cfp h ASP 192 CO 0.48 0.74 -0.56 0.54 -1.72 0.00 0.00 179.24 178.72 3cfp s ASN 193 N -6.06 0.32 0.21 6.45 2.20 -1.26 -3.79 114.94 113.01 3cfp s ASN 193 Ca -0.13 -0.81 -0.09 0.00 -0.94 0.00 0.00 52.86 50.90 3cfp s ASN 193 Cb 0.12 0.25 0.17 0.00 -2.00 0.00 0.00 41.25 39.79 3cfp s ASN 193 CO 0.79 -0.62 1.82 -0.08 -2.94 0.00 0.00 177.10 176.07 3cfp h GLU 194 N 3.14 1.13 -0.32 3.55 4.81 -1.89 -2.04 114.58 122.95 3cfp h GLU 194 Ca -0.34 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 58.79 3cfp h GLU 194 Cb 1.17 -0.22 -0.07 0.00 0.63 0.00 0.00 28.75 30.26 3cfp h GLU 194 CO 0.60 0.85 -0.47 0.87 -0.73 0.00 0.00 179.01 180.12 3cfp h LYS 195 N 1.12 -0.34 -0.93 1.92 1.79 -1.98 0.16 116.57 118.32 3cfp h LYS 195 Ca 0.28 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.77 3cfp h LYS 195 Cb 0.06 0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 3cfp h LYS 195 CO -0.04 -0.23 0.55 0.93 -1.08 0.00 0.00 179.45 179.58 3cfp h GLU 196 N -0.35 1.27 -0.36 3.15 5.08 -1.95 0.13 114.58 121.54 3cfp h GLU 196 Ca 0.06 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.37 3cfp h GLU 196 Cb 0.51 -0.26 -0.09 0.00 0.50 0.00 0.00 28.75 29.41 3cfp h GLU 196 CO -0.49 0.89 -0.32 1.25 -1.00 0.00 0.00 179.01 179.34 3cfp h LEU 197 N 1.28 -1.06 -0.22 1.33 7.12 -0.80 0.24 115.31 123.20 3cfp h LEU 197 Ca 0.33 0.18 -0.12 0.00 0.13 0.00 0.00 57.88 58.41 3cfp h LEU 197 Cb -0.04 0.49 -0.00 0.00 -0.53 0.00 0.00 40.66 40.58 3cfp h LEU 197 CO -0.06 -0.32 -0.32 -0.07 -0.13 0.00 0.00 178.44 177.54 3cfp h LEU 198 N -0.27 0.66 -0.33 2.25 3.38 -0.42 -0.81 115.31 119.78 3cfp h LEU 198 Ca 0.16 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 3cfp h LEU 198 Cb 0.54 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3cfp h LEU 198 CO -0.51 1.05 0.18 -0.03 0.09 0.00 0.00 178.44 179.22 3cfp h MET 199 N 0.30 0.46 -0.30 1.13 4.05 -0.80 -1.00 114.93 118.77 3cfp h MET 199 Ca 0.02 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 3cfp h MET 199 Cb 0.90 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.59 3cfp h MET 199 CO 0.07 0.38 0.18 1.49 0.23 0.00 0.00 176.91 179.27 3cfp h GLU 200 N 0.41 0.41 -1.00 0.39 4.57 -0.49 -2.71 114.58 116.15 3cfp h GLU 200 Ca 0.12 -0.04 0.11 0.00 -1.18 0.00 0.00 59.36 58.36 3cfp h GLU 200 Cb 0.05 -0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 28.48 3cfp h GLU 200 CO -0.02 0.31 0.64 -0.92 -1.18 0.00 0.00 179.01 177.84 3cfp h TYR 201 N 0.39 1.16 -0.30 0.92 3.20 -0.66 -1.17 116.97 120.50 3cfp h TYR 201 Ca 0.11 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 3cfp h TYR 201 Cb 0.01 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 37.90 3cfp h TYR 201 CO -0.04 0.50 0.11 -0.07 -1.64 0.00 0.00 178.16 177.01 3cfp h LEU 202 N 1.04 0.42 -1.47 2.82 3.38 -1.00 0.22 115.31 120.72 3cfp h LEU 202 Ca 0.48 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 3cfp h LEU 202 Cb 0.40 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3cfp h LEU 202 CO -0.24 0.49 -0.06 0.78 0.09 0.00 0.00 178.44 179.50 3cfp h ASN 203 N 0.33 0.25 -0.21 -0.43 -0.26 -1.14 0.10 115.58 114.23 3cfp h ASN 203 Ca 0.10 -0.04 -0.05 0.00 -0.56 0.00 0.00 56.30 55.74 3cfp h ASN 203 Cb 0.21 -0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 3cfp h ASN 203 CO -0.01 0.35 -0.08 0.15 -1.06 0.00 0.00 177.43 176.79 3cfp h PHE 204 N 0.26 0.49 -0.96 1.19 3.57 -0.88 -2.59 116.94 118.02 3cfp h PHE 204 Ca 0.06 -0.11 0.07 0.00 3.53 0.00 0.00 57.97 61.51 3cfp h PHE 204 Cb 0.29 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.85 3cfp h PHE 204 CO 0.00 0.69 0.62 2.35 -2.23 0.00 0.00 178.31 179.75 3cfp h TRP 205 N 0.15 1.13 -0.05 0.41 2.91 0.43 -0.32 115.95 120.60 3cfp h TRP 205 Ca 0.05 0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.11 3cfp h TRP 205 Cb 0.55 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.82 3cfp h TRP 205 CO 0.06 0.59 0.01 0.37 -1.03 0.00 0.00 178.44 178.43 3cfp h GLN 206 N 1.11 0.03 0.00 2.65 4.15 -0.68 -1.83 115.11 120.55 3cfp h GLN 206 Ca 0.41 -0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.63 3cfp h GLN 206 Cb 0.18 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 3cfp h GLN 206 CO -0.16 0.02 -0.89 1.96 -1.93 0.00 0.00 178.83 177.83 3cfp h GLN 207 N 0.03 0.24 -2.27 1.69 1.08 -1.06 -3.33 115.11 111.49 3cfp h GLN 207 Ca 0.02 -0.26 -0.61 0.00 -1.45 0.00 0.00 58.65 56.35 3cfp h GLN 207 Cb 0.02 0.07 -0.41 0.00 -0.05 0.00 0.00 27.48 27.11 3cfp h GLN 207 CO -0.03 0.98 -0.49 1.63 -0.95 0.00 0.00 178.83 179.97 3cfp n LYS 208 N -3.68 3.06 -2.33 1.46 4.01 -0.17 -5.08 118.16 115.44 3cfp n LYS 208 Ca -0.04 -4.76 -0.43 0.00 -0.51 0.00 0.00 58.31 52.57 3cfp n LYS 208 Cb 0.81 -2.27 -0.02 0.00 -0.51 0.00 0.00 35.03 33.04 3cfp n LYS 208 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 3cfp s THR 209 N -3.49 4.12 0.35 -0.18 2.01 -0.69 -4.71 115.64 113.05 3cfp s THR 209 Ca 0.44 1.34 -0.29 0.00 0.31 0.00 0.00 61.69 63.50 3cfp s THR 209 Cb 0.21 -3.90 -0.11 0.00 0.01 0.00 0.00 72.50 68.71 3cfp s THR 209 CO -0.07 -0.15 1.51 -2.84 -0.69 0.00 0.00 174.62 172.38 3cfp s PRO 210 N 3.69 4.12 -0.19 4.92 0.02 -1.26 -4.89 135.00 141.41 3cfp s PRO 210 Ca 0.59 2.56 -0.15 0.00 0.02 0.00 0.00 61.00 64.02 3cfp s PRO 210 Cb -0.24 -2.98 -0.10 0.00 0.02 0.00 0.00 34.50 31.20 3cfp s PRO 210 CO 0.18 -0.55 -0.10 0.28 -0.33 0.00 0.00 177.00 176.49 3cfp n VAL 211 N 0.88 1.48 -3.64 3.83 0.31 0.34 -4.73 118.33 116.80 3cfp n VAL 211 Ca 0.03 0.04 -0.37 0.00 -0.01 0.00 0.00 64.34 64.03 3cfp n VAL 211 Cb 0.39 -2.20 -0.10 0.00 -0.91 0.00 0.00 33.84 31.02 3cfp n VAL 211 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3cfp s ILE 212 N -2.42 5.34 -0.21 2.52 -1.09 -0.91 -0.63 121.20 123.80 3cfp s ILE 212 Ca -0.25 0.19 -0.02 0.00 -2.23 0.00 0.00 60.65 58.34 3cfp s ILE 212 Cb 0.05 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.42 3cfp s ILE 212 CO 0.41 0.32 -0.08 -0.22 -1.23 0.00 0.00 174.94 174.14 3cfp s LEU 213 N 1.22 2.72 0.00 2.97 2.96 -0.23 -0.31 118.68 128.01 3cfp s LEU 213 Ca 0.08 -0.50 0.07 0.00 -0.22 0.00 0.00 54.13 53.55 3cfp s LEU 213 Cb -0.14 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.86 3cfp s LEU 213 CO 0.06 -0.02 0.24 1.07 -1.32 0.00 0.00 176.35 176.37 3cfp n THR 214 N 4.74 0.00 -1.30 3.68 5.66 0.73 -0.24 114.28 127.54 3cfp n THR 214 Ca -0.19 -2.13 0.00 0.00 -3.05 0.00 0.00 64.05 58.68 3cfp n THR 214 Cb 0.50 1.05 0.00 0.00 -1.55 0.00 0.00 70.33 70.33 3cfp n THR 214 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3cfp n GLY 215 N -0.55 0.23 3.48 1.09 0.00 -1.26 -1.84 105.19 106.33 3cfp n GLY 215 Ca 0.06 -1.69 -0.40 0.00 0.00 0.00 0.00 46.02 43.99 3cfp n GLY 215 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3cfp s TRP 216 N -2.34 3.22 -1.24 1.61 -0.11 -1.26 -0.26 118.94 118.55 3cfp s TRP 216 Ca 0.00 -0.44 0.00 0.00 1.22 0.00 0.00 56.10 56.88 3cfp s TRP 216 Cb 0.00 -2.46 0.00 0.00 -1.50 0.00 0.00 33.47 29.51 3cfp s TRP 216 CO 0.00 -0.45 0.00 -1.71 -4.62 0.00 0.00 176.95 170.17 3cfp n ASN 217 N 5.07 -4.54 0.26 5.86 5.15 -1.26 -4.86 115.26 120.93 3cfp n ASN 217 Ca -0.13 0.29 0.12 0.00 -0.60 0.00 0.00 54.58 54.27 3cfp n ASN 217 Cb 0.49 -3.07 0.69 0.00 -0.53 0.00 0.00 39.78 37.35 3cfp n ASN 217 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 3cfp h VAL 218 N 0.00 0.56 0.00 3.44 3.04 -1.93 -1.06 116.25 120.30 3cfp h VAL 218 Ca -0.24 -0.63 -0.08 0.00 -1.01 0.00 0.00 66.70 64.74 3cfp h VAL 218 Cb 0.81 1.41 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 3cfp h VAL 218 CO 0.35 0.13 -0.93 -0.08 -1.01 0.00 0.00 177.57 176.04 3cfp h GLU 219 N 0.00 0.00 0.00 4.17 4.81 -1.92 0.13 114.58 121.77 3cfp h GLU 219 Ca -0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 3cfp h GLU 219 Cb 0.40 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 3cfp h GLU 219 CO 0.02 0.21 -1.67 0.43 -0.73 0.00 0.00 179.01 177.27 3cfp n SER 220 N -2.92 0.42 0.02 1.04 7.64 -0.70 -4.56 113.62 114.56 3cfp n SER 220 Ca -0.03 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.03 3cfp n SER 220 Cb 0.69 1.02 0.00 0.00 -1.01 0.00 0.00 64.21 64.91 3cfp n SER 220 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 3cfp n PHE 221 N -2.59 -0.16 0.12 1.43 -0.00 -0.49 -4.80 117.46 110.97 3cfp n PHE 221 Ca -0.09 0.03 -0.13 0.00 -0.00 0.00 0.00 57.45 57.26 3cfp n PHE 221 Cb 0.72 0.16 -0.07 0.00 -0.00 0.00 0.00 39.48 40.29 3cfp n PHE 221 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 3cfp h ASP 222 N 0.00 -0.28 0.72 -2.13 3.45 -1.65 0.14 116.42 116.66 3cfp h ASP 222 Ca 0.00 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.45 3cfp h ASP 222 Cb 0.00 0.09 0.01 0.00 -0.56 0.00 0.00 39.33 38.87 3cfp h ASP 222 CO 0.00 -0.17 -0.34 0.40 -1.57 0.00 0.00 179.24 177.55 3cfp h ILE 223 N -0.26 0.27 -0.54 0.35 2.04 -1.06 -0.19 117.51 118.13 3cfp h ILE 223 Ca -0.01 -0.06 0.10 0.00 1.00 0.00 0.00 64.86 65.89 3cfp h ILE 223 Cb 0.23 0.29 -0.08 0.00 -0.74 0.00 0.00 36.82 36.53 3cfp h ILE 223 CO -0.01 0.01 0.09 -0.65 0.00 0.00 0.00 178.15 177.59 3cfp h PRO 224 N -1.01 0.21 0.01 2.37 0.11 -1.75 -0.79 132.00 131.16 3cfp h PRO 224 Ca -0.10 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 3cfp h PRO 224 Cb 0.75 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3cfp h PRO 224 CO 0.16 0.14 -0.01 -0.92 -0.21 0.00 0.00 178.00 177.16 3cfp h TYR 225 N 0.22 -0.02 -0.54 0.65 5.03 -0.51 -0.31 116.97 121.48 3cfp h TYR 225 Ca 0.28 -0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.53 3cfp h TYR 225 Cb 0.40 0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.66 3cfp h TYR 225 CO -0.26 0.01 0.11 -0.24 -1.32 0.00 0.00 178.16 176.47 3cfp h VAL 226 N -0.04 1.23 0.11 1.81 3.04 -0.86 0.15 116.25 121.69 3cfp h VAL 226 Ca -0.00 -0.85 -0.01 0.00 -1.01 0.00 0.00 66.70 64.83 3cfp h VAL 226 Cb 0.04 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 30.01 3cfp h VAL 226 CO 0.00 0.32 -0.05 0.22 -1.01 0.00 0.00 177.57 177.05 3cfp h TYR 227 N 0.81 -0.13 -0.22 3.17 3.20 -0.90 -2.35 116.97 120.54 3cfp h TYR 227 Ca 0.17 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.89 3cfp h TYR 227 Cb 0.32 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 3cfp h TYR 227 CO 0.02 -0.02 -0.48 -0.91 -1.64 0.00 0.00 178.16 175.12 3cfp h ASN 228 N -0.21 0.65 -0.32 -2.11 2.35 -0.84 -0.75 115.58 114.35 3cfp h ASN 228 Ca -0.01 -0.32 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 3cfp h ASN 228 Cb 0.17 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3cfp h ASN 228 CO 0.02 1.02 0.21 -0.09 -1.65 0.00 0.00 177.43 176.95 3cfp h ARG 229 N 0.47 0.42 -0.53 0.81 9.65 -0.68 0.17 114.38 124.69 3cfp h ARG 229 Ca 0.02 -0.03 -0.06 0.00 -1.10 0.00 0.00 59.98 58.81 3cfp h ARG 229 Cb 1.02 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.48 3cfp h ARG 229 CO 0.09 0.28 0.08 0.82 2.80 0.00 0.00 179.97 184.04 3cfp h ILE 230 N 0.43 1.25 -0.71 1.20 2.04 -1.32 -2.15 117.51 118.25 3cfp h ILE 230 Ca 0.12 -0.96 0.04 0.00 1.00 0.00 0.00 64.86 65.05 3cfp h ILE 230 Cb -0.05 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 3cfp h ILE 230 CO -0.03 0.35 0.44 0.50 0.00 0.00 0.00 178.15 179.41 3cfp h LYS 231 N 0.77 0.82 0.00 2.37 3.64 -0.79 0.36 116.57 123.73 3cfp h LYS 231 Ca 0.16 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 3cfp h LYS 231 Cb 0.42 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 3cfp h LYS 231 CO 0.01 0.54 -0.28 -0.91 -2.27 0.00 0.00 179.45 176.54 3cfp h ASN 232 N 0.84 0.00 0.00 4.20 2.35 -0.48 -2.44 115.58 120.06 3cfp h ASN 232 Ca 0.29 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.66 3cfp h ASN 232 Cb 0.06 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.37 3cfp h ASN 232 CO -0.13 0.28 -2.20 -0.38 -1.65 0.00 0.00 177.43 173.35 3cfp n ILE 233 N -3.66 1.53 0.73 2.81 5.41 -0.83 -4.72 119.36 120.63 3cfp n ILE 233 Ca -0.01 -0.28 0.08 0.00 1.00 0.00 0.00 62.75 63.54 3cfp n ILE 233 Cb 0.40 -1.96 -0.10 0.00 -0.71 0.00 0.00 39.64 37.27 3cfp n ILE 233 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 3cfp n PHE 234 N -4.30 0.00 0.00 1.39 3.01 0.12 -5.09 117.46 112.59 3cfp n PHE 234 Ca -0.47 0.00 0.00 0.00 1.01 0.00 0.00 57.45 57.99 3cfp n PHE 234 Cb 0.81 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 40.26 3cfp n PHE 234 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3cfp n GLY 235 N 1.40 2.36 0.27 1.37 0.00 -0.92 -4.57 105.19 105.12 3cfp n GLY 235 Ca 0.03 -1.90 0.16 0.00 0.00 0.00 0.00 46.02 44.30 3cfp n GLY 235 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3cfp h GLU 236 N 0.00 0.00 -0.31 1.61 4.81 -1.87 -2.67 114.58 116.16 3cfp h GLU 236 Ca 0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3cfp h GLU 236 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3cfp h GLU 236 CO 0.00 0.06 -0.07 0.77 -0.73 0.00 0.00 179.01 179.04 3cfp h SER 237 N 0.00 0.60 -0.00 1.04 0.02 -1.94 -1.94 113.55 111.32 3cfp h SER 237 Ca -0.00 -0.36 -0.00 0.00 -0.84 0.00 0.00 61.79 60.58 3cfp h SER 237 Cb 0.44 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 3cfp h SER 237 CO 0.01 0.82 0.00 0.74 -1.14 0.00 0.00 176.83 177.26 3cfp h THR 238 N 0.36 1.23 -0.98 -2.27 2.02 -1.75 -2.94 112.91 108.58 3cfp h THR 238 Ca 0.08 -0.67 0.27 0.00 0.77 0.00 0.00 66.41 66.85 3cfp h THR 238 Cb 0.56 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.60 3cfp h THR 238 CO 0.03 0.18 0.68 0.00 0.37 0.00 0.00 175.52 176.77 3cfp h ALA 239 N 0.72 2.64 0.00 6.16 0.00 -1.47 0.24 119.26 127.54 3cfp h ALA 239 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cfp h ALA 239 Cb 0.29 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3cfp h ALA 239 CO 0.00 -0.95 0.00 1.63 0.00 0.00 0.00 179.25 179.93 3cfp n LYS 240 N -4.37 0.05 0.31 0.00 5.02 -0.73 -2.43 118.16 116.00 3cfp n LYS 240 Ca 0.21 0.25 0.20 0.00 -2.02 0.00 0.00 58.31 56.95 3cfp n LYS 240 Cb 0.94 -1.50 0.92 0.00 -0.02 0.00 0.00 35.03 35.38 3cfp n LYS 240 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cfp h ARG 241 N 0.00 0.00 0.00 1.97 3.08 -0.63 -2.33 114.38 116.47 3cfp h ARG 241 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3cfp h ARG 241 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 3cfp h ARG 241 CO 0.00 0.00 -0.05 -0.07 -1.07 0.00 0.00 179.97 178.78 3cfp h LEU 242 N 0.00 0.00 -9.09 3.04 3.38 -1.69 -3.38 115.31 107.57 3cfp h LEU 242 Ca -0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 3cfp h LEU 242 Cb 0.29 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.92 3cfp h LEU 242 CO 0.00 0.05 -0.20 -0.55 0.09 0.00 0.00 178.44 177.83 3cfp s SER 243 N -5.73 6.40 0.60 -0.43 0.15 -0.88 -4.97 113.70 108.84 3cfp s SER 243 Ca -0.03 0.47 0.29 0.00 0.70 0.00 0.00 55.95 57.38 3cfp s SER 243 Cb 0.12 -2.23 1.43 0.00 -1.71 0.00 0.00 66.02 63.64 3cfp s SER 243 CO 0.52 -0.11 1.84 1.55 1.20 0.00 0.00 173.24 178.24 3cfp h PRO 244 N 7.55 0.00 -0.02 5.44 0.13 -1.75 0.27 132.00 143.62 3cfp h PRO 244 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3cfp h PRO 244 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3cfp h PRO 244 CO 0.70 0.00 -0.06 0.72 -0.23 0.00 0.00 178.00 179.14 3cfp n HIS 245 N -3.60 0.00 -1.05 1.56 8.25 -1.26 -4.98 115.22 114.13 3cfp n HIS 245 Ca 0.09 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.53 3cfp n HIS 245 Cb 0.72 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.83 3cfp n HIS 245 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3cfp n ARG 246 N 0.88 -0.63 -4.49 -0.41 5.12 0.08 -5.03 116.66 112.19 3cfp n ARG 246 Ca 0.10 0.32 -0.33 0.00 -1.93 0.00 0.00 57.85 56.01 3cfp n ARG 246 Cb 0.45 -3.91 -0.13 0.00 -1.16 0.00 0.00 32.46 27.72 3cfp n ARG 246 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 3cfp s LYS 247 N -1.18 3.61 -0.03 5.56 2.47 -1.26 -4.88 119.74 124.03 3cfp s LYS 247 Ca 0.00 -0.55 0.01 0.00 -1.56 0.00 0.00 55.97 53.87 3cfp s LYS 247 Cb 0.00 -2.85 0.01 0.00 -1.46 0.00 0.00 37.83 33.53 3cfp s LYS 247 CO 0.00 0.24 -0.05 0.95 0.16 0.00 0.00 175.35 176.65 3cfp s THR 248 N 0.35 0.52 -0.10 3.43 -4.23 -1.26 -2.59 115.64 111.76 3cfp s THR 248 Ca -0.06 -0.18 -0.10 0.00 -1.18 0.00 0.00 61.69 60.17 3cfp s THR 248 Cb -0.15 -0.51 -0.05 0.00 1.34 0.00 0.00 72.50 73.14 3cfp s THR 248 CO 0.04 0.19 0.23 -0.60 -0.54 0.00 0.00 174.62 173.94 3cfp s ARG 249 N 0.51 3.73 -0.36 3.99 3.52 -1.04 -4.96 118.95 124.35 3cfp s ARG 249 Ca -0.07 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.58 3cfp s ARG 249 Cb -0.10 -3.25 0.10 0.00 -1.56 0.00 0.00 34.95 30.14 3cfp s ARG 249 CO 0.00 0.65 0.10 0.08 -0.81 0.00 0.00 175.30 175.32 3cfp s VAL 250 N -0.75 2.79 -0.59 7.11 1.01 -1.26 -0.68 120.40 128.03 3cfp s VAL 250 Ca 0.17 -2.08 -0.27 0.00 0.00 0.00 0.00 61.98 59.80 3cfp s VAL 250 Cb -0.13 -2.92 0.03 0.00 0.00 0.00 0.00 36.38 33.36 3cfp s VAL 250 CO 0.06 -0.56 1.12 -0.75 0.00 0.00 0.00 175.10 174.97 3cfp s LYS 251 N 1.05 3.41 0.10 2.72 2.20 -0.43 -4.92 119.74 123.87 3cfp s LYS 251 Ca 0.07 0.01 -0.17 0.00 -0.36 0.00 0.00 55.97 55.52 3cfp s LYS 251 Cb -0.21 -4.05 -0.06 0.00 -1.51 0.00 0.00 37.83 32.00 3cfp s LYS 251 CO -0.05 -1.67 1.52 -0.39 -0.36 0.00 0.00 175.35 174.40 3cfp h VAL 252 N 6.10 1.26 -0.09 4.02 -1.51 -1.87 -2.43 116.25 121.73 3cfp h VAL 252 Ca -0.26 -0.99 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 3cfp h VAL 252 Cb 1.06 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 31.53 3cfp h VAL 252 CO 1.17 0.32 0.00 -0.38 -1.23 0.00 0.00 177.57 177.44 3cfp n ILE 253 N -4.54 0.00 -0.01 7.19 -0.00 -1.26 -4.42 119.36 116.32 3cfp n ILE 253 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.72 3cfp n ILE 253 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.92 3cfp n ILE 253 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 3cfp n GLU 254 N 0.33 3.36 -3.80 0.38 1.02 -1.26 -4.35 120.64 116.33 3cfp n GLU 254 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 3cfp n GLU 254 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 3cfp n GLU 254 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3cfp n ASN 255 N 0.00 -1.07 -0.06 1.62 0.23 -1.23 -4.79 115.26 109.95 3cfp n ASN 255 Ca 0.00 -1.20 -0.09 0.00 -0.53 0.00 0.00 54.58 52.76 3cfp n ASN 255 Cb 0.00 1.65 0.07 0.00 -2.08 0.00 0.00 39.78 39.42 3cfp n ASN 255 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 3cfp h MET 256 N 0.00 0.73 -1.79 -3.83 1.85 -2.04 -3.35 114.93 106.50 3cfp h MET 256 Ca -0.19 -0.35 -0.40 0.00 -0.61 0.00 0.00 59.70 58.15 3cfp h MET 256 Cb 1.06 -0.01 -0.15 0.00 0.43 0.00 0.00 31.60 32.93 3cfp h MET 256 CO 0.28 0.96 0.36 0.66 -0.40 0.00 0.00 176.91 178.77 3cfp n TYR 257 N -4.06 1.48 0.00 1.39 4.01 -1.26 -4.97 117.16 113.75 3cfp n TYR 257 Ca -0.01 -1.93 0.00 0.00 -0.16 0.00 0.00 57.90 55.80 3cfp n TYR 257 Cb 0.50 -1.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.32 3cfp n TYR 257 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3cfp n GLY 258 N 0.73 0.49 2.70 2.72 0.00 -1.26 -4.96 105.19 105.61 3cfp n GLY 258 Ca 0.40 -1.78 -0.28 0.00 0.00 0.00 0.00 46.02 44.36 3cfp n GLY 258 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cfp s SER 259 N -4.00 3.09 0.00 1.61 0.15 -1.26 -3.57 113.70 109.72 3cfp s SER 259 Ca 0.00 -0.98 -0.01 0.00 0.70 0.00 0.00 55.95 55.66 3cfp s SER 259 Cb 0.00 -0.56 -0.04 0.00 -1.71 0.00 0.00 66.02 63.71 3cfp s SER 259 CO 0.00 -0.34 0.15 -0.13 1.20 0.00 0.00 173.24 174.11 3cfp s ARG 260 N 1.89 3.29 -0.03 5.44 0.52 -1.26 -4.54 118.95 124.25 3cfp s ARG 260 Ca 0.02 -0.40 0.01 0.00 -0.52 0.00 0.00 55.73 54.84 3cfp s ARG 260 Cb -0.17 -3.00 0.02 0.00 0.52 0.00 0.00 34.95 32.33 3cfp s ARG 260 CO -0.14 0.66 -0.01 -2.00 0.02 0.00 0.00 175.30 173.83 3cfp s GLU 261 N -1.94 0.33 -0.17 3.54 2.12 -1.26 -4.25 118.70 117.08 3cfp s GLU 261 Ca 0.26 0.04 -0.00 0.00 0.36 0.00 0.00 54.97 55.63 3cfp s GLU 261 Cb -0.12 -0.48 -0.00 0.00 0.26 0.00 0.00 34.13 33.79 3cfp s GLU 261 CO 0.18 -0.11 -0.13 0.42 -0.54 0.00 0.00 175.26 175.08 3cfp s ILE 262 N 0.88 2.79 -0.13 -3.70 1.01 -0.92 -4.87 121.20 116.25 3cfp s ILE 262 Ca -0.09 -0.72 -0.10 0.00 0.00 0.00 0.00 60.65 59.74 3cfp s ILE 262 Cb -0.12 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 3cfp s ILE 262 CO -0.01 0.50 0.19 -0.63 0.00 0.00 0.00 174.94 174.99 3cfp s ILE 263 N 0.91 5.39 -0.25 2.92 1.09 -1.26 -1.31 121.20 128.69 3cfp s ILE 263 Ca -0.03 0.33 -0.09 0.00 -1.10 0.00 0.00 60.65 59.76 3cfp s ILE 263 Cb -0.15 -3.49 -0.04 0.00 -1.06 0.00 0.00 42.46 37.72 3cfp s ILE 263 CO -0.01 0.53 0.12 -0.89 -0.10 0.00 0.00 174.94 174.59 3cfp s THR 264 N -0.42 4.83 -0.57 2.92 2.01 0.14 -4.98 115.64 119.57 3cfp s THR 264 Ca 0.14 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 61.99 3cfp s THR 264 Cb -0.12 -3.27 0.14 0.00 0.01 0.00 0.00 72.50 69.26 3cfp s THR 264 CO 0.03 0.32 0.53 -0.76 -0.69 0.00 0.00 174.62 174.05 3cfp s LEU 265 N 1.51 6.25 0.28 4.42 1.43 -1.26 -2.49 118.68 128.80 3cfp s LEU 265 Ca 0.06 -1.88 -0.30 0.00 -1.03 0.00 0.00 54.13 50.98 3cfp s LEU 265 Cb -0.15 -2.21 -0.12 0.00 0.03 0.00 0.00 46.19 43.74 3cfp s LEU 265 CO 0.06 -0.83 1.58 0.49 0.23 0.00 0.00 176.35 177.88 3cfp n PHE 266 N 5.12 2.73 0.00 0.29 3.01 -1.07 -1.85 117.46 125.69 3cfp n PHE 266 Ca -0.11 0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.61 3cfp n PHE 266 Cb 0.41 -2.58 0.00 0.00 -0.01 0.00 0.00 39.48 37.29 3cfp n PHE 266 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3cfp n GLY 267 N 2.34 1.35 3.44 1.37 0.00 -1.26 -3.89 105.19 108.54 3cfp n GLY 267 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 3cfp n GLY 267 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cfp s ILE 268 N -2.34 2.79 -0.54 -0.61 1.01 -0.77 -4.76 121.20 115.98 3cfp s ILE 268 Ca 0.00 -0.90 -0.16 0.00 0.00 0.00 0.00 60.65 59.59 3cfp s ILE 268 Cb 0.00 -2.09 0.12 0.00 0.01 0.00 0.00 42.46 40.51 3cfp s ILE 268 CO 0.00 0.54 0.50 -0.44 0.00 0.00 0.00 174.94 175.54 3cfp s SER 269 N -0.85 6.19 -0.20 3.58 0.01 0.20 -4.81 113.70 117.82 3cfp s SER 269 Ca 0.12 -1.74 -0.28 0.00 1.31 0.00 0.00 55.95 55.35 3cfp s SER 269 Cb -0.10 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.92 3cfp s SER 269 CO 0.01 -0.86 0.99 -0.69 0.41 0.00 0.00 173.24 173.10 3cfp s VAL 270 N 1.65 4.74 -0.52 3.43 1.01 -1.26 -1.07 120.40 128.38 3cfp s VAL 270 Ca 0.03 1.93 0.03 0.00 0.00 0.00 0.00 61.98 63.98 3cfp s VAL 270 Cb -0.29 -4.27 0.14 0.00 0.00 0.00 0.00 36.38 31.96 3cfp s VAL 270 CO 0.03 -0.11 0.31 -0.76 0.00 0.00 0.00 175.10 174.58 3cfp s LEU 271 N 2.83 3.56 0.17 3.92 1.43 0.66 -4.84 118.68 126.41 3cfp s LEU 271 Ca 0.43 -3.07 -0.33 0.00 -1.03 0.00 0.00 54.13 50.13 3cfp s LEU 271 Cb -0.16 -1.30 -0.13 0.00 0.03 0.00 0.00 46.19 44.63 3cfp s LEU 271 CO 0.09 -0.21 1.64 -0.67 0.23 0.00 0.00 176.35 177.44 3cfp n ASP 272 N 2.99 3.46 0.19 2.29 -0.08 -1.26 -4.29 116.55 119.84 3cfp n ASP 272 Ca 0.12 1.07 0.03 0.00 -1.51 0.00 0.00 54.79 54.50 3cfp n ASP 272 Cb 0.35 -1.48 0.36 0.00 2.34 0.00 0.00 41.12 42.69 3cfp n ASP 272 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 3cfp h TYR 273 N 6.35 0.00 -0.84 -0.67 5.03 -1.00 -1.36 116.97 124.48 3cfp h TYR 273 Ca -0.44 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 60.85 3cfp h TYR 273 Cb 1.23 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 39.47 3cfp h TYR 273 CO 0.64 0.37 0.48 0.97 -1.32 0.00 0.00 178.16 179.30 3cfp h ILE 274 N 0.00 1.24 -0.37 1.81 2.10 -1.90 0.24 117.51 120.64 3cfp h ILE 274 Ca -0.00 -0.58 -0.13 0.00 1.08 0.00 0.00 64.86 65.23 3cfp h ILE 274 Cb 0.68 0.10 -0.01 0.00 -1.09 0.00 0.00 36.82 36.50 3cfp h ILE 274 CO 0.05 0.26 -0.26 0.44 -1.08 0.00 0.00 178.15 177.56 3cfp h ASP 275 N 1.16 0.86 -0.42 2.19 3.32 -1.73 0.94 116.42 122.75 3cfp h ASP 275 Ca 0.30 -0.44 0.07 0.00 0.02 0.00 0.00 57.03 56.98 3cfp h ASP 275 Cb 0.00 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.25 3cfp h ASP 275 CO -0.05 1.12 0.05 -0.07 -1.72 0.00 0.00 179.24 178.57 3cfp h LEU 276 N 0.62 -0.07 -0.18 1.55 3.38 -0.92 -1.42 115.31 118.27 3cfp h LEU 276 Ca 0.07 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3cfp h LEU 276 Cb 0.83 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3cfp h LEU 276 CO 0.07 0.00 0.06 0.22 0.09 0.00 0.00 178.44 178.88 3cfp h TYR 277 N 0.17 0.28 -1.01 1.13 3.20 -0.24 0.42 116.97 120.93 3cfp h TYR 277 Ca 0.21 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.11 3cfp h TYR 277 Cb 0.28 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.40 3cfp h TYR 277 CO -0.24 0.38 0.65 0.87 -1.64 0.00 0.00 178.16 178.18 3cfp h LYS 278 N 0.11 1.17 -0.00 1.82 6.56 -0.71 -0.16 116.57 125.36 3cfp h LYS 278 Ca 0.06 -0.07 -0.04 0.00 -1.06 0.00 0.00 60.65 59.53 3cfp h LYS 278 Cb 0.23 -0.26 0.00 0.00 -0.57 0.00 0.00 32.23 31.62 3cfp h LYS 278 CO -0.00 0.77 -0.17 -0.22 -2.06 0.00 0.00 179.45 177.77 3cfp h LYS 279 N 1.21 0.12 0.00 3.15 3.64 -1.01 -3.41 116.57 120.27 3cfp h LYS 279 Ca 0.43 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.61 3cfp h LYS 279 Cb 0.13 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3cfp h LYS 279 CO -0.16 0.87 -2.01 1.19 -2.27 0.00 0.00 179.45 177.07 3cfp n PHE 280 N -4.57 0.00 0.18 1.91 0.99 0.12 -4.49 117.46 111.60 3cfp n PHE 280 Ca -0.10 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.39 3cfp n PHE 280 Cb 0.46 -0.56 0.35 0.00 -1.00 0.00 0.00 39.48 38.74 3cfp n PHE 280 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3cfp h SER 281 N 0.00 0.00 -5.94 4.37 4.64 -1.18 -3.48 113.55 111.97 3cfp h SER 281 Ca -0.10 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.81 3cfp h SER 281 Cb 1.18 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.37 3cfp h SER 281 CO 0.01 0.39 -0.72 0.49 -0.87 0.00 0.00 176.83 176.13 3cfp n PHE 282 N -3.89 -2.58 -4.40 4.77 3.72 -1.26 -5.03 117.46 108.79 3cfp n PHE 282 Ca -0.01 0.97 -0.26 0.00 -0.05 0.00 0.00 57.45 58.09 3cfp n PHE 282 Cb 0.45 -4.77 -0.12 0.00 -0.94 0.00 0.00 39.48 34.10 3cfp n PHE 282 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3cfp s THR 283 N -3.35 2.25 -0.27 4.37 -4.23 -1.26 -5.11 115.64 108.04 3cfp s THR 283 Ca 0.47 -1.96 0.03 0.00 -1.18 0.00 0.00 61.69 59.05 3cfp s THR 283 Cb -0.22 -2.05 0.06 0.00 1.34 0.00 0.00 72.50 71.64 3cfp s THR 283 CO 0.76 -0.11 -0.09 0.21 -0.54 0.00 0.00 174.62 174.85 3cfp s ASN 284 N -2.54 4.45 0.10 3.99 2.47 -1.26 -4.97 114.94 117.18 3cfp s ASN 284 Ca 0.18 -1.47 -0.05 0.00 0.42 0.00 0.00 52.86 51.95 3cfp s ASN 284 Cb -0.08 -1.54 -0.05 0.00 -1.45 0.00 0.00 41.25 38.13 3cfp s ASN 284 CO 0.09 -0.21 0.33 -1.10 -3.72 0.00 0.00 177.10 172.49 3cfp s GLN 285 N 1.09 3.59 0.43 0.43 -1.52 -1.26 -4.58 119.66 117.85 3cfp s GLN 285 Ca -0.07 -0.12 0.23 0.00 -1.95 0.00 0.00 55.36 53.45 3cfp s GLN 285 Cb -0.20 -2.93 0.87 0.00 -0.22 0.00 0.00 33.01 30.53 3cfp s GLN 285 CO -0.05 0.53 1.81 -1.35 -0.25 0.00 0.00 175.29 175.97 3cfp h PRO 286 N 3.12 0.00 -3.33 2.91 0.11 -2.00 -3.45 132.00 129.35 3cfp h PRO 286 Ca -0.47 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 3cfp h PRO 286 Cb 1.17 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.13 3cfp h PRO 286 CO 0.72 0.26 -0.15 -1.54 -0.21 0.00 0.00 178.00 177.07 3cfp s SER 287 N -6.25 -0.18 -0.18 -2.05 1.04 -1.26 -4.68 113.70 100.13 3cfp s SER 287 Ca 0.00 -0.25 0.16 0.00 0.48 0.00 0.00 55.95 56.34 3cfp s SER 287 Cb 0.10 0.42 0.44 0.00 0.10 0.00 0.00 66.02 67.09 3cfp s SER 287 CO 0.65 -0.74 1.18 -1.22 0.98 0.00 0.00 173.24 174.09 3cfp n TYR 288 N 0.13 0.82 -2.43 5.02 4.02 -1.26 -4.72 117.16 118.74 3cfp n TYR 288 Ca -0.17 -1.52 -0.34 0.00 -0.01 0.00 0.00 57.90 55.86 3cfp n TYR 288 Cb 0.62 -0.24 -0.02 0.00 -0.02 0.00 0.00 39.34 39.67 3cfp n TYR 288 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3cfp s SER 289 N -3.11 6.12 0.18 7.72 1.04 -1.26 -4.95 113.70 119.45 3cfp s SER 289 Ca 0.38 2.00 -0.10 0.00 0.48 0.00 0.00 55.95 58.71 3cfp s SER 289 Cb 0.38 -2.57 0.10 0.00 0.10 0.00 0.00 66.02 64.03 3cfp s SER 289 CO -0.06 -0.94 1.73 0.25 0.98 0.00 0.00 173.24 175.20 3cfp h LEU 290 N 1.40 0.93 -0.54 2.42 5.85 -1.98 -1.83 115.31 121.56 3cfp h LEU 290 Ca -0.50 -0.19 0.10 0.00 0.84 0.00 0.00 57.88 58.13 3cfp h LEU 290 Cb 1.23 -0.24 -0.11 0.00 0.37 0.00 0.00 40.66 41.91 3cfp h LEU 290 CO 0.58 0.88 -0.28 0.44 -0.34 0.00 0.00 178.44 179.72 3cfp h ASP 291 N 0.94 -0.98 -0.14 1.25 3.45 -1.92 1.12 116.42 120.14 3cfp h ASP 291 Ca 0.21 0.21 -0.00 0.00 0.43 0.00 0.00 57.03 57.88 3cfp h ASP 291 Cb 0.26 0.50 -0.01 0.00 -0.56 0.00 0.00 39.33 39.53 3cfp h ASP 291 CO -0.01 -0.28 0.08 0.22 -1.57 0.00 0.00 179.24 177.68 3cfp h TYR 292 N -0.15 0.18 -0.26 4.55 5.03 -1.81 0.83 116.97 125.35 3cfp h TYR 292 Ca 0.23 0.00 -0.15 0.00 2.58 0.00 0.00 58.73 61.39 3cfp h TYR 292 Cb 0.52 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.74 3cfp h TYR 292 CO -0.57 0.14 -0.44 0.82 -1.32 0.00 0.00 178.16 176.79 3cfp h ILE 293 N 0.16 1.30 -0.56 1.81 5.03 -0.87 -0.53 117.51 123.85 3cfp h ILE 293 Ca 0.05 -1.63 0.10 0.00 -0.12 0.00 0.00 64.86 63.26 3cfp h ILE 293 Cb 0.02 1.69 -0.08 0.00 -3.03 0.00 0.00 36.82 35.42 3cfp h ILE 293 CO -0.01 0.52 0.13 0.28 -0.68 0.00 0.00 178.15 178.39 3cfp h SER 294 N 0.51 0.03 0.16 1.72 0.02 0.14 0.18 113.55 116.31 3cfp h SER 294 Ca 0.02 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 3cfp h SER 294 Cb 1.04 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3cfp h SER 294 CO 0.10 0.03 -0.08 -0.08 -1.14 0.00 0.00 176.83 175.66 3cfp h GLU 295 N 0.27 -0.21 -0.88 3.45 4.81 -0.63 0.31 114.58 121.69 3cfp h GLU 295 Ca 0.29 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.61 3cfp h GLU 295 Cb 0.41 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.77 3cfp h GLU 295 CO -0.36 0.02 0.54 0.35 -0.73 0.00 0.00 179.01 178.83 3cfp h PHE 296 N -0.43 0.99 0.10 0.92 3.57 -0.78 0.62 116.94 121.93 3cfp h PHE 296 Ca -0.02 0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.23 3cfp h PHE 296 Cb 0.34 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.75 3cfp h PHE 296 CO -0.00 0.47 -1.44 0.93 -2.23 0.00 0.00 178.31 176.04 3cfp h GLU 297 N 0.95 0.21 -0.00 1.11 4.39 -0.50 -3.40 114.58 117.34 3cfp h GLU 297 Ca 0.40 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.73 3cfp h GLU 297 Cb 0.25 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3cfp h GLU 297 CO -0.20 1.18 -0.18 1.28 -1.16 0.00 0.00 179.01 179.92 3cfp n LEU 298 N -3.94 0.81 -2.87 1.33 4.77 0.11 -4.99 117.00 112.21 3cfp n LEU 298 Ca -0.26 -0.70 -0.21 0.00 -0.03 0.00 0.00 56.01 54.82 3cfp n LEU 298 Cb 0.89 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.02 3cfp n LEU 298 CO 0.39 0.17 0.05 -3.20 -1.33 0.00 0.00 177.39 173.47 3cfp n ASN 299 N -0.54 -5.79 -4.83 -1.43 5.15 0.21 -4.97 115.26 103.05 3cfp n ASN 299 Ca 0.02 -0.31 -0.26 0.00 -0.60 0.00 0.00 54.58 53.43 3cfp n ASN 299 Cb 0.13 -4.56 -0.05 0.00 -0.53 0.00 0.00 39.78 34.77 3cfp n ASN 299 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3cfp s VAL 300 N -3.16 4.68 0.00 3.44 -7.23 -1.25 -5.00 120.40 111.88 3cfp s VAL 300 Ca 0.33 -1.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.50 3cfp s VAL 300 Cb -0.15 -3.40 0.00 0.00 0.56 0.00 0.00 36.38 33.39 3cfp s VAL 300 CO 0.41 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.70 3cfp n GLY 301 N -0.43 -2.25 0.03 2.32 0.00 -1.26 -3.74 105.19 99.85 3cfp n GLY 301 Ca -0.08 -1.28 0.11 0.00 0.00 0.00 0.00 46.02 44.77 3cfp n GLY 301 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3cfp n LYS 302 N 0.00 0.40 -2.68 1.61 4.81 -1.26 -4.70 118.16 116.34 3cfp n LYS 302 Ca 0.00 -0.06 -0.01 0.00 -0.87 0.00 0.00 58.31 57.37 3cfp n LYS 302 Cb 0.00 -1.57 0.00 0.00 0.02 0.00 0.00 35.03 33.48 3cfp n LYS 302 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3cfp n LEU 303 N -2.04 -5.78 -4.76 3.14 4.32 -1.26 -4.90 117.00 105.71 3cfp n LEU 303 Ca -0.00 -0.00 -0.39 0.00 -0.02 0.00 0.00 56.01 55.60 3cfp n LEU 303 Cb 0.47 -2.79 -0.06 0.00 -1.62 0.00 0.00 43.42 39.43 3cfp n LEU 303 CO 0.43 -0.97 0.65 -0.54 -1.22 0.00 0.00 177.39 175.73 3cfp s LYS 304 N -2.91 4.74 0.14 3.23 -0.14 -1.26 -5.07 119.74 118.47 3cfp s LYS 304 Ca 0.02 1.42 -0.07 0.00 -1.36 0.00 0.00 55.97 55.98 3cfp s LYS 304 Cb -0.01 -3.09 -0.01 0.00 -1.68 0.00 0.00 37.83 33.04 3cfp s LYS 304 CO 0.58 0.43 0.21 1.52 -0.76 0.00 0.00 175.35 177.32 3cfp s TYR 305 N -1.35 0.42 0.19 3.18 -0.85 -1.26 -5.16 117.35 112.51 3cfp s TYR 305 Ca 0.44 -0.81 -0.04 0.00 -0.52 0.00 0.00 57.07 56.14 3cfp s TYR 305 Cb -0.23 -0.14 -0.05 0.00 0.38 0.00 0.00 41.96 41.91 3cfp s TYR 305 CO 0.29 -0.63 0.42 -0.51 -1.52 0.00 0.00 175.55 173.60 3cfp s ASP 306 N -2.95 6.48 0.73 -0.18 1.01 -1.26 -4.98 116.67 115.51 3cfp s ASP 306 Ca 0.15 0.60 0.00 0.00 0.71 0.00 0.00 52.55 54.02 3cfp s ASP 306 Cb 0.05 -2.10 0.00 0.00 1.01 0.00 0.00 42.92 41.88 3cfp s ASP 306 CO -0.03 -0.02 0.00 0.61 0.21 0.00 0.00 175.17 175.95 3cfp n GLY 307 N -0.24 -1.30 3.86 0.21 0.00 -1.26 -4.85 105.19 101.62 3cfp n GLY 307 Ca -0.02 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 3cfp n GLY 307 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cfp s PRO 308 N -0.63 1.49 0.25 1.61 0.05 -1.26 -4.97 135.00 131.54 3cfp s PRO 308 Ca 0.00 0.10 0.13 0.00 0.05 0.00 0.00 61.00 61.28 3cfp s PRO 308 Cb 0.00 -1.90 0.16 0.00 0.05 0.00 0.00 34.50 32.82 3cfp s PRO 308 CO 0.00 -1.92 1.48 0.97 0.05 0.00 0.00 177.00 177.58 3cfp h ILE 309 N -1.29 1.19 0.00 0.56 -0.00 -1.99 -2.99 117.51 112.98 3cfp h ILE 309 Ca -0.47 -2.40 -0.01 0.00 -0.00 0.00 0.00 64.86 61.98 3cfp h ILE 309 Cb 1.32 2.40 -0.00 0.00 -0.00 0.00 0.00 36.82 40.54 3cfp h ILE 309 CO 0.61 0.62 -0.04 0.77 -0.00 0.00 0.00 178.15 180.11 3cfp h SER 310 N 0.00 0.00 -0.35 2.19 4.64 -1.94 -2.18 113.55 115.91 3cfp h SER 310 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3cfp h SER 310 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 3cfp h SER 310 CO 0.08 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 176.37 3cfp n LYS 311 N -3.29 2.32 -0.02 4.77 5.02 -1.13 -4.59 118.16 121.25 3cfp n LYS 311 Ca -0.01 -2.02 -0.16 0.00 -2.02 0.00 0.00 58.31 54.09 3cfp n LYS 311 Cb 0.20 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 33.76 3cfp n LYS 311 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3cfp h LEU 312 N 2.94 0.54 -1.05 -0.35 5.85 -1.35 -2.44 115.31 119.45 3cfp h LEU 312 Ca 0.00 -0.69 0.05 0.00 0.84 0.00 0.00 57.88 58.08 3cfp h LEU 312 Cb 0.78 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 3cfp h LEU 312 CO 0.00 1.16 0.63 -0.09 -0.34 0.00 0.00 178.44 179.80 3cfp h ARG 313 N -0.02 1.13 0.01 1.25 2.43 -1.81 0.11 114.38 117.48 3cfp h ARG 313 Ca -0.05 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3cfp h ARG 313 Cb 1.19 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 3cfp h ARG 313 CO 0.10 0.75 -0.00 1.05 -1.51 0.00 0.00 179.97 180.36 3cfp h GLU 314 N 1.17 -0.01 -0.20 0.20 4.11 -1.85 -2.37 114.58 115.63 3cfp h GLU 314 Ca 0.41 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.66 3cfp h GLU 314 Cb 0.12 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 3cfp h GLU 314 CO -0.15 0.70 -0.61 0.66 0.07 0.00 0.00 179.01 179.68 3cfp h SER 315 N -0.74 0.78 -1.62 3.06 4.64 -1.39 -3.40 113.55 114.87 3cfp h SER 315 Ca -0.00 -0.44 -0.43 0.00 -0.47 0.00 0.00 61.79 60.44 3cfp h SER 315 Cb 0.72 -0.22 -0.30 0.00 -0.31 0.00 0.00 62.40 62.28 3cfp h SER 315 CO 0.00 1.20 -0.84 -3.20 -0.87 0.00 0.00 176.83 173.12 3cfp n ASN 316 N -3.95 -1.29 -0.20 4.97 2.85 0.36 -4.98 115.26 113.02 3cfp n ASN 316 Ca -0.04 -2.72 0.03 0.00 -0.11 0.00 0.00 54.58 51.74 3cfp n ASN 316 Cb 0.65 0.27 0.30 0.00 1.24 0.00 0.00 39.78 42.23 3cfp n ASN 316 CO 0.00 0.00 0.00 -0.74 -2.11 0.00 0.00 177.26 174.41 3cfp h HIS 317 N 4.80 0.86 -0.29 1.20 -0.00 -1.46 -1.06 115.15 119.19 3cfp h HIS 317 Ca 0.11 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.56 3cfp h HIS 317 Cb 0.96 -0.29 -0.08 0.00 -0.00 0.00 0.00 27.41 28.00 3cfp h HIS 317 CO 0.22 0.50 -0.41 0.37 -0.00 0.00 0.00 177.93 178.60 3cfp h GLN 318 N 0.89 -0.37 -0.05 5.26 5.75 -1.89 -1.25 115.11 123.45 3cfp h GLN 318 Ca 0.29 0.03 -0.14 0.00 -0.15 0.00 0.00 58.65 58.68 3cfp h GLN 318 Cb 0.06 0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 3cfp h GLN 318 CO -0.08 -0.25 -0.62 -0.09 -2.65 0.00 0.00 178.83 175.13 3cfp h ARG 319 N -0.39 0.17 -0.44 1.69 2.43 -1.83 -2.81 114.38 113.20 3cfp h ARG 319 Ca 0.11 -0.12 0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3cfp h ARG 319 Cb 0.60 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.11 3cfp h ARG 319 CO -0.49 0.74 0.14 -0.92 -1.51 0.00 0.00 179.97 177.93 3cfp h TYR 320 N 0.12 0.25 -0.21 2.20 3.20 -0.57 -0.40 116.97 121.57 3cfp h TYR 320 Ca -0.01 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.75 3cfp h TYR 320 Cb 1.13 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.35 3cfp h TYR 320 CO 0.02 0.09 -0.39 0.82 -1.64 0.00 0.00 178.16 177.05 3cfp h ILE 321 N 0.31 1.32 -0.66 1.81 1.08 -1.21 -2.74 117.51 117.42 3cfp h ILE 321 Ca 0.21 -1.61 -0.02 0.00 -0.39 0.00 0.00 64.86 63.05 3cfp h ILE 321 Cb 0.21 1.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.76 3cfp h ILE 321 CO -0.22 0.50 0.34 0.28 -0.69 0.00 0.00 178.15 178.36 3cfp h SER 322 N 0.32 0.85 -0.32 1.72 0.02 -1.31 -1.22 113.55 113.61 3cfp h SER 322 Ca 0.01 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 3cfp h SER 322 Cb 0.99 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 3cfp h SER 322 CO 0.09 0.73 0.11 1.88 -1.14 0.00 0.00 176.83 178.50 3cfp h TYR 323 N 0.91 0.57 -0.56 3.45 0.99 -1.11 0.11 116.97 121.32 3cfp h TYR 323 Ca 0.23 -0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.84 3cfp h TYR 323 Cb 0.09 -0.17 -0.02 0.00 1.00 0.00 0.00 36.73 37.62 3cfp h TYR 323 CO -0.00 0.48 0.00 -0.97 -0.00 0.00 0.00 178.16 177.68 3cfp h ASN 324 N 0.56 0.98 -0.24 3.88 -0.73 -1.08 -1.26 115.58 117.69 3cfp h ASN 324 Ca 0.13 -0.31 -0.03 0.00 1.87 0.00 0.00 56.30 57.97 3cfp h ASN 324 Cb 0.19 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 3cfp h ASN 324 CO -0.01 1.04 0.03 0.40 -0.37 0.00 0.00 177.43 178.52 3cfp h ILE 325 N 0.88 1.24 -0.63 2.57 2.04 -0.52 -2.98 117.51 120.10 3cfp h ILE 325 Ca 0.16 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 3cfp h ILE 325 Cb 0.54 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 3cfp h ILE 325 CO 0.03 0.25 0.29 0.40 0.00 0.00 0.00 178.15 179.12 3cfp h ILE 326 N 0.19 1.21 -0.97 -0.67 2.04 -0.79 -1.86 117.51 116.66 3cfp h ILE 326 Ca 0.07 -0.62 0.01 0.00 1.00 0.00 0.00 64.86 65.33 3cfp h ILE 326 Cb 0.35 0.42 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 3cfp h ILE 326 CO 0.01 0.25 0.64 0.44 0.00 0.00 0.00 178.15 179.49 3cfp h ASP 327 N 0.90 1.11 -0.42 1.72 3.32 -1.13 0.13 116.42 122.05 3cfp h ASP 327 Ca 0.22 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 3cfp h ASP 327 Cb 0.12 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3cfp h ASP 327 CO -0.03 0.80 -0.13 0.58 -1.72 0.00 0.00 179.24 178.74 3cfp h VAL 328 N 1.31 1.28 -0.73 -1.35 2.07 -1.25 -2.99 116.25 114.58 3cfp h VAL 328 Ca 0.36 -1.25 -0.06 0.00 0.82 0.00 0.00 66.70 66.57 3cfp h VAL 328 Cb -0.14 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3cfp h VAL 328 CO -0.08 0.42 0.23 0.22 0.02 0.00 0.00 177.57 178.38 3cfp h TYR 329 N 0.65 1.17 -0.67 1.57 3.20 -0.65 -2.88 116.97 119.36 3cfp h TYR 329 Ca 0.10 -0.12 0.12 0.00 3.14 0.00 0.00 58.73 61.98 3cfp h TYR 329 Cb 0.67 -0.34 -0.09 0.00 1.54 0.00 0.00 36.73 38.52 3cfp h TYR 329 CO 0.05 0.93 0.23 0.00 -1.64 0.00 0.00 178.16 177.72 3cfp h ARG 330 N 1.07 0.36 -0.91 1.82 3.08 -0.63 0.24 114.38 119.41 3cfp h ARG 330 Ca 0.23 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 3cfp h ARG 330 Cb 0.31 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 3cfp h ARG 330 CO -0.01 0.24 0.57 0.28 -1.07 0.00 0.00 179.97 179.98 3cfp h VAL 331 N 0.38 1.25 -0.68 2.04 2.07 -1.44 0.19 116.25 120.05 3cfp h VAL 331 Ca 0.36 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.37 3cfp h VAL 331 Cb 0.52 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3cfp h VAL 331 CO -0.38 0.25 0.45 -0.07 0.02 0.00 0.00 177.57 177.84 3cfp h LEU 332 N 1.25 0.79 -0.41 2.57 4.07 -1.02 0.10 115.31 122.65 3cfp h LEU 332 Ca 0.33 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.25 3cfp h LEU 332 Cb -0.08 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.45 3cfp h LEU 332 CO -0.06 0.57 0.17 1.56 -1.08 0.00 0.00 178.44 179.60 3cfp h GLN 333 N 0.93 0.61 -0.32 1.13 4.20 0.49 0.48 115.11 122.62 3cfp h GLN 333 Ca 0.25 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.88 3cfp h GLN 333 Cb -0.10 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.55 3cfp h GLN 333 CO -0.05 0.57 0.15 0.82 -0.67 0.00 0.00 178.83 179.65 3cfp h ILE 334 N 0.53 0.97 -0.28 2.54 2.04 -0.40 -2.77 117.51 120.15 3cfp h ILE 334 Ca 0.14 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 3cfp h ILE 334 Cb 0.17 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 3cfp h ILE 334 CO -0.01 0.06 -0.00 -0.78 0.00 0.00 0.00 178.15 177.41 3cfp h ASP 335 N 0.32 0.39 0.17 1.72 3.58 -0.38 0.18 116.42 122.39 3cfp h ASP 335 Ca 0.14 -0.06 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 3cfp h ASP 335 Cb 0.06 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 3cfp h ASP 335 CO -0.10 0.45 -0.15 0.00 -2.88 0.00 0.00 179.24 176.57 3cfp h ALA 336 N 1.60 1.70 0.00 -0.78 0.00 -0.65 0.17 119.26 121.29 3cfp h ALA 336 Ca 0.09 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3cfp h ALA 336 Cb 0.27 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3cfp h ALA 336 CO 0.01 0.18 -0.34 -0.22 0.00 0.00 0.00 179.25 178.88 3cfp h LYS 337 N 0.00 0.00 0.00 0.00 3.64 -0.97 -3.41 116.57 115.83 3cfp h LYS 337 Ca -0.00 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.15 3cfp h LYS 337 Cb 0.27 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 3cfp h LYS 337 CO 0.02 0.73 -1.18 0.00 -2.27 0.00 0.00 179.45 176.75 3cfp h ARG 338 N -1.00 0.00 -3.15 1.90 2.47 -0.69 -3.36 114.38 110.55 3cfp h ARG 338 Ca -0.08 0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.34 3cfp h ARG 338 Cb 0.85 0.00 0.03 0.00 -1.65 0.00 0.00 29.97 29.20 3cfp h ARG 338 CO -0.05 0.85 -0.44 1.04 0.56 0.00 0.00 179.97 181.93 3cfp n GLN 339 N -3.26 -3.11 0.06 0.04 6.02 0.58 -4.78 117.38 112.93 3cfp n GLN 339 Ca -0.04 0.69 -0.08 0.00 -0.01 0.00 0.00 57.00 57.56 3cfp n GLN 339 Cb 0.96 -5.06 0.06 0.00 1.02 0.00 0.00 30.24 27.23 3cfp n GLN 339 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 3cfp h PHE 340 N -0.81 0.45 -0.22 1.08 0.04 -1.92 -1.66 116.94 113.91 3cfp h PHE 340 Ca -0.39 -0.19 -0.01 0.00 2.80 0.00 0.00 57.97 60.19 3cfp h PHE 340 Cb 1.27 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.34 3cfp h PHE 340 CO 0.39 0.92 0.11 0.82 -0.60 0.00 0.00 178.31 179.96 3cfp h ILE 341 N 0.23 1.12 -0.33 -0.55 1.08 -1.92 -1.46 117.51 115.69 3cfp h ILE 341 Ca -0.02 -0.34 0.07 0.00 -0.39 0.00 0.00 64.86 64.18 3cfp h ILE 341 Cb 1.25 0.95 -0.06 0.00 -3.07 0.00 0.00 36.82 35.89 3cfp h ILE 341 CO 0.11 0.12 -0.08 -1.13 -0.69 0.00 0.00 178.15 176.48 3cfp h ASN 342 N 0.23 -0.31 -0.49 1.72 -1.24 -1.91 -0.52 115.58 113.07 3cfp h ASN 342 Ca 0.08 0.10 0.07 0.00 0.71 0.00 0.00 56.30 57.25 3cfp h ASN 342 Cb 0.09 0.20 -0.06 0.00 0.73 0.00 0.00 38.32 39.28 3cfp h ASN 342 CO -0.01 -0.11 0.15 0.25 -1.29 0.00 0.00 177.43 176.42 3cfp h LEU 343 N -0.00 0.13 -1.03 0.34 6.46 -1.15 -0.56 115.31 119.49 3cfp h LEU 343 Ca 0.16 0.07 -0.08 0.00 -0.12 0.00 0.00 57.88 57.90 3cfp h LEU 343 Cb 0.24 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.22 3cfp h LEU 343 CO -0.34 0.10 -0.20 0.28 -0.62 0.00 0.00 178.44 177.66 3cfp h SER 344 N 0.32 0.45 0.10 1.25 0.02 -0.62 -1.62 113.55 113.45 3cfp h SER 344 Ca 0.24 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3cfp h SER 344 Cb 0.27 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.69 3cfp h SER 344 CO -0.26 0.67 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.98 3cfp h LEU 345 N 0.41 -0.11 -0.70 5.07 3.38 -0.43 -1.53 115.31 121.40 3cfp h LEU 345 Ca 0.07 -0.30 0.10 0.00 0.09 0.00 0.00 57.88 57.84 3cfp h LEU 345 Cb 0.59 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.25 3cfp h LEU 345 CO 0.04 0.25 -0.42 0.44 0.09 0.00 0.00 178.44 178.84 3cfp h ASP 346 N -0.49 -1.48 -0.09 -0.43 5.19 -0.75 -1.79 116.42 116.58 3cfp h ASP 346 Ca -0.01 0.26 -0.04 0.00 -0.62 0.00 0.00 57.03 56.62 3cfp h ASP 346 Cb 0.41 0.70 -0.00 0.00 0.18 0.00 0.00 39.33 40.62 3cfp h ASP 346 CO 0.02 -0.31 -0.10 0.24 -3.12 0.00 0.00 179.24 175.97 3cfp h MET 347 N -0.15 0.22 -0.47 3.56 2.86 -1.33 -0.66 114.93 118.96 3cfp h MET 347 Ca 0.22 -0.12 0.09 0.00 -2.06 0.00 0.00 59.70 57.84 3cfp h MET 347 Cb 0.56 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.13 3cfp h MET 347 CO -0.77 0.66 -0.14 0.78 1.06 0.00 0.00 176.91 178.50 3cfp h GLY 348 N -0.21 0.30 1.84 8.32 0.00 -1.09 -0.89 103.07 111.33 3cfp h GLY 348 Ca 0.01 0.18 -0.18 0.00 0.00 0.00 0.00 47.33 47.34 3cfp h GLY 348 CO 0.02 -0.19 -0.82 -0.97 0.00 0.00 0.00 176.54 174.59 3cfp h TYR 349 N -0.03 0.21 -0.85 5.60 0.05 -1.35 0.74 116.97 121.35 3cfp h TYR 349 Ca 0.23 -0.11 -0.01 0.00 0.05 0.00 0.00 58.73 58.89 3cfp h TYR 349 Cb 0.37 -0.03 -0.04 0.00 1.01 0.00 0.00 36.73 38.04 3cfp h TYR 349 CO -0.42 0.90 0.51 -0.92 -1.05 0.00 0.00 178.16 177.18 3cfp h TYR 350 N 0.09 1.12 0.00 4.88 3.20 -0.50 -2.97 116.97 122.79 3cfp h TYR 350 Ca -0.03 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.80 3cfp h TYR 350 Cb 1.42 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 3cfp h TYR 350 CO 0.02 0.75 -1.44 0.00 -1.64 0.00 0.00 178.16 175.85 3cfp n ALA 351 N -2.41 2.49 -2.60 1.82 0.00 -0.39 -4.98 120.51 114.43 3cfp n ALA 351 Ca 0.09 -0.42 -0.09 0.00 0.00 0.00 0.00 53.44 53.02 3cfp n ALA 351 Cb 0.07 -0.93 0.04 0.00 0.00 0.00 0.00 19.45 18.63 3cfp n ALA 351 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3cfp n LYS 352 N -2.58 -1.75 -4.49 0.00 5.02 0.17 -4.24 118.16 110.30 3cfp n LYS 352 Ca -0.04 0.52 -0.23 0.00 -2.02 0.00 0.00 58.31 56.54 3cfp n LYS 352 Cb 0.62 -4.19 -0.10 0.00 -0.02 0.00 0.00 35.03 31.35 3cfp n LYS 352 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3cfp s ILE 353 N -3.23 1.18 0.26 -0.18 -4.36 -0.68 -4.83 121.20 109.36 3cfp s ILE 353 Ca 0.24 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.32 3cfp s ILE 353 Cb -0.03 -2.73 -0.11 0.00 1.25 0.00 0.00 42.46 40.84 3cfp s ILE 353 CO 0.45 0.00 1.55 -1.10 0.24 0.00 0.00 174.94 176.08 3cfp s GLN 354 N -3.85 4.18 0.34 0.37 -0.21 -1.26 -4.71 119.66 114.52 3cfp s GLN 354 Ca 0.34 2.46 0.09 0.00 0.02 0.00 0.00 55.36 58.27 3cfp s GLN 354 Cb 0.08 -3.07 0.84 0.00 1.00 0.00 0.00 33.01 31.85 3cfp s GLN 354 CO 0.15 -0.57 1.81 0.82 -2.12 0.00 0.00 175.29 175.38 3cfp h ILE 355 N 3.55 0.71 0.00 1.08 1.08 -1.89 0.16 117.51 122.20 3cfp h ILE 355 Ca -0.46 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 63.78 3cfp h ILE 355 Cb 1.22 -0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.95 3cfp h ILE 355 CO 0.82 0.12 0.00 0.00 -0.69 0.00 0.00 178.15 178.40 3cfp n GLN 356 N -4.67 0.13 0.00 2.37 0.00 -1.26 -1.92 117.38 112.03 3cfp n GLN 356 Ca 0.22 0.43 0.12 0.00 0.00 0.00 0.00 57.00 57.77 3cfp n GLN 356 Cb 0.60 -1.78 0.62 0.00 0.00 0.00 0.00 30.24 29.67 3cfp n GLN 356 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3cfp n SER 357 N -2.03 0.00 0.32 2.61 7.64 0.55 -3.35 113.62 119.35 3cfp n SER 357 Ca 0.02 -0.19 0.20 0.00 1.01 0.00 0.00 58.87 59.90 3cfp n SER 357 Cb 0.16 -0.23 1.05 0.00 -1.01 0.00 0.00 64.21 64.18 3cfp n SER 357 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3cfp h VAL 358 N 0.00 0.17 0.00 0.44 -1.51 -1.54 -0.05 116.25 113.77 3cfp h VAL 358 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 3cfp h VAL 358 Cb 0.18 1.10 0.00 0.00 -2.13 0.00 0.00 31.29 30.43 3cfp h VAL 358 CO 0.00 0.01 0.00 0.49 -1.23 0.00 0.00 177.57 176.84 3cfp n PHE 359 N -3.30 0.00 -3.94 5.19 3.72 -1.21 -4.39 117.46 113.52 3cfp n PHE 359 Ca -0.02 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 3cfp n PHE 359 Cb 0.12 -0.32 -0.15 0.00 -0.94 0.00 0.00 39.48 38.19 3cfp n PHE 359 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3cfp s SER 360 N -2.64 4.54 0.46 4.37 0.15 -0.03 -4.97 113.70 115.57 3cfp s SER 360 Ca 0.10 -2.10 0.18 0.00 0.70 0.00 0.00 55.95 54.83 3cfp s SER 360 Cb 0.07 -1.43 1.14 0.00 -1.71 0.00 0.00 66.02 64.09 3cfp s SER 360 CO 0.17 -0.38 1.96 1.55 1.20 0.00 0.00 173.24 177.74 3cfp h PRO 361 N 7.64 0.29 -0.27 5.44 0.13 -1.81 -0.33 132.00 143.09 3cfp h PRO 361 Ca -0.06 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 3cfp h PRO 361 Cb 1.01 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 3cfp h PRO 361 CO 0.52 0.19 -0.27 0.82 -0.23 0.00 0.00 178.00 179.03 3cfp h ILE 362 N 0.30 1.31 -0.52 -3.56 2.04 -1.93 -1.71 117.51 113.43 3cfp h ILE 362 Ca 0.31 -1.44 -0.11 0.00 1.00 0.00 0.00 64.86 64.62 3cfp h ILE 362 Cb 0.80 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 3cfp h ILE 362 CO -0.07 0.46 -0.09 0.50 0.00 0.00 0.00 178.15 178.94 3cfp h LYS 363 N 0.39 0.96 -0.29 2.37 1.63 -1.76 -1.61 116.57 118.25 3cfp h LYS 363 Ca 0.04 -0.33 -0.01 0.00 -0.85 0.00 0.00 60.65 59.50 3cfp h LYS 363 Cb 0.84 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.39 3cfp h LYS 363 CO 0.07 1.00 0.14 1.15 -3.45 0.00 0.00 179.45 178.36 3cfp h THR 364 N 0.86 1.15 0.03 1.00 2.02 -1.04 -2.87 112.91 114.05 3cfp h THR 364 Ca 0.14 -0.43 -0.23 0.00 0.77 0.00 0.00 66.41 66.66 3cfp h THR 364 Cb 0.63 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 3cfp h THR 364 CO 0.04 0.15 -0.99 -0.50 0.37 0.00 0.00 175.52 174.60 3cfp h TRP 365 N 0.34 0.54 -0.72 3.16 4.06 -1.25 -2.23 115.95 119.86 3cfp h TRP 365 Ca 0.10 -0.31 0.11 0.00 2.06 0.00 0.00 58.89 60.85 3cfp h TRP 365 Cb 0.11 -0.05 -0.08 0.00 -1.00 0.00 0.00 29.16 28.14 3cfp h TRP 365 CO -0.02 1.15 0.32 0.22 -3.56 0.00 0.00 178.44 176.55 3cfp h ASP 366 N 0.18 0.37 -0.16 -3.49 3.58 -1.29 0.66 116.42 116.28 3cfp h ASP 366 Ca -0.08 0.08 -0.07 0.00 0.42 0.00 0.00 57.03 57.37 3cfp h ASP 366 Cb 1.64 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 42.71 3cfp h ASP 366 CO 0.17 0.19 -0.19 0.00 -2.88 0.00 0.00 179.24 176.53 3cfp h ALA 367 N 1.47 0.23 -0.32 -0.78 0.00 -1.41 0.32 119.26 118.77 3cfp h ALA 367 Ca 0.37 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3cfp h ALA 367 Cb 0.47 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3cfp h ALA 367 CO -0.32 0.16 0.16 0.82 0.00 0.00 0.00 179.25 180.06 3cfp h ILE 368 N 0.04 0.98 -0.44 0.00 2.04 -1.08 0.10 117.51 119.15 3cfp h ILE 368 Ca 0.02 -0.11 -0.14 0.00 1.00 0.00 0.00 64.86 65.63 3cfp h ILE 368 Cb 0.74 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3cfp h ILE 368 CO 0.05 0.06 -0.27 0.40 0.00 0.00 0.00 178.15 178.39 3cfp h ILE 369 N 0.33 1.27 0.39 -0.67 2.04 -0.85 -1.58 117.51 118.44 3cfp h ILE 369 Ca 0.13 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 64.55 3cfp h ILE 369 Cb 0.05 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3cfp h ILE 369 CO -0.10 0.49 -0.34 0.15 0.00 0.00 0.00 178.15 178.36 3cfp h PHE 370 N 0.81 -0.91 -0.88 1.37 -0.00 0.06 -1.18 116.94 116.21 3cfp h PHE 370 Ca 0.09 0.00 0.05 0.00 -0.00 0.00 0.00 57.97 58.11 3cfp h PHE 370 Cb 0.85 0.35 -0.06 0.00 -0.00 0.00 0.00 35.95 37.09 3cfp h PHE 370 CO 0.05 -0.49 0.56 -0.91 -0.00 0.00 0.00 178.31 177.52 3cfp h ASN 371 N -0.74 0.91 -0.55 0.41 2.35 -0.69 0.14 115.58 117.42 3cfp h ASN 371 Ca -0.03 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.75 3cfp h ASN 371 Cb 0.65 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 3cfp h ASN 371 CO -0.03 0.61 0.33 -1.28 -1.65 0.00 0.00 177.43 175.41 3cfp h SER 372 N 1.06 0.54 -0.42 5.81 0.87 -1.14 -2.17 113.55 118.10 3cfp h SER 372 Ca 0.36 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.84 3cfp h SER 372 Cb 0.07 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 3cfp h SER 372 CO -0.14 0.38 -0.06 -0.07 -0.53 0.00 0.00 176.83 176.41 3cfp h LEU 373 N 0.66 0.78 -1.49 2.23 4.07 -0.36 -3.02 115.31 118.17 3cfp h LEU 373 Ca 0.22 -0.34 0.08 0.00 0.08 0.00 0.00 57.88 57.91 3cfp h LEU 373 Cb 0.02 -0.21 -0.04 0.00 1.08 0.00 0.00 40.66 41.51 3cfp h LEU 373 CO -0.10 0.94 0.44 0.50 -1.08 0.00 0.00 178.44 179.14 3cfp h LYS 374 N 0.61 0.59 0.00 1.13 3.64 -0.34 -1.80 116.57 120.39 3cfp h LYS 374 Ca 0.11 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3cfp h LYS 374 Cb 0.58 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3cfp h LYS 374 CO 0.03 0.39 -0.02 0.93 -2.27 0.00 0.00 179.45 178.52 3cfp h GLU 375 N 0.61 0.00 -0.24 1.90 4.39 -1.27 -2.20 114.58 117.77 3cfp h GLU 375 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 3cfp h GLU 375 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3cfp h GLU 375 CO -0.09 0.02 0.00 1.04 -1.16 0.00 0.00 179.01 178.81 3cfp n GLN 376 N -3.22 2.74 -1.30 2.33 6.02 -0.72 -4.95 117.38 118.28 3cfp n GLN 376 Ca -0.02 -2.46 -0.10 0.00 -0.01 0.00 0.00 57.00 54.40 3cfp n GLN 376 Cb 0.15 -1.56 -0.04 0.00 1.02 0.00 0.00 30.24 29.81 3cfp n GLN 376 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3cfp n ASN 377 N -0.29 -4.97 -4.87 1.08 3.02 -0.83 -4.97 115.26 103.43 3cfp n ASN 377 Ca 0.16 0.25 -0.30 0.00 -0.03 0.00 0.00 54.58 54.66 3cfp n ASN 377 Cb 0.67 -3.37 0.00 0.00 -0.61 0.00 0.00 39.78 36.48 3cfp n ASN 377 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3cfp s LYS 378 N -2.68 3.62 -0.12 3.52 1.02 -0.93 -3.32 119.74 120.85 3cfp s LYS 378 Ca 0.00 0.66 0.03 0.00 0.02 0.00 0.00 55.97 56.68 3cfp s LYS 378 Cb 0.00 -2.14 0.01 0.00 -0.52 0.00 0.00 37.83 35.17 3cfp s LYS 378 CO 0.00 -0.47 -0.22 0.08 -0.92 0.00 0.00 175.35 173.82 3cfp s VAL 379 N -3.04 1.96 0.62 3.17 1.01 0.76 -4.25 120.40 120.63 3cfp s VAL 379 Ca 0.54 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 61.41 3cfp s VAL 379 Cb -0.11 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 3cfp s VAL 379 CO 0.50 0.53 1.11 0.27 0.00 0.00 0.00 175.10 177.51 3cfp s ILE 380 N 0.62 3.28 0.71 2.22 -4.36 -1.26 -3.07 121.20 119.34 3cfp s ILE 380 Ca -0.12 0.65 -0.11 0.00 -0.26 0.00 0.00 60.65 60.81 3cfp s ILE 380 Cb -0.17 -3.19 0.02 0.00 1.25 0.00 0.00 42.46 40.38 3cfp s ILE 380 CO 0.03 -0.31 1.07 -2.16 0.24 0.00 0.00 174.94 173.81 3cfp s PRO 381 N -3.85 2.83 0.30 0.37 0.04 -1.26 -2.60 135.00 130.83 3cfp s PRO 381 Ca 0.68 0.74 -0.29 0.00 0.04 0.00 0.00 61.00 62.17 3cfp s PRO 381 Cb -0.21 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.24 3cfp s PRO 381 CO 0.37 -1.12 1.13 -1.14 0.04 0.00 0.00 177.00 176.28 3cfp s GLN 382 N -5.16 4.55 -0.26 4.56 0.74 -1.26 -4.58 119.66 118.24 3cfp s GLN 382 Ca 0.58 1.86 -0.29 0.00 0.05 0.00 0.00 55.36 57.56 3cfp s GLN 382 Cb -0.13 -3.12 -0.01 0.00 1.10 0.00 0.00 33.01 30.85 3cfp s GLN 382 CO 0.54 0.11 1.35 0.20 -0.55 0.00 0.00 175.29 176.94 3cfp s GLY 383 N -0.86 1.40 0.51 2.59 0.00 -1.26 -5.01 107.32 104.70 3cfp s GLY 383 Ca 0.46 0.22 0.09 0.00 0.00 0.00 0.00 44.72 45.49 3cfp s GLY 383 CO 0.42 2.64 0.70 0.50 0.00 0.00 0.00 173.10 177.36 3cfp s ARG 384 N 4.14 2.53 0.10 2.90 0.52 -1.26 -5.11 118.95 122.77 3cfp s ARG 384 Ca 0.58 -1.45 0.04 0.00 -0.52 0.00 0.00 55.73 54.39 3cfp s ARG 384 Cb -0.19 -2.69 -0.04 0.00 0.52 0.00 0.00 34.95 32.55 3cfp s ARG 384 CO 0.23 -0.61 0.04 -1.54 0.02 0.00 0.00 175.30 173.43 3cfp s SER 385 N -4.53 5.21 0.02 0.23 1.04 -1.26 -4.89 113.70 109.52 3cfp s SER 385 Ca 0.59 -0.14 -0.07 0.00 0.48 0.00 0.00 55.95 56.81 3cfp s SER 385 Cb -0.08 -1.30 -0.00 0.00 0.10 0.00 0.00 66.02 64.74 3cfp s SER 385 CO 0.36 0.16 0.13 -1.00 0.98 0.00 0.00 173.24 173.87 3cfp s HIS 386 N -1.42 0.10 0.36 5.02 0.09 -1.26 -5.14 115.29 113.04 3cfp s HIS 386 Ca 0.28 -0.28 -0.26 0.00 -0.00 0.00 0.00 55.06 54.80 3cfp s HIS 386 Cb -0.11 -0.08 -0.09 0.00 -0.00 0.00 0.00 32.58 32.30 3cfp s HIS 386 CO 0.20 -0.34 1.04 -1.25 -0.00 0.00 0.00 174.74 174.40 3cfp s PRO 387 N -1.98 4.34 -0.18 8.40 0.04 -1.26 -4.96 135.00 139.40 3cfp s PRO 387 Ca -0.10 1.54 -0.29 0.00 0.04 0.00 0.00 61.00 62.19 3cfp s PRO 387 Cb -0.04 -2.73 -0.02 0.00 0.04 0.00 0.00 34.50 31.74 3cfp s PRO 387 CO -0.01 0.01 1.47 0.08 0.04 0.00 0.00 177.00 178.59 3cfp s VAL 388 N -1.54 3.91 -0.13 -0.36 1.01 -1.26 -4.99 120.40 117.04 3cfp s VAL 388 Ca 0.54 1.06 -0.00 0.00 0.00 0.00 0.00 61.98 63.57 3cfp s VAL 388 Cb -0.24 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 3cfp s VAL 388 CO 0.30 -0.23 -0.12 -1.10 0.00 0.00 0.00 175.10 173.95 3cfp s GLN 389 N 4.13 3.41 0.67 2.72 -0.21 -1.26 -5.12 119.66 124.00 3cfp s GLN 389 Ca 0.65 -0.67 -0.17 0.00 0.02 0.00 0.00 55.36 55.19 3cfp s GLN 389 Cb -0.24 -2.66 0.01 0.00 1.00 0.00 0.00 33.01 31.11 3cfp s GLN 389 CO 0.24 0.22 1.23 -2.14 -2.12 0.00 0.00 175.29 172.72 3cfp s PRO 390 N 0.35 2.47 0.09 2.91 0.02 -1.26 -5.06 135.00 134.52 3cfp s PRO 390 Ca -0.10 1.87 -0.10 0.00 0.02 0.00 0.00 61.00 62.68 3cfp s PRO 390 Cb -0.16 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.51 3cfp s PRO 390 CO 0.05 -1.61 0.24 1.52 -0.33 0.00 0.00 177.00 176.87 3cfp s TYR 391 N -1.71 0.06 0.43 6.54 1.13 -1.26 -5.15 117.35 117.39 3cfp s TYR 391 Ca 0.78 -0.43 -0.19 0.00 -1.41 0.00 0.00 57.07 55.81 3cfp s TYR 391 Cb -0.32 0.01 -0.10 0.00 -1.10 0.00 0.00 41.96 40.45 3cfp s TYR 391 CO 0.41 -0.56 0.92 -1.25 -2.51 0.00 0.00 175.55 172.55 3cfp s PRO 392 N -3.65 4.12 0.00 -3.49 0.04 -1.26 -5.04 135.00 125.72 3cfp s PRO 392 Ca 0.03 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.06 3cfp s PRO 392 Cb 0.03 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3cfp s PRO 392 CO -0.10 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.30 3cfp n GLY 393 N -0.81 1.65 3.93 0.56 0.00 -1.26 -4.79 105.19 104.46 3cfp n GLY 393 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 3cfp n GLY 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cfp s ALA 394 N -2.13 3.22 -0.09 4.61 0.00 -1.26 -4.57 121.76 121.53 3cfp s ALA 394 Ca 0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.10 3cfp s ALA 394 Cb 0.00 -2.60 -0.03 0.00 0.00 0.00 0.00 23.12 20.49 3cfp s ALA 394 CO 0.00 -1.13 -0.05 0.12 0.00 0.00 0.00 175.76 174.70 3cfp s PHE 395 N -3.16 3.01 -0.06 0.00 5.36 -1.26 -4.98 117.98 116.88 3cfp s PHE 395 Ca 0.58 -0.01 0.03 0.00 -0.96 0.00 0.00 56.93 56.57 3cfp s PHE 395 Cb -0.11 -1.78 0.01 0.00 -0.34 0.00 0.00 43.02 40.80 3cfp s PHE 395 CO 0.45 0.28 -0.14 0.08 -1.46 0.00 0.00 175.22 174.42 3cfp s VAL 396 N -0.57 1.29 0.21 3.12 1.01 -1.26 -1.28 120.40 122.92 3cfp s VAL 396 Ca 0.09 -0.59 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 3cfp s VAL 396 Cb -0.12 -1.15 -0.08 0.00 0.00 0.00 0.00 36.38 35.03 3cfp s VAL 396 CO 0.02 0.39 1.00 -0.75 0.00 0.00 0.00 175.10 175.75 3cfp s LYS 397 N 0.48 4.75 -0.40 2.72 2.20 -0.12 -5.00 119.74 124.37 3cfp s LYS 397 Ca -0.13 1.57 -0.29 0.00 -0.36 0.00 0.00 55.97 56.77 3cfp s LYS 397 Cb -0.15 -3.28 0.02 0.00 -1.51 0.00 0.00 37.83 32.91 3cfp s LYS 397 CO 0.04 0.33 1.11 -2.00 -0.36 0.00 0.00 175.35 174.47 3cfp s GLU 398 N -0.85 3.89 0.29 4.03 2.56 -1.26 -4.63 118.70 122.73 3cfp s GLU 398 Ca 0.44 0.82 -0.08 0.00 0.00 0.00 0.00 54.97 56.15 3cfp s GLU 398 Cb -0.27 -3.82 -0.06 0.00 2.00 0.00 0.00 34.13 31.97 3cfp s GLU 398 CO 0.34 -1.15 0.59 -1.25 -0.56 0.00 0.00 175.26 173.23 3cfp s PRO 399 N 4.06 3.73 -0.29 4.30 0.04 -1.26 -4.99 135.00 140.60 3cfp s PRO 399 Ca 0.47 0.21 -0.29 0.00 0.04 0.00 0.00 61.00 61.42 3cfp s PRO 399 Cb -0.10 -2.60 -0.00 0.00 0.04 0.00 0.00 34.50 31.84 3cfp s PRO 399 CO 0.24 0.21 1.35 0.42 0.04 0.00 0.00 177.00 179.25 3cfp s ILE 400 N -2.03 4.08 0.32 0.56 1.01 -1.26 -4.77 121.20 119.11 3cfp s ILE 400 Ca 0.47 1.21 -0.29 0.00 0.00 0.00 0.00 60.65 62.04 3cfp s ILE 400 Cb -0.11 -4.09 -0.11 0.00 0.01 0.00 0.00 42.46 38.17 3cfp s ILE 400 CO 0.26 -0.45 1.49 -2.84 0.00 0.00 0.00 174.94 173.41 3cfp s PRO 401 N 4.24 4.17 0.00 2.79 0.02 -1.26 -4.84 135.00 140.11 3cfp s PRO 401 Ca 0.58 2.49 0.00 0.00 0.02 0.00 0.00 61.00 64.09 3cfp s PRO 401 Cb -0.18 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.32 3cfp s PRO 401 CO 0.24 -0.51 0.00 -1.71 -0.33 0.00 0.00 177.00 174.69 3cfp n ASN 402 N 1.39 0.00 -4.85 2.53 5.15 -1.05 -4.97 115.26 113.45 3cfp n ASN 402 Ca 0.04 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.70 3cfp n ASN 402 Cb 0.39 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.62 3cfp n ASN 402 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3cfp s ARG 403 N -2.00 3.84 -0.04 1.20 1.70 -1.21 -1.26 118.95 121.18 3cfp s ARG 403 Ca 0.00 0.89 -0.02 0.00 -0.47 0.00 0.00 55.73 56.13 3cfp s ARG 403 Cb 0.00 -2.12 0.03 0.00 -0.57 0.00 0.00 34.95 32.29 3cfp s ARG 403 CO 0.00 -0.36 0.08 0.71 -1.08 0.00 0.00 175.30 174.65 3cfp s TYR 404 N -2.79 -0.04 -0.10 5.89 2.02 0.77 -4.91 117.35 118.19 3cfp s TYR 404 Ca 0.58 0.31 -0.12 0.00 -0.37 0.00 0.00 57.07 57.47 3cfp s TYR 404 Cb -0.10 -0.24 -0.09 0.00 -0.40 0.00 0.00 41.96 41.12 3cfp s TYR 404 CO 0.38 -0.15 0.37 -0.22 -1.57 0.00 0.00 175.55 174.37 3cfp h LYS 405 N 7.60 -0.08 -5.15 -0.62 3.64 -1.81 -1.43 116.57 118.73 3cfp h LYS 405 Ca -0.36 0.01 -0.67 0.00 -1.27 0.00 0.00 60.65 58.36 3cfp h LYS 405 Cb 1.13 0.02 -0.34 0.00 -0.41 0.00 0.00 32.23 32.62 3cfp h LYS 405 CO 0.37 0.24 -0.86 0.71 -2.27 0.00 0.00 179.45 177.63 3cfp s TYR 406 N -2.15 2.71 -0.01 1.91 1.51 -1.26 -4.08 117.35 115.98 3cfp s TYR 406 Ca -0.07 -1.45 0.04 0.00 -1.01 0.00 0.00 57.07 54.58 3cfp s TYR 406 Cb -0.01 -1.85 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 3cfp s TYR 406 CO 0.26 -0.68 -0.12 0.08 -1.11 0.00 0.00 175.55 173.98 3cfp s VAL 407 N 0.98 0.93 -0.06 0.71 1.01 -0.17 0.09 120.40 123.90 3cfp s VAL 407 Ca -0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 3cfp s VAL 407 Cb -0.15 -0.78 0.03 0.00 0.00 0.00 0.00 36.38 35.48 3cfp s VAL 407 CO -0.06 0.27 -0.01 -0.32 0.00 0.00 0.00 175.10 174.98 3cfp s MET 408 N -0.23 0.56 0.29 2.72 0.00 -0.34 -0.69 119.30 121.62 3cfp s MET 408 Ca 0.04 0.07 0.07 0.00 0.00 0.00 0.00 55.69 55.87 3cfp s MET 408 Cb -0.05 -0.83 -0.03 0.00 0.00 0.00 0.00 34.83 33.92 3cfp s MET 408 CO -0.00 -0.23 0.27 -1.54 0.00 0.00 0.00 175.02 173.52 3cfp s SER 409 N 1.58 5.58 -0.07 1.11 1.04 -0.61 -0.53 113.70 121.81 3cfp s SER 409 Ca -0.01 -0.29 -0.05 0.00 0.48 0.00 0.00 55.95 56.08 3cfp s SER 409 Cb -0.13 -1.30 0.03 0.00 0.10 0.00 0.00 66.02 64.72 3cfp s SER 409 CO -0.03 -0.18 0.18 -0.36 0.98 0.00 0.00 173.24 173.83 3cfp s PHE 410 N -2.18 -0.21 0.05 5.02 0.40 -0.21 -0.97 117.98 119.89 3cfp s PHE 410 Ca 0.37 0.54 0.04 0.00 -0.60 0.00 0.00 56.93 57.27 3cfp s PHE 410 Cb -0.07 0.03 -0.03 0.00 0.51 0.00 0.00 43.02 43.46 3cfp s PHE 410 CO 0.27 -0.14 -0.11 0.34 0.70 0.00 0.00 175.22 176.28 3cfp s ASP 411 N 0.56 1.25 -0.03 1.36 -1.08 -0.71 -0.95 116.67 117.08 3cfp s ASP 411 Ca -0.04 -0.57 -0.19 0.00 -0.52 0.00 0.00 52.55 51.23 3cfp s ASP 411 Cb -0.05 -0.01 -0.05 0.00 -1.46 0.00 0.00 42.92 41.35 3cfp s ASP 411 CO -0.03 -0.13 0.54 -0.76 0.52 0.00 0.00 175.17 175.31 3cfp s LEU 412 N -1.61 4.39 0.04 -1.34 1.43 -0.44 -2.28 118.68 118.87 3cfp s LEU 412 Ca -0.06 1.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.79 3cfp s LEU 412 Cb -0.10 -2.82 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 3cfp s LEU 412 CO 0.01 0.11 1.22 -0.89 0.23 0.00 0.00 176.35 177.04 3cfp s THR 413 N -0.14 4.01 -0.29 5.49 2.01 -0.83 -4.15 115.64 121.74 3cfp s THR 413 Ca 0.29 1.43 -0.02 0.00 0.31 0.00 0.00 61.69 63.69 3cfp s THR 413 Cb -0.17 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.43 3cfp s THR 413 CO 0.15 0.09 0.23 -1.20 -0.69 0.00 0.00 174.62 173.19 3cfp n SER 414 N 4.19 -1.81 0.41 3.53 7.64 -1.26 -4.62 113.62 121.69 3cfp n SER 414 Ca 0.10 -0.33 -0.16 0.00 1.01 0.00 0.00 58.87 59.49 3cfp n SER 414 Cb 0.46 -0.59 -0.08 0.00 -1.01 0.00 0.00 64.21 62.99 3cfp n SER 414 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3cfp h LEU 415 N 0.55 -0.88 -0.45 -3.43 5.85 -1.97 0.51 115.31 115.48 3cfp h LEU 415 Ca -0.24 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.54 3cfp h LEU 415 Cb 0.52 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 3cfp h LEU 415 CO 0.13 -0.58 0.24 1.88 -0.34 0.00 0.00 178.44 179.77 3cfp h TYR 416 N -1.15 0.44 -0.64 1.25 -1.99 -1.96 0.44 116.97 113.37 3cfp h TYR 416 Ca -0.11 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.61 3cfp h TYR 416 Cb 0.80 -0.14 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 3cfp h TYR 416 CO 0.03 0.24 0.27 -1.35 -0.00 0.00 0.00 178.16 177.34 3cfp h PRO 417 N 0.48 0.95 -0.84 4.88 0.11 -1.85 -1.36 132.00 134.36 3cfp h PRO 417 Ca 0.19 -0.17 0.09 0.00 0.11 0.00 0.00 66.00 66.22 3cfp h PRO 417 Cb 0.06 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 30.95 3cfp h PRO 417 CO -0.11 0.79 0.49 0.77 -0.21 0.00 0.00 178.00 179.73 3cfp h SER 418 N 0.90 0.72 -0.38 -2.05 0.02 0.14 0.38 113.55 113.27 3cfp h SER 418 Ca 0.22 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 3cfp h SER 418 Cb 0.19 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3cfp h SER 418 CO -0.02 0.42 0.22 0.40 -1.14 0.00 0.00 176.83 176.71 3cfp h ILE 419 N 0.84 1.14 -0.28 3.27 2.04 0.22 0.40 117.51 125.13 3cfp h ILE 419 Ca 0.40 -0.35 0.06 0.00 1.00 0.00 0.00 64.86 65.98 3cfp h ILE 419 Cb 0.34 0.68 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 3cfp h ILE 419 CO -0.23 0.14 -0.14 0.40 0.00 0.00 0.00 178.15 178.31 3cfp h ILE 420 N 0.49 0.56 -0.43 -0.67 2.04 -0.11 -0.38 117.51 119.01 3cfp h ILE 420 Ca 0.14 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.88 3cfp h ILE 420 Cb 0.04 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3cfp h ILE 420 CO -0.02 0.00 -0.16 0.03 0.00 0.00 0.00 178.15 178.00 3cfp h ARG 421 N -0.11 0.88 -0.63 2.37 3.08 -0.34 0.16 114.38 119.79 3cfp h ARG 421 Ca 0.15 -0.36 -0.09 0.00 0.07 0.00 0.00 59.98 59.74 3cfp h ARG 421 Cb 0.33 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 3cfp h ARG 421 CO -0.35 1.01 0.03 0.37 -1.07 0.00 0.00 179.97 179.96 3cfp h GLN 422 N 0.71 1.10 0.00 0.04 4.15 0.01 -3.17 115.11 117.95 3cfp h GLN 422 Ca 0.10 -0.33 -0.06 0.00 0.77 0.00 0.00 58.65 59.13 3cfp h GLN 422 Cb 0.72 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.29 3cfp h GLN 422 CO 0.05 1.04 -1.20 0.28 -1.93 0.00 0.00 178.83 177.08 3cfp n VAL 423 N -4.19 0.79 -2.50 2.39 0.31 -0.17 -1.21 118.33 113.76 3cfp n VAL 423 Ca 0.03 -0.60 -0.07 0.00 -0.01 0.00 0.00 64.34 63.70 3cfp n VAL 423 Cb 0.33 -0.46 0.04 0.00 -0.91 0.00 0.00 33.84 32.84 3cfp n VAL 423 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3cfp n ASN 424 N -2.73 -2.56 -4.65 4.52 5.15 0.51 -4.65 115.26 110.85 3cfp n ASN 424 Ca -0.04 -0.27 -0.41 0.00 -0.60 0.00 0.00 54.58 53.27 3cfp n ASN 424 Cb 0.65 -2.45 -0.06 0.00 -0.53 0.00 0.00 39.78 37.39 3cfp n ASN 424 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3cfp s ILE 425 N -3.15 4.97 -0.20 -1.44 1.01 -0.77 -4.78 121.20 116.84 3cfp s ILE 425 Ca 0.05 1.26 -0.29 0.00 0.00 0.00 0.00 60.65 61.68 3cfp s ILE 425 Cb -0.01 -3.98 0.13 0.00 0.01 0.00 0.00 42.46 38.61 3cfp s ILE 425 CO 0.31 0.05 1.04 -0.55 0.00 0.00 0.00 174.94 175.79 3cfp s SER 426 N 1.30 -0.36 0.56 3.58 0.15 -1.26 -4.17 113.70 113.49 3cfp s SER 426 Ca 0.30 0.48 0.31 0.00 0.70 0.00 0.00 55.95 57.73 3cfp s SER 426 Cb -0.16 0.41 1.46 0.00 -1.71 0.00 0.00 66.02 66.03 3cfp s SER 426 CO 0.10 -0.27 1.86 1.55 1.20 0.00 0.00 173.24 177.67 3cfp h PRO 427 N 2.93 0.00 -0.28 5.44 0.13 -1.95 -1.39 132.00 136.88 3cfp h PRO 427 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 3cfp h PRO 427 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3cfp h PRO 427 CO 0.25 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.17 3cfp n GLU 428 N -4.03 2.90 -0.01 0.86 0.00 -1.26 -4.33 120.64 114.76 3cfp n GLU 428 Ca 0.16 -2.59 0.05 0.00 0.00 0.00 0.00 57.16 54.78 3cfp n GLU 428 Cb 0.93 -1.66 0.05 0.00 0.00 0.00 0.00 31.44 30.75 3cfp n GLU 428 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3cfp n THR 429 N -0.22 0.06 -1.80 3.84 -2.24 -0.52 -4.95 114.28 108.45 3cfp n THR 429 Ca 0.18 -0.53 -0.42 0.00 -2.27 0.00 0.00 64.05 61.01 3cfp n THR 429 Cb 0.75 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 70.12 3cfp n THR 429 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3cfp s ILE 430 N -0.86 2.68 -0.09 2.28 1.01 -1.24 -1.24 121.20 123.73 3cfp s ILE 430 Ca 0.12 0.23 0.07 0.00 0.00 0.00 0.00 60.65 61.07 3cfp s ILE 430 Cb 0.09 -3.14 -0.11 0.00 0.01 0.00 0.00 42.46 39.31 3cfp s ILE 430 CO 0.13 0.00 0.01 0.00 0.00 0.00 0.00 174.94 175.08 3cfp n ALA 431 N 5.42 1.77 0.00 9.38 0.00 0.28 -4.84 120.51 132.52 3cfp n ALA 431 Ca 0.17 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 53.02 3cfp n ALA 431 Cb 0.39 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.92 3cfp n ALA 431 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cfp n GLY 432 N 2.52 -0.51 3.39 0.00 0.00 -1.13 -5.02 105.19 104.43 3cfp n GLY 432 Ca -0.16 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.69 3cfp n GLY 432 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3cfp s THR 433 N -3.05 0.99 0.18 2.61 -4.23 -1.26 -1.32 115.64 109.57 3cfp s THR 433 Ca 0.00 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.51 3cfp s THR 433 Cb 0.00 -2.65 -0.05 0.00 1.34 0.00 0.00 72.50 71.15 3cfp s THR 433 CO 0.00 -0.08 0.02 0.72 -0.54 0.00 0.00 174.62 174.74 3cfp s PHE 434 N -3.45 1.24 -0.16 3.99 -0.71 0.17 -4.87 117.98 114.19 3cfp s PHE 434 Ca 0.35 -1.06 -0.27 0.00 -1.04 0.00 0.00 56.93 54.91 3cfp s PHE 434 Cb 0.08 -0.71 -0.01 0.00 -1.21 0.00 0.00 43.02 41.17 3cfp s PHE 434 CO 0.13 -0.26 0.91 0.15 -1.34 0.00 0.00 175.22 174.82 3cfp s LYS 435 N -3.94 4.33 -0.09 1.99 1.02 -1.26 -4.66 119.74 117.13 3cfp s LYS 435 Ca 0.26 1.17 -0.24 0.00 0.02 0.00 0.00 55.97 57.19 3cfp s LYS 435 Cb 0.06 -3.57 -0.03 0.00 -0.52 0.00 0.00 37.83 33.77 3cfp s LYS 435 CO 0.05 -0.36 0.71 0.54 -0.92 0.00 0.00 175.35 175.38 3cfp s VAL 436 N 2.24 5.02 0.66 3.17 0.11 -1.26 -5.04 120.40 125.31 3cfp s VAL 436 Ca 0.42 1.45 -0.13 0.00 -2.93 0.00 0.00 61.98 60.80 3cfp s VAL 436 Cb -0.17 -4.05 -0.01 0.00 -1.53 0.00 0.00 36.38 30.63 3cfp s VAL 436 CO 0.13 0.21 1.06 0.00 -3.33 0.00 0.00 175.10 173.18 3cfp s ALA 437 N 1.05 2.66 0.58 1.54 0.00 -1.26 -5.01 121.76 121.33 3cfp s ALA 437 Ca 0.37 0.23 -0.19 0.00 0.00 0.00 0.00 51.96 52.38 3cfp s ALA 437 Cb -0.17 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 3cfp s ALA 437 CO 0.17 -1.11 0.84 -2.30 0.00 0.00 0.00 175.76 173.36 3cfp n PRO 438 N -2.71 0.81 -0.27 0.00 -0.02 -1.26 -4.85 135.00 126.71 3cfp n PRO 438 Ca 0.08 0.31 0.10 0.00 -2.02 0.00 0.00 63.50 61.98 3cfp n PRO 438 Cb 0.53 -2.02 0.35 0.00 -0.02 0.00 0.00 33.50 32.35 3cfp n PRO 438 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3cfp h LEU 439 N 0.49 0.70 -1.75 2.45 5.85 -1.95 -2.46 115.31 118.64 3cfp h LEU 439 Ca -0.47 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3cfp h LEU 439 Cb 1.37 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3cfp h LEU 439 CO 0.50 0.38 0.00 0.45 -0.34 0.00 0.00 178.44 179.43 3cfp h HIS 440 N 0.75 0.00 0.00 1.25 3.86 -2.00 -2.09 115.15 116.92 3cfp h HIS 440 Ca 0.43 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.48 3cfp h HIS 440 Cb 0.59 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.04 3cfp h HIS 440 CO -0.00 0.00 -0.74 -0.44 0.86 0.00 0.00 177.93 177.61 3cfp h ASP 441 N 0.00 0.00 -0.07 2.45 3.32 -1.79 -2.15 116.42 118.19 3cfp h ASP 441 Ca 0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.82 3cfp h ASP 441 Cb 0.26 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.82 3cfp h ASP 441 CO 0.00 0.74 -0.82 1.88 -1.72 0.00 0.00 179.24 179.32 3cfp h TYR 442 N 0.00 1.00 -0.71 4.55 0.05 -1.54 0.24 116.97 120.57 3cfp h TYR 442 Ca -0.01 -0.46 0.01 0.00 0.05 0.00 0.00 58.73 58.32 3cfp h TYR 442 Cb 1.37 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.93 3cfp h TYR 442 CO 0.00 1.29 0.46 0.82 -1.05 0.00 0.00 178.16 179.68 3cfp h ILE 443 N 0.49 1.18 -0.48 -2.88 2.04 -1.30 -2.97 117.51 113.60 3cfp h ILE 443 Ca -0.06 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3cfp h ILE 443 Cb 1.45 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3cfp h ILE 443 CO 0.16 0.18 0.00 0.59 0.00 0.00 0.00 178.15 179.08 3cfp n ASN 444 N -4.59 3.25 -2.69 1.72 3.02 -0.82 -4.63 115.26 110.52 3cfp n ASN 444 Ca 0.06 -1.96 -0.18 0.00 -0.03 0.00 0.00 54.58 52.47 3cfp n ASN 444 Cb 0.02 -0.31 0.05 0.00 -0.61 0.00 0.00 39.78 38.92 3cfp n ASN 444 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cfp n ALA 445 N 1.31 -0.90 -0.12 5.41 0.00 -0.97 -4.94 120.51 120.30 3cfp n ALA 445 Ca 0.20 0.28 -0.27 0.00 0.00 0.00 0.00 53.44 53.65 3cfp n ALA 445 Cb 0.55 -3.86 -0.11 0.00 0.00 0.00 0.00 19.45 16.04 3cfp n ALA 445 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3cfp n VAL 446 N -4.37 1.54 -1.74 0.00 0.31 0.75 -4.97 118.33 109.85 3cfp n VAL 446 Ca -0.04 -0.31 -0.42 0.00 -0.01 0.00 0.00 64.34 63.57 3cfp n VAL 446 Cb 0.57 -1.89 -0.00 0.00 -0.91 0.00 0.00 33.84 31.61 3cfp n VAL 446 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3cfp n ALA 447 N -3.90 1.81 -1.76 3.52 0.00 -0.57 -4.92 120.51 114.69 3cfp n ALA 447 Ca -0.47 0.34 -0.39 0.00 0.00 0.00 0.00 53.44 52.92 3cfp n ALA 447 Cb 0.84 -2.33 0.01 0.00 0.00 0.00 0.00 19.45 17.97 3cfp n ALA 447 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3cfp s GLU 448 N -2.04 3.59 -0.14 0.00 -1.05 -1.26 -4.87 118.70 112.92 3cfp s GLU 448 Ca 0.55 2.16 -0.39 0.00 -0.15 0.00 0.00 54.97 57.14 3cfp s GLU 448 Cb -0.52 -2.50 -0.16 0.00 -0.44 0.00 0.00 34.13 30.52 3cfp s GLU 448 CO 0.62 -0.81 1.58 -2.13 0.95 0.00 0.00 175.26 175.48 3cfp n ARG 449 N -0.45 1.10 -0.15 -4.83 0.63 -1.26 -4.88 116.66 106.82 3cfp n ARG 449 Ca 0.07 0.40 -0.10 0.00 -0.92 0.00 0.00 57.85 57.30 3cfp n ARG 449 Cb 0.45 -2.06 -0.01 0.00 0.45 0.00 0.00 32.46 31.29 3cfp n ARG 449 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 3cfp h PRO 450 N 6.11 0.77 -3.25 -0.14 0.11 -1.91 -3.46 132.00 130.23 3cfp h PRO 450 Ca -0.47 -0.23 -0.10 0.00 0.11 0.00 0.00 66.00 65.31 3cfp h PRO 450 Cb 1.33 -0.08 -0.17 0.00 0.11 0.00 0.00 31.00 32.19 3cfp h PRO 450 CO 0.89 0.82 -0.25 0.45 -0.21 0.00 0.00 178.00 179.69 3cfp s SER 451 N -6.23 -0.14 -0.01 -2.05 0.15 -1.26 -4.99 113.70 99.18 3cfp s SER 451 Ca -0.13 -0.14 0.16 0.00 0.70 0.00 0.00 55.95 56.55 3cfp s SER 451 Cb 0.11 0.35 -0.20 0.00 -1.71 0.00 0.00 66.02 64.57 3cfp s SER 451 CO 0.80 -0.58 0.59 -0.67 1.20 0.00 0.00 173.24 174.58 3cfp n ASP 452 N 0.71 0.88 -0.05 5.45 4.64 -1.26 -4.66 116.55 122.26 3cfp n ASP 452 Ca -0.19 -0.65 -0.09 0.00 -1.38 0.00 0.00 54.79 52.49 3cfp n ASP 452 Cb 0.59 1.20 -0.05 0.00 -1.04 0.00 0.00 41.12 41.82 3cfp n ASP 452 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 3cfp n VAL 453 N -1.56 0.62 -3.79 5.18 0.24 -1.26 -5.07 118.33 112.68 3cfp n VAL 453 Ca 0.01 -0.22 -0.22 0.00 -2.04 0.00 0.00 64.34 61.88 3cfp n VAL 453 Cb 0.30 -1.06 -0.04 0.00 -1.47 0.00 0.00 33.84 31.56 3cfp n VAL 453 CO 0.00 0.00 0.00 -0.31 -2.14 0.00 0.00 176.83 174.38 3cfp s TYR 454 N -2.21 2.73 -0.06 6.34 2.02 -1.26 -4.63 117.35 120.28 3cfp s TYR 454 Ca -0.15 -0.45 -0.18 0.00 -0.37 0.00 0.00 57.07 55.92 3cfp s TYR 454 Cb 0.04 -1.98 -0.05 0.00 -0.40 0.00 0.00 41.96 39.58 3cfp s TYR 454 CO 0.24 0.07 0.50 0.45 -1.57 0.00 0.00 175.55 175.23 3cfp s SER 455 N -4.02 6.80 0.09 2.29 0.15 0.69 -4.69 113.70 115.01 3cfp s SER 455 Ca 0.44 0.95 0.08 0.00 0.70 0.00 0.00 55.95 58.12 3cfp s SER 455 Cb -0.02 -2.30 -0.03 0.00 -1.71 0.00 0.00 66.02 61.95 3cfp s SER 455 CO 0.26 0.10 -0.21 0.00 1.20 0.00 0.00 173.24 174.59 3cfp s SER 457 N -1.75 4.04 0.00 0.00 0.15 -0.87 -4.88 113.70 110.39 3cfp s SER 457 Ca 0.07 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.44 3cfp s SER 457 Cb -0.10 -0.80 0.00 0.00 -1.71 0.00 0.00 66.02 63.42 3cfp s SER 457 CO 0.04 0.30 0.69 -0.81 1.20 0.00 0.00 173.24 174.66 3cfp n PRO 458 N 1.89 0.00 0.00 5.44 -0.04 -1.26 -0.91 135.00 140.12 3cfp n PRO 458 Ca -0.16 0.22 0.14 0.00 -0.04 0.00 0.00 63.50 63.66 3cfp n PRO 458 Cb 0.52 -1.52 0.68 0.00 -0.04 0.00 0.00 33.50 33.13 3cfp n PRO 458 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3cfp n ASN 459 N -1.19 0.13 0.00 3.54 6.94 -1.26 -4.86 115.26 118.55 3cfp n ASN 459 Ca 0.00 -0.12 0.00 0.00 -0.02 0.00 0.00 54.58 54.44 3cfp n ASN 459 Cb 0.02 -0.25 0.00 0.00 -2.36 0.00 0.00 39.78 37.19 3cfp n ASN 459 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3cfp n GLY 460 N 1.34 0.76 3.89 4.83 0.00 -0.09 -4.91 105.19 111.01 3cfp n GLY 460 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3cfp n GLY 460 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3cfp s MET 461 N -0.90 3.68 -0.02 1.61 -1.94 -1.23 -0.66 119.30 119.84 3cfp s MET 461 Ca 0.00 0.04 0.03 0.00 -1.71 0.00 0.00 55.69 54.05 3cfp s MET 461 Cb 0.00 -2.72 -0.00 0.00 2.01 0.00 0.00 34.83 34.12 3cfp s MET 461 CO 0.00 0.34 -0.11 -1.64 -0.01 0.00 0.00 175.02 173.60 3cfp s MET 462 N -3.02 1.07 0.05 2.03 -1.94 -0.43 -2.05 119.30 115.01 3cfp s MET 462 Ca 0.44 -0.39 0.06 0.00 -1.71 0.00 0.00 55.69 54.09 3cfp s MET 462 Cb -0.11 -1.00 -0.02 0.00 2.01 0.00 0.00 34.83 35.71 3cfp s MET 462 CO 0.25 0.18 -0.16 0.71 -0.01 0.00 0.00 175.02 175.99 3cfp s TYR 463 N 0.00 1.41 0.31 -0.03 1.51 0.87 -0.56 117.35 120.86 3cfp s TYR 463 Ca -0.00 -0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 55.39 3cfp s TYR 463 Cb -0.07 -0.83 -0.12 0.00 -0.11 0.00 0.00 41.96 40.83 3cfp s TYR 463 CO 0.00 0.06 1.55 0.66 -1.11 0.00 0.00 175.55 176.72 3cfp n TYR 464 N 1.78 2.82 0.02 2.71 4.02 -0.37 -0.22 117.16 127.92 3cfp n TYR 464 Ca -0.18 0.32 -0.10 0.00 -0.01 0.00 0.00 57.90 57.93 3cfp n TYR 464 Cb 0.54 -2.57 -0.13 0.00 -0.02 0.00 0.00 39.34 37.16 3cfp n TYR 464 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 3cfp h LYS 465 N 4.25 0.05 0.06 -0.72 1.57 -1.92 -3.41 116.57 116.46 3cfp h LYS 465 Ca -0.48 -0.09 -0.24 0.00 -1.87 0.00 0.00 60.65 57.97 3cfp h LYS 465 Cb 1.23 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.58 3cfp h LYS 465 CO 0.75 0.77 -1.07 0.38 -0.57 0.00 0.00 179.45 179.71 3cfp h ASP 466 N 0.01 0.45 -2.90 0.86 2.03 -1.94 -3.47 116.42 111.46 3cfp h ASP 466 Ca -0.21 -0.41 -0.17 0.00 -0.73 0.00 0.00 57.03 55.52 3cfp h ASP 466 Cb 1.95 -0.14 0.06 0.00 -0.83 0.00 0.00 39.33 40.37 3cfp h ASP 466 CO 0.11 1.26 0.15 0.54 -1.03 0.00 0.00 179.24 180.26 3cfp n ARG 467 N -3.64 -0.39 -0.02 4.15 1.74 -1.26 -5.08 116.66 112.16 3cfp n ARG 467 Ca -0.07 -0.82 -0.03 0.00 -0.77 0.00 0.00 57.85 56.15 3cfp n ARG 467 Cb 0.92 -0.49 -0.01 0.00 -1.02 0.00 0.00 32.46 31.86 3cfp n ARG 467 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3cfp n ASP 468 N -3.28 1.15 -0.53 0.55 8.00 -1.26 -5.08 116.55 116.11 3cfp n ASP 468 Ca 0.06 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.74 3cfp n ASP 468 Cb 0.22 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 3cfp n ASP 468 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cfp n GLY 469 N 2.44 -3.74 0.31 0.44 0.00 -1.26 -4.51 105.19 98.87 3cfp n GLY 469 Ca -0.05 -0.78 0.04 0.00 0.00 0.00 0.00 46.02 45.23 3cfp n GLY 469 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3cfp h VAL 470 N 0.38 0.89 0.67 1.61 -1.51 -1.97 -2.11 116.25 114.21 3cfp h VAL 470 Ca 0.00 -0.28 -0.03 0.00 -1.23 0.00 0.00 66.70 65.17 3cfp h VAL 470 Cb 0.00 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.18 3cfp h VAL 470 CO 0.00 0.15 -0.41 0.58 -1.23 0.00 0.00 177.57 176.65 3cfp h VAL 471 N 0.80 0.00 -0.50 7.19 2.07 -1.89 0.56 116.25 124.49 3cfp h VAL 471 Ca 0.42 0.00 0.10 0.00 0.82 0.00 0.00 66.70 68.03 3cfp h VAL 471 Cb 0.41 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.07 3cfp h VAL 471 CO -0.26 0.00 -0.28 -0.65 0.02 0.00 0.00 177.57 176.40 3cfp h PRO 472 N -1.01 -0.16 0.45 1.57 0.11 -1.71 0.28 132.00 131.54 3cfp h PRO 472 Ca -0.09 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 3cfp h PRO 472 Cb 0.81 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 3cfp h PRO 472 CO 0.09 -0.11 -0.47 1.15 -0.21 0.00 0.00 178.00 178.45 3cfp h THR 473 N -0.16 0.07 -0.35 -1.15 2.02 -1.04 -0.01 112.91 112.30 3cfp h THR 473 Ca 0.22 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.35 3cfp h THR 473 Cb 0.52 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3cfp h THR 473 CO -0.60 0.00 -0.01 -0.33 0.37 0.00 0.00 175.52 174.96 3cfp h GLU 474 N -0.93 0.55 -0.51 6.66 4.39 0.26 -2.95 114.58 122.04 3cfp h GLU 474 Ca -0.05 -0.12 -0.13 0.00 0.34 0.00 0.00 59.36 59.40 3cfp h GLU 474 Cb 0.82 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 3cfp h GLU 474 CO -0.08 0.58 -0.18 0.97 -1.16 0.00 0.00 179.01 179.14 3cfp h ILE 475 N 0.52 1.27 -0.92 3.13 2.10 -0.07 -2.97 117.51 120.57 3cfp h ILE 475 Ca 0.11 -1.35 0.06 0.00 1.08 0.00 0.00 64.86 64.76 3cfp h ILE 475 Cb 0.35 1.06 -0.06 0.00 -1.09 0.00 0.00 36.82 37.08 3cfp h ILE 475 CO 0.01 0.47 0.60 0.74 -1.08 0.00 0.00 178.15 178.89 3cfp h THR 476 N 0.89 1.08 0.51 2.19 2.02 -0.84 -0.60 112.91 118.16 3cfp h THR 476 Ca 0.12 -0.36 -0.03 0.00 0.77 0.00 0.00 66.41 66.91 3cfp h THR 476 Cb 0.76 -0.08 0.01 0.00 -1.74 0.00 0.00 68.15 67.10 3cfp h THR 476 CO 0.06 0.19 -0.25 0.11 0.37 0.00 0.00 175.52 176.01 3cfp h LYS 477 N 1.06 -0.66 -0.15 6.66 1.57 -1.40 -1.18 116.57 122.47 3cfp h LYS 477 Ca 0.39 0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 59.15 3cfp h LYS 477 Cb 0.17 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 3cfp h LYS 477 CO -0.15 -0.40 -0.22 0.28 -0.57 0.00 0.00 179.45 178.39 3cfp h VAL 478 N -0.78 1.23 -0.58 0.50 2.07 -1.44 -1.62 116.25 115.63 3cfp h VAL 478 Ca -0.07 -1.06 0.07 0.00 0.82 0.00 0.00 66.70 66.46 3cfp h VAL 478 Cb 0.57 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 3cfp h VAL 478 CO 0.12 0.33 0.25 0.15 0.02 0.00 0.00 177.57 178.43 3cfp h PHE 479 N 0.24 0.45 -0.69 1.57 3.57 -0.96 -0.41 116.94 120.71 3cfp h PHE 479 Ca 0.04 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3cfp h PHE 479 Cb 0.54 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 3cfp h PHE 479 CO 0.01 0.16 0.30 -0.91 -2.23 0.00 0.00 178.31 175.65 3cfp h ASN 480 N 0.46 0.92 -0.12 0.41 2.35 -0.23 0.24 115.58 119.62 3cfp h ASN 480 Ca 0.28 -0.12 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3cfp h ASN 480 Cb 0.28 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 3cfp h ASN 480 CO -0.24 0.80 0.07 1.56 -1.65 0.00 0.00 177.43 177.97 3cfp h GLN 481 N 0.99 0.16 -0.43 0.81 4.20 -1.26 -2.13 115.11 117.45 3cfp h GLN 481 Ca 0.24 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 59.02 3cfp h GLN 481 Cb 0.15 -0.03 -0.10 0.00 0.30 0.00 0.00 27.48 27.80 3cfp h GLN 481 CO -0.03 0.14 -0.31 -0.09 -0.67 0.00 0.00 178.83 177.88 3cfp h ARG 482 N 0.13 -0.21 -0.55 1.46 1.12 -0.16 -1.86 114.38 114.31 3cfp h ARG 482 Ca 0.04 0.01 0.04 0.00 -1.11 0.00 0.00 59.98 58.97 3cfp h ARG 482 Cb 0.02 0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 30.00 3cfp h ARG 482 CO -0.01 -0.14 0.36 -0.22 -3.11 0.00 0.00 179.97 176.85 3cfp h LYS 483 N -0.22 0.59 0.43 0.20 3.64 -0.81 -0.31 116.57 120.08 3cfp h LYS 483 Ca 0.19 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3cfp h LYS 483 Cb 0.53 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3cfp h LYS 483 CO -0.56 0.39 -0.20 1.49 -2.27 0.00 0.00 179.45 178.30 3cfp h GLU 484 N 0.61 -0.55 -0.01 1.90 4.81 -0.67 -2.04 114.58 118.63 3cfp h GLU 484 Ca 0.22 0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.40 3cfp h GLU 484 Cb 0.13 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3cfp h GLU 484 CO -0.06 -0.27 -0.45 0.45 -0.73 0.00 0.00 179.01 177.96 3cfp h HIS 485 N -0.79 0.01 -0.90 0.92 3.86 -1.24 -1.89 115.15 115.13 3cfp h HIS 485 Ca -0.06 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 3cfp h HIS 485 Cb 0.54 -0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.96 3cfp h HIS 485 CO -0.00 0.46 0.49 -0.22 0.86 0.00 0.00 177.93 179.52 3cfp h LYS 486 N 0.01 1.26 -0.50 2.45 3.64 -1.05 -0.35 116.57 122.03 3cfp h LYS 486 Ca -0.00 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 3cfp h LYS 486 Cb 0.80 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 3cfp h LYS 486 CO 0.06 0.92 0.27 0.78 -2.27 0.00 0.00 179.45 179.21 3cfp h GLY 487 N 1.26 0.76 0.95 5.01 0.00 -0.61 0.87 103.07 111.31 3cfp h GLY 487 Ca 0.32 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 3cfp h GLY 487 CO -0.05 0.34 0.17 -0.97 0.00 0.00 0.00 176.54 176.03 3cfp h TYR 488 N 0.67 0.63 0.40 5.60 0.05 -1.23 -2.35 116.97 120.73 3cfp h TYR 488 Ca 0.18 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.90 3cfp h TYR 488 Cb 0.07 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 3cfp h TYR 488 CO -0.01 0.55 -0.34 1.98 -1.05 0.00 0.00 178.16 179.28 3cfp h MET 489 N 0.52 -0.72 -0.56 4.88 4.05 -0.29 -1.33 114.93 121.49 3cfp h MET 489 Ca 0.14 0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.62 3cfp h MET 489 Cb 0.18 0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.12 3cfp h MET 489 CO -0.01 -0.48 0.36 -0.07 0.23 0.00 0.00 176.91 176.94 3cfp h LEU 490 N -0.74 0.61 -0.99 3.39 3.38 -0.82 -1.65 115.31 118.49 3cfp h LEU 490 Ca -0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3cfp h LEU 490 Cb 0.65 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3cfp h LEU 490 CO -0.03 0.44 0.28 0.00 0.09 0.00 0.00 178.44 179.22 3cfp h ALA 491 N 1.22 1.20 -0.61 1.53 0.00 -1.33 0.28 119.26 121.56 3cfp h ALA 491 Ca 0.21 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3cfp h ALA 491 Cb -0.05 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3cfp h ALA 491 CO -0.07 0.59 0.21 0.00 0.00 0.00 0.00 179.25 179.98 3cfp h ALA 492 N 1.32 1.22 -0.14 0.00 0.00 -0.62 0.80 119.26 121.84 3cfp h ALA 492 Ca 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3cfp h ALA 492 Cb 0.18 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3cfp h ALA 492 CO -0.02 0.56 0.03 0.37 0.00 0.00 0.00 179.25 180.18 3cfp h GLN 493 N 0.89 0.23 -0.39 0.00 4.15 -0.44 -0.37 115.11 119.18 3cfp h GLN 493 Ca 0.21 -0.06 0.04 0.00 0.77 0.00 0.00 58.65 59.60 3cfp h GLN 493 Cb 0.22 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.85 3cfp h GLN 493 CO -0.01 0.41 0.17 0.00 -1.93 0.00 0.00 178.83 177.47 3cfp h ARG 494 N 0.02 0.35 0.09 1.69 3.08 -0.02 -1.51 114.38 118.09 3cfp h ARG 494 Ca 0.04 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.08 3cfp h ARG 494 Cb 0.29 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 3cfp h ARG 494 CO 0.00 0.23 -0.13 -0.91 -1.07 0.00 0.00 179.97 178.09 3cfp h ASN 495 N 0.36 -0.35 -1.06 7.04 2.35 -0.79 -2.00 115.58 121.14 3cfp h ASN 495 Ca 0.17 0.04 0.29 0.00 -0.55 0.00 0.00 56.30 56.26 3cfp h ASN 495 Cb 0.11 0.13 -0.06 0.00 0.05 0.00 0.00 38.32 38.55 3cfp h ASN 495 CO -0.14 -0.19 0.74 1.23 -1.65 0.00 0.00 177.43 177.41 3cfp h GLY 496 N -0.26 0.38 1.94 2.83 0.00 -0.60 0.17 103.07 107.52 3cfp h GLY 496 Ca 0.01 -0.07 -0.15 0.00 0.00 0.00 0.00 47.33 47.13 3cfp h GLY 496 CO -0.06 -0.04 -0.69 0.83 0.00 0.00 0.00 176.54 176.58 3cfp h GLU 497 N 0.13 0.06 -0.22 4.80 4.39 -0.53 -2.63 114.58 120.57 3cfp h GLU 497 Ca 0.53 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 60.03 3cfp h GLU 497 Cb 1.86 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.52 3cfp h GLU 497 CO -0.10 0.73 -0.51 0.82 -1.16 0.00 0.00 179.01 178.79 3cfp h ILE 498 N 0.04 1.31 -0.54 3.13 2.04 -0.43 -1.84 117.51 121.21 3cfp h ILE 498 Ca -0.01 -1.73 -0.09 0.00 1.00 0.00 0.00 64.86 64.03 3cfp h ILE 498 Cb 1.22 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.97 3cfp h ILE 498 CO 0.09 0.54 -0.03 0.40 0.00 0.00 0.00 178.15 179.16 3cfp h ILE 499 N 0.49 1.27 -0.43 -0.67 2.04 -1.31 -2.06 117.51 116.83 3cfp h ILE 499 Ca 0.02 -1.15 0.02 0.00 1.00 0.00 0.00 64.86 64.75 3cfp h ILE 499 Cb 1.05 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 3cfp h ILE 499 CO 0.10 0.41 0.24 0.11 0.00 0.00 0.00 178.15 179.01 3cfp h LYS 500 N 0.85 0.48 -0.92 2.37 1.57 -1.23 -2.20 116.57 117.48 3cfp h LYS 500 Ca 0.15 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.93 3cfp h LYS 500 Cb 0.57 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.72 3cfp h LYS 500 CO 0.03 0.32 0.60 0.93 -0.57 0.00 0.00 179.45 180.76 3cfp h GLU 501 N 0.49 1.13 0.00 3.15 4.39 -1.21 -2.48 114.58 120.05 3cfp h GLU 501 Ca 0.17 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 3cfp h GLU 501 Cb 0.03 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 3cfp h GLU 501 CO -0.09 0.75 -0.22 0.00 -1.16 0.00 0.00 179.01 178.28 3cfp h ALA 502 N 1.38 1.42 0.00 3.43 0.00 -0.87 -2.99 119.26 121.63 3cfp h ALA 502 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3cfp h ALA 502 Cb -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3cfp h ALA 502 CO -0.12 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.69 3cfp n LEU 503 N -3.97 0.11 -0.01 0.00 4.77 -0.87 -1.00 117.00 116.02 3cfp n LEU 503 Ca -0.02 -0.06 0.05 0.00 -0.03 0.00 0.00 56.01 55.95 3cfp n LEU 503 Cb 0.30 -0.06 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 3cfp n LEU 503 CO 0.35 0.03 -0.72 1.41 -1.33 0.00 0.00 177.39 177.13 3cfp n HIS 504 N -0.35 0.21 -2.23 -1.77 8.25 -1.13 -4.47 115.22 113.74 3cfp n HIS 504 Ca 0.00 0.07 -0.31 0.00 -0.26 0.00 0.00 57.72 57.21 3cfp n HIS 504 Cb 0.03 -0.73 0.02 0.00 1.12 0.00 0.00 29.99 30.42 3cfp n HIS 504 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3cfp n ASN 505 N -2.49 5.77 -4.71 0.41 0.23 -0.17 -5.06 115.26 109.24 3cfp n ASN 505 Ca -0.11 -3.76 -0.42 0.00 -0.53 0.00 0.00 54.58 49.75 3cfp n ASN 505 Cb 0.74 -0.68 -0.03 0.00 -2.08 0.00 0.00 39.78 37.73 3cfp n ASN 505 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 3cfp s PRO 506 N -3.73 4.25 0.10 -0.53 0.04 -1.24 -4.82 135.00 129.06 3cfp s PRO 506 Ca 0.50 2.27 -0.24 0.00 0.04 0.00 0.00 61.00 63.57 3cfp s PRO 506 Cb 0.42 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 31.66 3cfp s PRO 506 CO -0.25 -0.57 0.72 -0.80 0.04 0.00 0.00 177.00 176.14 3cfp s ASN 507 N 1.25 7.25 -0.71 6.66 0.02 -0.55 -4.82 114.94 124.05 3cfp s ASN 507 Ca 0.69 1.48 -0.26 0.00 -1.02 0.00 0.00 52.86 53.75 3cfp s ASN 507 Cb -0.41 -2.45 -0.01 0.00 0.02 0.00 0.00 41.25 38.40 3cfp s ASN 507 CO 0.31 0.16 1.69 -0.76 0.02 0.00 0.00 177.10 178.53 3cfp s LEU 508 N -0.78 3.25 -0.23 0.60 2.01 -1.26 -4.02 118.68 118.24 3cfp s LEU 508 Ca 0.35 -0.10 -0.27 0.00 0.01 0.00 0.00 54.13 54.12 3cfp s LEU 508 Cb -0.21 -2.54 0.12 0.00 0.01 0.00 0.00 46.19 43.56 3cfp s LEU 508 CO 0.23 -2.23 1.00 -0.55 1.01 0.00 0.00 176.35 175.81 3cfp s SER 509 N 6.75 -0.44 -0.34 2.29 0.15 -1.26 -5.07 113.70 115.79 3cfp s SER 509 Ca 0.58 0.72 -0.07 0.00 0.70 0.00 0.00 55.95 57.87 3cfp s SER 509 Cb -0.10 0.68 0.04 0.00 -1.71 0.00 0.00 66.02 64.93 3cfp s SER 509 CO 0.15 -0.24 0.11 -0.69 1.20 0.00 0.00 173.24 173.78 3cfp s VAL 510 N -0.28 3.89 0.34 4.45 1.01 -1.26 -4.66 120.40 123.89 3cfp s VAL 510 Ca 0.01 -1.06 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 3cfp s VAL 510 Cb -0.03 -3.18 0.01 0.00 0.00 0.00 0.00 36.38 33.18 3cfp s VAL 510 CO -0.03 -0.16 0.47 -0.90 0.00 0.00 0.00 175.10 174.48 3cfp n ASP 511 N 4.84 -1.31 -4.52 3.32 5.68 -1.26 -5.11 116.55 118.18 3cfp n ASP 511 Ca -0.13 -2.81 -0.30 0.00 -0.50 0.00 0.00 54.79 51.06 3cfp n ASP 511 Cb 0.45 2.45 -0.11 0.00 -1.14 0.00 0.00 41.12 42.77 3cfp n ASP 511 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 3cfp s GLU 512 N -2.76 1.96 0.54 0.11 -1.05 -1.26 -4.77 118.70 111.46 3cfp s GLU 512 Ca 0.28 -1.09 -0.21 0.00 -0.15 0.00 0.00 54.97 53.79 3cfp s GLU 512 Cb -0.01 -2.20 -0.06 0.00 -0.44 0.00 0.00 34.13 31.42 3cfp s GLU 512 CO 0.20 0.50 1.13 -0.35 0.95 0.00 0.00 175.26 177.68 3cfp n PRO 513 N 0.84 1.31 -2.17 -4.83 -0.04 -1.26 -4.93 135.00 123.93 3cfp n PRO 513 Ca -0.15 0.49 -0.40 0.00 -0.04 0.00 0.00 63.50 63.39 3cfp n PRO 513 Cb 0.52 -2.30 -0.02 0.00 -0.04 0.00 0.00 33.50 31.67 3cfp n PRO 513 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3cfp s LEU 514 N -2.22 4.42 -0.87 1.53 1.02 -1.26 -4.95 118.68 116.36 3cfp s LEU 514 Ca 0.71 2.62 -0.24 0.00 0.02 0.00 0.00 54.13 57.24 3cfp s LEU 514 Cb -0.45 -3.67 0.05 0.00 0.02 0.00 0.00 46.19 42.14 3cfp s LEU 514 CO 0.50 -0.50 1.33 -0.62 0.02 0.00 0.00 176.35 177.07 3cfp s ASP 515 N -0.58 6.34 0.07 2.29 3.68 -1.26 -4.97 116.67 122.24 3cfp s ASP 515 Ca 0.49 -1.02 0.01 0.00 2.13 0.00 0.00 52.55 54.16 3cfp s ASP 515 Cb -0.38 -2.55 -0.03 0.00 -1.45 0.00 0.00 42.92 38.51 3cfp s ASP 515 CO 0.51 -1.62 -0.06 0.68 0.13 0.00 0.00 175.17 174.80 3cfp s VAL 516 N 5.11 0.53 -0.39 1.11 -7.23 -1.26 -5.12 120.40 113.15 3cfp s VAL 516 Ca 0.39 -1.59 -0.17 0.00 -1.81 0.00 0.00 61.98 58.81 3cfp s VAL 516 Cb -0.05 -1.23 0.01 0.00 0.56 0.00 0.00 36.38 35.67 3cfp s VAL 516 CO 0.02 -0.72 0.41 -0.62 -0.31 0.00 0.00 175.10 173.88 3cfp s ASP 517 N -2.47 6.19 0.00 4.85 3.68 -1.26 -4.95 116.67 122.71 3cfp s ASP 517 Ca 0.03 -0.51 0.21 0.00 2.13 0.00 0.00 52.55 54.40 3cfp s ASP 517 Cb 0.00 -2.21 0.91 0.00 -1.45 0.00 0.00 42.92 40.17 3cfp s ASP 517 CO -0.04 -0.49 1.67 -1.22 0.13 0.00 0.00 175.17 175.22 3cfp n TYR 518 N 5.52 0.00 0.34 -5.34 4.02 -1.26 -3.01 117.16 117.42 3cfp n TYR 518 Ca -0.08 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.94 3cfp n TYR 518 Cb 0.48 -0.48 0.57 0.00 -0.02 0.00 0.00 39.34 39.89 3cfp n TYR 518 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3cfp h ARG 519 N 0.00 0.00 -6.68 -0.72 3.08 -1.91 -3.03 114.38 105.12 3cfp h ARG 519 Ca 0.00 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.36 3cfp h ARG 519 Cb 0.35 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 30.12 3cfp h ARG 519 CO 0.00 0.00 -0.88 -0.06 -1.07 0.00 0.00 179.97 177.96 3cfp s PHE 520 N -3.44 2.29 0.18 3.04 0.08 -1.17 -4.36 117.98 114.61 3cfp s PHE 520 Ca 0.02 -0.42 -0.33 0.00 0.12 0.00 0.00 56.93 56.33 3cfp s PHE 520 Cb 0.09 -1.40 -0.14 0.00 -0.57 0.00 0.00 43.02 41.00 3cfp s PHE 520 CO 0.39 0.09 1.44 -0.25 -0.10 0.00 0.00 175.22 176.78 3cfp n ASP 521 N 1.92 2.57 -4.70 1.36 8.00 -1.26 -4.85 116.55 119.59 3cfp n ASP 521 Ca -0.17 1.12 -0.43 0.00 0.71 0.00 0.00 54.79 56.02 3cfp n ASP 521 Cb 0.52 -1.37 -0.01 0.00 -0.02 0.00 0.00 41.12 40.24 3cfp n ASP 521 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3cfp n PHE 522 N 2.51 2.31 -1.88 1.24 3.72 -1.26 -4.99 117.46 119.11 3cfp n PHE 522 Ca 0.15 0.53 -0.31 0.00 -0.05 0.00 0.00 57.45 57.77 3cfp n PHE 522 Cb 0.28 -2.43 0.02 0.00 -0.94 0.00 0.00 39.48 36.41 3cfp n PHE 522 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3cfp s SER 523 N -0.21 5.91 0.26 4.37 1.04 -1.26 -4.88 113.70 118.93 3cfp s SER 523 Ca 0.57 1.30 -0.03 0.00 0.48 0.00 0.00 55.95 58.27 3cfp s SER 523 Cb -0.57 -2.24 0.41 0.00 0.10 0.00 0.00 66.02 63.72 3cfp s SER 523 CO 0.60 -1.06 1.84 0.44 0.98 0.00 0.00 173.24 176.04 3cfp h ASP 524 N -0.45 0.84 -0.34 7.02 3.45 -1.99 -0.37 116.42 124.57 3cfp h ASP 524 Ca -0.44 0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.03 3cfp h ASP 524 Cb 1.22 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.83 3cfp h ASP 524 CO 0.63 0.50 0.15 1.05 -1.57 0.00 0.00 179.24 180.00 3cfp h GLU 525 N 0.95 0.50 -0.38 3.56 9.09 -1.98 0.21 114.58 126.53 3cfp h GLU 525 Ca 0.42 -0.08 0.04 0.00 0.05 0.00 0.00 59.36 59.79 3cfp h GLU 525 Cb 0.30 -0.09 -0.04 0.00 -1.65 0.00 0.00 28.75 27.28 3cfp h GLU 525 CO -0.22 0.47 0.14 0.82 0.05 0.00 0.00 179.01 180.28 3cfp h ILE 526 N 0.41 0.90 -0.54 -1.06 2.04 -1.84 0.15 117.51 117.57 3cfp h ILE 526 Ca 0.12 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.91 3cfp h ILE 526 Cb 0.15 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 3cfp h ILE 526 CO -0.01 0.06 0.30 0.11 0.00 0.00 0.00 178.15 178.61 3cfp h LYS 527 N 0.31 0.57 -0.66 2.37 1.57 -0.57 -0.20 116.57 119.97 3cfp h LYS 527 Ca 0.17 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3cfp h LYS 527 Cb 0.14 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 3cfp h LYS 527 CO -0.17 0.38 0.29 1.49 -0.57 0.00 0.00 179.45 180.87 3cfp h GLU 528 N 0.59 0.96 0.00 3.15 4.81 -0.27 -2.21 114.58 121.60 3cfp h GLU 528 Ca 0.23 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3cfp h GLU 528 Cb 0.10 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 3cfp h GLU 528 CO -0.14 0.78 -0.08 0.87 -0.73 0.00 0.00 179.01 179.71 3cfp h LYS 529 N 0.91 0.00 -0.00 1.92 1.57 0.13 -3.29 116.57 117.82 3cfp h LYS 529 Ca 0.22 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.88 3cfp h LYS 529 Cb 0.15 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.47 3cfp h LYS 529 CO -0.02 0.08 -0.47 0.82 -0.57 0.00 0.00 179.45 179.29 3cfp h ILE 530 N 0.00 1.47 -0.84 1.86 2.04 -0.41 -3.32 117.51 118.31 3cfp h ILE 530 Ca -0.00 -2.02 0.10 0.00 1.00 0.00 0.00 64.86 63.93 3cfp h ILE 530 Cb 0.39 2.65 -0.06 0.00 -0.74 0.00 0.00 36.82 39.06 3cfp h ILE 530 CO 0.01 0.58 0.55 0.11 0.00 0.00 0.00 178.15 179.39 3cfp h LYS 531 N -0.25 0.79 0.00 2.37 6.56 -1.61 -1.25 116.57 123.18 3cfp h LYS 531 Ca -0.06 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.49 3cfp h LYS 531 Cb 1.19 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 32.68 3cfp h LYS 531 CO 0.09 0.52 0.00 1.63 -2.06 0.00 0.00 179.45 179.63 3cfp n LYS 532 N -4.52 0.07 -1.73 3.15 4.01 -1.25 -4.57 118.16 113.32 3cfp n LYS 532 Ca 0.14 0.11 -0.31 0.00 -0.51 0.00 0.00 58.31 57.74 3cfp n LYS 532 Cb 0.32 -1.50 0.05 0.00 -0.51 0.00 0.00 35.03 33.38 3cfp n LYS 532 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3cfp s LEU 533 N -2.91 3.00 0.56 -0.35 1.43 -0.47 -4.54 118.68 115.41 3cfp s LEU 533 Ca 0.13 1.39 -0.08 0.00 -1.03 0.00 0.00 54.13 54.53 3cfp s LEU 533 Cb 0.15 -4.24 -0.03 0.00 0.03 0.00 0.00 46.19 42.09 3cfp s LEU 533 CO 0.40 -1.35 0.92 -0.94 0.23 0.00 0.00 176.35 175.61 3cfp s SER 534 N -4.06 6.19 0.20 2.29 1.04 -1.26 -1.48 113.70 116.62 3cfp s SER 534 Ca 0.58 1.17 -0.12 0.00 0.48 0.00 0.00 55.95 58.06 3cfp s SER 534 Cb -0.12 -2.32 0.23 0.00 0.10 0.00 0.00 66.02 63.90 3cfp s SER 534 CO 0.54 -0.77 1.71 0.00 0.98 0.00 0.00 173.24 175.70 3cfp h ALA 535 N -0.10 0.61 -0.65 5.32 0.00 -1.88 0.34 119.26 122.91 3cfp h ALA 535 Ca -0.45 0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.66 3cfp h ALA 535 Cb 1.20 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 19.08 3cfp h ALA 535 CO 0.62 -0.31 0.29 -0.22 0.00 0.00 0.00 179.25 179.63 3cfp h LYS 536 N 0.24 0.50 0.01 0.00 3.64 -1.94 -0.67 116.57 118.35 3cfp h LYS 536 Ca 0.28 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.44 3cfp h LYS 536 Cb 0.39 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3cfp h LYS 536 CO -0.36 0.33 -0.89 0.77 -2.27 0.00 0.00 179.45 177.03 3cfp h SER 537 N 0.51 0.06 -0.32 4.20 0.02 -1.77 -3.08 113.55 113.16 3cfp h SER 537 Ca 0.32 -0.05 -0.14 0.00 -0.84 0.00 0.00 61.79 61.08 3cfp h SER 537 Cb 0.35 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 3cfp h SER 537 CO -0.27 0.91 -0.35 -0.07 -1.14 0.00 0.00 176.83 175.91 3cfp h LEU 538 N 0.02 0.87 -0.65 5.07 3.38 -0.42 -2.86 115.31 120.71 3cfp h LEU 538 Ca -0.02 -0.48 -0.09 0.00 0.09 0.00 0.00 57.88 57.39 3cfp h LEU 538 Cb 1.55 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 3cfp h LEU 538 CO 0.12 1.17 0.07 0.78 0.09 0.00 0.00 178.44 180.67 3cfp h ASN 539 N 0.59 1.06 -0.68 -0.43 -0.26 -1.20 0.18 115.58 114.84 3cfp h ASN 539 Ca 0.05 -0.27 0.06 0.00 -0.56 0.00 0.00 56.30 55.58 3cfp h ASN 539 Cb 0.94 -0.28 -0.06 0.00 -1.06 0.00 0.00 38.32 37.85 3cfp h ASN 539 CO 0.09 1.07 0.37 -0.33 -1.06 0.00 0.00 177.43 177.57 3cfp h GLU 540 N 1.02 0.66 -0.61 0.81 5.08 -1.57 -0.72 114.58 119.25 3cfp h GLU 540 Ca 0.19 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 3cfp h GLU 540 Cb 0.48 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 3cfp h GLU 540 CO 0.02 0.43 0.09 0.52 -1.00 0.00 0.00 179.01 179.07 3cfp h MET 541 N 0.68 1.01 0.41 2.33 2.86 -1.19 -1.55 114.93 119.48 3cfp h MET 541 Ca 0.31 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 3cfp h MET 541 Cb 0.22 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 3cfp h MET 541 CO -0.20 0.95 -0.29 1.25 1.06 0.00 0.00 176.91 179.68 3cfp h LEU 542 N 0.91 -0.75 -0.70 1.22 5.85 -0.51 0.28 115.31 121.60 3cfp h LEU 542 Ca 0.18 0.05 0.15 0.00 0.84 0.00 0.00 57.88 59.11 3cfp h LEU 542 Cb 0.44 0.23 -0.12 0.00 0.37 0.00 0.00 40.66 41.58 3cfp h LEU 542 CO 0.01 -0.45 0.01 0.15 -0.34 0.00 0.00 178.44 177.82 3cfp h PHE 543 N -0.69 -0.04 -0.30 1.25 3.57 -1.07 0.13 116.94 119.79 3cfp h PHE 543 Ca -0.04 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3cfp h PHE 543 Cb 0.59 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 3cfp h PHE 543 CO -0.12 -0.21 0.07 0.00 -2.23 0.00 0.00 178.31 175.82 3cfp h ARG 544 N 0.11 0.48 0.13 1.11 3.08 -0.73 -0.44 114.38 118.12 3cfp h ARG 544 Ca 0.38 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.33 3cfp h ARG 544 Cb 0.64 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 3cfp h ARG 544 CO -0.61 0.56 -0.37 0.00 -1.07 0.00 0.00 179.97 178.48 3cfp h ALA 545 N 0.91 -0.65 -0.76 0.04 0.00 0.76 0.95 119.26 120.51 3cfp h ALA 545 Ca 0.09 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.07 3cfp h ALA 545 Cb 0.29 0.61 -0.09 0.00 0.00 0.00 0.00 17.79 18.60 3cfp h ALA 545 CO 0.00 -0.92 0.34 1.96 0.00 0.00 0.00 179.25 180.63 3cfp h GLN 546 N -0.60 0.50 -0.74 0.00 4.20 -0.67 0.10 115.11 117.89 3cfp h GLN 546 Ca 0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3cfp h GLN 546 Cb 0.63 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 3cfp h GLN 546 CO -0.21 0.33 0.47 0.00 -0.67 0.00 0.00 178.83 178.75 3cfp h ARG 547 N 0.51 0.99 -0.39 1.46 2.47 -0.31 0.17 114.38 119.29 3cfp h ARG 547 Ca 0.41 -0.07 -0.04 0.00 -1.26 0.00 0.00 59.98 59.02 3cfp h ARG 547 Cb 0.57 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 3cfp h ARG 547 CO -0.36 0.67 0.09 1.15 0.56 0.00 0.00 179.97 182.07 3cfp h THR 548 N 1.01 1.23 0.19 2.04 2.02 0.87 -2.21 112.91 118.07 3cfp h THR 548 Ca 0.27 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3cfp h THR 548 Cb -0.08 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 3cfp h THR 548 CO -0.05 0.28 -0.09 -0.08 0.37 0.00 0.00 175.52 175.94 3cfp h GLU 549 N 0.49 -0.24 -0.45 6.66 4.81 0.16 -0.08 114.58 125.93 3cfp h GLU 549 Ca 0.12 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.46 3cfp h GLU 549 Cb 0.32 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.66 3cfp h GLU 549 CO 0.00 -0.08 -0.22 0.28 -0.73 0.00 0.00 179.01 178.26 3cfp h VAL 550 N -0.36 0.35 -0.51 0.32 2.07 -0.72 0.87 116.25 118.28 3cfp h VAL 550 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.59 3cfp h VAL 550 Cb 0.28 0.35 -0.08 0.00 -1.52 0.00 0.00 31.29 30.32 3cfp h VAL 550 CO 0.04 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.65 3cfp h ALA 551 N 1.14 0.49 -0.15 1.67 0.00 -1.16 0.17 119.26 121.42 3cfp h ALA 551 Ca 0.21 0.15 -0.12 0.00 0.00 0.00 0.00 54.91 55.15 3cfp h ALA 551 Cb 0.46 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3cfp h ALA 551 CO -0.53 -0.38 -0.42 0.78 0.00 0.00 0.00 179.25 178.70 3cfp h GLY 552 N 0.13 0.38 0.90 0.00 0.00 0.38 -2.42 103.07 102.44 3cfp h GLY 552 Ca 0.26 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3cfp h GLY 552 CO -0.41 0.34 -0.12 1.98 0.00 0.00 0.00 176.54 178.32 3cfp h MET 553 N 0.29 -0.28 -0.57 4.80 -1.53 0.21 -2.51 114.93 115.34 3cfp h MET 553 Ca 0.02 0.02 0.10 0.00 -3.44 0.00 0.00 59.70 56.40 3cfp h MET 553 Cb 0.86 0.06 -0.08 0.00 -0.55 0.00 0.00 31.60 31.90 3cfp h MET 553 CO 0.07 -0.19 0.15 1.15 0.14 0.00 0.00 176.91 178.23 3cfp h THR 554 N -0.29 0.70 -0.06 -0.77 2.02 -0.53 -0.08 112.91 113.89 3cfp h THR 554 Ca -0.01 -0.10 -0.10 0.00 0.77 0.00 0.00 66.41 66.97 3cfp h THR 554 Cb 0.26 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 3cfp h THR 554 CO -0.00 0.05 -0.42 0.00 0.37 0.00 0.00 175.52 175.52 3cfp h ALA 555 N 1.43 1.18 0.00 6.16 0.00 -1.32 -3.16 119.26 123.56 3cfp h ALA 555 Ca 0.29 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3cfp h ALA 555 Cb 0.40 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3cfp h ALA 555 CO -0.35 0.57 -0.81 0.37 0.00 0.00 0.00 179.25 179.03 3cfp h GLN 556 N 0.12 0.00 0.00 0.00 -0.00 -0.98 -3.12 115.11 111.13 3cfp h GLN 556 Ca 0.01 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.59 3cfp h GLN 556 Cb 0.79 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.26 3cfp h GLN 556 CO 0.06 0.75 -0.33 0.97 0.00 0.00 0.00 178.83 180.27 3cfp h ILE 557 N -1.00 1.10 0.00 2.39 2.10 -1.13 -0.67 117.51 120.31 3cfp h ILE 557 Ca -0.20 -1.19 -0.16 0.00 1.08 0.00 0.00 64.86 64.39 3cfp h ILE 557 Cb 1.01 1.67 -0.03 0.00 -1.09 0.00 0.00 36.82 38.39 3cfp h ILE 557 CO -0.12 0.33 -1.09 0.78 -1.08 0.00 0.00 178.15 176.97 3cfp h ASN 558 N 0.00 0.00 -0.13 2.19 2.35 -1.71 0.16 115.58 118.45 3cfp h ASN 558 Ca -0.00 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.67 3cfp h ASN 558 Cb 0.64 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.01 3cfp h ASN 558 CO 0.04 0.61 -0.23 0.03 -1.65 0.00 0.00 177.43 176.23 3cfp h ARG 559 N 0.00 0.39 -0.49 0.81 3.08 -1.38 -2.19 114.38 114.60 3cfp h ARG 559 Ca -0.10 -0.24 0.10 0.00 0.07 0.00 0.00 59.98 59.80 3cfp h ARG 559 Cb 1.56 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.53 3cfp h ARG 559 CO 0.06 0.83 -0.27 -0.22 -1.07 0.00 0.00 179.97 179.30 3cfp h LYS 560 N -0.01 -0.15 -0.54 0.04 3.64 -1.11 0.38 116.57 118.81 3cfp h LYS 560 Ca 0.01 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.51 3cfp h LYS 560 Cb 0.81 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.57 3cfp h LYS 560 CO 0.05 -0.10 -0.05 0.00 -2.27 0.00 0.00 179.45 177.08 3cfp h ALA 561 N 1.06 0.47 -0.49 5.00 0.00 -0.64 -0.08 119.26 124.59 3cfp h ALA 561 Ca 0.22 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 3cfp h ALA 561 Cb 0.51 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 3cfp h ALA 561 CO -0.59 -0.41 0.27 1.25 0.00 0.00 0.00 179.25 179.77 3cfp h LEU 562 N 0.07 0.61 -0.41 0.00 5.85 -0.57 -0.69 115.31 120.17 3cfp h LEU 562 Ca 0.27 -0.09 -0.16 0.00 0.84 0.00 0.00 57.88 58.74 3cfp h LEU 562 Cb 0.43 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3cfp h LEU 562 CO -0.50 0.52 -0.45 0.16 -0.34 0.00 0.00 178.44 177.84 3cfp h ILE 563 N 0.64 1.28 0.00 4.05 3.07 -0.42 -2.37 117.51 123.76 3cfp h ILE 563 Ca 0.17 -1.63 -0.02 0.00 1.55 0.00 0.00 64.86 64.93 3cfp h ILE 563 Cb 0.05 1.49 -0.00 0.00 -0.27 0.00 0.00 36.82 38.09 3cfp h ILE 563 CO -0.03 0.53 -0.10 0.78 -1.05 0.00 0.00 178.15 178.29 3cfp h ASN 564 N 0.68 0.00 0.28 2.16 -0.26 -0.90 -2.85 115.58 114.69 3cfp h ASN 564 Ca 0.04 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.60 3cfp h ASN 564 Cb 1.03 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.29 3cfp h ASN 564 CO 0.10 0.10 -0.74 1.23 -1.06 0.00 0.00 177.43 177.06 3cfp h GLY 565 N 0.50 0.43 0.79 2.83 0.00 -0.62 -2.48 103.07 104.51 3cfp h GLY 565 Ca -0.00 -0.62 0.04 0.00 0.00 0.00 0.00 47.33 46.75 3cfp h GLY 565 CO 0.01 0.55 0.38 -2.00 0.00 0.00 0.00 176.54 175.48 3cfp h LEU 566 N 0.26 0.59 -0.70 3.11 5.85 -1.22 0.50 115.31 123.70 3cfp h LEU 566 Ca -0.03 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 3cfp h LEU 566 Cb 1.32 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 3cfp h LEU 566 CO 0.13 0.40 0.33 0.00 -0.34 0.00 0.00 178.44 178.96 3cfp h ALA 567 N 1.30 0.91 -0.00 1.25 0.00 -1.45 -2.21 119.26 119.05 3cfp h ALA 567 Ca 0.27 -0.15 -0.19 0.00 0.00 0.00 0.00 54.91 54.84 3cfp h ALA 567 Cb 0.09 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3cfp h ALA 567 CO -0.14 0.48 -0.84 0.78 0.00 0.00 0.00 179.25 179.53 3cfp h GLY 568 N 0.98 0.19 0.85 0.00 0.00 -1.19 -3.17 103.07 100.74 3cfp h GLY 568 Ca 0.24 -0.33 0.12 0.00 0.00 0.00 0.00 47.33 47.36 3cfp h GLY 568 CO -0.03 0.29 0.46 0.00 0.00 0.00 0.00 176.54 177.27 3cfp h ALA 569 N 1.02 2.03 0.00 3.60 0.00 0.59 0.24 119.26 126.74 3cfp h ALA 569 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3cfp h ALA 569 Cb 1.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3cfp h ALA 569 CO 0.13 -0.20 0.08 -0.07 0.00 0.00 0.00 179.25 179.19 3cfp h LEU 570 N 0.45 0.00 -3.16 0.00 3.38 -1.43 -0.02 115.31 114.54 3cfp h LEU 570 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3cfp h LEU 570 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3cfp h LEU 570 CO -0.10 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.04 3cfp n GLY 571 N -1.19 4.04 3.31 0.83 0.00 0.83 -0.54 105.19 112.47 3cfp n GLY 571 Ca -0.02 -0.95 -0.35 0.00 0.00 0.00 0.00 46.02 44.69 3cfp n GLY 571 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3cfp s ASN 572 N -1.99 4.43 0.00 1.61 3.84 -0.02 -5.00 114.94 117.80 3cfp s ASN 572 Ca 0.37 -0.45 0.00 0.00 0.21 0.00 0.00 52.86 52.99 3cfp s ASN 572 Cb 0.29 -1.76 0.00 0.00 -0.55 0.00 0.00 41.25 39.24 3cfp s ASN 572 CO 0.08 -0.04 0.90 1.33 -2.79 0.00 0.00 177.10 176.58 3cfp n VAL 573 N 4.80 1.62 0.14 -5.21 0.24 -1.26 -1.10 118.33 117.56 3cfp n VAL 573 Ca -0.18 0.44 0.11 0.00 -2.04 0.00 0.00 64.34 62.67 3cfp n VAL 573 Cb 0.50 -1.44 -0.08 0.00 -1.47 0.00 0.00 33.84 31.35 3cfp n VAL 573 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 3cfp n TRP 574 N -1.40 0.37 -1.84 6.34 7.02 -1.26 -4.49 117.44 122.19 3cfp n TRP 574 Ca 0.00 0.11 -0.42 0.00 -1.02 0.00 0.00 57.50 56.17 3cfp n TRP 574 Cb 0.03 -0.63 -0.02 0.00 -2.42 0.00 0.00 31.31 28.27 3cfp n TRP 574 CO 0.00 0.00 0.00 0.12 -2.02 0.00 0.00 177.69 175.79 3cfp s PHE 575 N -3.40 2.84 0.47 -5.99 5.36 -0.26 -4.89 117.98 112.11 3cfp s PHE 575 Ca -0.03 0.79 0.20 0.00 -0.96 0.00 0.00 56.93 56.93 3cfp s PHE 575 Cb 0.13 -4.01 1.19 0.00 -0.34 0.00 0.00 43.02 39.99 3cfp s PHE 575 CO 0.85 -3.43 1.94 -0.09 -1.46 0.00 0.00 175.22 173.04 3cfp h ARG 576 N 5.16 0.25 -0.44 10.12 2.43 -1.91 -1.94 114.38 128.05 3cfp h ARG 576 Ca -0.46 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.57 3cfp h ARG 576 Cb 1.22 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 30.64 3cfp h ARG 576 CO 0.81 0.16 0.07 0.66 -1.51 0.00 0.00 179.97 180.16 3cfp n TYR 577 N -4.43 1.45 -1.49 2.20 4.02 -1.26 -4.81 117.16 112.84 3cfp n TYR 577 Ca 0.13 -1.21 -0.54 0.00 -0.01 0.00 0.00 57.90 56.27 3cfp n TYR 577 Cb 0.58 -0.49 -0.06 0.00 -0.02 0.00 0.00 39.34 39.36 3cfp n TYR 577 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 3cfp n TYR 578 N -0.63 0.45 -3.15 -0.72 4.19 -0.73 -4.79 117.16 111.78 3cfp n TYR 578 Ca 0.31 0.95 0.06 0.00 3.31 0.00 0.00 57.90 62.53 3cfp n TYR 578 Cb 1.09 -2.09 -0.00 0.00 0.49 0.00 0.00 39.34 38.83 3cfp n TYR 578 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 3cfp s ASP 579 N -0.28 -0.18 0.54 2.98 3.68 0.29 -5.03 116.67 118.68 3cfp s ASP 579 Ca 0.80 0.03 0.24 0.00 2.13 0.00 0.00 52.55 55.74 3cfp s ASP 579 Cb -1.09 1.12 1.53 0.00 -1.45 0.00 0.00 42.92 43.03 3cfp s ASP 579 CO 0.56 -0.03 2.17 -0.07 0.13 0.00 0.00 175.17 177.92 3cfp h LEU 580 N 7.18 0.00 -0.71 -1.34 4.07 -1.93 -0.33 115.31 122.25 3cfp h LEU 580 Ca -0.11 0.00 0.07 0.00 0.08 0.00 0.00 57.88 57.92 3cfp h LEU 580 Cb 1.17 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.85 3cfp h LEU 580 CO -0.15 0.04 0.40 0.03 -1.08 0.00 0.00 178.44 177.68 3cfp h ARG 581 N 0.00 0.69 0.08 1.13 3.08 -1.96 0.15 114.38 117.56 3cfp h ARG 581 Ca -0.00 -0.04 -0.21 0.00 0.07 0.00 0.00 59.98 59.80 3cfp h ARG 581 Cb 0.09 -0.16 0.02 0.00 0.08 0.00 0.00 29.97 30.00 3cfp h ARG 581 CO 0.01 0.46 -0.88 -0.91 -1.07 0.00 0.00 179.97 177.57 3cfp h ASN 582 N 0.71 0.63 -0.46 7.04 2.35 -1.46 -1.87 115.58 122.53 3cfp h ASN 582 Ca 0.32 -0.84 0.00 0.00 -0.55 0.00 0.00 56.30 55.24 3cfp h ASN 582 Cb 0.23 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3cfp h ASN 582 CO -0.20 1.41 0.29 0.00 -1.65 0.00 0.00 177.43 177.28 3cfp h ALA 583 N 0.24 0.59 -0.10 -0.83 0.00 -1.18 -1.84 119.26 116.13 3cfp h ALA 583 Ca -0.13 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 3cfp h ALA 583 Cb 1.62 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 3cfp h ALA 583 CO 0.17 0.05 -0.38 1.15 0.00 0.00 0.00 179.25 180.25 3cfp h THR 584 N 0.62 1.29 -0.51 0.00 2.02 -0.81 -2.22 112.91 113.30 3cfp h THR 584 Ca 0.17 -1.41 -0.04 0.00 0.77 0.00 0.00 66.41 65.89 3cfp h THR 584 Cb -0.04 1.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 3cfp h THR 584 CO -0.03 0.42 0.15 0.00 0.37 0.00 0.00 175.52 176.42 3cfp h ALA 585 N 1.45 1.30 0.37 6.16 0.00 -0.69 -1.21 119.26 126.63 3cfp h ALA 585 Ca 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3cfp h ALA 585 Cb 0.75 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3cfp h ALA 585 CO 0.06 0.50 -0.18 0.82 0.00 0.00 0.00 179.25 180.45 3cfp h ILE 586 N 0.75 0.00 -0.55 0.00 2.04 -0.80 -2.72 117.51 116.22 3cfp h ILE 586 Ca 0.17 -0.15 0.08 0.00 1.00 0.00 0.00 64.86 65.96 3cfp h ILE 586 Cb 0.24 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.26 3cfp h ILE 586 CO -0.01 0.00 0.20 0.71 0.00 0.00 0.00 178.15 179.05 3cfp h THR 587 N -0.66 0.80 -0.57 -0.27 1.35 -1.41 -1.36 112.91 110.80 3cfp h THR 587 Ca -0.05 -0.13 -0.06 0.00 -0.55 0.00 0.00 66.41 65.62 3cfp h THR 587 Cb 0.39 0.39 -0.02 0.00 -1.73 0.00 0.00 68.15 67.17 3cfp h THR 587 CO 0.08 0.07 0.13 0.74 -0.25 0.00 0.00 175.52 176.29 3cfp h THR 588 N 0.38 1.25 -0.90 6.82 2.02 -1.33 0.16 112.91 121.30 3cfp h THR 588 Ca 0.27 -0.92 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 3cfp h THR 588 Cb 0.31 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 3cfp h THR 588 CO -0.28 0.34 0.55 0.15 0.37 0.00 0.00 175.52 176.66 3cfp h PHE 589 N 0.83 1.18 0.15 3.16 3.04 -1.13 -1.68 116.94 122.49 3cfp h PHE 589 Ca 0.18 0.00 0.01 0.00 3.98 0.00 0.00 57.97 62.14 3cfp h PHE 589 Cb 0.37 -0.39 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 3cfp h PHE 589 CO 0.03 0.77 -0.20 0.78 -2.02 0.00 0.00 178.31 177.66 3cfp h GLY 590 N 1.25 -0.40 0.26 2.40 0.00 -0.11 0.46 103.07 106.92 3cfp h GLY 590 Ca 0.33 0.24 0.12 0.00 0.00 0.00 0.00 47.33 48.02 3cfp h GLY 590 CO -0.06 -0.19 0.31 1.46 0.00 0.00 0.00 176.54 178.05 3cfp h GLN 591 N -0.41 0.47 -0.20 4.80 4.20 -0.63 -1.55 115.11 121.80 3cfp h GLN 591 Ca 0.01 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 3cfp h GLN 591 Cb 0.41 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3cfp h GLN 591 CO -0.09 0.31 0.06 1.98 -0.67 0.00 0.00 178.83 180.43 3cfp h MET 592 N 0.48 0.30 -0.34 1.46 4.05 -1.02 -2.71 114.93 117.15 3cfp h MET 592 Ca 0.39 -0.06 0.06 0.00 -0.28 0.00 0.00 59.70 59.80 3cfp h MET 592 Cb 0.53 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.23 3cfp h MET 592 CO -0.36 0.40 -0.00 0.00 0.23 0.00 0.00 176.91 177.18 3cfp h ALA 593 N 0.89 0.30 0.42 0.39 0.00 -0.09 0.47 119.26 121.64 3cfp h ALA 593 Ca 0.06 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3cfp h ALA 593 Cb 0.22 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3cfp h ALA 593 CO -0.00 -0.40 -0.20 1.25 0.00 0.00 0.00 179.25 179.89 3cfp h LEU 594 N 0.09 -0.48 -0.97 0.00 7.12 -1.32 -1.90 115.31 117.85 3cfp h LEU 594 Ca 0.16 -0.00 -0.11 0.00 0.13 0.00 0.00 57.88 58.06 3cfp h LEU 594 Cb 0.22 0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 40.46 3cfp h LEU 594 CO -0.28 -0.32 -0.51 1.56 -0.13 0.00 0.00 178.44 178.77 3cfp h GLN 595 N -0.60 0.01 0.18 1.25 4.20 -1.28 -1.62 115.11 117.25 3cfp h GLN 595 Ca -0.06 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 3cfp h GLN 595 Cb 0.46 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 3cfp h GLN 595 CO 0.10 0.52 -0.10 2.35 -0.67 0.00 0.00 178.83 181.03 3cfp h TRP 596 N 0.01 -0.26 0.00 2.96 2.91 0.09 -1.86 115.95 119.80 3cfp h TRP 596 Ca -0.00 -0.00 -0.08 0.00 1.13 0.00 0.00 58.89 59.93 3cfp h TRP 596 Cb 0.91 0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.63 3cfp h TRP 596 CO 0.00 -0.16 -0.37 0.97 -1.03 0.00 0.00 178.44 177.86 3cfp h ILE 597 N -0.26 0.91 -0.76 2.65 6.09 -1.15 -0.98 117.51 124.01 3cfp h ILE 597 Ca -0.02 -1.46 0.01 0.00 -1.37 0.00 0.00 64.86 62.02 3cfp h ILE 597 Cb 0.21 1.88 -0.04 0.00 0.47 0.00 0.00 36.82 39.34 3cfp h ILE 597 CO 0.03 0.36 0.50 -0.08 -3.07 0.00 0.00 178.15 175.88 3cfp h GLU 598 N 0.00 0.98 0.39 2.19 4.81 -1.11 0.64 114.58 122.48 3cfp h GLU 598 Ca -0.00 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 3cfp h GLU 598 Cb 0.85 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.01 3cfp h GLU 598 CO 0.05 0.65 -0.19 -0.09 -0.73 0.00 0.00 179.01 178.70 3cfp h ARG 599 N 1.01 -0.51 -0.45 1.92 2.43 -0.43 -1.51 114.38 116.84 3cfp h ARG 599 Ca 0.28 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.52 3cfp h ARG 599 Cb -0.10 0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.53 3cfp h ARG 599 CO -0.07 -0.24 0.23 0.87 -1.51 0.00 0.00 179.97 179.26 3cfp h LYS 600 N -0.72 0.45 -0.09 0.20 1.79 -1.05 -0.10 116.57 117.06 3cfp h LYS 600 Ca -0.05 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.29 3cfp h LYS 600 Cb 0.51 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 3cfp h LYS 600 CO 0.09 0.30 -0.39 0.28 -1.08 0.00 0.00 179.45 178.65 3cfp h VAL 601 N 0.47 1.30 -0.31 0.50 2.07 0.27 0.12 116.25 120.67 3cfp h VAL 601 Ca 0.19 -1.45 -0.13 0.00 0.82 0.00 0.00 66.70 66.14 3cfp h VAL 601 Cb 0.08 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3cfp h VAL 601 CO -0.12 0.43 -0.33 0.78 0.02 0.00 0.00 177.57 178.35 3cfp h ASN 602 N 0.16 0.69 0.44 0.57 2.35 -0.98 -3.17 115.58 115.64 3cfp h ASN 602 Ca 0.02 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.47 3cfp h ASN 602 Cb 0.76 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.95 3cfp h ASN 602 CO 0.06 0.96 -0.21 -0.33 -1.65 0.00 0.00 177.43 176.26 3cfp h GLU 603 N 0.56 -0.57 -0.39 0.81 5.08 -0.04 -2.76 114.58 117.27 3cfp h GLU 603 Ca 0.06 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.53 3cfp h GLU 603 Cb 0.83 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 30.12 3cfp h GLU 603 CO 0.07 -0.26 -0.41 -0.92 -1.00 0.00 0.00 179.01 176.49 3cfp h TYR 604 N -0.91 -1.19 -0.50 4.33 5.03 -0.92 -2.25 116.97 120.56 3cfp h TYR 604 Ca -0.06 0.07 -0.07 0.00 2.58 0.00 0.00 58.73 61.25 3cfp h TYR 604 Cb 0.57 0.58 -0.02 0.00 1.55 0.00 0.00 36.73 39.40 3cfp h TYR 604 CO 0.01 -0.43 0.03 -0.07 -1.32 0.00 0.00 178.16 176.38 3cfp h LEU 605 N -0.32 0.78 -1.21 2.82 3.38 -1.62 0.90 115.31 120.04 3cfp h LEU 605 Ca 0.14 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3cfp h LEU 605 Cb 0.58 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3cfp h LEU 605 CO -0.56 0.83 0.32 0.78 0.09 0.00 0.00 178.44 179.89 3cfp h ASN 606 N 0.76 0.78 0.05 -0.43 2.35 -1.14 0.39 115.58 118.33 3cfp h ASN 606 Ca 0.15 -0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3cfp h ASN 606 Cb 0.43 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3cfp h ASN 606 CO 0.02 0.64 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.34 3cfp h GLU 607 N 0.87 -0.06 0.00 0.81 4.81 -0.93 -0.33 114.58 119.76 3cfp h GLU 607 Ca 0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 3cfp h GLU 607 Cb 0.06 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.45 3cfp h GLU 607 CO -0.03 0.40 0.00 0.28 -0.73 0.00 0.00 179.01 178.92 3cfp h VAL 608 N -0.54 0.00 -0.22 0.32 2.07 -0.26 0.89 116.25 118.51 3cfp h VAL 608 Ca -0.01 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.41 3cfp h VAL 608 Cb 0.48 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3cfp h VAL 608 CO 0.01 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.60 3cfp n GLY 610 N 0.04 0.67 3.61 0.00 0.00 0.30 -4.93 105.19 104.89 3cfp n GLY 610 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 3cfp n GLY 610 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3cfp s THR 611 N -0.36 2.23 -0.21 2.61 -1.32 -0.19 -4.84 115.64 113.55 3cfp s THR 611 Ca 0.00 0.07 -0.01 0.00 -1.21 0.00 0.00 61.69 60.54 3cfp s THR 611 Cb 0.00 -2.25 0.02 0.00 -1.51 0.00 0.00 72.50 68.76 3cfp s THR 611 CO 0.00 -0.10 -0.11 -1.61 -2.21 0.00 0.00 174.62 170.59 3cfp s GLU 612 N -4.66 3.00 -1.48 7.08 0.41 -1.26 -4.36 118.70 117.43 3cfp s GLU 612 Ca 0.66 -0.85 -0.13 0.00 -0.41 0.00 0.00 54.97 54.25 3cfp s GLU 612 Cb -0.22 -2.82 0.10 0.00 -1.78 0.00 0.00 34.13 29.41 3cfp s GLU 612 CO 0.60 -0.28 0.73 0.41 -0.49 0.00 0.00 175.26 176.23 3cfp n GLY 613 N 4.67 -0.48 3.87 -1.39 0.00 -1.26 -4.97 105.19 105.63 3cfp n GLY 613 Ca -0.19 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 3cfp n GLY 613 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cfp s GLU 614 N -6.42 3.80 -0.13 1.61 2.56 -1.26 -5.07 118.70 113.80 3cfp s GLU 614 Ca 0.57 0.46 -0.22 0.00 0.00 0.00 0.00 54.97 55.78 3cfp s GLU 614 Cb -0.30 -2.43 -0.03 0.00 2.00 0.00 0.00 34.13 33.38 3cfp s GLU 614 CO 0.70 0.02 0.64 0.00 -0.56 0.00 0.00 175.26 176.07 3cfp s ALA 615 N -2.27 3.44 -0.09 6.30 0.00 -1.26 -4.93 121.76 122.95 3cfp s ALA 615 Ca 0.51 -0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.39 3cfp s ALA 615 Cb -0.10 -2.92 -0.05 0.00 0.00 0.00 0.00 23.12 20.05 3cfp s ALA 615 CO 0.29 -0.27 -0.09 1.19 0.00 0.00 0.00 175.76 176.88 3cfp n PHE 616 N 4.27 0.00 -2.06 0.00 3.72 -1.26 -4.92 117.46 117.21 3cfp n PHE 616 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 3cfp n PHE 616 Cb 0.51 -0.33 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 3cfp n PHE 616 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3cfp s VAL 617 N -2.17 3.61 -0.18 -4.37 1.01 -1.26 0.49 120.40 117.53 3cfp s VAL 617 Ca -0.12 0.67 0.22 0.00 0.00 0.00 0.00 61.98 62.75 3cfp s VAL 617 Cb 0.04 -3.65 -0.32 0.00 0.00 0.00 0.00 36.38 32.45 3cfp s VAL 617 CO 0.18 -0.30 0.56 0.00 0.00 0.00 0.00 175.10 175.54 3cfp n LEU 618 N 8.86 0.17 -3.79 3.92 -0.00 -0.01 -4.96 117.00 121.18 3cfp n LEU 618 Ca 0.20 -0.07 -0.08 0.00 -0.00 0.00 0.00 56.01 56.06 3cfp n LEU 618 Cb 0.45 -0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.85 3cfp n LEU 618 CO 0.66 0.03 0.45 -0.47 -0.00 0.00 0.00 177.39 178.06 3cfp s TYR 619 N -3.44 -0.23 -0.30 1.47 6.14 -1.24 -4.41 117.35 115.34 3cfp s TYR 619 Ca -0.05 -0.19 -0.26 0.00 0.64 0.00 0.00 57.07 57.21 3cfp s TYR 619 Cb 0.14 0.67 0.19 0.00 0.42 0.00 0.00 41.96 43.39 3cfp s TYR 619 CO 0.90 -1.17 1.43 0.20 0.64 0.00 0.00 175.55 177.55 3cfp s GLY 620 N -2.90 0.30 -0.13 8.97 0.00 -1.26 -1.57 107.32 110.73 3cfp s GLY 620 Ca 0.10 3.36 -0.04 0.00 0.00 0.00 0.00 44.72 48.14 3cfp s GLY 620 CO 0.04 1.71 0.07 -0.35 0.00 0.00 0.00 173.10 174.56 3cfp s ASP 621 N -0.27 2.04 0.00 1.64 -1.08 -1.17 -0.94 116.67 116.89 3cfp s ASP 621 Ca 0.08 -0.41 0.00 0.00 -0.52 0.00 0.00 52.55 51.70 3cfp s ASP 621 Cb -0.04 -0.28 0.00 0.00 -1.46 0.00 0.00 42.92 41.14 3cfp s ASP 621 CO -0.14 -0.30 0.00 0.41 0.52 0.00 0.00 175.17 175.66 3cfp n THR 622 N 5.24 0.00 -2.18 1.71 -1.04 -0.41 -2.70 114.28 114.91 3cfp n THR 622 Ca -0.06 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 61.95 3cfp n THR 622 Cb 0.49 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.99 3cfp n THR 622 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 3cfp n ASP 623 N 1.79 0.13 -3.96 8.00 3.85 -1.26 -4.59 116.55 120.52 3cfp n ASP 623 Ca 0.00 -1.84 -0.13 0.00 -0.71 0.00 0.00 54.79 52.11 3cfp n ASP 623 Cb 0.00 -0.09 -0.13 0.00 -1.35 0.00 0.00 41.12 39.55 3cfp n ASP 623 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 3cfp s SER 624 N -1.19 0.46 0.04 -1.12 1.04 -1.10 -1.33 113.70 110.51 3cfp s SER 624 Ca 0.12 -0.21 0.09 0.00 0.48 0.00 0.00 55.95 56.42 3cfp s SER 624 Cb 0.14 -0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.22 3cfp s SER 624 CO -0.06 -0.05 -0.25 0.27 0.98 0.00 0.00 173.24 174.13 3cfp s ILE 625 N -0.51 1.99 -0.26 -1.02 -4.36 -0.12 -3.03 121.20 113.89 3cfp s ILE 625 Ca -0.03 -1.30 -0.03 0.00 -0.26 0.00 0.00 60.65 59.03 3cfp s ILE 625 Cb -0.04 -1.70 0.02 0.00 1.25 0.00 0.00 42.46 41.99 3cfp s ILE 625 CO -0.00 0.34 -0.02 -0.31 0.24 0.00 0.00 174.94 175.19 3cfp s TYR 626 N -0.78 3.08 -0.20 1.37 1.51 -0.61 -1.05 117.35 120.68 3cfp s TYR 626 Ca 0.10 -1.35 -0.08 0.00 -1.01 0.00 0.00 57.07 54.73 3cfp s TYR 626 Cb -0.10 -2.11 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 3cfp s TYR 626 CO 0.02 -0.67 0.09 0.08 -1.11 0.00 0.00 175.55 173.95 3cfp s VAL 627 N 1.38 4.92 -0.41 0.71 1.01 0.31 -0.83 120.40 127.50 3cfp s VAL 627 Ca 0.01 0.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.73 3cfp s VAL 627 Cb -0.17 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 3cfp s VAL 627 CO -0.02 0.42 1.60 -0.55 0.00 0.00 0.00 175.10 176.55 3cfp s SER 628 N 0.66 6.05 0.00 3.32 0.15 0.18 -1.19 113.70 122.86 3cfp s SER 628 Ca 0.05 0.93 0.21 0.00 0.70 0.00 0.00 55.95 57.83 3cfp s SER 628 Cb -0.13 -2.53 0.69 0.00 -1.71 0.00 0.00 66.02 62.34 3cfp s SER 628 CO 0.01 -1.65 1.52 0.00 1.20 0.00 0.00 173.24 174.32 3cfp n ALA 629 N 9.81 2.50 -0.20 5.45 0.00 0.11 -4.46 120.51 133.72 3cfp n ALA 629 Ca 0.19 -0.59 -0.03 0.00 0.00 0.00 0.00 53.44 53.01 3cfp n ALA 629 Cb 0.48 -1.05 0.08 0.00 0.00 0.00 0.00 19.45 18.95 3cfp n ALA 629 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3cfp h ASP 630 N 2.58 0.46 0.20 0.00 3.32 -1.90 -2.35 116.42 118.74 3cfp h ASP 630 Ca 0.00 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.97 3cfp h ASP 630 Cb 0.57 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3cfp h ASP 630 CO 0.00 0.31 -0.42 0.11 -1.72 0.00 0.00 179.24 177.51 3cfp h LYS 631 N 0.60 0.28 -0.11 3.56 1.57 -1.95 0.70 116.57 121.22 3cfp h LYS 631 Ca 0.26 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3cfp h LYS 631 Cb 0.16 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 3cfp h LYS 631 CO -0.17 0.66 0.02 0.82 -0.57 0.00 0.00 179.45 180.21 3cfp h ILE 632 N 0.23 1.20 -0.35 1.86 2.04 -1.79 -1.36 117.51 119.35 3cfp h ILE 632 Ca 0.02 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 3cfp h ILE 632 Cb 0.85 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 3cfp h ILE 632 CO 0.07 0.18 0.21 0.40 0.00 0.00 0.00 178.15 179.01 3cfp h ILE 633 N -0.03 1.12 0.00 -0.67 1.08 -1.20 -2.91 117.51 114.90 3cfp h ILE 633 Ca 0.03 -0.30 -0.03 0.00 -0.39 0.00 0.00 64.86 64.18 3cfp h ILE 633 Cb 0.26 0.69 -0.00 0.00 -3.07 0.00 0.00 36.82 34.70 3cfp h ILE 633 CO 0.00 0.12 -0.13 0.44 -0.69 0.00 0.00 178.15 177.90 3cfp h ASP 634 N 0.45 0.00 0.34 1.72 5.19 -0.80 0.16 116.42 123.48 3cfp h ASP 634 Ca 0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 3cfp h ASP 634 Cb 0.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.53 3cfp h ASP 634 CO -0.02 0.13 0.00 1.17 -3.12 0.00 0.00 179.24 177.39 3cfp n LYS 635 N -3.89 0.13 -0.02 3.56 3.00 -0.52 -2.91 118.16 117.51 3cfp n LYS 635 Ca -0.02 0.49 -0.03 0.00 -0.00 0.00 0.00 58.31 58.75 3cfp n LYS 635 Cb 0.22 -1.81 -0.03 0.00 0.00 0.00 0.00 35.03 33.42 3cfp n LYS 635 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 3cfp n VAL 636 N -2.06 0.28 0.00 3.15 0.31 -0.20 -5.11 118.33 114.70 3cfp n VAL 636 Ca 0.01 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3cfp n VAL 636 Cb 0.12 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 3cfp n VAL 636 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3cfp n GLY 637 N 3.10 -0.32 0.32 2.92 0.00 0.38 -4.80 105.19 106.79 3cfp n GLY 637 Ca -0.08 -1.24 0.21 0.00 0.00 0.00 0.00 46.02 44.92 3cfp n GLY 637 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3cfp h GLU 638 N 0.00 0.00 -6.40 1.61 5.08 -1.91 -3.37 114.58 109.60 3cfp h GLU 638 Ca 0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 3cfp h GLU 638 Cb 0.00 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 3cfp h GLU 638 CO 0.00 0.00 1.08 -1.12 -1.00 0.00 0.00 179.01 177.97 3cfp s SER 639 N -5.07 6.15 0.00 1.42 0.01 -1.26 -4.64 113.70 110.30 3cfp s SER 639 Ca -0.04 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.20 3cfp s SER 639 Cb 0.12 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.80 3cfp s SER 639 CO 0.40 -1.76 0.00 1.17 0.41 0.00 0.00 173.24 173.46 3cfp n LYS 640 N 8.91 0.00 0.00 12.44 3.00 -1.26 -5.04 118.16 136.21 3cfp n LYS 640 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 3cfp n LYS 640 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.52 3cfp n LYS 640 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 3cfp n PHE 641 N -0.12 0.00 0.00 5.64 0.99 -1.26 -4.69 117.46 118.02 3cfp n PHE 641 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3cfp n PHE 641 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 3cfp n PHE 641 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3cfp n ARG 642 N 0.00 0.00 -4.39 -1.08 1.74 -1.26 -4.40 116.66 107.26 3cfp n ARG 642 Ca 0.00 0.00 -0.20 0.00 -0.77 0.00 0.00 57.85 56.88 3cfp n ARG 642 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 3cfp n ARG 642 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 3cfp s ASP 643 N 0.00 2.47 0.20 0.55 1.47 -1.26 -5.03 116.67 115.07 3cfp s ASP 643 Ca 0.00 -1.19 -0.15 0.00 1.18 0.00 0.00 52.55 52.40 3cfp s ASP 643 Cb 0.00 -0.11 0.20 0.00 -0.34 0.00 0.00 42.92 42.66 3cfp s ASP 643 CO 0.00 -0.38 1.63 0.74 0.68 0.00 0.00 175.17 177.84 3cfp h THR 644 N 2.36 0.40 -0.11 2.11 2.02 -1.93 -2.59 112.91 115.17 3cfp h THR 644 Ca -0.39 0.00 0.03 0.00 0.77 0.00 0.00 66.41 66.82 3cfp h THR 644 Cb 1.23 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 3cfp h THR 644 CO 0.66 0.00 0.11 -1.13 0.37 0.00 0.00 175.52 175.53 3cfp h ASN 645 N -0.02 0.00 0.66 4.18 -1.24 -1.96 -2.05 115.58 115.15 3cfp h ASN 645 Ca 0.27 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.25 3cfp h ASN 645 Cb 0.43 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.49 3cfp h ASN 645 CO -0.60 0.00 -0.32 -0.74 -1.29 0.00 0.00 177.43 174.49 3cfp h HIS 646 N 0.00 -0.82 0.00 0.67 2.76 -1.67 -2.45 115.15 113.65 3cfp h HIS 646 Ca 0.05 -0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.14 3cfp h HIS 646 Cb 0.28 0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.50 3cfp h HIS 646 CO 0.00 -0.48 -0.27 0.11 -1.30 0.00 0.00 177.93 175.99 3cfp h TRP 647 N -1.00 0.00 -0.09 5.26 5.08 -1.49 -0.15 115.95 123.56 3cfp h TRP 647 Ca -0.09 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.87 3cfp h TRP 647 Cb 0.71 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.87 3cfp h TRP 647 CO -0.01 0.27 0.04 0.28 -1.28 0.00 0.00 178.44 177.74 3cfp h VAL 648 N 0.00 1.14 0.00 0.12 2.07 -1.55 -0.69 116.25 117.34 3cfp h VAL 648 Ca -0.00 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 3cfp h VAL 648 Cb 0.50 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3cfp h VAL 648 CO 0.04 0.12 -0.13 -0.78 0.02 0.00 0.00 177.57 176.83 3cfp h ASP 649 N 0.00 0.00 0.08 0.57 -0.00 -0.89 -0.76 116.42 115.42 3cfp h ASP 649 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 57.03 57.06 3cfp h ASP 649 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.49 3cfp h ASP 649 CO -0.00 0.13 -0.04 0.15 -0.00 0.00 0.00 179.24 179.48 3cfp h PHE 650 N 0.00 -0.10 -0.65 0.28 3.57 -0.77 -3.06 116.94 116.21 3cfp h PHE 650 Ca -0.00 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.63 3cfp h PHE 650 Cb 0.27 0.03 -0.12 0.00 2.79 0.00 0.00 35.95 38.93 3cfp h PHE 650 CO 0.00 -0.06 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.90 3cfp h LEU 651 N -0.14 -0.40 -0.47 0.59 3.38 -0.98 -0.55 115.31 116.74 3cfp h LEU 651 Ca -0.01 0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.19 3cfp h LEU 651 Cb 0.08 0.33 -0.08 0.00 0.09 0.00 0.00 40.66 41.08 3cfp h LEU 651 CO 0.02 -0.16 -0.55 -0.78 0.09 0.00 0.00 178.44 177.05 3cfp h ASP 652 N 0.07 -1.87 -0.90 -0.43 3.58 -1.29 0.39 116.42 115.97 3cfp h ASP 652 Ca 0.34 0.25 0.12 0.00 0.42 0.00 0.00 57.03 58.16 3cfp h ASP 652 Cb 0.55 0.77 -0.07 0.00 1.72 0.00 0.00 39.33 42.30 3cfp h ASP 652 CO -0.60 -0.37 0.58 0.50 -2.88 0.00 0.00 179.24 176.47 3cfp h LYS 653 N -0.34 0.78 -0.22 0.28 3.64 -1.06 -0.23 116.57 119.42 3cfp h LYS 653 Ca 0.08 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 3cfp h LYS 653 Cb 0.56 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 3cfp h LYS 653 CO -0.63 0.51 -0.31 0.35 -2.27 0.00 0.00 179.45 177.11 3cfp h PHE 654 N 0.80 0.50 0.02 1.91 3.04 0.27 -0.09 116.94 123.40 3cfp h PHE 654 Ca 0.44 -0.12 -0.00 0.00 3.98 0.00 0.00 57.97 62.27 3cfp h PHE 654 Cb 0.58 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 38.97 3cfp h PHE 654 CO -0.00 0.71 -0.01 0.00 -2.02 0.00 0.00 178.31 176.99 3cfp h ALA 655 N 1.29 -0.03 0.00 2.41 0.00 0.13 -1.84 119.26 121.22 3cfp h ALA 655 Ca 0.05 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 3cfp h ALA 655 Cb 0.74 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3cfp h ALA 655 CO 0.06 -0.31 -0.44 -0.09 0.00 0.00 0.00 179.25 178.47 3cfp h ARG 656 N -0.44 0.00 0.00 0.00 2.43 -1.07 -1.15 114.38 114.15 3cfp h ARG 656 Ca -0.00 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.80 3cfp h ARG 656 Cb 0.42 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.91 3cfp h ARG 656 CO 0.00 0.44 -2.39 0.39 -1.51 0.00 0.00 179.97 176.90 3cfp n GLU 657 N -3.51 0.70 -0.06 0.20 1.02 -0.05 -4.68 120.64 114.26 3cfp n GLU 657 Ca -0.00 0.08 -0.10 0.00 -0.02 0.00 0.00 57.16 57.12 3cfp n GLU 657 Cb 0.57 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 3cfp n GLU 657 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3cfp n ARG 658 N -3.03 0.38 0.34 3.49 1.74 -0.74 -4.61 116.66 114.22 3cfp n ARG 658 Ca -0.39 0.15 -0.14 0.00 -0.77 0.00 0.00 57.85 56.70 3cfp n ARG 658 Cb 1.04 -1.15 -0.06 0.00 -1.02 0.00 0.00 32.46 31.26 3cfp n ARG 658 CO 0.00 0.00 0.00 0.52 -1.52 0.00 0.00 177.63 176.63 3cfp h MET 659 N -0.69 -0.86 -0.62 5.56 2.86 -1.35 -3.08 114.93 116.76 3cfp h MET 659 Ca -0.15 0.06 0.13 0.00 -2.06 0.00 0.00 59.70 57.68 3cfp h MET 659 Cb 0.91 0.19 -0.11 0.00 0.06 0.00 0.00 31.60 32.66 3cfp h MET 659 CO -0.09 -0.57 -0.01 0.93 1.06 0.00 0.00 176.91 178.23 3cfp h GLU 660 N -1.07 0.10 -0.83 1.72 5.08 -1.49 0.25 114.58 118.34 3cfp h GLU 660 Ca -0.09 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3cfp h GLU 660 Cb 0.68 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.86 3cfp h GLU 660 CO 0.15 0.07 0.55 -1.35 -1.00 0.00 0.00 179.01 177.42 3cfp h PRO 661 N 0.11 0.99 -0.21 2.33 0.11 -1.81 1.06 132.00 134.58 3cfp h PRO 661 Ca 0.32 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.36 3cfp h PRO 661 Cb 0.52 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 3cfp h PRO 661 CO -0.54 0.66 0.07 0.00 -0.21 0.00 0.00 178.00 177.98 3cfp h ALA 662 N 1.52 0.27 -0.89 -0.75 0.00 -0.84 -1.16 119.26 117.41 3cfp h ALA 662 Ca 0.33 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.18 3cfp h ALA 662 Cb 0.05 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 3cfp h ALA 662 CO -0.10 -0.12 0.56 0.82 0.00 0.00 0.00 179.25 180.41 3cfp h ILE 663 N 0.17 1.06 0.06 0.00 2.04 0.32 -0.73 117.51 120.43 3cfp h ILE 663 Ca 0.07 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 3cfp h ILE 663 Cb 0.21 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 3cfp h ILE 663 CO -0.00 0.19 -0.03 -0.78 0.00 0.00 0.00 178.15 177.53 3cfp h ASP 664 N 1.03 -0.07 -0.80 1.72 3.58 0.13 -2.12 116.42 119.89 3cfp h ASP 664 Ca 0.39 -0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.82 3cfp h ASP 664 Cb 0.16 0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.17 3cfp h ASP 664 CO -0.17 0.04 0.52 0.03 -2.88 0.00 0.00 179.24 176.78 3cfp h ARG 665 N -0.17 0.83 -0.51 0.28 3.08 -0.74 -0.89 114.38 116.27 3cfp h ARG 665 Ca -0.01 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 3cfp h ARG 665 Cb 0.14 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3cfp h ARG 665 CO 0.01 0.55 0.31 0.78 -1.07 0.00 0.00 179.97 180.56 3cfp h GLY 666 N 0.86 0.74 2.00 0.04 0.00 -0.84 -2.23 103.07 103.63 3cfp h GLY 666 Ca 0.34 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.32 3cfp h GLY 666 CO -0.12 0.29 -0.23 0.74 0.00 0.00 0.00 176.54 177.22 3cfp h PHE 667 N 0.68 0.00 -0.22 5.60 0.04 -0.67 -2.75 116.94 119.62 3cfp h PHE 667 Ca 0.18 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.93 3cfp h PHE 667 Cb -0.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 3cfp h PHE 667 CO -0.03 0.23 0.04 0.00 -0.60 0.00 0.00 178.31 177.95 3cfp h ARG 668 N 0.00 0.37 0.04 1.51 3.08 -0.89 -1.97 114.38 116.52 3cfp h ARG 668 Ca -0.00 -0.10 0.01 0.00 0.07 0.00 0.00 59.98 59.96 3cfp h ARG 668 Cb 0.93 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 3cfp h ARG 668 CO 0.03 0.50 -0.07 1.49 -1.07 0.00 0.00 179.97 180.86 3cfp h GLU 669 N 0.18 -0.13 -0.56 0.04 4.81 -1.30 -1.47 114.58 116.15 3cfp h GLU 669 Ca 0.07 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3cfp h GLU 669 Cb 0.31 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 3cfp h GLU 669 CO 0.00 -0.09 0.35 1.98 -0.73 0.00 0.00 179.01 180.52 3cfp h MET 670 N -0.14 0.67 -0.92 1.92 4.05 -1.48 0.36 114.93 119.39 3cfp h MET 670 Ca 0.02 -0.04 0.10 0.00 -0.28 0.00 0.00 59.70 59.49 3cfp h MET 670 Cb 0.15 -0.15 -0.08 0.00 -0.80 0.00 0.00 31.60 30.72 3cfp h MET 670 CO -0.04 0.44 0.56 0.00 0.23 0.00 0.00 176.91 178.10 3cfp h GLU 672 N 0.93 -0.86 -0.91 0.00 4.57 -0.04 0.18 114.58 118.46 3cfp h GLU 672 Ca 0.44 0.06 0.26 0.00 -1.18 0.00 0.00 59.36 58.94 3cfp h GLU 672 Cb 0.38 0.19 -0.15 0.00 -0.16 0.00 0.00 28.75 29.02 3cfp h GLU 672 CO -0.24 -0.54 0.30 -0.92 -1.18 0.00 0.00 179.01 176.43 3cfp h TYR 673 N -1.16 0.46 -0.00 0.92 3.20 -0.15 0.49 116.97 120.73 3cfp h TYR 673 Ca -0.09 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.83 3cfp h TYR 673 Cb 0.71 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.93 3cfp h TYR 673 CO 0.00 -0.23 -0.23 -0.12 -1.64 0.00 0.00 178.16 175.95 3cfp n MET 674 N -5.21 0.04 -3.76 1.82 1.56 0.46 -4.39 117.12 107.65 3cfp n MET 674 Ca 0.24 -0.01 -0.27 0.00 -0.27 0.00 0.00 57.70 57.39 3cfp n MET 674 Cb 0.77 -1.50 0.05 0.00 2.15 0.00 0.00 33.22 34.69 3cfp n MET 674 CO 0.00 0.00 0.00 -1.71 -0.73 0.00 0.00 175.97 173.53 3cfp n ASN 675 N -1.47 -5.09 -4.79 6.12 5.15 0.17 -1.87 115.26 113.49 3cfp n ASN 675 Ca 0.07 -0.68 -0.30 0.00 -0.60 0.00 0.00 54.58 53.06 3cfp n ASN 675 Cb 0.33 -4.40 0.09 0.00 -0.53 0.00 0.00 39.78 35.27 3cfp n ASN 675 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3cfp s ASN 676 N -3.43 4.56 0.02 1.20 0.02 -0.47 -3.69 114.94 113.15 3cfp s ASN 676 Ca 0.56 1.48 -0.12 0.00 -1.02 0.00 0.00 52.86 53.77 3cfp s ASN 676 Cb -0.27 -2.24 -0.07 0.00 0.02 0.00 0.00 41.25 38.69 3cfp s ASN 676 CO 0.79 -1.95 1.10 0.50 0.02 0.00 0.00 177.10 177.56 3cfp h LYS 677 N -1.07 -0.42 -4.24 -0.60 3.64 -1.42 -3.45 116.57 109.00 3cfp h LYS 677 Ca -0.46 0.03 -0.35 0.00 -1.27 0.00 0.00 60.65 58.60 3cfp h LYS 677 Cb 1.25 0.10 -0.30 0.00 -0.41 0.00 0.00 32.23 32.87 3cfp h LYS 677 CO 0.57 -0.28 -0.76 1.14 -2.27 0.00 0.00 179.45 177.85 3cfp s GLN 678 N -3.81 0.51 0.04 1.90 -2.07 -1.18 -5.09 119.66 109.97 3cfp s GLN 678 Ca -0.06 -0.16 -0.30 0.00 -1.82 0.00 0.00 55.36 53.01 3cfp s GLN 678 Cb 0.01 -0.52 -0.09 0.00 -1.09 0.00 0.00 33.01 31.32 3cfp s GLN 678 CO 0.19 0.06 1.87 -1.58 -1.32 0.00 0.00 175.29 174.52 3cfp s HIS 679 N 0.16 1.63 0.00 9.60 5.65 -1.26 -4.23 115.29 126.84 3cfp s HIS 679 Ca -0.01 -0.23 0.00 0.00 0.25 0.00 0.00 55.06 55.07 3cfp s HIS 679 Cb -0.05 -4.16 0.00 0.00 -1.18 0.00 0.00 32.58 27.18 3cfp s HIS 679 CO -0.00 -5.06 0.62 1.28 -0.65 0.00 0.00 174.74 170.93 3cfp n LEU 680 N 6.99 0.00 -4.51 8.88 4.77 -1.26 -5.02 117.00 126.84 3cfp n LEU 680 Ca 0.19 -0.40 -0.42 0.00 -0.03 0.00 0.00 56.01 55.35 3cfp n LEU 680 Cb 0.41 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 3cfp n LEU 680 CO 0.66 0.16 1.12 -0.04 -1.33 0.00 0.00 177.39 177.96 3cfp s MET 681 N 0.00 3.34 -0.31 3.23 -1.94 -1.26 -4.89 119.30 117.47 3cfp s MET 681 Ca 0.00 -0.85 -0.03 0.00 -1.71 0.00 0.00 55.69 53.09 3cfp s MET 681 Cb 0.00 -4.62 0.05 0.00 2.01 0.00 0.00 34.83 32.26 3cfp s MET 681 CO 0.00 -2.03 0.03 -0.06 -0.01 0.00 0.00 175.02 172.95 3cfp s PHE 682 N 4.66 3.26 -0.37 -0.03 0.08 -1.26 -4.91 117.98 119.42 3cfp s PHE 682 Ca 0.34 -1.75 -0.04 0.00 0.12 0.00 0.00 56.93 55.60 3cfp s PHE 682 Cb -0.08 -2.17 0.08 0.00 -0.57 0.00 0.00 43.02 40.28 3cfp s PHE 682 CO 0.03 -0.78 0.14 1.41 -0.10 0.00 0.00 175.22 175.92 3cfp s MET 683 N 1.29 2.31 0.20 0.44 1.75 -1.26 -1.97 119.30 122.07 3cfp s MET 683 Ca -0.04 -1.51 0.09 0.00 -1.25 0.00 0.00 55.69 52.98 3cfp s MET 683 Cb -0.20 -3.49 -0.04 0.00 2.84 0.00 0.00 34.83 33.94 3cfp s MET 683 CO 0.00 -0.87 -0.08 0.16 -0.65 0.00 0.00 175.02 173.58 3cfp s ASP 684 N 1.66 4.29 0.33 1.11 3.84 -0.97 -4.82 116.67 122.12 3cfp s ASP 684 Ca 0.02 -0.60 -0.29 0.00 -0.00 0.00 0.00 52.55 51.68 3cfp s ASP 684 Cb -0.22 -0.74 -0.11 0.00 -1.38 0.00 0.00 42.92 40.48 3cfp s ASP 684 CO -0.01 0.08 1.54 -0.60 -0.00 0.00 0.00 175.17 176.18 3cfp s ARG 685 N -3.01 4.11 0.00 2.11 3.00 -1.26 -1.73 118.95 122.17 3cfp s ARG 685 Ca 0.26 2.58 0.00 0.00 -1.00 0.00 0.00 55.73 57.57 3cfp s ARG 685 Cb -0.08 -3.00 0.00 0.00 0.00 0.00 0.00 34.95 31.87 3cfp s ARG 685 CO 0.16 -0.59 0.00 0.39 0.00 0.00 0.00 175.30 175.26 3cfp n GLU 686 N 1.34 0.00 -3.79 5.12 1.02 -0.14 -4.47 120.64 119.72 3cfp n GLU 686 Ca 0.05 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.81 3cfp n GLU 686 Cb 0.38 -0.05 -0.06 0.00 -0.02 0.00 0.00 31.44 31.69 3cfp n GLU 686 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cfp s ALA 687 N -3.56 3.83 -0.20 0.62 0.00 -1.26 0.25 121.76 121.44 3cfp s ALA 687 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.40 3cfp s ALA 687 Cb 0.00 -2.07 0.01 0.00 0.00 0.00 0.00 23.12 21.06 3cfp s ALA 687 CO 0.00 0.57 -0.12 0.42 0.00 0.00 0.00 175.76 176.63 3cfp s ILE 688 N -0.99 2.68 -0.03 0.00 1.01 -0.19 -1.57 121.20 122.12 3cfp s ILE 688 Ca 0.17 -0.75 0.02 0.00 0.00 0.00 0.00 60.65 60.09 3cfp s ILE 688 Cb -0.13 -2.19 0.00 0.00 0.01 0.00 0.00 42.46 40.15 3cfp s ILE 688 CO 0.06 0.47 -0.09 0.00 0.00 0.00 0.00 174.94 175.37 3cfp s ALA 689 N 1.37 0.89 0.02 9.38 0.00 0.14 -0.70 121.76 132.85 3cfp s ALA 689 Ca 0.05 -0.33 -0.19 0.00 0.00 0.00 0.00 51.96 51.49 3cfp s ALA 689 Cb -0.14 -0.34 0.06 0.00 0.00 0.00 0.00 23.12 22.70 3cfp s ALA 689 CO -0.08 0.13 0.87 0.41 0.00 0.00 0.00 175.76 177.09 3cfp n GLY 690 N 3.36 0.44 3.90 0.00 0.00 -0.65 -1.00 105.19 111.23 3cfp n GLY 690 Ca -0.19 -1.01 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 3cfp n GLY 690 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cfp s PRO 691 N -2.02 3.61 0.66 1.61 0.05 -1.26 -4.62 135.00 133.03 3cfp s PRO 691 Ca 0.20 0.27 -0.17 0.00 0.05 0.00 0.00 61.00 61.35 3cfp s PRO 691 Cb -0.01 -2.39 -0.03 0.00 0.05 0.00 0.00 34.50 32.13 3cfp s PRO 691 CO 0.01 -0.15 0.95 -2.30 0.05 0.00 0.00 177.00 175.56 3cfp n PRO 692 N -1.96 0.71 -1.64 0.56 -0.02 -1.26 -4.82 135.00 126.58 3cfp n PRO 692 Ca 0.01 0.29 -0.49 0.00 -2.02 0.00 0.00 63.50 61.29 3cfp n PRO 692 Cb 0.55 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.79 3cfp n PRO 692 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3cfp n LEU 693 N -1.15 2.51 -2.97 2.45 4.77 -1.26 -2.47 117.00 118.88 3cfp n LEU 693 Ca 0.14 1.09 -0.19 0.00 -0.03 0.00 0.00 56.01 57.02 3cfp n LEU 693 Cb 0.48 -1.32 -0.00 0.00 -2.33 0.00 0.00 43.42 40.25 3cfp n LEU 693 CO 0.49 -0.59 -0.08 0.61 -1.33 0.00 0.00 177.39 176.49 3cfp n GLY 694 N 3.12 -0.49 4.01 -0.72 0.00 -1.26 -4.97 105.19 104.87 3cfp n GLY 694 Ca 0.18 0.06 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 3cfp n GLY 694 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3cfp s SER 695 N -2.45 4.67 0.00 1.61 1.04 -1.03 -5.00 113.70 112.54 3cfp s SER 695 Ca 0.23 -0.51 0.28 0.00 0.48 0.00 0.00 55.95 56.43 3cfp s SER 695 Cb -0.12 0.03 1.20 0.00 0.10 0.00 0.00 66.02 67.23 3cfp s SER 695 CO 0.29 -1.63 1.83 0.29 0.98 0.00 0.00 173.24 175.00 3cfp n LYS 696 N -2.59 1.50 -2.13 4.02 4.76 -1.26 -4.94 118.16 117.52 3cfp n LYS 696 Ca 0.15 -0.73 -0.36 0.00 -2.87 0.00 0.00 58.31 54.50 3cfp n LYS 696 Cb 0.61 -1.47 0.01 0.00 -1.84 0.00 0.00 35.03 32.35 3cfp n LYS 696 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3cfp s GLY 697 N -1.93 2.73 0.00 0.72 0.00 -0.83 -3.58 107.32 104.44 3cfp s GLY 697 Ca 0.39 0.97 0.25 0.00 0.00 0.00 0.00 44.72 46.33 3cfp s GLY 697 CO 0.33 1.38 1.39 0.29 0.00 0.00 0.00 173.10 176.48 3cfp n ILE 698 N -1.18 0.00 0.00 0.90 -5.35 -0.80 -4.75 119.36 108.18 3cfp n ILE 698 Ca 0.11 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 3cfp n ILE 698 Cb 0.49 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 3cfp n ILE 698 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3cfp n GLY 699 N 1.33 1.35 3.67 3.28 0.00 -1.01 -3.63 105.19 110.17 3cfp n GLY 699 Ca 0.13 -0.01 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 3cfp n GLY 699 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfp s GLY 700 N 0.00 -0.32 0.07 -0.02 0.00 -0.54 -1.62 107.32 104.89 3cfp s GLY 700 Ca 0.00 0.53 -0.21 0.00 0.00 0.00 0.00 44.72 45.04 3cfp s GLY 700 CO 0.00 0.13 0.51 -0.11 0.00 0.00 0.00 173.10 173.62 3cfp s PHE 701 N -2.99 -0.39 0.12 1.90 -0.71 -0.65 -0.16 117.98 115.10 3cfp s PHE 701 Ca 0.11 0.35 0.10 0.00 -1.04 0.00 0.00 56.93 56.45 3cfp s PHE 701 Cb 0.00 0.35 -0.04 0.00 -1.21 0.00 0.00 43.02 42.12 3cfp s PHE 701 CO -0.02 -0.67 -0.20 -1.58 -1.34 0.00 0.00 175.22 171.41 3cfp s TRP 702 N -2.82 2.47 -0.03 3.49 0.51 -0.39 -1.46 118.94 120.71 3cfp s TRP 702 Ca -0.03 -0.29 0.09 0.00 -2.12 0.00 0.00 56.10 53.75 3cfp s TRP 702 Cb -0.00 -1.31 -0.14 0.00 -0.81 0.00 0.00 33.47 31.20 3cfp s TRP 702 CO -0.05 0.38 0.17 0.25 -0.51 0.00 0.00 176.95 177.20 3cfp n THR 703 N 0.78 0.15 -3.60 2.01 -2.24 -0.45 -2.54 114.28 108.39 3cfp n THR 703 Ca -0.16 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3cfp n THR 703 Cb 0.53 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 3cfp n THR 703 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cfp n GLY 704 N 2.06 -1.20 3.61 3.38 0.00 -1.23 -4.73 105.19 107.09 3cfp n GLY 704 Ca -0.05 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 3cfp n GLY 704 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cfp n LYS 705 N 0.00 1.45 -1.11 1.61 5.02 -1.26 -2.73 118.16 121.14 3cfp n LYS 705 Ca 0.00 0.52 -0.04 0.00 -2.02 0.00 0.00 58.31 56.77 3cfp n LYS 705 Cb 0.00 -2.02 -0.02 0.00 -0.02 0.00 0.00 35.03 32.98 3cfp n LYS 705 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3cfp n LYS 706 N 0.37 -1.60 -3.55 1.97 4.76 -1.26 -4.91 118.16 113.93 3cfp n LYS 706 Ca 0.09 0.57 -0.27 0.00 -2.87 0.00 0.00 58.31 55.83 3cfp n LYS 706 Cb 0.37 -4.84 -0.15 0.00 -1.84 0.00 0.00 35.03 28.56 3cfp n LYS 706 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3cfp s ARG 707 N -2.07 0.16 0.20 1.97 0.52 -1.11 -3.48 118.95 115.14 3cfp s ARG 707 Ca 0.00 -0.34 -0.19 0.00 -0.52 0.00 0.00 55.73 54.67 3cfp s ARG 707 Cb 0.00 -1.35 0.04 0.00 0.52 0.00 0.00 34.95 34.16 3cfp s ARG 707 CO 0.00 -0.90 0.57 1.52 0.02 0.00 0.00 175.30 176.52 3cfp s TYR 708 N 2.13 -0.24 -0.04 -0.53 1.13 -1.04 -1.34 117.35 117.42 3cfp s TYR 708 Ca 0.07 -0.09 -0.02 0.00 -1.41 0.00 0.00 57.07 55.62 3cfp s TYR 708 Cb -0.16 0.49 0.02 0.00 -1.10 0.00 0.00 41.96 41.21 3cfp s TYR 708 CO -0.27 -0.95 0.08 0.00 -2.51 0.00 0.00 175.55 171.90 3cfp s ALA 709 N -3.85 -0.11 0.06 9.51 0.00 -0.53 -1.02 121.76 125.82 3cfp s ALA 709 Ca 0.07 0.39 0.03 0.00 0.00 0.00 0.00 51.96 52.45 3cfp s ALA 709 Cb -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 3cfp s ALA 709 CO -0.04 -0.10 -0.09 -0.51 0.00 0.00 0.00 175.76 175.02 3cfp s LEU 710 N 0.76 2.30 -0.53 0.00 1.43 0.65 -1.63 118.68 121.67 3cfp s LEU 710 Ca -0.06 -0.63 -0.17 0.00 -1.03 0.00 0.00 54.13 52.24 3cfp s LEU 710 Cb -0.08 -0.26 0.10 0.00 0.03 0.00 0.00 46.19 45.98 3cfp s LEU 710 CO -0.03 -0.20 0.52 0.21 0.23 0.00 0.00 176.35 177.08 3cfp s ASN 711 N -1.84 6.18 -0.18 2.29 2.47 -0.64 -0.96 114.94 122.26 3cfp s ASN 711 Ca -0.04 -1.48 -0.11 0.00 0.42 0.00 0.00 52.86 51.65 3cfp s ASN 711 Cb -0.08 -2.23 -0.05 0.00 -1.45 0.00 0.00 41.25 37.44 3cfp s ASN 711 CO 0.00 -0.85 0.20 -0.69 -3.72 0.00 0.00 177.10 172.04 3cfp s VAL 712 N 1.94 5.37 -0.22 -5.21 1.01 0.09 -1.64 120.40 121.74 3cfp s VAL 712 Ca 0.06 0.34 0.09 0.00 0.00 0.00 0.00 61.98 62.47 3cfp s VAL 712 Cb -0.26 -3.53 -0.19 0.00 0.00 0.00 0.00 36.38 32.39 3cfp s VAL 712 CO 0.06 0.43 -0.08 0.79 0.00 0.00 0.00 175.10 176.29 3cfp n TRP 713 N 3.49 0.00 -4.04 5.22 7.02 0.12 -0.84 117.44 128.41 3cfp n TRP 713 Ca -0.14 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.15 3cfp n TRP 713 Cb 0.52 -0.93 -0.16 0.00 -2.42 0.00 0.00 31.31 28.32 3cfp n TRP 713 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3cfp s ASP 714 N -5.86 0.62 -0.23 -0.99 -1.08 -1.23 -1.64 116.67 106.27 3cfp s ASP 714 Ca -0.22 -0.07 -0.00 0.00 -0.52 0.00 0.00 52.55 51.74 3cfp s ASP 714 Cb 0.07 -0.31 0.06 0.00 -1.46 0.00 0.00 42.92 41.28 3cfp s ASP 714 CO 0.66 -0.08 -0.02 -0.32 0.52 0.00 0.00 175.17 175.94 3cfp s MET 715 N 0.94 1.26 -1.48 4.34 -2.45 -0.26 -1.02 119.30 120.63 3cfp s MET 715 Ca -0.11 -0.83 -0.12 0.00 -1.25 0.00 0.00 55.69 53.39 3cfp s MET 715 Cb -0.14 -2.42 0.06 0.00 1.25 0.00 0.00 34.83 33.58 3cfp s MET 715 CO -0.01 -0.64 1.01 0.39 1.05 0.00 0.00 175.02 176.82 3cfp n GLU 716 N 4.79 -6.09 -0.60 4.11 1.02 0.14 -1.89 120.64 122.12 3cfp n GLU 716 Ca -0.10 0.67 0.00 0.00 -0.02 0.00 0.00 57.16 57.71 3cfp n GLU 716 Cb 0.45 -5.60 0.00 0.00 -0.02 0.00 0.00 31.44 26.27 3cfp n GLU 716 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cfp n GLY 717 N -1.76 0.72 3.47 0.62 0.00 -1.26 -5.03 105.19 101.95 3cfp n GLY 717 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3cfp n GLY 717 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cfp s THR 718 N -2.27 4.81 -0.33 2.61 2.01 -0.79 -5.01 115.64 116.66 3cfp s THR 718 Ca 0.00 -0.36 -0.17 0.00 0.31 0.00 0.00 61.69 61.47 3cfp s THR 718 Cb 0.00 -3.46 -0.01 0.00 0.01 0.00 0.00 72.50 69.04 3cfp s THR 718 CO 0.00 0.04 0.48 -0.60 -0.69 0.00 0.00 174.62 173.85 3cfp s ARG 719 N 1.65 3.72 0.28 4.92 6.06 -1.26 -1.10 118.95 133.22 3cfp s ARG 719 Ca 0.05 -0.10 -0.28 0.00 -2.50 0.00 0.00 55.73 52.90 3cfp s ARG 719 Cb -0.17 -3.77 -0.09 0.00 0.06 0.00 0.00 34.95 30.98 3cfp s ARG 719 CO 0.08 -0.54 0.98 0.71 -2.50 0.00 0.00 175.30 174.02 3cfp s TYR 720 N 2.29 3.77 0.13 5.12 2.02 -0.65 -4.93 117.35 125.10 3cfp s TYR 720 Ca 0.18 1.82 -0.25 0.00 -0.37 0.00 0.00 57.07 58.45 3cfp s TYR 720 Cb -0.16 -3.03 -0.03 0.00 -0.40 0.00 0.00 41.96 38.34 3cfp s TYR 720 CO 0.12 0.11 1.64 0.00 -1.57 0.00 0.00 175.55 175.85 3cfp h ALA 721 N 3.66 -0.28 -3.95 3.71 0.00 -1.90 -3.42 119.26 117.09 3cfp h ALA 721 Ca -0.46 0.02 -0.68 0.00 0.00 0.00 0.00 54.91 53.78 3cfp h ALA 721 Cb 1.20 0.45 -0.22 0.00 0.00 0.00 0.00 17.79 19.23 3cfp h ALA 721 CO 0.66 -0.73 -0.79 -1.21 0.00 0.00 0.00 179.25 177.19 3cfp s GLU 722 N -6.07 2.19 0.44 0.00 0.41 -1.26 -5.09 118.70 109.33 3cfp s GLU 722 Ca -0.15 -0.91 -0.25 0.00 -0.41 0.00 0.00 54.97 53.25 3cfp s GLU 722 Cb 0.10 -2.25 -0.08 0.00 -1.78 0.00 0.00 34.13 30.12 3cfp s GLU 722 CO 0.66 0.56 1.29 -1.25 -0.49 0.00 0.00 175.26 176.04 3cfp s PRO 723 N -1.33 3.79 -0.05 0.39 0.04 -1.26 -4.99 135.00 131.58 3cfp s PRO 723 Ca 0.14 2.11 0.05 0.00 0.04 0.00 0.00 61.00 63.35 3cfp s PRO 723 Cb -0.11 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.80 3cfp s PRO 723 CO 0.05 -0.63 -0.19 0.21 0.04 0.00 0.00 177.00 176.48 3cfp s LYS 724 N -2.43 2.50 -0.09 4.56 2.20 -0.02 -4.90 119.74 121.55 3cfp s LYS 724 Ca 0.60 -0.79 -0.27 0.00 -0.36 0.00 0.00 55.97 55.16 3cfp s LYS 724 Cb -0.37 -2.28 -0.02 0.00 -1.51 0.00 0.00 37.83 33.65 3cfp s LYS 724 CO 0.46 0.52 0.86 -0.51 -0.36 0.00 0.00 175.35 176.33 3cfp s LEU 725 N -0.49 4.27 -0.38 5.43 1.43 -1.26 -0.74 118.68 126.94 3cfp s LEU 725 Ca 0.06 1.35 -0.13 0.00 -1.03 0.00 0.00 54.13 54.38 3cfp s LEU 725 Cb -0.12 -3.33 0.01 0.00 0.03 0.00 0.00 46.19 42.79 3cfp s LEU 725 CO 0.01 -0.30 0.25 -0.75 0.23 0.00 0.00 176.35 175.79 3cfp s LYS 726 N 1.53 3.05 -0.13 1.70 2.36 -0.13 -4.97 119.74 123.15 3cfp s LYS 726 Ca 0.43 -0.95 0.01 0.00 -2.55 0.00 0.00 55.97 52.91 3cfp s LYS 726 Cb -0.18 -3.85 0.02 0.00 -1.05 0.00 0.00 37.83 32.77 3cfp s LYS 726 CO 0.18 -0.66 -0.15 0.42 1.55 0.00 0.00 175.35 176.70 3cfp s ILE 727 N 1.65 1.54 -0.13 5.43 1.01 -1.26 -0.25 121.20 129.18 3cfp s ILE 727 Ca 0.04 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.06 3cfp s ILE 727 Cb -0.19 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.85 3cfp s ILE 727 CO 0.09 0.45 -0.17 -0.04 0.00 0.00 0.00 174.94 175.27 3cfp s MET 728 N 1.22 3.24 0.00 2.79 -1.94 -0.19 -4.78 119.30 119.64 3cfp s MET 728 Ca -0.01 -0.76 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 3cfp s MET 728 Cb -0.14 -2.55 0.00 0.00 2.01 0.00 0.00 34.83 34.15 3cfp s MET 728 CO -0.06 0.13 0.00 0.41 -0.01 0.00 0.00 175.02 175.49 3cfp n GLY 729 N 3.73 1.99 3.74 -0.03 0.00 -1.23 -2.49 105.19 110.91 3cfp n GLY 729 Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 3cfp n GLY 729 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfp s LEU 730 N 0.00 2.20 0.60 0.99 1.43 -1.26 -4.86 118.68 117.77 3cfp s LEU 730 Ca 0.00 1.31 0.30 0.00 -1.03 0.00 0.00 54.13 54.71 3cfp s LEU 730 Cb 0.00 -3.73 1.74 0.00 0.03 0.00 0.00 46.19 44.24 3cfp s LEU 730 CO 0.00 -2.54 2.15 -0.33 0.23 0.00 0.00 176.35 175.87 3cfp h GLU 731 N -1.48 0.00 -0.04 1.70 3.07 -1.95 -0.09 114.58 115.78 3cfp h GLU 731 Ca -0.50 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.37 3cfp h GLU 731 Cb 1.29 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.20 3cfp h GLU 731 CO 0.57 0.00 0.13 1.79 -1.40 0.00 0.00 179.01 180.11 3cfp h THR 732 N 0.00 0.15 0.00 1.13 1.35 -1.90 -2.66 112.91 110.98 3cfp h THR 732 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.91 3cfp h THR 732 Cb 0.33 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 3cfp h THR 732 CO -0.00 0.00 -1.00 0.00 -0.25 0.00 0.00 175.52 174.27 3cfp n GLN 733 N -3.26 0.05 -3.54 4.72 1.13 -0.05 -4.92 117.38 111.52 3cfp n GLN 733 Ca -0.02 -0.01 -0.37 0.00 -1.94 0.00 0.00 57.00 54.66 3cfp n GLN 733 Cb 0.21 -1.51 -0.07 0.00 0.11 0.00 0.00 30.24 28.99 3cfp n GLN 733 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3cfp s LYS 734 N -3.04 4.12 0.00 -1.09 1.02 -1.00 -4.95 119.74 114.79 3cfp s LYS 734 Ca 0.07 0.18 0.13 0.00 0.02 0.00 0.00 55.97 56.37 3cfp s LYS 734 Cb 0.16 -3.36 0.58 0.00 -0.52 0.00 0.00 37.83 34.69 3cfp s LYS 734 CO 0.85 0.38 1.43 -1.13 -0.92 0.00 0.00 175.35 175.95 3cfp n SER 735 N 3.07 0.00 0.04 2.83 3.41 -1.26 -2.73 113.62 118.98 3cfp n SER 735 Ca -0.13 0.49 0.12 0.00 -0.26 0.00 0.00 58.87 59.09 3cfp n SER 735 Cb 0.52 -0.49 0.21 0.00 -0.26 0.00 0.00 64.21 64.19 3cfp n SER 735 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3cfp n SER 736 N -1.49 0.61 -4.75 4.04 3.41 -1.26 -4.45 113.62 109.72 3cfp n SER 736 Ca 0.03 0.03 -0.39 0.00 -0.26 0.00 0.00 58.87 58.28 3cfp n SER 736 Cb 0.16 0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 3cfp n SER 736 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3cfp s THR 737 N -3.11 5.00 0.21 6.66 -4.23 -1.10 -1.44 115.64 117.63 3cfp s THR 737 Ca 0.08 1.18 -0.30 0.00 -1.18 0.00 0.00 61.69 61.46 3cfp s THR 737 Cb 0.15 -3.90 -0.16 0.00 1.34 0.00 0.00 72.50 69.93 3cfp s THR 737 CO 0.71 0.38 0.93 -2.65 -0.54 0.00 0.00 174.62 173.45 3cfp n PRO 738 N 3.05 0.84 -0.07 3.99 -0.02 -1.23 -4.64 135.00 136.92 3cfp n PRO 738 Ca -0.07 0.30 -0.08 0.00 -2.02 0.00 0.00 63.50 61.64 3cfp n PRO 738 Cb 0.51 -1.61 -0.01 0.00 -0.02 0.00 0.00 33.50 32.36 3cfp n PRO 738 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3cfp h LYS 739 N 2.20 -0.22 -0.86 -0.52 1.79 -1.47 0.07 116.57 117.55 3cfp h LYS 739 Ca -0.38 0.02 0.15 0.00 -2.18 0.00 0.00 60.65 58.25 3cfp h LYS 739 Cb 1.37 0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 32.01 3cfp h LYS 739 CO 0.63 -0.15 0.56 0.00 -1.08 0.00 0.00 179.45 179.41 3cfp h ALA 740 N 0.84 1.91 -0.07 3.86 0.00 -1.21 -1.64 119.26 122.95 3cfp h ALA 740 Ca 0.15 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.84 3cfp h ALA 740 Cb 0.47 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 18.17 3cfp h ALA 740 CO -0.42 -0.15 -0.86 0.28 0.00 0.00 0.00 179.25 178.11 3cfp h VAL 741 N 0.62 1.30 -0.16 0.00 2.07 -1.30 -1.68 116.25 117.10 3cfp h VAL 741 Ca 0.43 -2.08 0.04 0.00 0.82 0.00 0.00 66.70 65.91 3cfp h VAL 741 Cb 0.77 2.22 -0.05 0.00 -1.52 0.00 0.00 31.29 32.71 3cfp h VAL 741 CO -0.19 0.65 -0.13 1.56 0.02 0.00 0.00 177.57 179.49 3cfp h GLN 742 N 0.39 -0.13 -0.36 1.57 4.20 -0.51 0.13 115.11 120.40 3cfp h GLN 742 Ca -0.09 0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.69 3cfp h GLN 742 Cb 1.50 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 29.26 3cfp h GLN 742 CO 0.17 -0.09 0.06 -0.22 -0.67 0.00 0.00 178.83 178.09 3cfp h LYS 743 N -0.14 0.18 -0.31 1.46 3.64 -1.27 -0.47 116.57 119.66 3cfp h LYS 743 Ca 0.10 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.29 3cfp h LYS 743 Cb 0.28 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3cfp h LYS 743 CO -0.24 0.12 -0.51 0.00 -2.27 0.00 0.00 179.45 176.55 3cfp h ALA 744 N 1.27 0.50 -0.39 5.00 0.00 -0.96 -1.74 119.26 122.94 3cfp h ALA 744 Ca 0.17 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 3cfp h ALA 744 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3cfp h ALA 744 CO -0.23 0.68 -0.05 -0.07 0.00 0.00 0.00 179.25 179.58 3cfp h LEU 745 N 0.69 0.62 -0.69 0.00 3.38 -0.55 -1.27 115.31 117.49 3cfp h LEU 745 Ca 0.03 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3cfp h LEU 745 Cb 1.12 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 3cfp h LEU 745 CO 0.12 0.72 0.37 0.50 0.09 0.00 0.00 178.44 180.24 3cfp h LYS 746 N 0.60 0.96 -0.32 1.13 3.64 -0.88 -0.24 116.57 121.46 3cfp h LYS 746 Ca 0.12 -0.12 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 3cfp h LYS 746 Cb 0.45 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3cfp h LYS 746 CO 0.02 0.73 -0.26 1.49 -2.27 0.00 0.00 179.45 179.15 3cfp h GLU 747 N 0.95 0.66 -0.76 1.90 4.57 -0.92 0.22 114.58 121.20 3cfp h GLU 747 Ca 0.24 -0.27 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3cfp h GLU 747 Cb 0.05 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 3cfp h GLU 747 CO -0.04 0.86 0.35 0.00 -1.18 0.00 0.00 179.01 179.00 3cfp h ILE 749 N 1.08 1.35 -0.64 0.00 2.04 -0.78 0.66 117.51 121.22 3cfp h ILE 749 Ca 0.26 -1.11 0.11 0.00 1.00 0.00 0.00 64.86 65.12 3cfp h ILE 749 Cb 0.14 1.96 -0.08 0.00 -0.74 0.00 0.00 36.82 38.10 3cfp h ILE 749 CO -0.03 0.31 0.21 -0.09 0.00 0.00 0.00 178.15 178.55 3cfp h ARG 750 N -0.27 0.36 0.00 2.37 2.43 -0.30 0.16 114.38 119.14 3cfp h ARG 750 Ca 0.01 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.08 3cfp h ARG 750 Cb 0.51 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 3cfp h ARG 750 CO 0.01 0.24 -0.38 0.00 -1.51 0.00 0.00 179.97 178.33 3cfp h ARG 751 N 0.37 0.00 -0.24 0.20 3.08 0.04 -0.63 114.38 117.19 3cfp h ARG 751 Ca 0.33 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.29 3cfp h ARG 751 Cb 0.46 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3cfp h ARG 751 CO -0.36 0.38 -0.21 0.52 -1.07 0.00 0.00 179.97 179.23 3cfp h MET 752 N 0.00 0.56 0.09 0.04 2.86 0.16 -2.99 114.93 115.66 3cfp h MET 752 Ca -0.00 -0.29 -0.30 0.00 -2.06 0.00 0.00 59.70 57.05 3cfp h MET 752 Cb 0.71 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 3cfp h MET 752 CO 0.05 0.87 -1.52 -0.07 1.06 0.00 0.00 176.91 177.30 3cfp h LEU 753 N 0.27 0.31 0.05 1.22 3.38 -0.77 -2.12 115.31 117.65 3cfp h LEU 753 Ca 0.04 -0.44 -0.36 0.00 0.09 0.00 0.00 57.88 57.21 3cfp h LEU 753 Cb 0.75 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 3cfp h LEU 753 CO 0.05 1.37 -2.06 0.00 0.09 0.00 0.00 178.44 177.89 3cfp n GLN 754 N -3.40 0.67 -0.84 1.13 6.02 -0.26 -2.42 117.38 118.29 3cfp n GLN 754 Ca -0.15 0.30 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 3cfp n GLN 754 Cb 1.03 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 30.66 3cfp n GLN 754 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3cfp n GLU 755 N -3.73 2.46 0.00 -1.09 1.02 -1.13 -3.55 120.64 114.61 3cfp n GLU 755 Ca -0.39 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.75 3cfp n GLU 755 Cb 0.93 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.35 3cfp n GLU 755 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cfp n GLY 756 N 5.00 2.86 0.18 0.62 0.00 -1.22 -1.96 105.19 110.66 3cfp n GLY 756 Ca 0.00 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.02 3cfp n GLY 756 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3cfp h GLU 757 N 0.00 0.54 -0.11 1.61 4.81 -1.85 -3.04 114.58 116.55 3cfp h GLU 757 Ca 0.00 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 3cfp h GLU 757 Cb 0.00 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3cfp h GLU 757 CO 0.00 0.91 -0.08 0.93 -0.73 0.00 0.00 179.01 180.04 3cfp h GLU 758 N 0.22 -0.09 -0.69 1.92 5.08 -1.95 0.20 114.58 119.26 3cfp h GLU 758 Ca 0.02 0.01 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 3cfp h GLU 758 Cb 0.84 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.02 3cfp h GLU 758 CO 0.06 -0.06 0.28 1.03 -1.00 0.00 0.00 179.01 179.32 3cfp h SER 759 N -0.09 0.27 -0.31 1.42 0.87 -1.91 0.13 113.55 113.93 3cfp h SER 759 Ca 0.07 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 3cfp h SER 759 Cb 0.19 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 3cfp h SER 759 CO -0.16 0.13 0.10 0.25 -0.53 0.00 0.00 176.83 176.62 3cfp h LEU 760 N 0.45 0.45 -0.46 2.23 7.12 -1.29 -2.60 115.31 121.21 3cfp h LEU 760 Ca 0.37 -0.20 -0.00 0.00 0.13 0.00 0.00 57.88 58.18 3cfp h LEU 760 Cb 0.50 -0.12 -0.02 0.00 -0.53 0.00 0.00 40.66 40.49 3cfp h LEU 760 CO -0.35 0.53 0.28 1.56 -0.13 0.00 0.00 178.44 180.32 3cfp h GLN 761 N 0.35 0.62 -0.95 1.25 4.20 -0.36 -1.07 115.11 119.14 3cfp h GLN 761 Ca 0.10 -0.05 0.11 0.00 0.06 0.00 0.00 58.65 58.87 3cfp h GLN 761 Cb 0.23 -0.13 -0.08 0.00 0.30 0.00 0.00 27.48 27.80 3cfp h GLN 761 CO -0.00 0.44 0.59 1.49 -0.67 0.00 0.00 178.83 180.67 3cfp h GLU 762 N 0.61 0.91 -0.09 1.46 4.81 -0.71 0.06 114.58 121.64 3cfp h GLU 762 Ca 0.16 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 3cfp h GLU 762 Cb -0.02 -0.21 0.01 0.00 0.63 0.00 0.00 28.75 29.16 3cfp h GLU 762 CO -0.03 0.61 -0.54 -0.92 -0.73 0.00 0.00 179.01 177.40 3cfp h TYR 763 N 0.94 0.71 -0.69 0.92 5.03 -1.09 -2.53 116.97 120.26 3cfp h TYR 763 Ca 0.47 -0.32 0.02 0.00 2.58 0.00 0.00 58.73 61.47 3cfp h TYR 763 Cb 0.44 -0.10 -0.04 0.00 1.55 0.00 0.00 36.73 38.58 3cfp h TYR 763 CO -0.02 1.11 0.44 0.35 -1.32 0.00 0.00 178.16 178.72 3cfp h PHE 764 N 0.10 0.83 -0.09 -3.82 3.57 -0.87 0.22 116.94 116.89 3cfp h PHE 764 Ca -0.04 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.51 3cfp h PHE 764 Cb 1.19 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.62 3cfp h PHE 764 CO 0.12 0.50 -0.15 -0.22 -2.23 0.00 0.00 178.31 176.33 3cfp h LYS 765 N 0.88 -0.19 0.06 1.11 3.64 -1.00 -2.34 116.57 118.72 3cfp h LYS 765 Ca 0.27 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3cfp h LYS 765 Cb -0.03 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3cfp h LYS 765 CO -0.09 -0.13 -0.04 1.49 -2.27 0.00 0.00 179.45 178.41 3cfp h GLU 766 N -0.20 -0.10 -0.49 1.90 4.57 -0.99 -2.63 114.58 116.64 3cfp h GLU 766 Ca 0.08 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.33 3cfp h GLU 766 Cb 0.31 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.87 3cfp h GLU 766 CO -0.20 -0.06 0.19 0.35 -1.18 0.00 0.00 179.01 178.10 3cfp h PHE 767 N -0.10 0.34 -0.64 0.92 3.04 -0.44 -1.10 116.94 118.96 3cfp h PHE 767 Ca -0.00 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.93 3cfp h PHE 767 Cb 0.09 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.49 3cfp h PHE 767 CO -0.09 0.13 0.25 1.49 -2.02 0.00 0.00 178.31 178.07 3cfp h GLU 768 N 0.38 0.96 -0.35 1.11 4.81 -1.42 0.16 114.58 120.22 3cfp h GLU 768 Ca 0.23 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 3cfp h GLU 768 Cb 0.22 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3cfp h GLU 768 CO -0.22 0.81 0.20 -0.22 -0.73 0.00 0.00 179.01 178.86 3cfp h LYS 769 N 0.90 0.48 0.00 1.92 1.63 -1.00 -3.12 116.57 117.38 3cfp h LYS 769 Ca 0.21 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.97 3cfp h LYS 769 Cb 0.22 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 3cfp h LYS 769 CO -0.02 0.35 -1.01 0.39 -3.45 0.00 0.00 179.45 175.72 3cfp n GLU 770 N -4.45 0.12 -0.31 1.90 -0.58 -0.48 -4.60 120.64 112.25 3cfp n GLU 770 Ca 0.02 -0.00 0.18 0.00 -0.42 0.00 0.00 57.16 56.93 3cfp n GLU 770 Cb 0.09 -1.48 0.43 0.00 -0.57 0.00 0.00 31.44 29.91 3cfp n GLU 770 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 3cfp h PHE 771 N 0.00 0.79 0.00 -0.32 3.57 -0.65 -2.06 116.94 118.27 3cfp h PHE 771 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3cfp h PHE 771 Cb 0.50 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.01 3cfp h PHE 771 CO 0.00 0.16 0.00 0.54 -2.23 0.00 0.00 178.31 176.78 3cfp n ARG 772 N -4.64 0.18 0.00 1.11 1.74 -1.26 -3.07 116.66 110.71 3cfp n ARG 772 Ca 0.23 0.10 0.10 0.00 -0.77 0.00 0.00 57.85 57.51 3cfp n ARG 772 Cb 0.70 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.60 3cfp n ARG 772 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3cfp n GLN 773 N -1.38 1.08 -1.80 5.56 3.00 -0.77 -4.98 117.38 118.09 3cfp n GLN 773 Ca 0.08 -0.66 -0.33 0.00 -0.01 0.00 0.00 57.00 56.09 3cfp n GLN 773 Cb 0.21 -1.43 0.04 0.00 0.00 0.00 0.00 30.24 29.06 3cfp n GLN 773 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3cfp s LEU 774 N -2.54 3.38 0.24 1.08 1.43 -1.17 -4.99 118.68 116.10 3cfp s LEU 774 Ca 0.14 1.89 -0.30 0.00 -1.03 0.00 0.00 54.13 54.84 3cfp s LEU 774 Cb 0.16 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.75 3cfp s LEU 774 CO 0.62 -1.49 1.27 0.21 0.23 0.00 0.00 176.35 177.18 3cfp s ASN 775 N -2.81 6.94 0.27 2.29 3.84 -1.26 -4.93 114.94 119.28 3cfp s ASN 775 Ca 0.65 2.42 0.00 0.00 0.21 0.00 0.00 52.86 56.14 3cfp s ASN 775 Cb -0.18 -2.62 0.61 0.00 -0.55 0.00 0.00 41.25 38.51 3cfp s ASN 775 CO 0.42 -0.46 1.71 0.10 -2.79 0.00 0.00 177.10 176.08 3cfp h TYR 776 N 4.74 0.59 -0.89 0.43 -0.00 -1.98 0.13 116.97 119.98 3cfp h TYR 776 Ca -0.46 0.04 0.03 0.00 0.00 0.00 0.00 58.73 58.34 3cfp h TYR 776 Cb 1.22 -0.13 -0.05 0.00 0.00 0.00 0.00 36.73 37.77 3cfp h TYR 776 CO 0.60 0.01 0.58 0.82 -0.00 0.00 0.00 178.16 180.17 3cfp h ILE 777 N 0.43 1.17 0.00 -0.90 2.04 -1.96 -1.94 117.51 116.35 3cfp h ILE 777 Ca 0.50 -0.39 -0.07 0.00 1.00 0.00 0.00 64.86 65.90 3cfp h ILE 777 Cb 0.86 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 3cfp h ILE 777 CO -0.48 0.21 -0.32 0.77 0.00 0.00 0.00 178.15 178.33 3cfp h SER 778 N 1.13 0.00 -0.08 1.72 4.64 -1.12 -3.11 113.55 116.74 3cfp h SER 778 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3cfp h SER 778 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3cfp h SER 778 CO -0.10 0.32 0.00 2.30 -0.87 0.00 0.00 176.83 178.48 3cfp n ILE 779 N -3.74 0.08 -2.70 0.95 -5.35 -0.91 -0.62 119.36 107.06 3cfp n ILE 779 Ca -0.01 -0.54 -0.35 0.00 -0.27 0.00 0.00 62.75 61.58 3cfp n ILE 779 Cb 0.41 1.36 -0.06 0.00 -1.74 0.00 0.00 39.64 39.62 3cfp n ILE 779 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3cfp s ALA 780 N -1.68 3.08 0.63 -1.28 0.00 -0.78 -4.69 121.76 117.04 3cfp s ALA 780 Ca 0.26 0.54 -0.09 0.00 0.00 0.00 0.00 51.96 52.67 3cfp s ALA 780 Cb 0.18 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 3cfp s ALA 780 CO 0.26 -0.01 0.99 -1.12 0.00 0.00 0.00 175.76 175.89 3cfp s SER 781 N -1.83 5.78 0.12 0.00 0.01 -0.64 -3.51 113.70 113.63 3cfp s SER 781 Ca 0.58 1.07 0.09 0.00 1.31 0.00 0.00 55.95 59.01 3cfp s SER 781 Cb -0.16 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 63.98 3cfp s SER 781 CO 0.21 -1.06 -0.23 -0.69 0.41 0.00 0.00 173.24 171.88 3cfp s VAL 782 N -3.14 1.92 0.07 3.43 1.01 -0.52 -0.53 120.40 122.63 3cfp s VAL 782 Ca 0.55 -1.67 -0.26 0.00 0.00 0.00 0.00 61.98 60.59 3cfp s VAL 782 Cb -0.11 -1.75 0.08 0.00 0.00 0.00 0.00 36.38 34.60 3cfp s VAL 782 CO 0.50 -0.05 0.72 -0.55 0.00 0.00 0.00 175.10 175.72 3cfp s SER 783 N -2.08 -0.51 0.43 3.32 0.15 -0.46 -4.40 113.70 110.15 3cfp s SER 783 Ca 0.10 0.13 -0.13 0.00 0.70 0.00 0.00 55.95 56.74 3cfp s SER 783 Cb -0.09 0.51 -0.07 0.00 -1.71 0.00 0.00 66.02 64.65 3cfp s SER 783 CO 0.05 -0.78 0.84 -0.44 1.20 0.00 0.00 173.24 174.11 3cfp s SER 784 N -2.36 6.61 -0.92 5.45 0.01 -1.26 0.51 113.70 121.74 3cfp s SER 784 Ca 0.00 1.31 0.00 0.00 1.31 0.00 0.00 55.95 58.57 3cfp s SER 784 Cb -0.01 -2.40 0.31 0.00 0.21 0.00 0.00 66.02 64.14 3cfp s SER 784 CO -0.08 -0.42 1.47 0.00 0.41 0.00 0.00 173.24 174.62 3cfp n ALA 785 N -1.20 5.38 -2.43 1.44 0.00 0.10 -4.86 120.51 118.95 3cfp n ALA 785 Ca 0.04 -4.70 -0.39 0.00 0.00 0.00 0.00 53.44 48.39 3cfp n ALA 785 Cb 0.54 -1.83 -0.05 0.00 0.00 0.00 0.00 19.45 18.11 3cfp n ALA 785 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3cfp s ASN 786 N -1.98 7.08 -1.10 0.00 0.01 -1.26 -0.72 114.94 116.97 3cfp s ASN 786 Ca 0.39 1.29 -0.07 0.00 -0.71 0.00 0.00 52.86 53.76 3cfp s ASN 786 Cb 0.17 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.42 3cfp s ASN 786 CO -0.06 0.08 0.89 0.59 -1.51 0.00 0.00 177.10 177.09 3cfp n ASN 787 N 2.69 -5.46 -0.00 -1.22 5.03 -1.26 -4.93 115.26 110.10 3cfp n ASN 787 Ca -0.05 -0.40 -0.13 0.00 0.87 0.00 0.00 54.58 54.86 3cfp n ASN 787 Cb 0.51 -4.09 -0.07 0.00 -1.02 0.00 0.00 39.78 35.10 3cfp n ASN 787 CO 0.00 0.00 0.00 0.40 -1.83 0.00 0.00 177.26 175.83 3cfp h ILE 788 N -2.02 0.09 -0.60 2.41 2.04 -1.99 -2.82 117.51 114.61 3cfp h ILE 788 Ca -0.45 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.53 3cfp h ILE 788 Cb 1.29 0.09 -0.12 0.00 -0.74 0.00 0.00 36.82 37.35 3cfp h ILE 788 CO 0.45 0.00 -0.18 0.00 0.00 0.00 0.00 178.15 178.42 3cfp h ALA 789 N -0.02 0.35 -0.93 1.87 0.00 -1.96 -1.74 119.26 116.82 3cfp h ALA 789 Ca 0.06 0.23 0.25 0.00 0.00 0.00 0.00 54.91 55.46 3cfp h ALA 789 Cb 0.65 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 3cfp h ALA 789 CO -0.42 -0.46 0.65 -0.22 0.00 0.00 0.00 179.25 178.81 3cfp h LYS 790 N -0.03 0.13 -0.02 0.00 3.64 -1.90 0.60 116.57 119.01 3cfp h LYS 790 Ca 0.29 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3cfp h LYS 790 Cb 0.47 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3cfp h LYS 790 CO -0.64 0.09 -0.09 0.66 -2.27 0.00 0.00 179.45 177.21 3cfp n TYR 791 N -4.36 0.00 0.18 1.91 4.02 -0.70 -4.74 117.16 113.47 3cfp n TYR 791 Ca 0.20 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 58.01 3cfp n TYR 791 Cb 0.91 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.19 3cfp n TYR 791 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 176.86 176.07 3cfp h ASP 792 N 2.52 -0.54 -6.69 7.72 -0.00 -0.35 0.48 116.42 119.55 3cfp h ASP 792 Ca 0.00 0.03 -0.49 0.00 -0.00 0.00 0.00 57.03 56.58 3cfp h ASP 792 Cb 0.58 0.16 0.00 0.00 -0.00 0.00 0.00 39.33 40.07 3cfp h ASP 792 CO 0.00 -0.32 -1.01 0.52 -0.00 0.00 0.00 179.24 178.43 3cfp n VAL 793 N -3.60 -3.71 -0.80 2.25 0.31 -1.26 -2.63 118.33 108.88 3cfp n VAL 793 Ca -0.06 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 3cfp n VAL 793 Cb 0.22 -3.09 0.00 0.00 -0.91 0.00 0.00 33.84 30.06 3cfp n VAL 793 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3cfp n GLY 794 N -1.76 0.51 2.17 2.92 0.00 -1.26 -3.79 105.19 103.98 3cfp n GLY 794 Ca -0.25 -0.78 -0.00 0.00 0.00 0.00 0.00 46.02 44.99 3cfp n GLY 794 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfp n GLY 795 N -2.80 0.42 3.23 -0.02 0.00 -1.08 -5.02 105.19 99.92 3cfp n GLY 795 Ca 0.00 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 3cfp n GLY 795 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3cfp s PHE 796 N -1.83 1.69 -0.45 1.61 0.08 -1.14 -4.78 117.98 113.17 3cfp s PHE 796 Ca 0.00 -0.38 -0.44 0.00 0.12 0.00 0.00 56.93 56.23 3cfp s PHE 796 Cb 0.00 -1.00 -0.18 0.00 -0.57 0.00 0.00 43.02 41.27 3cfp s PHE 796 CO 0.00 0.09 1.78 -2.30 -0.10 0.00 0.00 175.22 174.69 3cfp n PRO 797 N 1.76 0.29 0.00 0.24 -0.01 -1.26 -4.40 135.00 131.62 3cfp n PRO 797 Ca -0.18 0.10 0.00 0.00 -0.01 0.00 0.00 63.50 63.41 3cfp n PRO 797 Cb 0.54 -1.67 0.00 0.00 -0.01 0.00 0.00 33.50 32.35 3cfp n PRO 797 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3cfp n GLY 798 N 4.93 -1.22 3.74 -1.23 0.00 0.16 -4.94 105.19 106.62 3cfp n GLY 798 Ca 0.36 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 3cfp n GLY 798 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cfp s PRO 799 N -0.58 4.73 -1.71 1.61 0.05 -1.26 -2.99 135.00 134.86 3cfp s PRO 799 Ca 0.00 1.50 0.00 0.00 0.05 0.00 0.00 61.00 62.55 3cfp s PRO 799 Cb 0.00 -3.33 0.00 0.00 0.05 0.00 0.00 34.50 31.22 3cfp s PRO 799 CO 0.00 0.28 0.00 1.17 0.05 0.00 0.00 177.00 178.50 3cfp n LYS 800 N 2.35 -1.70 -1.69 4.56 4.81 -1.26 -4.89 118.16 120.35 3cfp n LYS 800 Ca 0.01 0.96 -0.44 0.00 -0.87 0.00 0.00 58.31 57.97 3cfp n LYS 800 Cb 0.48 -5.51 -0.04 0.00 0.02 0.00 0.00 35.03 29.98 3cfp n LYS 800 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3cfp s PRO 802 N 2.36 2.61 0.20 0.00 0.02 -1.26 -4.80 135.00 134.12 3cfp s PRO 802 Ca 0.82 1.97 -0.11 0.00 0.02 0.00 0.00 61.00 63.70 3cfp s PRO 802 Cb -0.57 -1.87 0.22 0.00 0.02 0.00 0.00 34.50 32.31 3cfp s PRO 802 CO 0.39 -1.52 1.75 0.35 -0.33 0.00 0.00 177.00 177.63 3cfp h PHE 803 N 0.54 0.35 -0.37 6.54 3.57 -1.99 0.39 116.94 125.97 3cfp h PHE 803 Ca -0.50 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.92 3cfp h PHE 803 Cb 1.32 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 3cfp h PHE 803 CO 0.43 0.10 -0.18 1.12 -2.23 0.00 0.00 178.31 177.55 3cfp h HIS 804 N 0.38 0.89 -0.88 0.41 2.07 -1.97 -2.25 115.15 113.81 3cfp h HIS 804 Ca 0.27 -0.22 0.00 0.00 -2.85 0.00 0.00 60.37 57.57 3cfp h HIS 804 Cb 0.31 -0.21 -0.04 0.00 2.57 0.00 0.00 27.41 30.05 3cfp h HIS 804 CO -0.17 0.96 0.55 0.82 -3.07 0.00 0.00 177.93 177.02 3cfp h ILE 805 N 0.57 1.24 -0.58 6.12 1.08 -1.76 -0.02 117.51 124.15 3cfp h ILE 805 Ca 0.08 -0.48 0.06 0.00 -0.39 0.00 0.00 64.86 64.13 3cfp h ILE 805 Cb 0.73 -0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.40 3cfp h ILE 805 CO 0.05 0.24 0.29 -0.09 -0.69 0.00 0.00 178.15 177.96 3cfp h ARG 806 N 1.20 0.53 -0.24 2.37 2.43 -0.68 -1.60 114.38 118.39 3cfp h ARG 806 Ca 0.32 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.41 3cfp h ARG 806 Cb -0.08 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 3cfp h ARG 806 CO -0.06 0.35 -0.06 0.78 -1.51 0.00 0.00 179.97 179.47 3cfp h GLY 807 N 0.55 0.40 0.86 2.80 0.00 -0.44 -1.52 103.07 105.72 3cfp h GLY 807 Ca 0.26 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.27 3cfp h GLY 807 CO -0.19 0.22 -0.19 -2.22 0.00 0.00 0.00 176.54 174.16 3cfp h ILE 808 N 0.36 1.32 -0.94 2.60 2.04 -0.84 -0.02 117.51 122.03 3cfp h ILE 808 Ca 0.08 -1.33 0.13 0.00 1.00 0.00 0.00 64.86 64.73 3cfp h ILE 808 Cb 0.34 1.68 -0.09 0.00 -0.74 0.00 0.00 36.82 38.02 3cfp h ILE 808 CO 0.02 0.41 0.56 -0.07 0.00 0.00 0.00 178.15 179.07 3cfp h LEU 809 N 0.23 0.78 -0.63 1.44 3.38 -0.51 0.23 115.31 120.23 3cfp h LEU 809 Ca 0.04 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 3cfp h LEU 809 Cb 0.73 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3cfp h LEU 809 CO 0.05 0.39 -0.38 0.71 0.09 0.00 0.00 178.44 179.30 3cfp h THR 810 N 0.85 1.29 0.27 0.22 1.35 -1.19 -1.94 112.91 113.77 3cfp h THR 810 Ca 0.48 -1.54 -0.01 0.00 -0.55 0.00 0.00 66.41 64.80 3cfp h THR 810 Cb 0.56 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.45 3cfp h THR 810 CO -0.30 0.49 -0.19 0.22 -0.25 0.00 0.00 175.52 175.50 3cfp h TYR 811 N 0.55 -0.51 -0.93 4.73 3.20 -0.29 -0.94 116.97 122.78 3cfp h TYR 811 Ca 0.05 -0.00 0.27 0.00 3.14 0.00 0.00 58.73 62.19 3cfp h TYR 811 Cb 0.90 0.19 -0.15 0.00 1.54 0.00 0.00 36.73 39.20 3cfp h TYR 811 CO 0.04 -0.27 0.32 -0.91 -1.64 0.00 0.00 178.16 175.70 3cfp h ASN 812 N -0.44 0.12 -0.46 -2.11 2.35 -0.61 0.73 115.58 115.15 3cfp h ASN 812 Ca -0.04 0.21 -0.09 0.00 -0.55 0.00 0.00 56.30 55.83 3cfp h ASN 812 Cb 0.36 0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 3cfp h ASN 812 CO 0.02 -0.18 -0.04 -0.09 -1.65 0.00 0.00 177.43 175.49 3cfp h ARG 813 N 0.21 0.90 0.00 0.81 2.43 -1.32 -2.19 114.38 115.22 3cfp h ARG 813 Ca 0.62 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 3cfp h ARG 813 Cb 1.34 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3cfp h ARG 813 CO -0.67 0.92 -0.04 0.00 -1.51 0.00 0.00 179.97 178.67 3cfp n ALA 814 N -2.48 2.34 -0.45 2.80 0.00 0.23 -3.26 120.51 119.68 3cfp n ALA 814 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.47 3cfp n ALA 814 Cb 0.34 -1.45 0.17 0.00 0.00 0.00 0.00 19.45 18.52 3cfp n ALA 814 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3cfp n ILE 815 N -2.13 1.44 -1.69 0.00 -5.35 0.15 -4.97 119.36 106.82 3cfp n ILE 815 Ca 0.06 -1.33 -0.42 0.00 -0.27 0.00 0.00 62.75 60.79 3cfp n ILE 815 Cb 0.42 0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.55 3cfp n ILE 815 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 3cfp n LYS 816 N 0.02 2.00 0.00 6.28 4.81 -0.84 -3.91 118.16 126.53 3cfp n LYS 816 Ca 0.14 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 3cfp n LYS 816 Cb 0.57 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.29 3cfp n LYS 816 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3cfp n GLY 817 N 0.81 1.85 3.58 3.14 0.00 -1.26 -4.90 105.19 108.40 3cfp n GLY 817 Ca 0.06 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 3cfp n GLY 817 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfp s ASN 818 N -0.41 6.24 -0.56 1.61 2.20 -1.25 -4.90 114.94 117.86 3cfp s ASN 818 Ca 0.00 -2.06 -0.26 0.00 -0.94 0.00 0.00 52.86 49.60 3cfp s ASN 818 Cb 0.00 -2.58 -0.06 0.00 -2.00 0.00 0.00 41.25 36.61 3cfp s ASN 818 CO 0.00 -1.79 2.23 -0.63 -2.94 0.00 0.00 177.10 173.97 3cfp s ILE 819 N 6.40 3.12 0.00 0.54 1.01 -1.26 -2.95 121.20 128.06 3cfp s ILE 819 Ca 0.58 0.05 0.00 0.00 0.00 0.00 0.00 60.65 61.28 3cfp s ILE 819 Cb 0.02 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3cfp s ILE 819 CO 0.07 -0.31 0.00 -0.67 0.00 0.00 0.00 174.94 174.03 3cfp n ASP 820 N 15.12 0.00 -4.77 3.58 4.64 -1.26 -4.17 116.55 129.69 3cfp n ASP 820 Ca 0.33 0.00 -0.40 0.00 -1.38 0.00 0.00 54.79 53.33 3cfp n ASP 820 Cb 0.53 0.02 -0.02 0.00 -1.04 0.00 0.00 41.12 40.61 3cfp n ASP 820 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3cfp s ALA 821 N -1.53 3.43 0.28 -1.67 0.00 -1.15 -4.72 121.76 116.40 3cfp s ALA 821 Ca 0.00 1.16 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 3cfp s ALA 821 Cb 0.00 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 3cfp s ALA 821 CO 0.00 -0.55 1.45 -1.25 0.00 0.00 0.00 175.76 175.41 3cfp s PRO 822 N -1.80 4.24 0.02 0.00 0.04 -1.26 -4.95 135.00 131.29 3cfp s PRO 822 Ca 0.49 2.36 -0.20 0.00 0.04 0.00 0.00 61.00 63.69 3cfp s PRO 822 Cb -0.37 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 31.04 3cfp s PRO 822 CO 0.49 -0.43 0.58 -0.65 0.04 0.00 0.00 177.00 177.04 3cfp s GLN 823 N -0.82 4.27 -0.06 4.56 -1.52 -1.26 -4.91 119.66 119.92 3cfp s GLN 823 Ca 0.57 0.73 -0.29 0.00 -1.95 0.00 0.00 55.36 54.42 3cfp s GLN 823 Cb -0.43 -3.31 -0.07 0.00 -0.22 0.00 0.00 33.01 28.98 3cfp s GLN 823 CO 0.48 0.46 2.05 0.08 -0.25 0.00 0.00 175.29 178.11 3cfp s VAL 824 N -0.51 3.04 0.06 1.09 1.01 -1.26 -4.93 120.40 118.91 3cfp s VAL 824 Ca 0.30 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 3cfp s VAL 824 Cb -0.19 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 3cfp s VAL 824 CO 0.18 -0.01 1.16 -0.69 0.00 0.00 0.00 175.10 175.73 3cfp s VAL 825 N 5.87 4.14 0.06 2.92 1.01 -1.26 -4.96 120.40 128.18 3cfp s VAL 825 Ca 0.92 1.55 -0.31 0.00 0.00 0.00 0.00 61.98 64.15 3cfp s VAL 825 Cb -0.39 -4.00 -0.08 0.00 0.00 0.00 0.00 36.38 31.92 3cfp s VAL 825 CO 0.39 0.13 1.65 -0.70 0.00 0.00 0.00 175.10 176.57 3cfp s GLU 826 N 0.94 4.20 0.00 2.72 -6.30 -1.26 -1.96 118.70 117.04 3cfp s GLU 826 Ca 0.57 2.32 0.00 0.00 -2.50 0.00 0.00 54.97 55.37 3cfp s GLU 826 Cb -0.28 -3.62 0.00 0.00 0.00 0.00 0.00 34.13 30.22 3cfp s GLU 826 CO 0.29 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 175.24 3cfp n GLY 827 N 4.00 0.96 3.97 -1.50 0.00 0.10 -5.01 105.19 107.72 3cfp n GLY 827 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 3cfp n GLY 827 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cfp s GLU 828 N -0.50 2.57 0.28 1.61 0.41 -0.83 -4.42 118.70 117.81 3cfp s GLU 828 Ca 0.00 -0.75 -0.18 0.00 -0.41 0.00 0.00 54.97 53.63 3cfp s GLU 828 Cb 0.00 -2.48 -0.09 0.00 -1.78 0.00 0.00 34.13 29.78 3cfp s GLU 828 CO 0.00 -0.70 0.75 0.15 -0.49 0.00 0.00 175.26 174.97 3cfp s LYS 829 N -4.76 4.16 0.03 1.61 -0.14 -1.26 0.02 119.74 119.41 3cfp s LYS 829 Ca 0.57 0.82 0.03 0.00 -1.36 0.00 0.00 55.97 56.03 3cfp s LYS 829 Cb -0.10 -2.66 -0.02 0.00 -1.68 0.00 0.00 37.83 33.37 3cfp s LYS 829 CO 0.39 0.27 -0.09 0.14 -0.76 0.00 0.00 175.35 175.29 3cfp s VAL 830 N -1.75 0.69 0.39 3.17 -7.23 0.18 -1.69 120.40 114.16 3cfp s VAL 830 Ca 0.49 -0.89 -0.24 0.00 -1.81 0.00 0.00 61.98 59.53 3cfp s VAL 830 Cb -0.14 -0.68 -0.09 0.00 0.56 0.00 0.00 36.38 36.03 3cfp s VAL 830 CO 0.19 -0.17 1.02 -0.31 -0.31 0.00 0.00 175.10 175.53 3cfp s TYR 831 N -0.96 3.34 -0.01 2.82 2.02 0.06 -1.35 117.35 123.27 3cfp s TYR 831 Ca -0.04 1.66 0.01 0.00 -0.37 0.00 0.00 57.07 58.34 3cfp s TYR 831 Cb -0.08 -3.07 0.00 0.00 -0.40 0.00 0.00 41.96 38.42 3cfp s TYR 831 CO 0.01 -0.44 -0.04 0.08 -1.57 0.00 0.00 175.55 173.58 3cfp s VAL 832 N -1.71 0.40 -0.02 0.71 1.01 0.31 -1.84 120.40 119.26 3cfp s VAL 832 Ca 0.57 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.41 3cfp s VAL 832 Cb -0.20 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.81 3cfp s VAL 832 CO 0.25 0.14 -0.08 -0.76 0.00 0.00 0.00 175.10 174.65 3cfp s LEU 833 N 0.20 1.84 0.46 3.92 1.43 0.11 -1.62 118.68 125.03 3cfp s LEU 833 Ca -0.02 -0.17 -0.21 0.00 -1.03 0.00 0.00 54.13 52.70 3cfp s LEU 833 Cb -0.06 -0.49 -0.09 0.00 0.03 0.00 0.00 46.19 45.59 3cfp s LEU 833 CO -0.00 0.07 1.03 -2.16 0.23 0.00 0.00 176.35 175.51 3cfp s PRO 834 N 0.09 3.94 -0.10 1.29 0.04 -1.26 -1.06 135.00 137.94 3cfp s PRO 834 Ca -0.01 1.35 -0.00 0.00 0.04 0.00 0.00 61.00 62.38 3cfp s PRO 834 Cb -0.07 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 3cfp s PRO 834 CO 0.00 -0.31 -0.08 -0.51 0.04 0.00 0.00 177.00 176.14 3cfp s LEU 835 N -3.27 3.04 0.50 -3.56 1.02 0.15 -2.50 118.68 114.06 3cfp s LEU 835 Ca 0.65 -0.13 -0.20 0.00 0.02 0.00 0.00 54.13 54.47 3cfp s LEU 835 Cb -0.16 -1.68 -0.08 0.00 0.02 0.00 0.00 46.19 44.29 3cfp s LEU 835 CO 0.20 0.27 1.04 -0.60 0.02 0.00 0.00 176.35 177.28 3cfp s ARG 836 N -0.27 3.76 -0.25 1.70 3.00 -0.74 -4.64 118.95 121.50 3cfp s ARG 836 Ca 0.03 1.33 -0.37 0.00 -1.00 0.00 0.00 55.73 55.72 3cfp s ARG 836 Cb -0.13 -2.09 -0.13 0.00 0.00 0.00 0.00 34.95 32.60 3cfp s ARG 836 CO 0.03 -0.46 1.91 -1.91 0.00 0.00 0.00 175.30 174.86 3cfp n GLU 837 N -1.10 1.40 -1.60 5.12 2.13 -1.26 -3.26 120.64 122.07 3cfp n GLU 837 Ca 0.09 0.48 0.00 0.00 0.66 0.00 0.00 57.16 58.40 3cfp n GLU 837 Cb 0.53 -2.34 0.00 0.00 0.27 0.00 0.00 31.44 29.90 3cfp n GLU 837 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cfp n GLY 838 N 4.91 0.74 3.98 8.31 0.00 -1.26 -5.10 105.19 116.78 3cfp n GLY 838 Ca 0.30 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 3cfp n GLY 838 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfp s ASN 839 N -2.57 5.66 0.00 1.61 2.20 -1.20 -5.01 114.94 115.63 3cfp s ASN 839 Ca 0.00 -0.10 0.25 0.00 -0.94 0.00 0.00 52.86 52.07 3cfp s ASN 839 Cb 0.00 -1.04 1.21 0.00 -2.00 0.00 0.00 41.25 39.43 3cfp s ASN 839 CO 0.00 -0.78 1.84 -0.81 -2.94 0.00 0.00 177.10 174.41 3cfp n PRO 840 N -1.99 0.24 0.04 3.55 -0.04 -1.26 -2.67 135.00 132.87 3cfp n PRO 840 Ca 0.05 0.05 0.13 0.00 -0.04 0.00 0.00 63.50 63.69 3cfp n PRO 840 Cb 0.59 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.89 3cfp n PRO 840 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3cfp n PHE 841 N -1.36 0.33 -1.79 0.54 3.72 -1.26 -4.95 117.46 112.70 3cfp n PHE 841 Ca 0.10 0.10 -0.14 0.00 -0.05 0.00 0.00 57.45 57.46 3cfp n PHE 841 Cb 0.23 -0.55 -0.04 0.00 -0.94 0.00 0.00 39.48 38.18 3cfp n PHE 841 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3cfp n GLY 842 N 1.42 0.70 3.22 1.37 0.00 -1.09 -4.95 105.19 105.86 3cfp n GLY 842 Ca 0.05 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 3cfp n GLY 842 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3cfp n ASP 843 N -0.42 -1.75 -0.80 1.61 -0.08 -1.26 -5.09 116.55 108.75 3cfp n ASP 843 Ca -0.15 -2.51 0.08 0.00 -1.51 0.00 0.00 54.79 50.70 3cfp n ASP 843 Cb 0.53 3.00 0.15 0.00 2.34 0.00 0.00 41.12 47.15 3cfp n ASP 843 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 3cfp n LYS 844 N -0.49 2.13 -3.56 -0.67 -0.00 -1.26 -4.76 118.16 109.55 3cfp n LYS 844 Ca -0.05 -1.93 -0.07 0.00 -0.00 0.00 0.00 58.31 56.26 3cfp n LYS 844 Cb 0.53 -1.35 -0.02 0.00 -0.00 0.00 0.00 35.03 34.18 3cfp n LYS 844 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3cfp s ILE 846 N -3.08 0.06 0.12 0.00 2.07 -0.22 -4.42 121.20 115.72 3cfp s ILE 846 Ca 0.07 -0.52 0.05 0.00 -1.41 0.00 0.00 60.65 58.84 3cfp s ILE 846 Cb -0.01 -0.31 -0.04 0.00 0.13 0.00 0.00 42.46 42.23 3cfp s ILE 846 CO -0.06 -0.29 -0.12 0.00 -1.91 0.00 0.00 174.94 172.56 3cfp s ALA 847 N -0.95 1.36 0.13 1.50 0.00 -0.09 -0.71 121.76 122.99 3cfp s ALA 847 Ca -0.10 -1.29 -0.16 0.00 0.00 0.00 0.00 51.96 50.41 3cfp s ALA 847 Cb -0.06 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.07 3cfp s ALA 847 CO 0.01 0.03 0.39 1.67 0.00 0.00 0.00 175.76 177.85 3cfp s TRP 848 N -2.42 -0.17 0.24 0.00 -2.14 -0.76 -4.50 118.94 109.19 3cfp s TRP 848 Ca 0.09 -0.15 -0.31 0.00 2.66 0.00 0.00 56.10 58.38 3cfp s TRP 848 Cb -0.03 0.24 -0.13 0.00 -3.10 0.00 0.00 33.47 30.45 3cfp s TRP 848 CO 0.02 -0.70 1.42 -2.30 -2.66 0.00 0.00 176.95 172.72 3cfp n PRO 849 N -0.22 2.07 -1.16 3.25 -0.02 -1.26 -0.76 135.00 136.90 3cfp n PRO 849 Ca -0.16 0.74 -0.30 0.00 -2.02 0.00 0.00 63.50 61.76 3cfp n PRO 849 Cb 0.64 -2.40 0.13 0.00 -0.02 0.00 0.00 33.50 31.85 3cfp n PRO 849 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cfp s SER 850 N 0.31 3.56 0.00 2.55 1.04 -0.68 -3.69 113.70 116.79 3cfp s SER 850 Ca 0.68 1.60 0.00 0.00 0.48 0.00 0.00 55.95 58.71 3cfp s SER 850 Cb -0.64 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.21 3cfp s SER 850 CO 0.49 -2.60 0.00 0.61 0.98 0.00 0.00 173.24 172.72 3cfp n GLY 851 N -0.99 1.97 3.69 7.32 0.00 -1.26 -4.86 105.19 111.06 3cfp n GLY 851 Ca 0.08 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 3cfp n GLY 851 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3cfp n THR 852 N 0.00 2.81 -2.89 2.61 -2.24 -1.24 -5.04 114.28 108.30 3cfp n THR 852 Ca 0.00 -0.30 -0.33 0.00 -2.27 0.00 0.00 64.05 61.15 3cfp n THR 852 Cb 0.00 -1.25 -0.07 0.00 -2.10 0.00 0.00 70.33 66.92 3cfp n THR 852 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3cfp s GLU 853 N -3.82 4.16 0.52 -0.78 0.41 -1.26 -4.95 118.70 112.98 3cfp s GLU 853 Ca 0.75 1.00 -0.20 0.00 -0.41 0.00 0.00 54.97 56.11 3cfp s GLU 853 Cb -0.32 -2.24 -0.06 0.00 -1.78 0.00 0.00 34.13 29.73 3cfp s GLU 853 CO 0.48 0.01 1.14 0.42 -0.49 0.00 0.00 175.26 176.82 3cfp s ILE 854 N -2.15 3.15 0.41 -1.63 1.01 -1.26 -4.96 121.20 115.77 3cfp s ILE 854 Ca 0.60 0.76 -0.27 0.00 0.00 0.00 0.00 60.65 61.74 3cfp s ILE 854 Cb -0.09 -3.33 -0.10 0.00 0.01 0.00 0.00 42.46 38.95 3cfp s ILE 854 CO 0.15 -0.11 1.47 0.42 0.00 0.00 0.00 174.94 176.86 3cfp s THR 855 N -1.70 2.03 0.55 2.92 -4.23 -1.26 -4.65 115.64 109.29 3cfp s THR 855 Ca 0.70 0.02 0.31 0.00 -1.18 0.00 0.00 61.69 61.55 3cfp s THR 855 Cb -0.25 -3.02 0.31 0.00 1.34 0.00 0.00 72.50 70.88 3cfp s THR 855 CO 0.29 0.00 1.94 0.44 -0.54 0.00 0.00 174.62 176.76 3cfp h ASP 856 N 2.68 0.00 -0.70 3.99 5.19 -1.98 -0.72 116.42 124.88 3cfp h ASP 856 Ca -0.51 0.00 0.20 0.00 -0.62 0.00 0.00 57.03 56.10 3cfp h ASP 856 Cb 1.25 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.73 3cfp h ASP 856 CO 0.63 0.00 0.50 -0.07 -3.12 0.00 0.00 179.24 177.18 3cfp h LEU 857 N 0.00 0.04 -0.39 1.55 3.38 -2.01 -3.11 115.31 114.78 3cfp h LEU 857 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3cfp h LEU 857 Cb 0.47 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3cfp h LEU 857 CO 0.00 0.02 0.00 2.30 0.09 0.00 0.00 178.44 180.85 3cfp n ILE 858 N -4.35 0.00 -0.17 1.22 -5.35 -0.32 -4.90 119.36 105.49 3cfp n ILE 858 Ca 0.14 -0.24 -0.05 0.00 -0.27 0.00 0.00 62.75 62.34 3cfp n ILE 858 Cb 0.75 1.44 0.05 0.00 -1.74 0.00 0.00 39.64 40.13 3cfp n ILE 858 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3cfp h LYS 859 N 0.00 0.53 -0.01 6.28 3.64 -1.37 -2.38 116.57 123.26 3cfp h LYS 859 Ca 0.00 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 3cfp h LYS 859 Cb 0.22 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 3cfp h LYS 859 CO 0.00 0.35 -0.75 -0.44 -2.27 0.00 0.00 179.45 176.34 3cfp h ASP 860 N 0.55 0.09 0.30 4.20 3.45 -1.90 -2.16 116.42 120.95 3cfp h ASP 860 Ca 0.22 -0.06 -0.12 0.00 0.43 0.00 0.00 57.03 57.50 3cfp h ASP 860 Cb 0.09 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.82 3cfp h ASP 860 CO -0.13 0.81 -0.48 0.44 -1.57 0.00 0.00 179.24 178.31 3cfp h ASP 861 N 0.04 0.23 -0.35 6.45 3.45 -1.90 -2.56 116.42 121.80 3cfp h ASP 861 Ca -0.02 -0.11 -0.07 0.00 0.43 0.00 0.00 57.03 57.27 3cfp h ASP 861 Cb 1.32 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 40.02 3cfp h ASP 861 CO 0.10 0.68 -0.05 1.62 -1.57 0.00 0.00 179.24 180.02 3cfp h VAL 862 N 0.18 1.27 -0.24 -1.35 3.04 -1.06 -2.29 116.25 115.80 3cfp h VAL 862 Ca 0.01 -1.08 -0.09 0.00 -1.01 0.00 0.00 66.70 64.53 3cfp h VAL 862 Cb 0.91 1.27 -0.01 0.00 -2.01 0.00 0.00 31.29 31.45 3cfp h VAL 862 CO 0.07 0.36 -0.23 -0.07 -1.01 0.00 0.00 177.57 176.69 3cfp h LEU 863 N 0.44 0.43 0.20 3.16 3.38 -1.30 -2.85 115.31 118.78 3cfp h LEU 863 Ca 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3cfp h LEU 863 Cb 0.54 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3cfp h LEU 863 CO 0.03 0.67 -0.10 -0.74 0.09 0.00 0.00 178.44 178.39 3cfp h HIS 864 N 0.39 -0.25 0.00 1.13 2.76 -1.45 -3.29 115.15 114.44 3cfp h HIS 864 Ca 0.06 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 3cfp h HIS 864 Cb 0.62 0.08 0.00 0.00 1.55 0.00 0.00 27.41 29.66 3cfp h HIS 864 CO 0.02 -0.16 0.00 0.91 -1.30 0.00 0.00 177.93 177.40 3cfp n TRP 865 N -4.87 0.00 -2.28 5.26 7.02 -0.87 -4.84 117.44 116.87 3cfp n TRP 865 Ca -0.03 -0.13 -0.41 0.00 -1.02 0.00 0.00 57.50 55.91 3cfp n TRP 865 Cb 0.11 -0.12 -0.03 0.00 -2.42 0.00 0.00 31.31 28.85 3cfp n TRP 865 CO 0.00 0.00 0.00 -1.64 -2.02 0.00 0.00 177.69 174.03 3cfp s MET 866 N -0.49 4.43 -1.05 -0.99 -1.94 -1.08 -1.80 119.30 116.38 3cfp s MET 866 Ca 0.00 1.99 -0.08 0.00 -1.71 0.00 0.00 55.69 55.89 3cfp s MET 866 Cb 0.00 -3.21 0.26 0.00 2.01 0.00 0.00 34.83 33.89 3cfp s MET 866 CO 0.00 -0.19 1.02 0.34 -0.01 0.00 0.00 175.02 176.18 3cfp s ASP 867 N 0.25 6.99 0.24 3.03 -1.08 -1.04 -4.68 116.67 120.38 3cfp s ASP 867 Ca 0.55 -3.59 -0.07 0.00 -0.52 0.00 0.00 52.55 48.92 3cfp s ASP 867 Cb -0.35 -2.14 0.23 0.00 -1.46 0.00 0.00 42.92 39.20 3cfp s ASP 867 CO 0.38 -0.27 1.90 1.88 0.52 0.00 0.00 175.17 179.58 3cfp h TYR 868 N 6.55 1.22 -0.41 -5.34 0.05 -1.93 -1.09 116.97 116.02 3cfp h TYR 868 Ca 0.17 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.97 3cfp h TYR 868 Cb 0.87 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 38.18 3cfp h TYR 868 CO 0.76 0.79 0.26 1.15 -1.05 0.00 0.00 178.16 180.07 3cfp h THR 869 N 1.29 1.11 -0.12 -2.88 2.02 -1.99 0.38 112.91 112.73 3cfp h THR 869 Ca 0.34 -0.21 -0.15 0.00 0.77 0.00 0.00 66.41 67.16 3cfp h THR 869 Cb -0.10 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3cfp h THR 869 CO -0.07 0.11 -0.58 0.58 0.37 0.00 0.00 175.52 175.92 3cfp h VAL 870 N 0.55 1.35 0.41 3.16 2.07 -1.94 -0.93 116.25 120.93 3cfp h VAL 870 Ca 0.15 -1.90 -0.02 0.00 0.82 0.00 0.00 66.70 65.75 3cfp h VAL 870 Cb -0.05 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3cfp h VAL 870 CO -0.03 0.57 -0.20 -0.07 0.02 0.00 0.00 177.57 177.87 3cfp h LEU 871 N 0.29 -0.46 0.10 2.57 3.38 -0.76 -0.74 115.31 119.69 3cfp h LEU 871 Ca -0.00 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.94 3cfp h LEU 871 Cb 1.11 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 3cfp h LEU 871 CO 0.10 -0.25 -0.21 0.25 0.09 0.00 0.00 178.44 178.42 3cfp h LEU 872 N -0.65 -0.59 0.20 1.67 5.85 -0.23 0.19 115.31 121.75 3cfp h LEU 872 Ca -0.06 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.75 3cfp h LEU 872 Cb 0.48 0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 3cfp h LEU 872 CO 0.09 -0.29 -0.33 -0.08 -0.34 0.00 0.00 178.44 177.49 3cfp h GLU 873 N -0.39 -0.59 0.02 1.25 4.57 -1.20 -0.56 114.58 117.67 3cfp h GLU 873 Ca 0.03 0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 3cfp h GLU 873 Cb 0.42 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3cfp h GLU 873 CO -0.13 -0.39 -0.01 0.87 -1.18 0.00 0.00 179.01 178.17 3cfp h LYS 874 N -0.61 -0.02 0.00 1.92 1.57 -1.06 -0.56 116.57 117.81 3cfp h LYS 874 Ca 0.01 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3cfp h LYS 874 Cb 0.60 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 3cfp h LYS 874 CO -0.14 0.49 -0.89 1.79 -0.57 0.00 0.00 179.45 180.14 3cfp h THR 875 N -0.55 0.36 0.00 -0.16 1.35 -1.02 -3.39 112.91 109.50 3cfp h THR 875 Ca -0.00 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.25 3cfp h THR 875 Cb 0.53 1.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 3cfp h THR 875 CO 0.00 0.21 -0.16 0.33 -0.25 0.00 0.00 175.52 175.65 3cfp n PHE 876 N -2.93 0.00 -0.05 4.73 7.35 -0.49 -4.61 117.46 121.46 3cfp n PHE 876 Ca -0.02 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.58 3cfp n PHE 876 Cb 0.69 -0.08 -0.02 0.00 0.35 0.00 0.00 39.48 40.42 3cfp n PHE 876 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3cfp h ILE 877 N -0.16 0.96 0.21 -2.13 2.04 -1.15 -1.37 117.51 115.91 3cfp h ILE 877 Ca 0.00 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.81 3cfp h ILE 877 Cb 0.16 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 3cfp h ILE 877 CO 0.00 0.04 -0.37 0.50 0.00 0.00 0.00 178.15 178.32 3cfp h LYS 878 N 0.19 -0.63 -0.49 2.37 3.11 -1.28 0.15 116.57 119.99 3cfp h LYS 878 Ca 0.09 0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.97 3cfp h LYS 878 Cb 0.05 0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.40 3cfp h LYS 878 CO -0.09 -0.42 0.26 -1.35 -2.81 0.00 0.00 179.45 175.03 3cfp h PRO 879 N -0.66 0.67 -0.65 1.90 0.11 -1.75 -2.45 132.00 129.16 3cfp h PRO 879 Ca 0.01 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.03 3cfp h PRO 879 Cb 0.65 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.59 3cfp h PRO 879 CO -0.16 0.50 0.34 1.25 -0.21 0.00 0.00 178.00 179.72 3cfp h LEU 880 N 0.67 0.83 -0.59 2.35 6.46 -0.35 -1.77 115.31 122.92 3cfp h LEU 880 Ca 0.17 -0.11 0.10 0.00 -0.12 0.00 0.00 57.88 57.92 3cfp h LEU 880 Cb 0.03 -0.21 -0.07 0.00 -0.73 0.00 0.00 40.66 39.68 3cfp h LEU 880 CO -0.03 0.71 0.19 -0.08 -0.62 0.00 0.00 178.44 178.61 3cfp h GLU 881 N 0.90 0.34 -0.30 1.25 4.57 -0.29 -0.60 114.58 120.45 3cfp h GLU 881 Ca 0.23 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.44 3cfp h GLU 881 Cb 0.08 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 3cfp h GLU 881 CO -0.03 0.23 -0.04 0.78 -1.18 0.00 0.00 179.01 178.77 3cfp h GLY 882 N 0.36 0.26 0.89 1.92 0.00 -1.02 -1.11 103.07 104.36 3cfp h GLY 882 Ca 0.30 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 3cfp h GLY 882 CO -0.33 -0.09 -0.03 0.74 0.00 0.00 0.00 176.54 176.83 3cfp h PHE 883 N 0.04 -0.07 -0.22 5.60 0.04 -0.62 -3.01 116.94 118.70 3cfp h PHE 883 Ca 0.15 -0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.77 3cfp h PHE 883 Cb 0.21 0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 3cfp h PHE 883 CO -0.26 0.06 -0.47 1.79 -0.60 0.00 0.00 178.31 178.83 3cfp h THR 884 N -0.19 1.31 0.72 -1.55 1.35 -1.02 -0.95 112.91 112.58 3cfp h THR 884 Ca -0.01 -1.68 -0.03 0.00 -0.55 0.00 0.00 66.41 64.14 3cfp h THR 884 Cb 0.17 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3cfp h THR 884 CO 0.01 0.53 -0.45 0.28 -0.25 0.00 0.00 175.52 175.64 3cfp h SER 885 N 0.47 -1.14 -0.96 5.36 0.02 -1.26 0.28 113.55 116.31 3cfp h SER 885 Ca 0.03 0.06 0.20 0.00 -0.84 0.00 0.00 61.79 61.24 3cfp h SER 885 Cb 1.00 0.33 -0.11 0.00 0.14 0.00 0.00 62.40 63.76 3cfp h SER 885 CO 0.09 -0.69 0.55 0.00 -1.14 0.00 0.00 176.83 175.64 3cfp h ALA 886 N -1.24 1.59 0.00 3.77 0.00 -1.51 0.18 119.26 122.04 3cfp h ALA 886 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cfp h ALA 886 Cb 0.88 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3cfp h ALA 886 CO 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.21 3cfp n ALA 887 N -2.36 2.28 -3.35 0.00 0.00 -0.36 -2.56 120.51 114.15 3cfp n ALA 887 Ca 0.23 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.37 3cfp n ALA 887 Cb 0.59 -1.43 0.07 0.00 0.00 0.00 0.00 19.45 18.67 3cfp n ALA 887 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3cfp n LYS 888 N -1.39 -6.28 -4.45 0.00 4.76 0.62 -4.41 118.16 107.01 3cfp n LYS 888 Ca 0.10 0.68 -0.22 0.00 -2.87 0.00 0.00 58.31 56.00 3cfp n LYS 888 Cb 0.26 -5.25 -0.10 0.00 -1.84 0.00 0.00 35.03 28.10 3cfp n LYS 888 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3cfp s LEU 889 N -6.01 2.09 -0.03 -0.35 1.43 0.67 -5.03 118.68 111.45 3cfp s LEU 889 Ca 0.39 -1.43 0.04 0.00 -1.03 0.00 0.00 54.13 52.10 3cfp s LEU 889 Cb -0.17 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 45.75 3cfp s LEU 889 CO 0.59 -0.68 -0.16 -1.81 0.23 0.00 0.00 176.35 174.52 3cfp s ASP 890 N -3.49 1.97 0.14 2.29 1.01 -1.26 -4.19 116.67 113.14 3cfp s ASP 890 Ca 0.34 -0.31 0.24 0.00 0.71 0.00 0.00 52.55 53.52 3cfp s ASP 890 Cb 0.08 -0.42 0.24 0.00 1.01 0.00 0.00 42.92 43.82 3cfp s ASP 890 CO 0.15 0.16 1.24 0.10 0.21 0.00 0.00 175.17 177.03 3cfp h TYR 891 N 6.07 0.00 -4.00 4.23 -0.00 -1.95 -3.44 116.97 117.88 3cfp h TYR 891 Ca -0.34 0.00 -0.69 0.00 -0.00 0.00 0.00 58.73 57.70 3cfp h TYR 891 Cb 1.17 0.00 -0.23 0.00 -0.00 0.00 0.00 36.73 37.67 3cfp h TYR 891 CO 0.42 0.00 -0.83 -1.21 -0.00 0.00 0.00 178.16 176.55 3cfp s GLU 892 N -3.21 1.91 0.25 0.10 2.02 -1.26 -4.31 118.70 114.19 3cfp s GLU 892 Ca 0.04 -1.07 -0.31 0.00 0.02 0.00 0.00 54.97 53.66 3cfp s GLU 892 Cb 0.12 -2.11 -0.12 0.00 0.10 0.00 0.00 34.13 32.13 3cfp s GLU 892 CO 0.74 0.52 1.65 0.21 0.02 0.00 0.00 175.26 178.40 3cfp s LYS 893 N -1.55 4.12 0.43 1.61 2.20 -1.26 -5.00 119.74 120.29 3cfp s LYS 893 Ca 0.14 2.59 -0.07 0.00 -0.36 0.00 0.00 55.97 58.27 3cfp s LYS 893 Cb -0.10 -3.05 -0.05 0.00 -1.51 0.00 0.00 37.83 33.12 3cfp s LYS 893 CO 0.05 -0.69 0.75 -1.59 -0.36 0.00 0.00 175.35 173.51 3cfp s LYS 894 N 0.26 3.65 -0.73 4.03 -2.85 -1.26 -4.98 119.74 117.85 3cfp s LYS 894 Ca 0.68 0.28 -0.26 0.00 -1.00 0.00 0.00 55.97 55.68 3cfp s LYS 894 Cb -0.49 -2.42 -0.04 0.00 -2.06 0.00 0.00 37.83 32.83 3cfp s LYS 894 CO 0.41 -0.08 1.93 0.00 0.10 0.00 0.00 175.35 177.70 3cfp s ALA 895 N -2.51 1.90 0.62 0.59 0.00 -1.26 -4.85 121.76 116.26 3cfp s ALA 895 Ca 0.48 -0.98 0.22 0.00 0.00 0.00 0.00 51.96 51.68 3cfp s ALA 895 Cb -0.10 -4.42 0.98 0.00 0.00 0.00 0.00 23.12 19.58 3cfp s ALA 895 CO 0.37 -4.35 1.49 1.03 0.00 0.00 0.00 175.76 174.31 3cfp h SER 896 N 13.59 0.00 0.00 0.00 0.87 -2.01 -3.44 113.55 122.56 3cfp h SER 896 Ca -0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 3cfp h SER 896 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 3cfp h SER 896 CO 1.21 0.00 0.00 -0.11 -0.53 0.00 0.00 176.83 177.40 3cfp n LEU 897 N -3.14 0.00 0.16 2.23 0.00 -1.26 -4.61 117.00 110.37 3cfp n LEU 897 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 56.01 56.24 3cfp n LEU 897 Cb 1.01 0.00 0.33 0.00 0.00 0.00 0.00 43.42 44.76 3cfp n LEU 897 CO 0.18 0.00 0.86 -0.26 0.00 0.00 0.00 177.39 178.17 3cfp h PHE 898 N 0.00 0.00 -0.66 1.96 0.04 -1.99 -3.38 116.94 112.91 3cfp h PHE 898 Ca 0.00 0.00 0.19 0.00 2.80 0.00 0.00 57.97 60.96 3cfp h PHE 898 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 3cfp h PHE 898 CO 0.00 0.00 0.84 -0.44 -0.60 0.00 0.00 178.31 178.11 3cfp h ASP 899 N 0.00 0.00 0.00 2.17 5.19 -1.93 -2.17 116.42 119.68 3cfp h ASP 899 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3cfp h ASP 899 Cb 0.81 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.32 3cfp h ASP 899 CO 0.00 0.00 0.00 0.23 -3.12 0.00 0.00 179.24 176.35 3cfp n MET 900 N -3.35 0.53 0.00 3.56 2.81 -1.26 -5.14 117.12 114.27 3cfp n MET 900 Ca 0.14 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 56.12 3cfp n MET 900 Cb 1.07 -1.26 0.07 0.00 -0.71 0.00 0.00 33.22 32.39 3cfp n MET 900 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67