#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wes s ILE 2 N 0.00 4.91 -0.14 1.12 -4.36 -1.26 -4.72 121.20 116.75 2wes s ILE 2 Ca 0.00 0.57 0.05 0.00 -0.26 0.00 0.00 60.65 61.01 2wes s ILE 2 Cb 0.00 -3.64 -0.12 0.00 1.25 0.00 0.00 42.46 39.94 2wes s ILE 2 CO 0.00 0.01 -0.07 -1.14 0.24 0.00 0.00 174.94 173.98 2wes n ARG 3 N 0.10 1.03 -4.55 0.37 0.63 -1.26 -4.98 116.66 108.00 2wes n ARG 3 Ca -0.01 0.05 -0.22 0.00 -0.92 0.00 0.00 57.85 56.75 2wes n ARG 3 Cb 0.52 -1.32 -0.16 0.00 0.45 0.00 0.00 32.46 31.96 2wes n ARG 3 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2wes s SER 4 N -5.13 1.55 -0.09 6.15 1.04 -1.26 -0.84 113.70 115.12 2wes s SER 4 Ca -0.15 -0.25 0.03 0.00 0.48 0.00 0.00 55.95 56.06 2wes s SER 4 Cb 0.05 -0.43 -0.01 0.00 0.10 0.00 0.00 66.02 65.72 2wes s SER 4 CO 0.42 0.09 -0.19 -0.69 0.98 0.00 0.00 173.24 173.86 2wes s VAL 5 N 0.16 2.61 -0.22 5.02 1.01 0.68 -1.02 120.40 128.65 2wes s VAL 5 Ca -0.04 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 2wes s VAL 5 Cb -0.10 -2.03 0.01 0.00 0.00 0.00 0.00 36.38 34.26 2wes s VAL 5 CO 0.01 0.56 -0.09 -0.69 0.00 0.00 0.00 175.10 174.89 2wes s VAL 6 N -0.05 2.92 -0.21 2.92 1.01 0.58 -1.30 120.40 126.26 2wes s VAL 6 Ca -0.05 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 2wes s VAL 6 Cb -0.14 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.85 2wes s VAL 6 CO 0.04 0.40 0.12 -0.63 0.00 0.00 0.00 175.10 175.04 2wes s ILE 7 N 1.40 5.20 -0.31 2.22 1.01 0.96 -0.88 121.20 130.78 2wes s ILE 7 Ca 0.04 0.12 -0.08 0.00 0.00 0.00 0.00 60.65 60.73 2wes s ILE 7 Cb -0.14 -3.39 0.01 0.00 0.01 0.00 0.00 42.46 38.95 2wes s ILE 7 CO -0.06 0.41 0.11 -0.69 0.00 0.00 0.00 174.94 174.71 2wes s VAL 8 N 0.64 4.14 0.00 2.92 1.01 -0.59 -0.44 120.40 128.08 2wes s VAL 8 Ca 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2wes s VAL 8 Cb -0.12 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.08 2wes s VAL 8 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2wes n GLY 9 N 4.90 3.84 1.67 4.51 0.00 0.91 -0.34 105.19 120.68 2wes n GLY 9 Ca -0.14 -1.36 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 2wes n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wes n GLY 10 N -0.07 5.31 0.00 -0.02 0.00 -1.26 -4.15 105.19 104.99 2wes n GLY 10 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.99 2wes n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wes n GLY 11 N -0.75 -0.49 0.33 -0.02 0.00 -1.26 -4.76 105.19 98.23 2wes n GLY 11 Ca 0.31 -1.62 -0.04 0.00 0.00 0.00 0.00 46.02 44.67 2wes n GLY 11 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2wes h THR 12 N 0.00 1.23 0.08 2.61 2.02 -1.90 -2.50 112.91 114.45 2wes h THR 12 Ca 0.00 -0.47 0.02 0.00 0.77 0.00 0.00 66.41 66.73 2wes h THR 12 Cb 0.00 0.03 -0.03 0.00 -1.74 0.00 0.00 68.15 66.40 2wes h THR 12 CO 0.00 0.23 -0.21 0.00 0.37 0.00 0.00 175.52 175.91 2wes h ALA 13 N 1.29 -0.34 -0.40 6.16 0.00 -1.91 -0.25 119.26 123.81 2wes h ALA 13 Ca 0.30 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 2wes h ALA 13 Cb -0.08 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2wes h ALA 13 CO -0.06 -0.73 0.17 0.78 0.00 0.00 0.00 179.25 179.41 2wes h GLY 14 N -0.39 0.63 1.64 0.00 0.00 -1.70 -1.68 103.07 101.57 2wes h GLY 14 Ca 0.04 -0.33 -0.22 0.00 0.00 0.00 0.00 47.33 46.81 2wes h GLY 14 CO -0.14 0.31 -0.96 1.49 0.00 0.00 0.00 176.54 177.24 2wes h TRP 15 N 0.50 0.49 -0.58 5.60 4.06 -1.38 -1.10 115.95 123.55 2wes h TRP 15 Ca 0.13 -0.28 0.03 0.00 2.06 0.00 0.00 58.89 60.84 2wes h TRP 15 Cb 0.16 -0.05 -0.04 0.00 -1.00 0.00 0.00 29.16 28.23 2wes h TRP 15 CO -0.01 1.11 0.34 0.52 -3.56 0.00 0.00 178.44 176.85 2wes h MET 16 N 0.17 0.65 -0.09 0.49 2.86 -0.99 -0.92 114.93 117.11 2wes h MET 16 Ca -0.07 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2wes h MET 16 Cb 1.61 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 33.12 2wes h MET 16 CO 0.16 0.43 0.05 1.15 1.06 0.00 0.00 176.91 179.76 2wes h THR 17 N 0.67 1.09 -0.16 2.22 2.02 -1.14 -1.46 112.91 116.16 2wes h THR 17 Ca 0.24 -0.26 0.01 0.00 0.77 0.00 0.00 66.41 67.17 2wes h THR 17 Cb 0.04 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2wes h THR 17 CO -0.11 0.08 0.08 0.00 0.37 0.00 0.00 175.52 175.94 2wes h ALA 18 N 0.94 0.19 -0.12 6.16 0.00 -1.10 -0.73 119.26 124.61 2wes h ALA 18 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2wes h ALA 18 Cb 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2wes h ALA 18 CO -0.00 -0.35 0.07 0.77 0.00 0.00 0.00 179.25 179.74 2wes h SER 19 N 0.17 0.14 -0.43 0.00 0.02 -1.14 -2.54 113.55 109.77 2wes h SER 19 Ca 0.06 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 2wes h SER 19 Cb 0.01 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 2wes h SER 19 CO -0.04 0.13 0.16 0.22 -1.14 0.00 0.00 176.83 176.16 2wes h TYR 20 N 0.13 0.67 -0.84 3.45 3.20 -1.09 0.08 116.97 122.57 2wes h TYR 20 Ca 0.04 -0.06 0.05 0.00 3.14 0.00 0.00 58.73 61.91 2wes h TYR 20 Cb 0.02 -0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.03 2wes h TYR 20 CO -0.06 0.59 0.52 -0.07 -1.64 0.00 0.00 178.16 177.50 2wes h LEU 21 N 0.55 0.83 -0.57 2.82 3.38 -1.07 0.16 115.31 121.41 2wes h LEU 21 Ca 0.14 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 2wes h LEU 21 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2wes h LEU 21 CO -0.01 0.54 -0.39 0.11 0.09 0.00 0.00 178.44 178.79 2wes h LYS 22 N 0.97 0.71 -0.53 1.13 1.79 -1.03 0.11 116.57 119.72 2wes h LYS 22 Ca 0.36 -0.36 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 2wes h LYS 22 Cb 0.13 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2wes h LYS 22 CO -0.16 0.98 0.09 0.00 -1.08 0.00 0.00 179.45 179.28 2wes h ALA 23 N 0.98 1.16 0.07 3.86 0.00 -0.23 0.22 119.26 125.31 2wes h ALA 23 Ca 0.05 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 2wes h ALA 23 Cb 0.92 -0.21 0.02 0.00 0.00 0.00 0.00 17.79 18.52 2wes h ALA 23 CO 0.08 0.56 -0.79 0.00 0.00 0.00 0.00 179.25 179.10 2wes h ALA 24 N 1.30 0.01 -0.00 0.00 0.00 -0.34 -3.39 119.26 116.84 2wes h ALA 24 Ca 0.17 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2wes h ALA 24 Cb 0.35 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2wes h ALA 24 CO 0.01 0.42 -0.14 1.19 0.00 0.00 0.00 179.25 180.73 2wes n PHE 25 N -4.11 0.00 0.00 0.00 3.72 0.35 -5.07 117.46 112.35 2wes n PHE 25 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 2wes n PHE 25 Cb 0.78 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.32 2wes n PHE 25 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2wes n ASP 26 N -0.73 0.00 -0.46 4.37 2.03 0.76 -0.62 116.55 121.90 2wes n ASP 26 Ca 0.01 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.39 2wes n ASP 26 Cb 0.08 0.00 0.23 0.00 -0.72 0.00 0.00 41.12 40.71 2wes n ASP 26 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2wes n ASP 27 N 2.85 1.36 -1.06 1.67 5.75 -1.26 -3.48 116.55 122.37 2wes n ASP 27 Ca 0.00 -1.86 0.04 0.00 -0.01 0.00 0.00 54.79 52.96 2wes n ASP 27 Cb 0.00 -0.14 0.20 0.00 -1.03 0.00 0.00 41.12 40.15 2wes n ASP 27 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wes n ARG 28 N 0.19 2.67 -3.77 0.11 1.74 0.21 -4.80 116.66 113.01 2wes n ARG 28 Ca 0.11 -1.56 -0.13 0.00 -0.77 0.00 0.00 57.85 55.50 2wes n ARG 28 Cb 0.24 -1.71 -0.12 0.00 -1.02 0.00 0.00 32.46 29.86 2wes n ARG 28 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2wes s ILE 29 N -1.78 -0.00 -0.20 0.55 1.10 -1.23 -4.95 121.20 114.69 2wes s ILE 29 Ca 0.28 0.02 -0.09 0.00 -0.51 0.00 0.00 60.65 60.34 2wes s ILE 29 Cb 0.19 -0.38 -0.05 0.00 0.15 0.00 0.00 42.46 42.37 2wes s ILE 29 CO 0.11 0.01 0.11 -1.81 -2.11 0.00 0.00 174.94 171.24 2wes s ASP 30 N 0.27 5.96 -0.08 4.50 1.01 -0.02 -4.92 116.67 123.39 2wes s ASP 30 Ca -0.01 0.16 0.03 0.00 0.71 0.00 0.00 52.55 53.43 2wes s ASP 30 Cb -0.03 -2.04 0.01 0.00 1.01 0.00 0.00 42.92 41.87 2wes s ASP 30 CO -0.01 0.16 -0.15 -0.69 0.21 0.00 0.00 175.17 174.70 2wes s VAL 31 N 0.45 1.37 -0.09 -1.27 1.01 -1.26 -0.23 120.40 120.38 2wes s VAL 31 Ca 0.06 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.46 2wes s VAL 31 Cb -0.12 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.03 2wes s VAL 31 CO -0.00 0.41 -0.19 -0.89 0.00 0.00 0.00 175.10 174.43 2wes s THR 32 N 0.65 1.69 -0.17 3.92 2.01 -0.42 -1.14 115.64 122.18 2wes s THR 32 Ca -0.14 -0.79 -0.03 0.00 0.31 0.00 0.00 61.69 61.03 2wes s THR 32 Cb -0.16 -1.49 -0.02 0.00 0.01 0.00 0.00 72.50 70.84 2wes s THR 32 CO 0.04 0.48 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.18 2wes s LEU 33 N 0.57 3.06 -0.21 4.42 0.20 0.36 -0.03 118.68 127.04 2wes s LEU 33 Ca -0.15 -0.24 -0.04 0.00 0.69 0.00 0.00 54.13 54.39 2wes s LEU 33 Cb -0.17 -1.74 -0.01 0.00 -0.43 0.00 0.00 46.19 43.84 2wes s LEU 33 CO 0.05 0.11 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.49 2wes s VAL 34 N 0.72 3.54 0.03 1.68 1.01 0.41 -0.79 120.40 127.00 2wes s VAL 34 Ca -0.02 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.54 2wes s VAL 34 Cb -0.15 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 2wes s VAL 34 CO 0.02 0.43 -0.09 -1.83 0.00 0.00 0.00 175.10 173.64 2wes s GLU 35 N 1.22 0.60 0.35 2.72 -1.05 -0.43 -0.06 118.70 122.05 2wes s GLU 35 Ca 0.03 -0.56 -0.28 0.00 -0.15 0.00 0.00 54.97 54.01 2wes s GLU 35 Cb -0.14 -0.50 -0.10 0.00 -0.44 0.00 0.00 34.13 32.95 2wes s GLU 35 CO -0.01 0.12 1.23 0.45 0.95 0.00 0.00 175.26 178.01 2wes s SER 36 N -0.97 6.75 0.09 0.83 0.15 -1.07 -1.07 113.70 118.41 2wes s SER 36 Ca -0.03 2.52 0.27 0.00 0.70 0.00 0.00 55.95 59.42 2wes s SER 36 Cb -0.07 -2.64 0.96 0.00 -1.71 0.00 0.00 66.02 62.56 2wes s SER 36 CO 0.00 -0.53 1.79 0.61 1.20 0.00 0.00 173.24 176.31 2wes n GLY 37 N 0.82 -1.56 0.00 9.45 0.00 -1.26 -4.40 105.19 108.24 2wes n GLY 37 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2wes n GLY 37 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wes n ASN 38 N -1.84 3.90 -4.61 1.61 0.23 -1.26 -4.95 115.26 108.34 2wes n ASN 38 Ca 0.06 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.68 2wes n ASN 38 Cb 0.38 0.75 -0.03 0.00 -2.08 0.00 0.00 39.78 38.79 2wes n ASN 38 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2wes s VAL 39 N -1.58 4.58 0.23 3.53 1.01 -1.26 -5.03 120.40 121.88 2wes s VAL 39 Ca 0.00 1.34 -0.30 0.00 0.00 0.00 0.00 61.98 63.02 2wes s VAL 39 Cb 0.00 -4.34 -0.09 0.00 0.00 0.00 0.00 36.38 31.95 2wes s VAL 39 CO 0.00 -0.50 0.99 -0.13 0.00 0.00 0.00 175.10 175.46 2wes s ARG 40 N 3.49 4.78 0.63 2.72 1.81 -1.26 -4.76 118.95 126.36 2wes s ARG 40 Ca 0.40 1.57 -0.15 0.00 -1.72 0.00 0.00 55.73 55.83 2wes s ARG 40 Cb -0.12 -3.27 -0.02 0.00 -0.45 0.00 0.00 34.95 31.09 2wes s ARG 40 CO 0.17 0.39 1.07 -0.98 -0.68 0.00 0.00 175.30 175.27 2wes s ARG 41 N -1.05 3.12 0.09 3.54 1.70 -1.26 -4.98 118.95 120.11 2wes s ARG 41 Ca 0.43 1.21 -0.31 0.00 -0.47 0.00 0.00 55.73 56.58 2wes s ARG 41 Cb -0.27 -2.01 -0.11 0.00 -0.57 0.00 0.00 34.95 32.00 2wes s ARG 41 CO 0.34 -0.97 1.86 -0.89 -1.08 0.00 0.00 175.30 174.56 2wes n ILE 42 N -2.30 0.46 -0.00 4.99 2.08 -1.26 -4.91 119.36 118.40 2wes n ILE 42 Ca 0.09 -0.08 0.00 0.00 0.56 0.00 0.00 62.75 63.32 2wes n ILE 42 Cb 0.53 -2.12 0.01 0.00 -0.75 0.00 0.00 39.64 37.31 2wes n ILE 42 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2wes n GLY 43 N 4.28 2.30 3.55 7.39 0.00 -1.26 -4.52 105.19 116.93 2wes n GLY 43 Ca 0.19 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2wes n GLY 43 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wes s VAL 44 N -0.85 1.93 0.32 1.61 -7.23 -1.26 -4.16 120.40 110.76 2wes s VAL 44 Ca 0.01 0.00 -0.29 0.00 -1.81 0.00 0.00 61.98 59.89 2wes s VAL 44 Cb 0.01 -2.26 -0.10 0.00 0.56 0.00 0.00 36.38 34.58 2wes s VAL 44 CO 0.01 0.00 1.31 -0.83 -0.31 0.00 0.00 175.10 175.27 2wes s GLY 45 N -3.02 2.96 0.05 2.32 0.00 -1.26 -1.72 107.32 106.66 2wes s GLY 45 Ca 0.67 1.25 0.05 0.00 0.00 0.00 0.00 44.72 46.69 2wes s GLY 45 CO 0.61 1.92 -0.14 1.20 0.00 0.00 0.00 173.10 176.68 2wes s GLN 46 N -1.69 0.89 0.18 2.90 -0.21 0.11 -4.91 119.66 116.93 2wes s GLN 46 Ca 0.49 -0.84 0.03 0.00 0.02 0.00 0.00 55.36 55.06 2wes s GLN 46 Cb -0.40 -0.91 -0.03 0.00 1.00 0.00 0.00 33.01 32.67 2wes s GLN 46 CO 0.52 0.22 0.32 0.00 -2.12 0.00 0.00 175.29 174.22 2wes s ALA 47 N -1.02 3.94 0.43 6.09 0.00 -1.26 -0.95 121.76 128.99 2wes s ALA 47 Ca 0.00 -1.05 0.03 0.00 0.00 0.00 0.00 51.96 50.94 2wes s ALA 47 Cb -0.09 -1.80 -0.03 0.00 0.00 0.00 0.00 23.12 21.20 2wes s ALA 47 CO 0.02 0.44 0.07 0.95 0.00 0.00 0.00 175.76 177.23 2wes s THR 48 N -1.83 1.00 0.38 0.00 -4.23 -0.41 -4.80 115.64 105.76 2wes s THR 48 Ca 0.35 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 2wes s THR 48 Cb -0.11 -2.40 -0.05 0.00 1.34 0.00 0.00 72.50 71.29 2wes s THR 48 CO 0.29 0.00 0.16 0.12 -0.54 0.00 0.00 174.62 174.65 2wes s PHE 49 N -3.06 2.64 0.53 3.99 5.36 -1.26 -4.59 117.98 121.59 2wes s PHE 49 Ca 0.20 -0.49 0.30 0.00 -0.96 0.00 0.00 56.93 55.98 2wes s PHE 49 Cb 0.04 -1.81 1.73 0.00 -0.34 0.00 0.00 43.02 42.64 2wes s PHE 49 CO 0.11 0.25 2.20 0.66 -1.46 0.00 0.00 175.22 176.98 2wes h SER 50 N 1.48 0.00 0.83 6.13 4.64 -1.88 -2.53 113.55 122.21 2wes h SER 50 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2wes h SER 50 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2wes h SER 50 CO 0.66 0.04 0.00 0.71 -0.87 0.00 0.00 176.83 177.38 2wes h THR 51 N 0.00 0.00 -0.14 2.95 1.35 -1.93 -3.32 112.91 111.81 2wes h THR 51 Ca -0.00 -0.29 -0.03 0.00 -0.55 0.00 0.00 66.41 65.54 2wes h THR 51 Cb 0.13 1.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.61 2wes h THR 51 CO 0.01 0.00 -0.04 1.62 -0.25 0.00 0.00 175.52 176.86 2wes h VAL 52 N 0.00 1.12 -0.95 6.82 3.04 -1.83 -1.39 116.25 123.06 2wes h VAL 52 Ca 0.00 -0.49 0.22 0.00 -1.01 0.00 0.00 66.70 65.42 2wes h VAL 52 Cb 0.41 1.06 -0.12 0.00 -2.01 0.00 0.00 31.29 30.63 2wes h VAL 52 CO 0.00 0.16 0.50 0.08 -1.01 0.00 0.00 177.57 177.30 2wes h ARG 53 N 0.21 0.51 -0.53 4.17 0.11 -1.83 -0.96 114.38 116.07 2wes h ARG 53 Ca 0.05 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.10 2wes h ARG 53 Cb 0.21 -0.12 -0.03 0.00 1.11 0.00 0.00 29.97 31.15 2wes h ARG 53 CO 0.01 0.34 0.34 0.45 0.10 0.00 0.00 179.97 181.20 2wes h HIS 54 N 0.53 0.67 0.13 4.08 3.86 -1.53 0.72 115.15 123.61 2wes h HIS 54 Ca 0.59 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.81 2wes h HIS 54 Cb 1.09 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 29.33 2wes h HIS 54 CO -0.06 0.44 -0.06 0.35 0.86 0.00 0.00 177.93 179.45 2wes h PHE 55 N 0.72 -0.16 -0.62 2.45 3.57 -1.27 -0.08 116.94 121.55 2wes h PHE 55 Ca 0.19 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 2wes h PHE 55 Cb -0.06 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2wes h PHE 55 CO 0.00 0.17 0.22 0.74 -2.23 0.00 0.00 178.31 177.21 2wes h PHE 56 N -0.51 0.97 -0.66 0.41 0.04 -1.36 -2.06 116.94 113.77 2wes h PHE 56 Ca -0.02 -0.09 0.09 0.00 2.80 0.00 0.00 57.97 60.75 2wes h PHE 56 Cb 0.40 -0.28 -0.07 0.00 2.20 0.00 0.00 35.95 38.20 2wes h PHE 56 CO 0.03 0.78 0.30 -0.44 -0.60 0.00 0.00 178.31 178.39 2wes h ASP 57 N 0.87 0.37 -0.49 2.17 3.32 -0.84 -0.35 116.42 121.48 2wes h ASP 57 Ca 0.20 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 2wes h ASP 57 Cb 0.25 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 2wes h ASP 57 CO -0.01 0.22 0.22 0.22 -1.72 0.00 0.00 179.24 178.16 2wes h TYR 58 N 0.53 0.76 0.00 4.55 3.20 -0.51 0.87 116.97 126.37 2wes h TYR 58 Ca 0.32 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2wes h TYR 58 Cb 0.35 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.38 2wes h TYR 58 CO -0.13 0.59 0.00 1.28 -1.64 0.00 0.00 178.16 178.27 2wes n LEU 59 N -4.34 0.09 -0.13 2.82 4.32 -0.82 -4.90 117.00 114.04 2wes n LEU 59 Ca 0.04 0.52 -0.01 0.00 -0.02 0.00 0.00 56.01 56.54 2wes n LEU 59 Cb 0.16 -0.49 -0.00 0.00 -1.62 0.00 0.00 43.42 41.46 2wes n LEU 59 CO 0.38 -0.16 -0.01 0.61 -1.22 0.00 0.00 177.39 176.99 2wes n GLY 60 N 0.71 0.34 3.49 -0.72 0.00 0.30 -5.06 105.19 104.25 2wes n GLY 60 Ca 0.05 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 2wes n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wes s LEU 61 N -0.33 3.41 0.31 0.99 1.43 -0.22 -5.01 118.68 119.27 2wes s LEU 61 Ca 0.00 -0.14 -0.27 0.00 -1.03 0.00 0.00 54.13 52.70 2wes s LEU 61 Cb 0.00 -1.87 -0.10 0.00 0.03 0.00 0.00 46.19 44.25 2wes s LEU 61 CO 0.00 0.07 0.96 -0.62 0.23 0.00 0.00 176.35 176.99 2wes s ASP 62 N 0.95 7.34 0.39 2.29 2.15 -1.26 -4.12 116.67 124.41 2wes s ASP 62 Ca 0.02 1.89 0.08 0.00 0.43 0.00 0.00 52.55 54.97 2wes s ASP 62 Cb -0.14 -2.59 0.82 0.00 -0.30 0.00 0.00 42.92 40.72 2wes s ASP 62 CO 0.02 -0.07 1.98 1.05 -0.17 0.00 0.00 175.17 177.99 2wes h GLU 63 N 3.30 0.63 -0.03 4.34 4.11 -1.99 0.10 114.58 125.05 2wes h GLU 63 Ca -0.47 -0.04 0.01 0.00 0.07 0.00 0.00 59.36 58.94 2wes h GLU 63 Cb 1.20 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 2wes h GLU 63 CO 0.65 0.41 0.09 0.00 0.07 0.00 0.00 179.01 180.24 2wes h ARG 64 N 0.65 0.00 0.00 1.06 3.08 -1.96 -1.42 114.38 115.78 2wes h ARG 64 Ca 0.28 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.18 2wes h ARG 64 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2wes h ARG 64 CO -0.08 0.00 -0.95 1.49 -1.07 0.00 0.00 179.97 179.36 2wes h GLU 65 N 0.00 0.00 0.14 0.04 4.57 -1.18 -3.42 114.58 114.73 2wes h GLU 65 Ca 0.02 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 57.86 2wes h GLU 65 Cb 0.19 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.78 2wes h GLU 65 CO -0.00 0.65 -1.71 0.11 -1.18 0.00 0.00 179.01 176.89 2wes h TRP 66 N -1.00 0.54 -0.26 0.92 5.08 -1.30 -3.39 115.95 116.55 2wes h TRP 66 Ca -0.22 -0.40 0.01 0.00 1.08 0.00 0.00 58.89 59.37 2wes h TRP 66 Cb 1.01 -0.02 -0.02 0.00 -3.00 0.00 0.00 29.16 27.13 2wes h TRP 66 CO 0.00 1.55 0.14 1.25 -1.28 0.00 0.00 178.44 180.09 2wes h LEU 67 N 0.08 0.21 -1.65 0.11 5.85 -1.53 -2.23 115.31 116.16 2wes h LEU 67 Ca -0.32 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2wes h LEU 67 Cb 2.06 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 2wes h LEU 67 CO 0.15 0.16 0.05 -0.65 -0.34 0.00 0.00 178.44 177.81 2wes h PRO 68 N 0.29 0.28 0.00 5.25 0.11 -1.77 -1.17 132.00 134.99 2wes h PRO 68 Ca 0.10 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2wes h PRO 68 Cb 0.02 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.07 2wes h PRO 68 CO -0.06 0.26 0.00 0.54 -0.21 0.00 0.00 178.00 178.53 2wes n ARG 69 N -4.43 0.11 -0.55 1.05 1.74 -0.85 -3.08 116.66 110.65 2wes n ARG 69 Ca -0.00 0.12 0.04 0.00 -0.77 0.00 0.00 57.85 57.24 2wes n ARG 69 Cb 0.14 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.28 2wes n ARG 69 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wes n ALA 71 N -1.14 -1.16 -1.69 0.00 0.00 -1.18 -1.40 120.51 113.95 2wes n ALA 71 Ca 0.22 0.12 -0.34 0.00 0.00 0.00 0.00 53.44 53.44 2wes n ALA 71 Cb 0.78 -3.54 0.01 0.00 0.00 0.00 0.00 19.45 16.71 2wes n ALA 71 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wes s GLY 72 N -3.00 2.45 0.36 0.00 0.00 -0.51 -1.28 107.32 105.34 2wes s GLY 72 Ca 0.54 0.70 0.05 0.00 0.00 0.00 0.00 44.72 46.01 2wes s GLY 72 CO 0.67 1.05 0.19 -0.32 0.00 0.00 0.00 173.10 174.68 2wes s GLY 73 N -2.10 2.41 -0.03 0.20 0.00 0.05 -3.92 107.32 103.93 2wes s GLY 73 Ca 0.70 -1.62 -0.06 0.00 0.00 0.00 0.00 44.72 43.74 2wes s GLY 73 CO 0.31 -1.65 0.22 -0.19 0.00 0.00 0.00 173.10 171.79 2wes s TYR 74 N -3.38 3.58 -0.26 1.90 1.51 -1.26 -0.66 117.35 118.79 2wes s TYR 74 Ca 0.32 0.53 0.03 0.00 -1.01 0.00 0.00 57.07 56.94 2wes s TYR 74 Cb 0.03 -1.95 0.06 0.00 -0.11 0.00 0.00 41.96 39.99 2wes s TYR 74 CO 0.20 0.65 -0.10 0.21 -1.11 0.00 0.00 175.55 175.40 2wes s LYS 75 N -1.59 2.17 0.10 -0.62 2.20 0.51 -2.78 119.74 119.73 2wes s LYS 75 Ca 0.24 -1.34 0.24 0.00 -0.36 0.00 0.00 55.97 54.76 2wes s LYS 75 Cb -0.13 -2.88 0.32 0.00 -1.51 0.00 0.00 37.83 33.64 2wes s LYS 75 CO 0.14 -0.58 1.29 1.28 -0.36 0.00 0.00 175.35 177.11 2wes n LEU 76 N 4.44 0.67 0.00 5.43 4.77 0.51 -0.26 117.00 132.56 2wes n LEU 76 Ca -0.13 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2wes n LEU 76 Cb 0.42 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2wes n LEU 76 CO 0.21 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 2wes n GLY 77 N 1.35 -0.73 3.07 -0.72 0.00 -1.26 -1.42 105.19 105.49 2wes n GLY 77 Ca 0.03 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 2wes n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wes s ILE 78 N -3.00 1.37 -0.26 -0.61 1.01 0.04 -2.40 121.20 117.35 2wes s ILE 78 Ca 0.00 -0.62 -0.21 0.00 0.00 0.00 0.00 60.65 59.83 2wes s ILE 78 Cb 0.00 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 2wes s ILE 78 CO 0.00 0.41 0.65 -0.60 0.00 0.00 0.00 174.94 175.39 2wes s ARG 79 N 0.57 4.08 -0.34 2.79 3.52 0.49 0.05 118.95 130.11 2wes s ARG 79 Ca -0.15 0.54 -0.13 0.00 -0.13 0.00 0.00 55.73 55.85 2wes s ARG 79 Cb -0.16 -3.66 -0.02 0.00 -1.56 0.00 0.00 34.95 29.55 2wes s ARG 79 CO 0.05 -0.45 0.27 -0.06 -0.81 0.00 0.00 175.30 174.30 2wes s PHE 80 N 2.56 3.22 -0.09 5.12 0.08 0.64 0.32 117.98 129.84 2wes s PHE 80 Ca 0.27 -0.15 0.05 0.00 0.12 0.00 0.00 56.93 57.21 2wes s PHE 80 Cb -0.15 -2.53 -0.00 0.00 -0.57 0.00 0.00 43.02 39.77 2wes s PHE 80 CO 0.09 -0.37 -0.24 -2.00 -0.10 0.00 0.00 175.22 172.59 2wes s GLU 81 N 1.80 2.88 -0.71 0.44 2.12 -0.47 -1.92 118.70 122.84 2wes s GLU 81 Ca 0.08 -0.88 0.00 0.00 0.36 0.00 0.00 54.97 54.52 2wes s GLU 81 Cb -0.17 -2.25 0.00 0.00 0.26 0.00 0.00 34.13 31.97 2wes s GLU 81 CO 0.11 0.24 0.00 0.09 -0.54 0.00 0.00 175.26 175.16 2wes n ASN 82 N 3.35 -4.15 0.09 -1.70 3.02 -0.86 -0.93 115.26 114.07 2wes n ASN 82 Ca -0.19 0.17 -0.06 0.00 -0.03 0.00 0.00 54.58 54.47 2wes n ASN 82 Cb 0.53 -2.24 0.02 0.00 -0.61 0.00 0.00 39.78 37.47 2wes n ASN 82 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 2wes h TRP 83 N 0.00 0.16 0.00 3.10 4.06 -1.85 -3.42 115.95 118.00 2wes h TRP 83 Ca -0.14 -0.09 0.00 0.00 2.06 0.00 0.00 58.89 60.73 2wes h TRP 83 Cb 0.55 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.69 2wes h TRP 83 CO 0.26 0.88 0.00 0.43 -3.56 0.00 0.00 178.44 176.45 2wes n SER 84 N -3.64 0.00 -4.71 -3.49 7.64 -1.26 -2.70 113.62 105.45 2wes n SER 84 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.44 2wes n SER 84 Cb 0.77 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.94 2wes n SER 84 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2wes s GLU 85 N 0.96 4.20 0.22 1.43 0.41 -1.26 -4.06 118.70 120.60 2wes s GLU 85 Ca 0.00 2.39 -0.32 0.00 -0.41 0.00 0.00 54.97 56.63 2wes s GLU 85 Cb 0.00 -3.26 -0.13 0.00 -1.78 0.00 0.00 34.13 28.95 2wes s GLU 85 CO 0.00 -0.66 1.53 -2.30 -0.49 0.00 0.00 175.26 173.34 2wes n PRO 86 N 4.41 2.28 0.00 0.39 -0.02 -1.26 -1.47 135.00 139.33 2wes n PRO 86 Ca 0.15 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 2wes n PRO 86 Cb 0.39 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2wes n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wes n GLY 87 N 2.76 2.92 3.83 -1.23 0.00 -1.26 -5.00 105.19 107.21 2wes n GLY 87 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 2wes n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wes s GLU 88 N -0.10 4.15 0.24 1.61 2.02 -0.54 -4.80 118.70 121.28 2wes s GLU 88 Ca 0.00 0.85 -0.03 0.00 0.02 0.00 0.00 54.97 55.81 2wes s GLU 88 Cb 0.00 -2.52 -0.03 0.00 0.10 0.00 0.00 34.13 31.69 2wes s GLU 88 CO 0.00 0.19 0.26 1.52 0.02 0.00 0.00 175.26 177.25 2wes s TYR 89 N -1.88 1.00 0.16 1.61 -0.85 -1.26 -2.02 117.35 114.11 2wes s TYR 89 Ca 0.53 -1.23 -0.18 0.00 -0.52 0.00 0.00 57.07 55.66 2wes s TYR 89 Cb -0.12 -0.34 0.04 0.00 0.38 0.00 0.00 41.96 41.92 2wes s TYR 89 CO 0.18 -0.80 0.50 -0.59 -1.52 0.00 0.00 175.55 173.32 2wes s PHE 90 N -3.96 -0.26 -0.11 -3.49 -0.12 -0.81 -4.99 117.98 104.24 2wes s PHE 90 Ca 0.34 -0.04 -0.07 0.00 -0.05 0.00 0.00 56.93 57.11 2wes s PHE 90 Cb 0.04 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 2wes s PHE 90 CO 0.13 -0.83 0.15 0.71 -0.05 0.00 0.00 175.22 175.34 2wes s TYR 91 N -3.82 3.60 -0.48 3.49 2.02 -1.26 -0.26 117.35 120.65 2wes s TYR 91 Ca 0.05 0.54 -0.10 0.00 -0.37 0.00 0.00 57.07 57.18 2wes s TYR 91 Cb -0.00 -1.95 0.12 0.00 -0.40 0.00 0.00 41.96 39.73 2wes s TYR 91 CO -0.09 0.73 0.36 -1.58 -1.57 0.00 0.00 175.55 173.41 2wes s HIS 92 N -1.04 3.39 0.42 2.71 5.65 0.11 -4.85 115.29 121.68 2wes s HIS 92 Ca 0.16 -1.75 0.01 0.00 0.25 0.00 0.00 55.06 53.73 2wes s HIS 92 Cb -0.12 -3.50 -0.01 0.00 -1.18 0.00 0.00 32.58 27.77 2wes s HIS 92 CO 0.05 -0.99 0.62 -1.25 -0.65 0.00 0.00 174.74 172.52 2wes s PRO 93 N 1.41 3.12 -1.07 2.88 0.04 -1.26 -0.78 135.00 139.33 2wes s PRO 93 Ca 0.05 -0.56 -0.15 0.00 0.04 0.00 0.00 61.00 60.38 2wes s PRO 93 Cb -0.27 -2.61 0.17 0.00 0.04 0.00 0.00 34.50 31.83 2wes s PRO 93 CO 0.00 -0.17 1.25 -0.06 0.04 0.00 0.00 177.00 178.06 2wes s PHE 94 N -2.47 3.45 -0.29 0.56 0.08 -0.51 -4.93 117.98 113.89 2wes s PHE 94 Ca 0.47 -1.91 -0.16 0.00 0.12 0.00 0.00 56.93 55.45 2wes s PHE 94 Cb -0.10 -4.23 0.12 0.00 -0.57 0.00 0.00 43.02 38.25 2wes s PHE 94 CO 0.37 -1.36 0.86 -2.00 -0.10 0.00 0.00 175.22 172.98 2wes s GLU 95 N 1.62 0.50 0.34 0.44 2.12 -1.26 -3.03 118.70 119.43 2wes s GLU 95 Ca 0.36 0.90 -0.26 0.00 0.36 0.00 0.00 54.97 56.34 2wes s GLU 95 Cb -0.05 0.17 -0.10 0.00 0.26 0.00 0.00 34.13 34.41 2wes s GLU 95 CO -0.05 -0.11 0.97 1.03 -0.54 0.00 0.00 175.26 176.56 2wes s ARG 96 N 1.61 4.50 0.33 4.30 0.52 -1.18 -4.98 118.95 124.05 2wes s ARG 96 Ca -0.09 1.37 -0.29 0.00 -0.52 0.00 0.00 55.73 56.20 2wes s ARG 96 Cb -0.05 -2.75 -0.11 0.00 0.52 0.00 0.00 34.95 32.57 2wes s ARG 96 CO -0.17 0.20 1.40 -0.51 0.02 0.00 0.00 175.30 176.24 2wes s LEU 97 N -2.18 4.38 0.65 2.53 1.43 -1.26 -5.04 118.68 119.20 2wes s LEU 97 Ca 0.52 2.82 -0.13 0.00 -1.03 0.00 0.00 54.13 56.31 2wes s LEU 97 Cb -0.19 -3.65 -0.01 0.00 0.03 0.00 0.00 46.19 42.37 2wes s LEU 97 CO 0.24 -0.69 1.05 -0.13 0.23 0.00 0.00 176.35 177.06 2wes s ARG 98 N -1.57 3.12 -0.09 1.70 0.52 -1.26 -4.88 118.95 116.50 2wes s ARG 98 Ca 0.53 1.02 0.04 0.00 -0.52 0.00 0.00 55.73 56.81 2wes s ARG 98 Cb -0.43 -2.01 -0.00 0.00 0.52 0.00 0.00 34.95 33.03 2wes s ARG 98 CO 0.54 -0.96 -0.24 0.08 0.02 0.00 0.00 175.30 174.75 2wes s VAL 99 N -2.85 2.02 -0.14 3.52 1.01 -1.26 -1.38 120.40 121.32 2wes s VAL 99 Ca 0.60 -1.01 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2wes s VAL 99 Cb -0.14 -1.74 0.03 0.00 0.00 0.00 0.00 36.38 34.52 2wes s VAL 99 CO 0.48 0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 175.35 2wes s VAL 100 N 0.24 1.28 -1.51 2.92 1.01 0.33 -4.80 120.40 119.87 2wes s VAL 100 Ca -0.15 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 2wes s VAL 100 Cb -0.17 -1.27 0.08 0.00 0.00 0.00 0.00 36.38 35.02 2wes s VAL 100 CO 0.08 0.37 0.87 0.47 0.00 0.00 0.00 175.10 176.89 2wes n ASP 101 N 4.86 -3.67 0.00 3.32 10.43 -1.26 -2.09 116.55 128.14 2wes n ASP 101 Ca -0.14 -0.84 0.00 0.00 2.57 0.00 0.00 54.79 56.38 2wes n ASP 101 Cb 0.50 -3.69 0.00 0.00 1.84 0.00 0.00 41.12 39.76 2wes n ASP 101 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2wes n GLY 102 N -1.66 1.32 3.31 0.44 0.00 -1.26 -5.03 105.19 102.31 2wes n GLY 102 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 2wes n GLY 102 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wes s PHE 103 N -3.00 2.23 0.71 1.61 0.40 -0.89 -5.12 117.98 113.92 2wes s PHE 103 Ca 0.00 -0.41 -0.11 0.00 -0.60 0.00 0.00 56.93 55.81 2wes s PHE 103 Cb 0.00 -1.37 0.02 0.00 0.51 0.00 0.00 43.02 42.18 2wes s PHE 103 CO 0.00 0.06 1.07 0.54 0.70 0.00 0.00 175.22 177.59 2wes s ASN 104 N -0.99 5.18 0.53 1.36 2.20 -1.26 -0.51 114.94 121.46 2wes s ASN 104 Ca 0.10 1.66 0.22 0.00 -0.94 0.00 0.00 52.86 53.90 2wes s ASN 104 Cb -0.10 -2.50 1.38 0.00 -2.00 0.00 0.00 41.25 38.03 2wes s ASN 104 CO 0.01 -1.58 2.08 0.24 -2.94 0.00 0.00 177.10 174.91 2wes h MET 105 N -0.81 0.00 -0.46 3.55 2.86 -1.57 -1.17 114.93 117.33 2wes h MET 105 Ca -0.44 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.20 2wes h MET 105 Cb 1.22 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.85 2wes h MET 105 CO 0.56 0.00 0.28 0.00 1.06 0.00 0.00 176.91 178.80 2wes h ALA 106 N 1.86 0.59 -0.45 6.32 0.00 -1.92 0.63 119.26 126.29 2wes h ALA 106 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2wes h ALA 106 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2wes h ALA 106 CO -0.00 0.08 0.27 0.93 0.00 0.00 0.00 179.25 180.53 2wes h GLU 107 N 0.61 0.61 -0.72 0.00 4.39 -1.60 -2.03 114.58 115.85 2wes h GLU 107 Ca 0.17 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 2wes h GLU 107 Cb 0.00 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 2wes h GLU 107 CO -0.03 0.45 0.28 -1.49 -1.16 0.00 0.00 179.01 177.06 2wes h TRP 108 N 0.59 1.09 -0.96 4.33 4.06 -1.12 -2.69 115.95 121.25 2wes h TRP 108 Ca 0.16 -0.08 0.00 0.00 2.06 0.00 0.00 58.89 61.03 2wes h TRP 108 Cb 0.01 -0.33 -0.05 0.00 -1.00 0.00 0.00 29.16 27.79 2wes h TRP 108 CO -0.03 0.84 0.62 2.35 -3.56 0.00 0.00 178.44 178.66 2wes h TRP 109 N 1.05 1.23 -0.01 0.49 7.01 0.69 0.22 115.95 126.63 2wes h TRP 109 Ca 0.24 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.20 2wes h TRP 109 Cb 0.21 -0.41 -0.01 0.00 -2.10 0.00 0.00 29.16 26.85 2wes h TRP 109 CO 0.02 0.79 -0.29 -0.07 -2.79 0.00 0.00 178.44 176.10 2wes h LEU 110 N 1.31 0.02 0.16 0.65 3.38 -1.06 -1.81 115.31 117.96 2wes h LEU 110 Ca 0.35 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.98 2wes h LEU 110 Cb -0.12 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2wes h LEU 110 CO -0.07 0.32 -1.68 0.00 0.09 0.00 0.00 178.44 177.10 2wes h ALA 111 N 1.69 0.19 0.00 1.53 0.00 -0.89 -3.42 119.26 118.35 2wes h ALA 111 Ca 0.00 -1.15 -0.03 0.00 0.00 0.00 0.00 54.91 53.72 2wes h ALA 111 Cb 0.53 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.74 2wes h ALA 111 CO 0.04 0.99 -0.51 1.33 0.00 0.00 0.00 179.25 181.10 2wes n VAL 112 N -3.68 0.49 -0.70 0.00 0.24 0.65 -5.06 118.33 110.25 2wes n VAL 112 Ca -0.26 -0.82 0.00 0.00 -2.04 0.00 0.00 64.34 61.23 2wes n VAL 112 Cb 1.02 0.41 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2wes n VAL 112 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wes n GLY 113 N -0.24 -0.16 0.73 7.63 0.00 -0.68 -4.96 105.19 107.51 2wes n GLY 113 Ca 0.05 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2wes n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wes n THR 117 N -0.38 -3.82 -1.53 2.61 -1.04 -1.26 -5.11 114.28 103.75 2wes n THR 117 Ca 0.00 0.59 -0.31 0.00 -2.04 0.00 0.00 64.05 62.29 2wes n THR 117 Cb 0.00 -2.51 0.06 0.00 -1.82 0.00 0.00 70.33 66.06 2wes n THR 117 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2wes s SER 118 N -0.20 5.14 0.14 8.00 1.04 -1.26 -4.86 113.70 121.70 2wes s SER 118 Ca 0.00 1.59 -0.19 0.00 0.48 0.00 0.00 55.95 57.83 2wes s SER 118 Cb 0.00 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2wes s SER 118 CO 0.00 -1.60 1.70 0.15 0.98 0.00 0.00 173.24 174.48 2wes h PHE 119 N -0.82 -0.08 -0.26 5.02 3.57 -1.99 -0.40 116.94 121.98 2wes h PHE 119 Ca -0.44 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 60.96 2wes h PHE 119 Cb 1.22 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 40.02 2wes h PHE 119 CO 0.59 -0.08 -0.34 0.66 -2.23 0.00 0.00 178.31 176.91 2wes h SER 120 N 0.03 0.58 -0.54 0.41 4.64 -1.94 0.38 113.55 117.11 2wes h SER 120 Ca 0.12 -0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.14 2wes h SER 120 Cb 0.17 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 2wes h SER 120 CO -0.23 0.88 0.08 -0.08 -0.87 0.00 0.00 176.83 176.62 2wes h GLU 121 N 0.47 0.90 -0.49 4.77 4.81 -1.80 -1.85 114.58 121.38 2wes h GLU 121 Ca 0.05 -0.24 -0.10 0.00 -0.13 0.00 0.00 59.36 58.94 2wes h GLU 121 Cb 0.82 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 2wes h GLU 121 CO 0.07 0.87 -0.08 0.00 -0.73 0.00 0.00 179.01 179.14 2wes h ALA 122 N 0.99 0.67 0.00 2.92 0.00 -0.76 -3.37 119.26 119.71 2wes h ALA 122 Ca 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2wes h ALA 122 Cb 0.41 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wes h ALA 122 CO 0.01 0.55 -1.30 0.00 0.00 0.00 0.00 179.25 178.52 2wes s TYR 124 N -3.29 1.28 0.23 0.00 2.02 -0.70 -4.78 117.35 112.11 2wes s TYR 124 Ca 0.00 -0.43 -0.06 0.00 -0.37 0.00 0.00 57.07 56.21 2wes s TYR 124 Cb 0.14 -0.95 0.34 0.00 -0.40 0.00 0.00 41.96 41.09 2wes s TYR 124 CO 0.84 -0.23 1.82 -0.07 -1.57 0.00 0.00 175.55 176.34 2wes h LEU 125 N 6.86 0.66 -1.90 -1.29 3.38 -1.88 -2.91 115.31 118.25 2wes h LEU 125 Ca -0.33 0.04 0.15 0.00 0.09 0.00 0.00 57.88 57.83 2wes h LEU 125 Cb 1.18 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 2wes h LEU 125 CO 0.48 0.40 0.41 0.74 0.09 0.00 0.00 178.44 180.56 2wes h THR 126 N 0.79 0.75 -0.23 0.22 2.02 -1.94 0.05 112.91 114.57 2wes h THR 126 Ca 0.36 -0.04 0.05 0.00 0.77 0.00 0.00 66.41 67.56 2wes h THR 126 Cb 0.28 0.64 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 2wes h THR 126 CO -0.22 0.02 -0.10 -0.74 0.37 0.00 0.00 175.52 174.85 2wes h HIS 127 N 0.10 -0.24 -0.58 3.16 -0.00 -1.77 -0.06 115.15 115.76 2wes h HIS 127 Ca 0.28 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.60 2wes h HIS 127 Cb 0.96 0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 28.49 2wes h HIS 127 CO -0.00 -0.16 0.09 0.00 -0.00 0.00 0.00 177.93 177.86 2wes h ARG 128 N -0.07 0.96 -0.89 5.26 2.47 -1.15 -1.38 114.38 119.58 2wes h ARG 128 Ca 0.12 -0.26 0.01 0.00 -1.26 0.00 0.00 59.98 58.59 2wes h ARG 128 Cb 0.26 -0.11 -0.04 0.00 -1.65 0.00 0.00 29.97 28.42 2wes h ARG 128 CO -0.28 0.92 0.59 -0.07 0.56 0.00 0.00 179.97 181.68 2wes h LEU 129 N 0.86 1.03 -0.15 3.04 4.07 -1.17 -1.00 115.31 121.99 2wes h LEU 129 Ca 0.17 -0.03 -0.02 0.00 0.08 0.00 0.00 57.88 58.08 2wes h LEU 129 Cb 0.43 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 41.90 2wes h LEU 129 CO 0.01 0.75 -0.00 0.00 -1.08 0.00 0.00 178.44 178.12 2wes h GLU 131 N 0.00 0.79 -0.11 0.00 4.39 -0.84 -1.26 114.58 117.55 2wes h GLU 131 Ca 0.04 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2wes h GLU 131 Cb 0.38 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2wes h GLU 131 CO 0.01 0.52 0.00 0.00 -1.16 0.00 0.00 179.01 178.38 2wes n ALA 132 N -2.44 2.52 -3.66 3.43 0.00 -0.42 -4.95 120.51 115.00 2wes n ALA 132 Ca 0.11 -0.56 -0.26 0.00 0.00 0.00 0.00 53.44 52.72 2wes n ALA 132 Cb 0.20 -1.06 0.05 0.00 0.00 0.00 0.00 19.45 18.64 2wes n ALA 132 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wes n LYS 133 N 0.52 -6.47 -2.61 0.00 5.02 -0.48 -4.91 118.16 109.23 2wes n LYS 133 Ca 0.17 0.73 -0.34 0.00 -2.02 0.00 0.00 58.31 56.85 2wes n LYS 133 Cb 0.40 -5.68 -0.04 0.00 -0.02 0.00 0.00 35.03 29.68 2wes n LYS 133 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wes s ARG 134 N -6.37 3.94 0.53 1.97 1.81 0.05 -0.57 118.95 120.31 2wes s ARG 134 Ca 0.59 1.32 -0.17 0.00 -1.72 0.00 0.00 55.73 55.74 2wes s ARG 134 Cb -0.28 -2.16 -0.07 0.00 -0.45 0.00 0.00 34.95 31.99 2wes s ARG 134 CO 0.72 -0.30 1.01 0.00 -0.68 0.00 0.00 175.30 176.06 2wes s ALA 135 N -1.99 2.93 -2.07 2.13 0.00 -0.45 -4.20 121.76 118.10 2wes s ALA 135 Ca 0.65 0.33 0.24 0.00 0.00 0.00 0.00 51.96 53.19 2wes s ALA 135 Cb -0.15 -3.18 1.36 0.00 0.00 0.00 0.00 23.12 21.15 2wes s ALA 135 CO 0.19 -0.40 1.89 -0.35 0.00 0.00 0.00 175.76 177.08 2wes n PRO 136 N -1.55 1.12 -4.62 0.00 -0.04 -1.26 -4.76 135.00 123.90 2wes n PRO 136 Ca 0.08 -0.18 -0.24 0.00 -0.04 0.00 0.00 63.50 63.11 2wes n PRO 136 Cb 0.53 -1.39 -0.14 0.00 -0.04 0.00 0.00 33.50 32.46 2wes n PRO 136 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2wes s ARG 137 N -1.98 1.31 0.77 0.54 0.52 -1.26 -1.79 118.95 117.07 2wes s ARG 137 Ca 0.36 -0.86 -0.11 0.00 -0.52 0.00 0.00 55.73 54.60 2wes s ARG 137 Cb 0.17 -1.38 0.06 0.00 0.52 0.00 0.00 34.95 34.32 2wes s ARG 137 CO 0.29 0.35 1.10 -1.64 0.02 0.00 0.00 175.30 175.42 2wes s MET 138 N -1.06 2.17 0.55 3.54 -1.94 -0.06 -4.44 119.30 118.06 2wes s MET 138 Ca 0.06 1.26 0.23 0.00 -1.71 0.00 0.00 55.69 55.53 2wes s MET 138 Cb -0.08 -1.88 1.52 0.00 2.01 0.00 0.00 34.83 36.40 2wes s MET 138 CO 0.01 -1.72 2.17 -0.07 -0.01 0.00 0.00 175.02 175.40 2wes h LEU 139 N -1.05 0.00 0.00 -0.03 3.38 -1.90 0.12 115.31 115.82 2wes h LEU 139 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2wes h LEU 139 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2wes h LEU 139 CO 0.50 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.13 2wes n ASP 140 N -4.20 0.00 0.00 -0.43 5.68 -1.26 -4.88 116.55 111.46 2wes n ASP 140 Ca -0.02 -0.35 0.00 0.00 -0.50 0.00 0.00 54.79 53.92 2wes n ASP 140 Cb 0.15 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2wes n ASP 140 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wes n GLY 141 N 0.51 0.52 3.78 6.12 0.00 0.41 -5.06 105.19 111.46 2wes n GLY 141 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2wes n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wes s SER 142 N -1.86 6.55 0.40 1.61 1.04 -1.25 -4.73 113.70 115.45 2wes s SER 142 Ca 0.00 2.12 -0.26 0.00 0.48 0.00 0.00 55.95 58.29 2wes s SER 142 Cb 0.00 -2.59 -0.09 0.00 0.10 0.00 0.00 66.02 63.44 2wes s SER 142 CO 0.00 -0.64 1.22 -0.22 0.98 0.00 0.00 173.24 174.57 2wes s LEU 143 N -2.81 4.22 0.46 2.42 2.96 -1.26 -0.88 118.68 123.80 2wes s LEU 143 Ca 0.60 2.46 0.19 0.00 -0.22 0.00 0.00 54.13 57.16 2wes s LEU 143 Cb -0.24 -3.96 1.11 0.00 0.50 0.00 0.00 46.19 43.61 2wes s LEU 143 CO 0.29 -0.72 1.99 2.19 -1.32 0.00 0.00 176.35 178.78 2wes h PHE 144 N 2.71 0.00 -1.11 5.38 -0.00 -1.72 -2.92 116.94 119.27 2wes h PHE 144 Ca -0.49 0.00 0.31 0.00 -0.00 0.00 0.00 57.97 57.79 2wes h PHE 144 Cb 1.24 0.00 -0.08 0.00 -0.00 0.00 0.00 35.95 37.10 2wes h PHE 144 CO 0.54 0.20 0.74 0.00 -0.00 0.00 0.00 178.31 179.79 2wes h ALA 145 N 1.80 2.54 -0.23 12.09 0.00 -1.89 -3.51 119.26 130.05 2wes h ALA 145 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2wes h ALA 145 Cb 0.39 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2wes h ALA 145 CO 0.03 -0.95 0.00 -1.13 0.00 0.00 0.00 179.25 177.20 2wes n SER 146 N -4.51 1.61 0.00 0.00 3.41 -1.11 -5.12 113.62 107.90 2wes n SER 146 Ca 0.27 -1.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 2wes n SER 146 Cb 1.04 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 2wes n SER 146 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2wes n GLU 159 N 0.32 0.00 0.01 4.33 4.07 -1.26 -5.13 120.64 122.99 2wes n GLU 159 Ca 0.13 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.35 2wes n GLU 159 Cb 0.29 0.00 0.16 0.00 -0.06 0.00 0.00 31.44 31.83 2wes n GLU 159 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wes n GLN 160 N 5.48 0.10 0.21 5.31 10.64 -1.26 -4.06 117.38 133.80 2wes n GLN 160 Ca 0.00 0.01 0.06 0.00 -1.83 0.00 0.00 57.00 55.24 2wes n GLN 160 Cb 0.00 -1.54 0.46 0.00 -0.86 0.00 0.00 30.24 28.29 2wes n GLN 160 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 2wes h ARG 161 N 0.00 0.00 -0.01 2.61 9.65 -2.02 -3.08 114.38 121.53 2wes h ARG 161 Ca 0.00 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.73 2wes h ARG 161 Cb 0.58 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.14 2wes h ARG 161 CO 0.00 0.29 -0.68 0.00 2.80 0.00 0.00 179.97 182.38 2wes h ALA 162 N 1.71 0.85 -0.07 2.80 0.00 -1.99 -2.65 119.26 119.91 2wes h ALA 162 Ca -0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.15 2wes h ALA 162 Cb 0.58 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2wes h ALA 162 CO 0.04 0.83 -0.61 0.37 0.00 0.00 0.00 179.25 179.87 2wes h GLN 163 N 0.04 0.24 -2.39 0.00 5.75 -1.76 -3.34 115.11 113.65 2wes h GLN 163 Ca -0.01 -0.17 -0.59 0.00 -0.15 0.00 0.00 58.65 57.73 2wes h GLN 163 Cb 1.21 0.03 -0.40 0.00 1.07 0.00 0.00 27.48 29.38 2wes h GLN 163 CO 0.09 0.78 -0.82 1.19 -2.65 0.00 0.00 178.83 177.42 2wes n PHE 164 N -3.86 1.40 -1.97 3.99 3.72 -1.21 -3.08 117.46 116.43 2wes n PHE 164 Ca -0.02 -3.83 -0.42 0.00 -0.05 0.00 0.00 57.45 53.12 2wes n PHE 164 Cb 0.62 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 2wes n PHE 164 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2wes n PRO 165 N 1.74 3.24 -1.34 -1.08 -0.04 -1.00 -4.82 135.00 131.70 2wes n PRO 165 Ca 0.25 -3.00 -0.33 0.00 -0.04 0.00 0.00 63.50 60.39 2wes n PRO 165 Cb 0.44 -3.11 0.10 0.00 -0.04 0.00 0.00 33.50 30.90 2wes n PRO 165 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2wes s TYR 166 N 1.88 2.15 0.00 0.54 1.13 -1.26 -4.42 117.35 117.36 2wes s TYR 166 Ca 0.45 1.62 0.00 0.00 -1.41 0.00 0.00 57.07 57.73 2wes s TYR 166 Cb 0.12 -3.34 0.00 0.00 -1.10 0.00 0.00 41.96 37.65 2wes s TYR 166 CO -0.05 -2.37 0.00 0.00 -2.51 0.00 0.00 175.55 170.63 2wes n ALA 167 N -3.03 0.00 -2.35 9.51 0.00 0.64 -4.83 120.51 120.44 2wes n ALA 167 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.42 2wes n ALA 167 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 2wes n ALA 167 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2wes s TYR 168 N 1.00 1.13 -0.03 0.00 1.51 -1.26 -0.36 117.35 119.34 2wes s TYR 168 Ca 0.00 -0.72 0.02 0.00 -1.01 0.00 0.00 57.07 55.36 2wes s TYR 168 Cb 0.00 -0.60 -0.03 0.00 -0.11 0.00 0.00 41.96 41.22 2wes s TYR 168 CO 0.00 0.02 -0.07 -1.01 -1.11 0.00 0.00 175.55 173.38 2wes s HIS 169 N -2.91 2.90 0.27 2.71 3.76 0.17 -1.28 115.29 120.89 2wes s HIS 169 Ca 0.11 -0.02 -0.21 0.00 -0.15 0.00 0.00 55.06 54.78 2wes s HIS 169 Cb 0.00 -1.66 0.02 0.00 1.11 0.00 0.00 32.58 32.06 2wes s HIS 169 CO -0.00 0.34 0.74 -0.59 -0.85 0.00 0.00 174.74 174.37 2wes s PHE 170 N -0.90 -0.19 -0.25 1.40 -0.00 -0.12 -0.77 117.98 117.15 2wes s PHE 170 Ca 0.15 -0.25 -0.27 0.00 -0.00 0.00 0.00 56.93 56.55 2wes s PHE 170 Cb -0.11 0.70 0.01 0.00 -0.00 0.00 0.00 43.02 43.62 2wes s PHE 170 CO 0.04 -1.20 0.97 0.34 -0.00 0.00 0.00 175.22 175.37 2wes s ASP 171 N -2.92 6.97 0.18 1.98 -1.08 -0.49 0.05 116.67 121.36 2wes s ASP 171 Ca 0.11 1.19 -0.13 0.00 -0.52 0.00 0.00 52.55 53.20 2wes s ASP 171 Cb -0.06 -2.50 0.17 0.00 -1.46 0.00 0.00 42.92 39.07 2wes s ASP 171 CO 0.06 -0.65 1.76 0.00 0.52 0.00 0.00 175.17 176.87 2wes h ALA 172 N 7.64 0.64 -0.28 3.66 0.00 -1.50 -1.65 119.26 127.78 2wes h ALA 172 Ca -0.21 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2wes h ALA 172 Cb 1.07 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2wes h ALA 172 CO 0.95 -0.16 0.15 -0.44 0.00 0.00 0.00 179.25 179.76 2wes h ASP 173 N 0.42 0.24 -0.81 0.00 3.32 -1.80 -2.21 116.42 115.59 2wes h ASP 173 Ca 0.24 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2wes h ASP 173 Cb 0.21 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 2wes h ASP 173 CO -0.21 0.18 0.52 -0.33 -1.72 0.00 0.00 179.24 177.68 2wes h GLU 174 N 0.32 1.08 -0.37 3.56 4.39 -1.79 -0.80 114.58 120.97 2wes h GLU 174 Ca 0.11 -0.08 -0.15 0.00 0.34 0.00 0.00 59.36 59.59 2wes h GLU 174 Cb 0.01 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 2wes h GLU 174 CO -0.06 0.73 -0.34 -0.24 -1.16 0.00 0.00 179.01 177.94 2wes h VAL 175 N 1.10 1.28 -0.70 3.13 3.04 -1.19 0.78 116.25 123.69 2wes h VAL 175 Ca 0.29 -1.51 0.02 0.00 -1.01 0.00 0.00 66.70 64.49 2wes h VAL 175 Cb -0.09 1.40 -0.04 0.00 -2.01 0.00 0.00 31.29 30.55 2wes h VAL 175 CO -0.06 0.50 0.46 0.00 -1.01 0.00 0.00 177.57 177.46 2wes h ALA 176 N 0.77 0.90 -0.09 3.17 0.00 -1.16 0.17 119.26 123.02 2wes h ALA 176 Ca 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wes h ALA 176 Cb 0.93 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2wes h ALA 176 CO 0.09 0.28 0.06 -0.09 0.00 0.00 0.00 179.25 179.58 2wes h ARG 177 N 0.92 0.13 -0.52 0.00 2.43 -0.74 0.20 114.38 116.81 2wes h ARG 177 Ca 0.27 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2wes h ARG 177 Cb -0.06 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 2wes h ARG 177 CO -0.08 0.14 0.34 -0.92 -1.51 0.00 0.00 179.97 177.95 2wes h TYR 178 N 0.08 0.65 -0.29 2.20 3.20 -0.57 -2.50 116.97 119.74 2wes h TYR 178 Ca 0.03 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 2wes h TYR 178 Cb 0.05 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 2wes h TYR 178 CO -0.05 0.41 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.49 2wes h LEU 179 N 0.70 0.64 -1.08 2.82 3.38 -0.46 -1.94 115.31 119.37 2wes h LEU 179 Ca 0.19 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2wes h LEU 179 Cb -0.08 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 2wes h LEU 179 CO -0.04 0.91 0.62 0.77 0.09 0.00 0.00 178.44 180.79 2wes h SER 180 N 0.53 1.07 -0.22 -0.43 4.64 -0.78 0.12 113.55 118.47 2wes h SER 180 Ca 0.06 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 2wes h SER 180 Cb 0.80 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 2wes h SER 180 CO 0.07 0.77 0.06 -0.08 -0.87 0.00 0.00 176.83 176.78 2wes h GLU 181 N 1.26 0.34 -0.29 4.77 4.81 -1.25 0.14 114.58 124.35 2wes h GLU 181 Ca 0.34 -0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.56 2wes h GLU 181 Cb -0.14 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.13 2wes h GLU 181 CO -0.08 0.44 -0.11 -0.92 -0.73 0.00 0.00 179.01 177.61 2wes h TYR 182 N 0.18 -0.26 -0.17 0.92 3.20 -0.64 -0.78 116.97 119.43 2wes h TYR 182 Ca 0.07 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.83 2wes h TYR 182 Cb 0.24 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2wes h TYR 182 CO 0.00 -0.17 -0.43 0.00 -1.64 0.00 0.00 178.16 175.92 2wes h ALA 183 N 1.21 0.28 -0.77 1.82 0.00 -0.63 -2.85 119.26 118.32 2wes h ALA 183 Ca 0.15 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 2wes h ALA 183 Cb 0.28 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2wes h ALA 183 CO -0.33 0.40 0.33 0.82 0.00 0.00 0.00 179.25 180.47 2wes h ILE 184 N 0.25 1.25 -0.04 0.00 2.04 -0.71 -0.61 117.51 119.69 2wes h ILE 184 Ca -0.01 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.11 2wes h ILE 184 Cb 1.04 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2wes h ILE 184 CO 0.09 0.31 0.10 0.00 0.00 0.00 0.00 178.15 178.65 2wes h ALA 185 N 1.25 1.33 -0.37 1.87 0.00 -1.01 -2.07 119.26 120.27 2wes h ALA 185 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2wes h ALA 185 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2wes h ALA 185 CO -0.03 -0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.65 2wes n ARG 186 N -3.36 3.52 -0.08 0.00 1.74 -0.28 -4.96 116.66 113.24 2wes n ARG 186 Ca -0.02 -2.91 0.00 0.00 -0.77 0.00 0.00 57.85 54.15 2wes n ARG 186 Cb 0.18 -1.95 0.00 0.00 -1.02 0.00 0.00 32.46 29.67 2wes n ARG 186 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wes n GLY 187 N -0.10 0.94 3.69 -0.13 0.00 -0.78 -4.96 105.19 103.85 2wes n GLY 187 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 2wes n GLY 187 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wes s VAL 188 N -2.01 3.87 0.08 1.61 1.01 -0.91 -4.67 120.40 119.38 2wes s VAL 188 Ca 0.00 1.24 -0.31 0.00 0.00 0.00 0.00 61.98 62.92 2wes s VAL 188 Cb 0.00 -3.80 -0.06 0.00 0.00 0.00 0.00 36.38 32.52 2wes s VAL 188 CO 0.00 0.00 1.20 -0.60 0.00 0.00 0.00 175.10 175.70 2wes s ARG 189 N 2.30 4.44 -0.19 2.72 3.52 -0.29 -4.55 118.95 126.90 2wes s ARG 189 Ca 0.61 1.79 -0.03 0.00 -0.13 0.00 0.00 55.73 57.97 2wes s ARG 189 Cb -0.29 -3.33 -0.02 0.00 -1.56 0.00 0.00 34.95 29.75 2wes s ARG 189 CO 0.25 -0.24 -0.05 -1.58 -0.81 0.00 0.00 175.30 172.87 2wes s HIS 190 N 0.91 2.95 -0.14 5.12 5.65 -1.26 -0.49 115.29 128.03 2wes s HIS 190 Ca 0.58 -0.70 0.01 0.00 0.25 0.00 0.00 55.06 55.20 2wes s HIS 190 Cb -0.30 -2.02 0.02 0.00 -1.18 0.00 0.00 32.58 29.10 2wes s HIS 190 CO 0.30 -0.35 -0.16 0.08 -0.65 0.00 0.00 174.74 173.96 2wes s VAL 191 N 0.98 1.68 -0.43 0.89 1.01 0.03 -4.99 120.40 119.58 2wes s VAL 191 Ca -0.00 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.11 2wes s VAL 191 Cb -0.15 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.72 2wes s VAL 191 CO 0.00 0.48 0.33 -0.69 0.00 0.00 0.00 175.10 175.22 2wes s VAL 192 N 1.26 5.25 0.01 2.92 1.01 -1.26 -1.31 120.40 128.28 2wes s VAL 192 Ca 0.01 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.93 2wes s VAL 192 Cb -0.14 -3.98 0.11 0.00 0.00 0.00 0.00 36.38 32.37 2wes s VAL 192 CO -0.08 -0.38 1.15 -0.62 0.00 0.00 0.00 175.10 175.17 2wes s ASP 193 N 1.92 -0.13 -0.15 3.32 -1.08 -0.23 -4.83 116.67 115.48 2wes s ASP 193 Ca 0.05 -0.18 -0.08 0.00 -0.52 0.00 0.00 52.55 51.81 2wes s ASP 193 Cb -0.20 0.27 -0.04 0.00 -1.46 0.00 0.00 42.92 41.48 2wes s ASP 193 CO 0.09 -0.49 0.13 -1.81 0.52 0.00 0.00 175.17 173.61 2wes s ASP 194 N -2.82 6.24 -0.16 -0.34 1.01 -1.26 -2.61 116.67 116.73 2wes s ASP 194 Ca 0.12 0.34 -0.29 0.00 0.71 0.00 0.00 52.55 53.43 2wes s ASP 194 Cb 0.02 -2.05 -0.00 0.00 1.01 0.00 0.00 42.92 41.89 2wes s ASP 194 CO -0.03 0.30 1.06 -0.69 0.21 0.00 0.00 175.17 176.03 2wes s VAL 195 N -0.39 4.65 -0.17 -1.27 1.01 -1.26 -2.31 120.40 120.66 2wes s VAL 195 Ca 0.11 1.95 0.18 0.00 0.00 0.00 0.00 61.98 64.23 2wes s VAL 195 Cb -0.12 -4.26 -0.26 0.00 0.00 0.00 0.00 36.38 31.75 2wes s VAL 195 CO 0.01 -0.09 0.13 0.00 0.00 0.00 0.00 175.10 175.15 2wes n GLN 196 N 5.74 0.75 -3.74 2.72 6.02 0.33 -4.99 117.38 124.21 2wes n GLN 196 Ca 0.11 -0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 56.93 2wes n GLN 196 Cb 0.47 -1.51 -0.10 0.00 1.02 0.00 0.00 30.24 30.12 2wes n GLN 196 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2wes s HIS 197 N -2.63 -0.41 -0.24 1.08 5.04 -1.20 -5.02 115.29 111.91 2wes s HIS 197 Ca -0.09 0.99 -0.05 0.00 -1.54 0.00 0.00 55.06 54.36 2wes s HIS 197 Cb 0.07 0.14 -0.01 0.00 0.04 0.00 0.00 32.58 32.82 2wes s HIS 197 CO 0.82 -0.22 0.01 0.08 -2.34 0.00 0.00 174.74 173.09 2wes s VAL 198 N 0.09 3.71 0.36 0.89 1.01 -1.26 -0.40 120.40 124.81 2wes s VAL 198 Ca -0.01 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.29 2wes s VAL 198 Cb -0.03 -2.74 -0.10 0.00 0.00 0.00 0.00 36.38 33.51 2wes s VAL 198 CO 0.01 0.35 0.94 -0.83 0.00 0.00 0.00 175.10 175.57 2wes s GLY 199 N 1.52 2.65 0.01 4.51 0.00 0.09 -5.00 107.32 111.09 2wes s GLY 199 Ca 0.05 0.47 0.04 0.00 0.00 0.00 0.00 44.72 45.29 2wes s GLY 199 CO -0.01 0.86 -0.13 1.20 0.00 0.00 0.00 173.10 175.02 2wes s GLN 200 N -2.47 1.00 1.04 2.90 -0.21 -1.26 -1.30 119.66 119.36 2wes s GLN 200 Ca 0.54 -0.56 -0.18 0.00 0.02 0.00 0.00 55.36 55.18 2wes s GLN 200 Cb -0.15 -0.98 0.24 0.00 1.00 0.00 0.00 33.01 33.12 2wes s GLN 200 CO 0.20 0.26 1.30 -0.40 -2.12 0.00 0.00 175.29 174.53 2wes n ASP 201 N 2.46 -0.34 0.29 5.90 5.68 0.59 -4.84 116.55 126.30 2wes n ASP 201 Ca -0.15 -1.42 0.18 0.00 -0.50 0.00 0.00 54.79 52.89 2wes n ASP 201 Cb 0.55 -1.03 0.99 0.00 -1.14 0.00 0.00 41.12 40.50 2wes n ASP 201 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2wes h GLU 202 N 0.00 0.00 -0.01 0.11 4.81 -2.02 -2.10 114.58 115.37 2wes h GLU 202 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2wes h GLU 202 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2wes h GLU 202 CO 0.30 0.00 -0.13 0.54 -0.73 0.00 0.00 179.01 178.99 2wes n ARG 203 N -3.49 0.99 -0.48 1.92 1.74 -1.26 -4.91 116.66 111.17 2wes n ARG 203 Ca -0.02 -0.48 0.00 0.00 -0.77 0.00 0.00 57.85 56.58 2wes n ARG 203 Cb 0.16 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 2wes n ARG 203 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wes n GLY 204 N 1.26 0.74 3.78 -0.13 0.00 -0.79 -5.05 105.19 105.00 2wes n GLY 204 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2wes n GLY 204 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wes s TRP 205 N -2.80 3.16 0.11 1.61 0.52 -1.26 -4.75 118.94 115.52 2wes s TRP 205 Ca 0.00 1.61 -0.31 0.00 0.02 0.00 0.00 56.10 57.43 2wes s TRP 205 Cb 0.00 -3.17 -0.07 0.00 -1.15 0.00 0.00 33.47 29.08 2wes s TRP 205 CO 0.00 -0.83 1.26 0.42 0.02 0.00 0.00 176.95 177.82 2wes s ILE 206 N -1.67 3.68 -0.14 2.03 1.01 -1.26 -0.30 121.20 124.55 2wes s ILE 206 Ca 0.60 1.25 0.14 0.00 0.00 0.00 0.00 60.65 62.64 2wes s ILE 206 Cb -0.23 -3.80 -0.20 0.00 0.01 0.00 0.00 42.46 38.24 2wes s ILE 206 CO 0.28 0.12 0.08 -1.54 0.00 0.00 0.00 174.94 173.88 2wes n SER 207 N 3.59 1.14 0.00 3.58 3.41 -0.42 -4.83 113.62 120.09 2wes n SER 207 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2wes n SER 207 Cb 0.45 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 2wes n SER 207 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wes n GLY 208 N 1.99 0.65 3.51 5.00 0.00 -1.24 -4.43 105.19 110.66 2wes n GLY 208 Ca -0.24 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 2wes n GLY 208 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wes s VAL 209 N -2.00 3.79 -0.31 1.61 -7.23 0.08 -0.74 120.40 115.60 2wes s VAL 209 Ca 0.00 -0.40 -0.13 0.00 -1.81 0.00 0.00 61.98 59.64 2wes s VAL 209 Cb 0.00 -2.64 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 2wes s VAL 209 CO 0.00 0.52 0.26 -1.00 -0.31 0.00 0.00 175.10 174.57 2wes s HIS 210 N 0.12 3.22 0.32 2.82 3.76 0.46 -0.77 115.29 125.23 2wes s HIS 210 Ca -0.02 -0.00 0.06 0.00 -0.15 0.00 0.00 55.06 54.95 2wes s HIS 210 Cb -0.14 -2.50 -0.01 0.00 1.11 0.00 0.00 32.58 31.04 2wes s HIS 210 CO 0.03 -0.30 0.45 0.95 -0.85 0.00 0.00 174.74 175.02 2wes s THR 211 N 1.83 4.36 0.14 1.30 -4.23 -0.14 -0.51 115.64 118.39 2wes s THR 211 Ca 0.08 -0.98 -0.15 0.00 -1.18 0.00 0.00 61.69 59.47 2wes s THR 211 Cb -0.17 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.17 2wes s THR 211 CO 0.11 -0.21 1.71 0.11 -0.54 0.00 0.00 174.62 175.81 2wes h LYS 212 N 0.94 0.64 0.00 3.99 1.57 -1.77 -3.35 116.57 118.60 2wes h LYS 212 Ca -0.47 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2wes h LYS 212 Cb 1.25 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2wes h LYS 212 CO 0.55 0.56 0.00 1.04 -0.57 0.00 0.00 179.45 181.03 2wes n GLN 213 N -4.64 0.79 -0.08 3.15 1.13 -1.26 -4.76 117.38 111.70 2wes n GLN 213 Ca 0.01 -0.29 0.05 0.00 -1.94 0.00 0.00 57.00 54.83 2wes n GLN 213 Cb 0.12 -0.77 0.07 0.00 0.11 0.00 0.00 30.24 29.78 2wes n GLN 213 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2wes n HIS 214 N -0.20 0.00 -4.67 1.08 8.25 -1.26 -5.12 115.22 113.31 2wes n HIS 214 Ca 0.00 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.78 2wes n HIS 214 Cb 0.04 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.05 2wes n HIS 214 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wes n GLY 215 N -0.90 0.32 3.72 -1.41 0.00 -1.25 -4.70 105.19 100.96 2wes n GLY 215 Ca 0.08 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2wes n GLY 215 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wes s GLU 216 N 0.00 4.51 -0.20 1.61 2.12 -1.26 -0.97 118.70 124.52 2wes s GLU 216 Ca 0.00 1.16 -0.04 0.00 0.36 0.00 0.00 54.97 56.45 2wes s GLU 216 Cb 0.00 -3.43 -0.02 0.00 0.26 0.00 0.00 34.13 30.94 2wes s GLU 216 CO 0.00 0.06 -0.04 0.42 -0.54 0.00 0.00 175.26 175.16 2wes s ILE 217 N 0.70 3.57 0.32 -3.70 1.01 0.06 -4.95 121.20 118.20 2wes s ILE 217 Ca 0.44 -0.44 0.09 0.00 0.00 0.00 0.00 60.65 60.74 2wes s ILE 217 Cb -0.20 -2.60 -0.06 0.00 0.01 0.00 0.00 42.46 39.61 2wes s ILE 217 CO 0.24 0.44 -0.10 -0.44 0.00 0.00 0.00 174.94 175.08 2wes s SER 218 N 1.09 3.44 -0.09 3.58 0.01 -1.26 -0.74 113.70 119.72 2wes s SER 218 Ca 0.01 -1.17 -0.31 0.00 1.31 0.00 0.00 55.95 55.79 2wes s SER 218 Cb -0.15 -0.29 0.11 0.00 0.21 0.00 0.00 66.02 65.90 2wes s SER 218 CO 0.00 -0.21 1.39 -0.83 0.41 0.00 0.00 173.24 174.00 2wes s GLY 219 N -3.55 -0.28 -0.02 3.44 0.00 -1.26 -4.88 107.32 100.78 2wes s GLY 219 Ca 0.31 0.33 -0.20 0.00 0.00 0.00 0.00 44.72 45.16 2wes s GLY 219 CO 0.15 5.52 0.97 -0.55 0.00 0.00 0.00 173.10 179.20 2wes h ASP 220 N 2.00 0.56 -3.68 1.64 3.32 -1.46 -3.46 116.42 115.34 2wes h ASP 220 Ca -0.22 -0.89 -0.62 0.00 0.02 0.00 0.00 57.03 55.31 2wes h ASP 220 Cb 1.18 -0.18 -0.32 0.00 0.22 0.00 0.00 39.33 40.22 2wes h ASP 220 CO 0.29 1.41 -0.86 -0.22 -1.72 0.00 0.00 179.24 178.15 2wes s LEU 221 N -7.96 1.96 -0.16 1.55 2.96 -0.72 -4.89 118.68 111.42 2wes s LEU 221 Ca -0.13 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.32 2wes s LEU 221 Cb 0.02 -1.17 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 2wes s LEU 221 CO 0.85 0.16 -0.09 -0.36 -1.32 0.00 0.00 176.35 175.59 2wes s PHE 222 N 0.18 2.89 -0.25 5.38 0.08 -0.45 -0.31 117.98 125.51 2wes s PHE 222 Ca -0.10 -0.71 -0.07 0.00 0.12 0.00 0.00 56.93 56.17 2wes s PHE 222 Cb -0.15 -1.95 -0.03 0.00 -0.57 0.00 0.00 43.02 40.33 2wes s PHE 222 CO 0.05 -0.30 0.07 0.08 -0.10 0.00 0.00 175.22 175.01 2wes s VAL 223 N 0.73 4.28 -0.59 -0.44 1.01 -0.06 -1.27 120.40 124.06 2wes s VAL 223 Ca -0.04 -0.18 -0.23 0.00 0.00 0.00 0.00 61.98 61.52 2wes s VAL 223 Cb -0.15 -3.00 0.05 0.00 0.00 0.00 0.00 36.38 33.28 2wes s VAL 223 CO 0.02 0.35 0.94 -0.62 0.00 0.00 0.00 175.10 175.78 2wes s ASP 224 N 1.58 6.27 -0.34 3.32 -1.08 0.82 -1.54 116.67 125.70 2wes s ASP 224 Ca 0.06 -0.61 0.06 0.00 -0.52 0.00 0.00 52.55 51.54 2wes s ASP 224 Cb -0.15 -2.42 0.46 0.00 -1.46 0.00 0.00 42.92 39.35 2wes s ASP 224 CO 0.03 -1.29 1.30 0.00 0.52 0.00 0.00 175.17 175.73 2wes n THR 226 N -0.74 0.58 -4.22 0.00 -2.24 -1.14 -4.28 114.28 102.23 2wes n THR 226 Ca 0.46 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2wes n THR 226 Cb 0.93 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2wes n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wes n GLY 227 N 0.88 -1.12 0.58 3.38 0.00 -1.26 -4.01 105.19 103.64 2wes n GLY 227 Ca 0.11 -1.23 0.38 0.00 0.00 0.00 0.00 46.02 45.28 2wes n GLY 227 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2wes h PHE 228 N 0.00 0.00 -0.54 1.61 0.04 -1.94 -0.38 116.94 115.74 2wes h PHE 228 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2wes h PHE 228 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 2wes h PHE 228 CO 0.00 0.00 0.21 -0.09 -0.60 0.00 0.00 178.31 177.83 2wes h ARG 229 N 0.00 0.77 -6.77 1.51 2.43 -1.89 -3.47 114.38 106.96 2wes h ARG 229 Ca 0.64 -0.11 -0.56 0.00 -0.81 0.00 0.00 59.98 59.13 2wes h ARG 229 Cb 2.88 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 32.27 2wes h ARG 229 CO -0.01 0.64 -0.99 0.41 -1.51 0.00 0.00 179.97 178.51 2wes n GLY 230 N -1.08 -0.75 0.23 2.80 0.00 -0.17 -4.54 105.19 101.68 2wes n GLY 230 Ca 0.04 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.40 2wes n GLY 230 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wes h LEU 231 N -2.34 0.06 0.00 0.99 5.85 -1.86 -0.10 115.31 117.90 2wes h LEU 231 Ca -0.69 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.10 2wes h LEU 231 Cb 1.39 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.55 2wes h LEU 231 CO 0.54 0.04 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.35 2wes h LEU 232 N 0.29 0.00 -0.44 2.25 3.38 -1.95 -1.18 115.31 117.67 2wes h LEU 232 Ca 0.31 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 2wes h LEU 232 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2wes h LEU 232 CO -0.38 0.76 -0.17 -0.29 0.09 0.00 0.00 178.44 178.46 2wes h ILE 233 N -1.00 1.27 0.00 1.22 6.09 -1.95 0.25 117.51 123.40 2wes h ILE 233 Ca -0.04 -1.31 -0.31 0.00 -1.37 0.00 0.00 64.86 61.83 2wes h ILE 233 Cb 0.45 1.18 -0.05 0.00 0.47 0.00 0.00 36.82 38.87 2wes h ILE 233 CO -0.02 0.45 -1.82 0.59 -3.07 0.00 0.00 178.15 174.28 2wes n ASN 234 N -4.21 1.91 -0.00 2.19 4.13 -0.37 -1.14 115.26 117.76 2wes n ASN 234 Ca -0.01 0.39 -0.18 0.00 1.68 0.00 0.00 54.58 56.46 2wes n ASN 234 Cb 0.42 -0.87 -0.09 0.00 -1.54 0.00 0.00 39.78 37.70 2wes n ASN 234 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 2wes h GLN 235 N -1.00 0.71 0.00 3.52 4.20 -1.02 -1.99 115.11 119.53 2wes h GLN 235 Ca -0.47 -0.65 -0.06 0.00 0.06 0.00 0.00 58.65 57.53 2wes h GLN 235 Cb 1.38 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 29.31 2wes h GLN 235 CO -0.29 1.25 -0.39 1.15 -0.67 0.00 0.00 178.83 179.89 2wes h THR 236 N 0.40 1.10 0.00 -0.54 2.02 -1.01 -3.41 112.91 111.48 2wes h THR 236 Ca -0.08 -1.96 0.00 0.00 0.77 0.00 0.00 66.41 65.14 2wes h THR 236 Cb 1.47 2.21 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 2wes h THR 236 CO 0.17 0.37 -0.47 0.18 0.37 0.00 0.00 175.52 176.13 2wes n LEU 237 N -4.59 0.62 -0.48 2.58 4.77 0.06 -4.96 117.00 115.00 2wes n LEU 237 Ca -0.14 0.25 -0.06 0.00 -0.03 0.00 0.00 56.01 56.03 2wes n LEU 237 Cb 0.44 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 2wes n LEU 237 CO 0.22 -0.03 -0.06 0.61 -1.33 0.00 0.00 177.39 176.80 2wes n GLY 238 N 1.38 0.63 3.63 -0.72 0.00 -0.75 -4.97 105.19 104.39 2wes n GLY 238 Ca 0.04 -0.77 -0.44 0.00 0.00 0.00 0.00 46.02 44.86 2wes n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wes n GLY 239 N -1.95 0.14 3.73 -0.02 0.00 -0.30 -4.93 105.19 101.86 2wes n GLY 239 Ca -0.06 0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 2wes n GLY 239 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wes s ARG 240 N -1.51 4.56 -0.18 1.61 0.52 -1.26 -4.67 118.95 118.01 2wes s ARG 240 Ca 0.59 1.23 -0.07 0.00 -0.52 0.00 0.00 55.73 56.95 2wes s ARG 240 Cb -0.66 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.37 2wes s ARG 240 CO 0.59 0.16 0.06 0.12 0.02 0.00 0.00 175.30 176.25 2wes s PHE 241 N 0.31 3.24 -0.39 -0.53 5.36 -1.26 -0.97 117.98 123.74 2wes s PHE 241 Ca 0.44 0.06 -0.11 0.00 -0.96 0.00 0.00 56.93 56.35 2wes s PHE 241 Cb -0.21 -2.07 0.03 0.00 -0.34 0.00 0.00 43.02 40.44 2wes s PHE 241 CO 0.25 0.16 0.23 -1.14 -1.46 0.00 0.00 175.22 173.26 2wes s GLN 242 N 0.33 2.82 0.32 10.12 0.74 0.89 -4.96 119.66 129.92 2wes s GLN 242 Ca 0.03 -1.12 -0.28 0.00 0.05 0.00 0.00 55.36 54.04 2wes s GLN 242 Cb -0.12 -3.78 -0.09 0.00 1.10 0.00 0.00 33.01 30.11 2wes s GLN 242 CO 0.00 -0.74 1.13 0.45 -0.55 0.00 0.00 175.29 175.59 2wes s SER 243 N 1.64 7.01 0.00 6.67 0.15 -1.26 -1.25 113.70 126.66 2wes s SER 243 Ca 0.02 2.32 0.21 0.00 0.70 0.00 0.00 55.95 59.20 2wes s SER 243 Cb -0.20 -2.62 0.50 0.00 -1.71 0.00 0.00 66.02 61.99 2wes s SER 243 CO 0.07 -0.33 1.43 0.49 1.20 0.00 0.00 173.24 176.10 2wes n PHE 244 N 0.80 0.69 -0.33 3.44 3.72 -0.76 -4.68 117.46 120.34 2wes n PHE 244 Ca 0.01 -0.37 0.29 0.00 -0.05 0.00 0.00 57.45 57.32 2wes n PHE 244 Cb 0.45 -0.00 0.61 0.00 -0.94 0.00 0.00 39.48 39.60 2wes n PHE 244 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2wes h SER 245 N 4.09 0.26 0.24 4.37 0.02 -1.76 0.12 113.55 120.89 2wes h SER 245 Ca 0.00 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2wes h SER 245 Cb 0.95 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.50 2wes h SER 245 CO 0.00 0.03 -0.12 -2.24 -1.14 0.00 0.00 176.83 173.36 2wes h ASP 246 N 0.22 0.00 0.00 3.07 2.03 -1.98 -3.13 116.42 116.63 2wes h ASP 246 Ca 0.60 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.88 2wes h ASP 246 Cb 1.88 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 40.38 2wes h ASP 246 CO -0.20 0.12 -1.29 1.33 -1.03 0.00 0.00 179.24 178.18 2wes n VAL 247 N -3.91 0.08 -3.51 4.15 0.24 -0.32 -4.51 118.33 110.56 2wes n VAL 247 Ca -0.02 -0.15 -0.29 0.00 -2.04 0.00 0.00 64.34 61.84 2wes n VAL 247 Cb 0.22 0.11 -0.12 0.00 -1.47 0.00 0.00 33.84 32.58 2wes n VAL 247 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2wes s LEU 248 N -3.61 1.56 0.51 1.34 1.43 0.25 -4.92 118.68 115.23 2wes s LEU 248 Ca -0.02 -2.56 0.29 0.00 -1.03 0.00 0.00 54.13 50.82 2wes s LEU 248 Cb 0.03 -0.57 0.97 0.00 0.03 0.00 0.00 46.19 46.65 2wes s LEU 248 CO 0.24 -0.26 1.84 1.55 0.23 0.00 0.00 176.35 179.95 2wes h PRO 249 N 6.55 0.00 -6.20 1.29 0.13 -1.78 -3.34 132.00 128.65 2wes h PRO 249 Ca 0.10 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.52 2wes h PRO 249 Cb 0.94 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.11 2wes h PRO 249 CO 0.35 0.01 0.55 0.09 -0.23 0.00 0.00 178.00 178.77 2wes n ASN 250 N -3.10 1.69 0.00 1.44 3.02 -1.26 -4.64 115.26 112.40 2wes n ASN 250 Ca 0.02 1.11 0.00 0.00 -0.03 0.00 0.00 54.58 55.68 2wes n ASN 250 Cb 0.39 -1.14 0.00 0.00 -0.61 0.00 0.00 39.78 38.42 2wes n ASN 250 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2wes n ASN 251 N 3.29 0.10 -3.95 6.41 6.94 -0.32 -4.90 115.26 122.84 2wes n ASN 251 Ca 0.21 -0.78 -0.08 0.00 -0.02 0.00 0.00 54.58 53.91 2wes n ASN 251 Cb 0.15 0.03 -0.08 0.00 -2.36 0.00 0.00 39.78 37.52 2wes n ASN 251 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2wes s ARG 252 N -0.03 0.79 0.02 -3.83 0.52 -0.93 -0.85 118.95 114.65 2wes s ARG 252 Ca 0.00 -1.07 0.00 0.00 -0.52 0.00 0.00 55.73 54.14 2wes s ARG 252 Cb 0.00 0.30 -0.02 0.00 0.52 0.00 0.00 34.95 35.75 2wes s ARG 252 CO 0.00 -0.23 -0.03 0.00 0.02 0.00 0.00 175.30 175.06 2wes s ALA 253 N -3.89 0.13 -0.05 2.13 0.00 -0.39 -1.11 121.76 118.58 2wes s ALA 253 Ca 0.07 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.49 2wes s ALA 253 Cb 0.06 0.14 0.01 0.00 0.00 0.00 0.00 23.12 23.33 2wes s ALA 253 CO -0.09 -0.15 -0.11 0.54 0.00 0.00 0.00 175.76 175.94 2wes s VAL 254 N -1.39 1.02 0.06 0.00 0.11 -0.70 -1.31 120.40 118.19 2wes s VAL 254 Ca -0.15 -0.45 0.08 0.00 -2.93 0.00 0.00 61.98 58.52 2wes s VAL 254 Cb -0.10 -0.92 -0.03 0.00 -1.53 0.00 0.00 36.38 33.80 2wes s VAL 254 CO -0.01 0.32 -0.21 0.00 -3.33 0.00 0.00 175.10 171.87 2wes s ALA 255 N 0.42 1.79 0.03 1.54 0.00 0.37 -0.52 121.76 125.39 2wes s ALA 255 Ca -0.09 -1.11 0.06 0.00 0.00 0.00 0.00 51.96 50.82 2wes s ALA 255 Cb -0.13 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2wes s ALA 255 CO 0.02 0.39 -0.19 -0.51 0.00 0.00 0.00 175.76 175.48 2wes s LEU 256 N -1.36 2.13 -0.37 0.00 1.43 0.83 -1.23 118.68 120.12 2wes s LEU 256 Ca 0.07 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 2wes s LEU 256 Cb -0.09 -0.89 0.02 0.00 0.03 0.00 0.00 46.19 45.26 2wes s LEU 256 CO 0.02 0.15 0.22 -0.13 0.23 0.00 0.00 176.35 176.84 2wes s ARG 257 N -0.98 2.94 -0.41 1.70 0.52 -1.26 -0.95 118.95 120.50 2wes s ARG 257 Ca 0.06 -1.01 -0.10 0.00 -0.52 0.00 0.00 55.73 54.17 2wes s ARG 257 Cb -0.08 -3.76 0.07 0.00 0.52 0.00 0.00 34.95 31.70 2wes s ARG 257 CO 0.01 -0.66 0.25 0.08 0.02 0.00 0.00 175.30 175.00 2wes s VAL 258 N 1.59 4.32 0.52 3.52 1.01 -0.02 -4.96 120.40 126.38 2wes s VAL 258 Ca 0.03 -1.27 -0.23 0.00 0.00 0.00 0.00 61.98 60.51 2wes s VAL 258 Cb -0.19 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.55 2wes s VAL 258 CO 0.07 -0.45 1.36 -2.84 0.00 0.00 0.00 175.10 173.25 2wes s PRO 259 N 1.46 3.31 -0.21 2.72 0.02 -1.26 -0.95 135.00 140.08 2wes s PRO 259 Ca 0.03 2.24 -0.18 0.00 0.02 0.00 0.00 61.00 63.11 2wes s PRO 259 Cb -0.22 -2.36 -0.03 0.00 0.02 0.00 0.00 34.50 31.91 2wes s PRO 259 CO 0.03 -1.06 0.49 0.50 -0.33 0.00 0.00 177.00 176.63 2wes s ARG 260 N -2.79 4.17 0.03 5.54 3.52 -0.20 -4.80 118.95 124.42 2wes s ARG 260 Ca 0.69 0.34 -0.18 0.00 -0.13 0.00 0.00 55.73 56.45 2wes s ARG 260 Cb -0.40 -3.57 -0.24 0.00 -1.56 0.00 0.00 34.95 29.18 2wes s ARG 260 CO 0.49 -0.15 1.13 1.49 -0.81 0.00 0.00 175.30 177.44 2wes h GLU 261 N 7.53 0.52 -4.44 5.12 4.81 -1.92 -3.42 114.58 122.77 2wes h GLU 261 Ca -0.34 -0.57 -0.72 0.00 -0.13 0.00 0.00 59.36 57.61 2wes h GLU 261 Cb 1.15 0.16 -0.25 0.00 0.63 0.00 0.00 28.75 30.45 2wes h GLU 261 CO 0.73 1.19 -0.44 1.21 -0.73 0.00 0.00 179.01 180.98 2wes s ASN 262 N -6.96 5.84 0.31 1.04 3.84 -1.26 -4.97 114.94 112.78 2wes s ASN 262 Ca -0.12 -1.29 0.08 0.00 0.21 0.00 0.00 52.86 51.74 2wes s ASN 262 Cb 0.05 -2.06 0.87 0.00 -0.55 0.00 0.00 41.25 39.55 2wes s ASN 262 CO 0.86 -0.53 1.69 0.44 -2.79 0.00 0.00 177.10 176.78 2wes h ASP 263 N 8.53 0.45 0.07 -4.21 3.32 -1.97 0.22 116.42 122.83 2wes h ASP 263 Ca -0.25 0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2wes h ASP 263 Cb 1.10 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2wes h ASP 263 CO 0.77 -0.02 0.00 -0.62 -1.72 0.00 0.00 179.24 177.65 2wes n GLU 264 N -5.02 0.85 0.00 3.56 -0.58 -1.26 -2.25 120.64 115.94 2wes n GLU 264 Ca 0.26 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 57.08 2wes n GLU 264 Cb 0.77 -1.50 0.41 0.00 -0.57 0.00 0.00 31.44 30.55 2wes n GLU 264 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2wes n ASP 265 N -1.04 0.00 -4.66 1.62 8.00 0.06 -4.84 116.55 115.69 2wes n ASP 265 Ca 0.21 0.02 -0.42 0.00 0.71 0.00 0.00 54.79 55.31 2wes n ASP 265 Cb 0.12 -0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 40.93 2wes n ASP 265 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2wes s MET 266 N -2.53 4.20 -0.16 -1.24 1.75 -0.96 -5.00 119.30 115.36 2wes s MET 266 Ca 0.16 2.01 -0.09 0.00 -1.25 0.00 0.00 55.69 56.52 2wes s MET 266 Cb 0.11 -3.91 -0.05 0.00 2.84 0.00 0.00 34.83 33.82 2wes s MET 266 CO 0.24 -0.80 0.14 1.03 -0.65 0.00 0.00 175.02 174.98 2wes s ARG 267 N 3.85 3.83 -0.29 4.11 0.52 -1.26 -4.56 118.95 125.15 2wes s ARG 267 Ca 0.67 -0.18 -0.03 0.00 -0.52 0.00 0.00 55.73 55.67 2wes s ARG 267 Cb -0.29 -3.31 0.03 0.00 0.52 0.00 0.00 34.95 31.90 2wes s ARG 267 CO 0.25 0.53 2.69 -0.35 0.02 0.00 0.00 175.30 178.44 2wes n PRO 268 N 2.77 2.05 -3.51 3.54 -0.04 -1.26 -4.69 135.00 133.87 2wes n PRO 268 Ca -0.18 -1.67 -0.09 0.00 -0.04 0.00 0.00 63.50 61.52 2wes n PRO 268 Cb 0.53 -1.88 -0.02 0.00 -0.04 0.00 0.00 33.50 32.09 2wes n PRO 268 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2wes s TYR 269 N -1.04 -0.37 0.27 0.54 -0.85 -1.12 -0.36 117.35 114.42 2wes s TYR 269 Ca 0.49 0.28 -0.19 0.00 -0.52 0.00 0.00 57.07 57.13 2wes s TYR 269 Cb 0.30 0.53 -0.09 0.00 0.38 0.00 0.00 41.96 43.08 2wes s TYR 269 CO -0.10 -0.54 0.75 0.99 -1.52 0.00 0.00 175.55 175.13 2wes s THR 270 N -2.93 4.57 -0.06 -3.49 2.01 -1.01 -4.51 115.64 110.23 2wes s THR 270 Ca 0.04 1.22 0.04 0.00 0.31 0.00 0.00 61.69 63.30 2wes s THR 270 Cb -0.01 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 2wes s THR 270 CO -0.08 0.05 -0.16 -0.89 -0.69 0.00 0.00 174.62 172.85 2wes s THR 271 N -1.71 2.85 -0.26 -0.82 2.01 -0.78 -0.38 115.64 116.55 2wes s THR 271 Ca 0.48 -0.79 0.01 0.00 0.31 0.00 0.00 61.69 61.70 2wes s THR 271 Cb -0.14 -2.11 0.07 0.00 0.01 0.00 0.00 72.50 70.32 2wes s THR 271 CO 0.20 0.58 -0.03 0.00 -0.69 0.00 0.00 174.62 174.68 2wes s ALA 272 N -0.49 2.11 -0.25 7.40 0.00 0.15 -1.53 121.76 129.15 2wes s ALA 272 Ca 0.06 -1.60 -0.06 0.00 0.00 0.00 0.00 51.96 50.37 2wes s ALA 272 Cb -0.12 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 2wes s ALA 272 CO 0.01 -1.31 0.03 0.99 0.00 0.00 0.00 175.76 175.48 2wes s THR 273 N 1.32 3.87 0.22 0.00 2.01 0.08 -1.37 115.64 121.77 2wes s THR 273 Ca -0.02 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.26 2wes s THR 273 Cb -0.19 -2.84 -0.09 0.00 0.01 0.00 0.00 72.50 69.39 2wes s THR 273 CO -0.08 0.31 1.40 0.00 -0.69 0.00 0.00 174.62 175.56 2wes s ALA 274 N 1.54 3.60 0.00 7.40 0.00 -0.11 -0.37 121.76 133.81 2wes s ALA 274 Ca 0.05 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2wes s ALA 274 Cb -0.15 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2wes s ALA 274 CO 0.01 -0.66 0.00 -1.33 0.00 0.00 0.00 175.76 173.77 2wes n MET 275 N 2.64 2.97 0.08 0.00 2.81 0.14 -4.86 117.12 120.90 2wes n MET 275 Ca 0.07 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.87 2wes n MET 275 Cb 0.41 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 32.92 2wes n MET 275 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2wes h SER 276 N 0.00 0.29 -0.44 7.83 4.64 -1.99 -3.37 113.55 120.51 2wes h SER 276 Ca 0.00 -0.23 -0.24 0.00 -0.47 0.00 0.00 61.79 60.85 2wes h SER 276 Cb 0.00 -0.09 -0.39 0.00 -0.31 0.00 0.00 62.40 61.61 2wes h SER 276 CO 0.00 1.02 -1.08 0.00 -0.87 0.00 0.00 176.83 175.90 2wes n ALA 277 N -2.47 2.63 0.00 5.18 0.00 -1.26 -4.58 120.51 120.01 2wes n ALA 277 Ca -0.04 -2.68 0.00 0.00 0.00 0.00 0.00 53.44 50.72 2wes n ALA 277 Cb 0.79 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 19.36 2wes n ALA 277 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wes n GLY 278 N -0.62 -0.23 3.45 0.00 0.00 -1.26 -3.26 105.19 103.27 2wes n GLY 278 Ca 0.06 -0.84 -0.09 0.00 0.00 0.00 0.00 46.02 45.15 2wes n GLY 278 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2wes s TRP 279 N -4.00 0.30 -0.03 1.61 1.48 -0.26 -0.69 118.94 117.35 2wes s TRP 279 Ca 0.00 -0.65 0.06 0.00 -1.06 0.00 0.00 56.10 54.45 2wes s TRP 279 Cb 0.00 0.10 -0.01 0.00 -1.16 0.00 0.00 33.47 32.40 2wes s TRP 279 CO 0.00 -0.84 -0.20 1.41 -4.06 0.00 0.00 176.95 173.26 2wes s MET 280 N -3.97 1.81 0.12 3.25 1.75 0.50 0.31 119.30 123.07 2wes s MET 280 Ca 0.18 -0.72 -0.03 0.00 -1.25 0.00 0.00 55.69 53.86 2wes s MET 280 Cb 0.01 -1.66 -0.05 0.00 2.84 0.00 0.00 34.83 35.97 2wes s MET 280 CO 0.02 0.38 0.33 1.67 -0.65 0.00 0.00 175.02 176.78 2wes s TRP 281 N -0.30 3.49 -0.16 4.11 -2.14 0.69 -0.74 118.94 123.88 2wes s TRP 281 Ca 0.03 0.47 0.00 0.00 2.66 0.00 0.00 56.10 59.26 2wes s TRP 281 Cb -0.10 -1.93 0.03 0.00 -3.10 0.00 0.00 33.47 28.37 2wes s TRP 281 CO 0.01 0.47 -0.10 0.99 -2.66 0.00 0.00 176.95 175.66 2wes s THR 282 N -1.63 1.39 -0.32 0.66 2.01 -0.58 -1.94 115.64 115.23 2wes s THR 282 Ca 0.39 -0.69 0.01 0.00 0.31 0.00 0.00 61.69 61.71 2wes s THR 282 Cb -0.12 -1.43 0.08 0.00 0.01 0.00 0.00 72.50 71.03 2wes s THR 282 CO 0.26 0.28 0.02 -0.63 -0.69 0.00 0.00 174.62 173.85 2wes s ILE 283 N 1.53 2.63 -0.51 1.82 1.01 0.50 -1.87 121.20 126.32 2wes s ILE 283 Ca 0.02 -1.82 -0.28 0.00 0.00 0.00 0.00 60.65 58.57 2wes s ILE 283 Cb -0.14 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.65 2wes s ILE 283 CO -0.09 -0.32 1.47 -2.84 0.00 0.00 0.00 174.94 173.16 2wes s PRO 284 N 1.10 3.34 0.82 2.79 0.02 -1.26 -1.16 135.00 140.65 2wes s PRO 284 Ca 0.00 0.67 -0.06 0.00 0.02 0.00 0.00 61.00 61.63 2wes s PRO 284 Cb -0.20 -4.12 0.16 0.00 0.02 0.00 0.00 34.50 30.36 2wes s PRO 284 CO -0.04 -1.88 1.13 -0.51 -0.33 0.00 0.00 177.00 175.37 2wes s LEU 285 N 6.14 2.87 0.28 -5.54 1.43 0.12 -4.26 118.68 119.73 2wes s LEU 285 Ca 0.58 -0.17 -0.03 0.00 -1.03 0.00 0.00 54.13 53.48 2wes s LEU 285 Cb -0.12 -2.02 0.39 0.00 0.03 0.00 0.00 46.19 44.47 2wes s LEU 285 CO 0.28 -2.24 1.91 0.15 0.23 0.00 0.00 176.35 176.67 2wes h PHE 286 N -0.98 1.02 0.00 0.29 -0.00 -1.31 -3.30 116.94 112.66 2wes h PHE 286 Ca -0.39 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.56 2wes h PHE 286 Cb 1.25 -0.33 0.00 0.00 -0.00 0.00 0.00 35.95 36.87 2wes h PHE 286 CO -0.61 0.71 0.00 1.63 -0.00 0.00 0.00 178.31 180.04 2wes n LYS 287 N -4.36 4.04 -3.82 1.11 4.76 -1.26 -5.02 118.16 113.61 2wes n LYS 287 Ca 0.08 -0.12 -0.11 0.00 -2.87 0.00 0.00 58.31 55.28 2wes n LYS 287 Cb 0.10 -0.57 -0.08 0.00 -1.84 0.00 0.00 35.03 32.63 2wes n LYS 287 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2wes s ARG 288 N -0.61 0.69 -0.19 1.97 1.70 -1.25 -1.03 118.95 120.23 2wes s ARG 288 Ca 0.00 -0.51 -0.09 0.00 -0.47 0.00 0.00 55.73 54.66 2wes s ARG 288 Cb 0.00 0.29 -0.05 0.00 -0.57 0.00 0.00 34.95 34.63 2wes s ARG 288 CO 0.00 -0.20 0.10 -0.51 -1.08 0.00 0.00 175.30 173.61 2wes s ASP 289 N -1.89 5.98 -0.02 -2.89 1.01 -0.12 -0.70 116.67 118.04 2wes s ASP 289 Ca -0.07 0.19 -0.18 0.00 0.71 0.00 0.00 52.55 53.19 2wes s ASP 289 Cb -0.02 -2.03 -0.05 0.00 1.01 0.00 0.00 42.92 41.82 2wes s ASP 289 CO -0.02 0.20 0.50 -0.83 0.21 0.00 0.00 175.17 175.23 2wes s GLY 290 N 0.26 2.53 -0.04 0.21 0.00 -0.31 -0.84 107.32 109.13 2wes s GLY 290 Ca 0.07 -0.10 0.04 0.00 0.00 0.00 0.00 44.72 44.72 2wes s GLY 290 CO -0.01 0.53 -0.15 -1.31 0.00 0.00 0.00 173.10 172.15 2wes s ASN 291 N -0.41 1.95 -0.03 1.64 0.01 -0.13 -0.37 114.94 117.61 2wes s ASN 291 Ca 0.27 -0.32 -0.02 0.00 -0.71 0.00 0.00 52.86 52.08 2wes s ASN 291 Cb -0.17 -0.53 0.01 0.00 0.41 0.00 0.00 41.25 40.97 2wes s ASN 291 CO 0.15 0.13 0.07 -0.83 -1.51 0.00 0.00 177.10 175.11 2wes s GLY 292 N 0.07 -0.04 -0.31 0.66 0.00 -0.82 -0.12 107.32 106.76 2wes s GLY 292 Ca -0.03 0.20 -0.08 0.00 0.00 0.00 0.00 44.72 44.81 2wes s GLY 292 CO 0.02 0.20 0.11 -0.47 0.00 0.00 0.00 173.10 172.96 2wes s TYR 293 N 0.11 3.18 -0.19 1.90 5.04 0.33 -0.22 117.35 127.49 2wes s TYR 293 Ca -0.01 -0.94 -0.12 0.00 -2.44 0.00 0.00 57.07 53.56 2wes s TYR 293 Cb -0.01 -2.30 -0.05 0.00 0.35 0.00 0.00 41.96 39.95 2wes s TYR 293 CO -0.00 -0.58 0.22 0.08 -1.34 0.00 0.00 175.55 173.93 2wes s VAL 294 N 1.52 5.34 0.21 3.14 1.01 0.15 -1.73 120.40 130.04 2wes s VAL 294 Ca 0.02 0.37 -0.13 0.00 0.00 0.00 0.00 61.98 62.25 2wes s VAL 294 Cb -0.18 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2wes s VAL 294 CO 0.04 0.39 0.43 -0.72 0.00 0.00 0.00 175.10 175.23 2wes s TYR 295 N 0.61 0.24 -0.24 5.22 -0.85 -0.27 -1.10 117.35 120.97 2wes s TYR 295 Ca 0.12 -0.60 -0.09 0.00 -0.52 0.00 0.00 57.07 55.98 2wes s TYR 295 Cb -0.12 0.17 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 2wes s TYR 295 CO 0.02 -0.88 0.13 0.45 -1.52 0.00 0.00 175.55 173.75 2wes s SER 296 N -2.96 5.80 0.00 -0.18 0.15 -1.20 -1.17 113.70 114.13 2wes s SER 296 Ca 0.17 0.02 0.17 0.00 0.70 0.00 0.00 55.95 57.00 2wes s SER 296 Cb 0.01 -2.04 0.90 0.00 -1.71 0.00 0.00 66.02 63.17 2wes s SER 296 CO 0.03 0.04 1.46 -0.90 1.20 0.00 0.00 173.24 175.07 2wes n ASP 297 N 4.42 0.00 0.18 5.45 5.68 -1.26 -1.34 116.55 129.68 2wes n ASP 297 Ca -0.15 -0.17 0.03 0.00 -0.50 0.00 0.00 54.79 53.99 2wes n ASP 297 Cb 0.52 -0.18 0.33 0.00 -1.14 0.00 0.00 41.12 40.65 2wes n ASP 297 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2wes h GLU 298 N 0.00 0.00 0.00 0.11 4.81 -1.93 -3.34 114.58 114.23 2wes h GLU 298 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2wes h GLU 298 Cb 0.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2wes h GLU 298 CO 0.00 0.42 -1.13 1.19 -0.73 0.00 0.00 179.01 178.76 2wes n PHE 299 N -3.91 0.00 -3.62 0.92 3.72 -0.45 -5.01 117.46 109.11 2wes n PHE 299 Ca -0.01 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.24 2wes n PHE 299 Cb 0.47 -0.16 -0.07 0.00 -0.94 0.00 0.00 39.48 38.78 2wes n PHE 299 CO 0.00 0.00 0.00 -1.50 -0.05 0.00 0.00 176.76 175.21 2wes s ILE 300 N -2.58 0.00 0.46 4.37 2.07 -1.14 -4.99 121.20 119.39 2wes s ILE 300 Ca -0.00 -0.00 -0.12 0.00 -1.41 0.00 0.00 60.65 59.11 2wes s ILE 300 Cb 0.09 -0.97 -0.06 0.00 0.13 0.00 0.00 42.46 41.64 2wes s ILE 300 CO 0.54 -0.00 0.86 -0.94 -1.91 0.00 0.00 174.94 173.49 2wes s SER 301 N 0.16 6.51 0.36 4.50 1.04 -1.26 -4.08 113.70 120.93 2wes s SER 301 Ca -0.01 1.29 0.13 0.00 0.48 0.00 0.00 55.95 57.83 2wes s SER 301 Cb -0.04 -2.39 0.93 0.00 0.10 0.00 0.00 66.02 64.62 2wes s SER 301 CO 0.02 -0.51 1.80 -0.65 0.98 0.00 0.00 173.24 174.88 2wes h PRO 302 N 0.95 0.55 -0.07 4.02 0.11 -1.97 0.13 132.00 135.72 2wes h PRO 302 Ca -0.47 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 2wes h PRO 302 Cb 1.19 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2wes h PRO 302 CO 0.63 0.36 -0.07 0.93 -0.21 0.00 0.00 178.00 179.64 2wes h GLU 303 N 0.57 0.18 -0.97 1.05 3.07 -2.00 -1.04 114.58 115.43 2wes h GLU 303 Ca 0.54 -0.09 0.07 0.00 -0.50 0.00 0.00 59.36 59.38 2wes h GLU 303 Cb 1.11 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.96 2wes h GLU 303 CO -0.29 0.62 0.62 0.93 -1.40 0.00 0.00 179.01 179.49 2wes h GLU 304 N -0.26 1.09 -0.51 2.33 5.08 -1.74 -2.03 114.58 118.55 2wes h GLU 304 Ca 0.01 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2wes h GLU 304 Cb 0.59 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2wes h GLU 304 CO 0.02 0.72 0.06 0.00 -1.00 0.00 0.00 179.01 178.81 2wes h ALA 305 N 1.45 0.68 -0.39 3.43 0.00 -0.62 -1.55 119.26 122.24 2wes h ALA 305 Ca 0.42 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2wes h ALA 305 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2wes h ALA 305 CO -0.18 0.43 0.24 1.49 0.00 0.00 0.00 179.25 181.24 2wes h GLU 306 N 0.73 0.48 -0.64 0.00 4.81 -0.86 -1.06 114.58 118.03 2wes h GLU 306 Ca 0.15 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2wes h GLU 306 Cb 0.43 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 2wes h GLU 306 CO 0.01 0.32 0.37 0.00 -0.73 0.00 0.00 179.01 178.98 2wes h ARG 307 N 0.50 0.88 -0.47 1.92 3.08 -1.17 0.27 114.38 119.39 2wes h ARG 307 Ca 0.15 -0.09 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 2wes h ARG 307 Cb -0.02 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 2wes h ARG 307 CO -0.06 0.65 -0.07 1.49 -1.07 0.00 0.00 179.97 180.92 2wes h GLU 308 N 0.87 0.83 0.28 0.04 4.81 -1.07 -0.07 114.58 120.28 2wes h GLU 308 Ca 0.23 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2wes h GLU 308 Cb 0.01 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.32 2wes h GLU 308 CO -0.04 0.88 -0.14 1.25 -0.73 0.00 0.00 179.01 180.23 2wes h LEU 309 N 0.76 -0.32 -0.57 1.64 5.85 -0.77 -2.66 115.31 119.23 2wes h LEU 309 Ca 0.13 -0.17 0.12 0.00 0.84 0.00 0.00 57.88 58.80 2wes h LEU 309 Cb 0.56 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 41.57 2wes h LEU 309 CO 0.03 0.01 -0.01 0.03 -0.34 0.00 0.00 178.44 178.16 2wes h ARG 310 N -0.68 0.11 -0.80 1.25 3.08 -0.86 -0.62 114.38 115.87 2wes h ARG 310 Ca -0.04 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.12 2wes h ARG 310 Cb 0.47 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.44 2wes h ARG 310 CO 0.06 0.07 0.52 0.77 -1.07 0.00 0.00 179.97 180.33 2wes h SER 311 N 0.11 0.59 0.21 7.04 0.02 -1.00 -0.50 113.55 120.02 2wes h SER 311 Ca 0.29 0.02 -0.35 0.00 -0.84 0.00 0.00 61.79 60.92 2wes h SER 311 Cb 0.46 -0.10 0.02 0.00 0.14 0.00 0.00 62.40 62.92 2wes h SER 311 CO -0.49 0.33 -1.66 0.74 -1.14 0.00 0.00 176.83 174.62 2wes h THR 312 N 0.64 1.05 0.00 -2.27 2.02 -0.78 -3.40 112.91 110.17 2wes h THR 312 Ca 0.38 -2.57 -0.00 0.00 0.77 0.00 0.00 66.41 64.99 2wes h THR 312 Cb 0.59 2.86 -0.00 0.00 -1.74 0.00 0.00 68.15 69.86 2wes h THR 312 CO -0.15 0.84 -1.01 1.33 0.37 0.00 0.00 175.52 176.90 2wes n VAL 313 N -3.65 0.00 -2.97 3.16 0.24 -0.65 -4.89 118.33 109.57 2wes n VAL 313 Ca -0.22 -0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 61.92 2wes n VAL 313 Cb 1.08 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2wes n VAL 313 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wes n ALA 314 N -1.56 0.59 -1.88 2.33 0.00 -0.27 -5.07 120.51 114.65 2wes n ALA 314 Ca -0.00 -2.44 -0.42 0.00 0.00 0.00 0.00 53.44 50.59 2wes n ALA 314 Cb 0.06 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 18.42 2wes n ALA 314 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2wes s PRO 315 N -0.57 4.22 0.00 0.00 0.04 -0.75 -2.42 135.00 135.52 2wes s PRO 315 Ca 0.33 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.74 2wes s PRO 315 Cb 0.24 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.67 2wes s PRO 315 CO -0.14 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 176.78 2wes n GLY 316 N 2.86 1.00 2.48 0.56 0.00 -1.26 -4.93 105.19 105.90 2wes n GLY 316 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2wes n GLY 316 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wes n ARG 317 N -2.00 4.48 0.00 1.61 5.12 -1.01 -4.69 116.66 120.17 2wes n ARG 317 Ca 0.00 -3.36 0.10 0.00 -1.93 0.00 0.00 57.85 52.67 2wes n ARG 317 Cb 0.00 -2.66 0.55 0.00 -1.16 0.00 0.00 32.46 29.19 2wes n ARG 317 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2wes n ASP 318 N 1.98 0.00 0.24 0.55 8.00 -1.26 -1.21 116.55 124.85 2wes n ASP 318 Ca 0.63 -0.11 0.08 0.00 0.71 0.00 0.00 54.79 56.10 2wes n ASP 318 Cb 0.25 -0.24 0.60 0.00 -0.02 0.00 0.00 41.12 41.71 2wes n ASP 318 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 2wes h ASP 319 N 0.00 0.00 -3.31 -2.24 2.03 -2.00 -3.43 116.42 107.47 2wes h ASP 319 Ca 0.00 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.72 2wes h ASP 319 Cb 0.17 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 38.60 2wes h ASP 319 CO 0.00 0.13 0.37 -0.76 -1.03 0.00 0.00 179.24 177.94 2wes s LEU 320 N -8.39 4.18 0.13 0.15 1.43 -0.35 -5.03 118.68 110.80 2wes s LEU 320 Ca -0.04 1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 53.92 2wes s LEU 320 Cb 0.15 -3.21 -0.06 0.00 0.03 0.00 0.00 46.19 43.10 2wes s LEU 320 CO 0.66 -0.38 0.97 -0.70 0.23 0.00 0.00 176.35 177.12 2wes s GLU 321 N 2.09 4.71 -0.02 1.70 2.12 -1.26 -5.05 118.70 123.00 2wes s GLU 321 Ca 0.38 1.47 -0.17 0.00 0.36 0.00 0.00 54.97 57.01 2wes s GLU 321 Cb -0.17 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.81 2wes s GLU 321 CO 0.12 0.25 0.47 0.00 -0.54 0.00 0.00 175.26 175.56 2wes s ALA 322 N -0.17 3.60 -0.27 6.30 0.00 -1.26 -4.59 121.76 125.36 2wes s ALA 322 Ca 0.46 -0.14 -0.07 0.00 0.00 0.00 0.00 51.96 52.21 2wes s ALA 322 Cb -0.24 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.34 2wes s ALA 322 CO 0.30 0.31 0.07 1.21 0.00 0.00 0.00 175.76 177.65 2wes s ASN 323 N -0.55 5.05 -0.13 0.00 2.47 -0.36 -4.93 114.94 116.49 2wes s ASN 323 Ca 0.26 -0.51 -0.04 0.00 0.42 0.00 0.00 52.86 52.98 2wes s ASN 323 Cb -0.17 -1.88 -0.03 0.00 -1.45 0.00 0.00 41.25 37.71 2wes s ASN 323 CO 0.14 -0.13 0.02 -1.00 -3.72 0.00 0.00 177.10 172.41 2wes s HIS 324 N 1.54 3.19 -0.02 0.43 3.76 -1.26 -0.48 115.29 122.44 2wes s HIS 324 Ca 0.04 0.08 -0.00 0.00 -0.15 0.00 0.00 55.06 55.03 2wes s HIS 324 Cb -0.16 -1.92 0.03 0.00 1.11 0.00 0.00 32.58 31.64 2wes s HIS 324 CO 0.02 0.30 0.03 0.42 -0.85 0.00 0.00 174.74 174.66 2wes s ILE 325 N -0.29 -0.05 0.07 0.60 1.01 -0.42 -5.02 121.20 117.09 2wes s ILE 325 Ca 0.07 0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 2wes s ILE 325 Cb -0.12 -0.08 -0.06 0.00 0.01 0.00 0.00 42.46 42.20 2wes s ILE 325 CO 0.02 0.08 0.52 -1.10 0.00 0.00 0.00 174.94 174.46 2wes s GLN 326 N 0.97 4.09 -0.12 2.79 -0.21 -1.26 -1.27 119.66 124.65 2wes s GLN 326 Ca -0.08 0.61 -0.01 0.00 0.02 0.00 0.00 55.36 55.90 2wes s GLN 326 Cb -0.11 -3.18 -0.02 0.00 1.00 0.00 0.00 33.01 30.69 2wes s GLN 326 CO -0.03 0.63 -0.09 -1.64 -2.12 0.00 0.00 175.29 172.04 2wes s MET 327 N -1.25 3.25 -0.43 2.91 -1.94 -0.03 -4.98 119.30 116.84 2wes s MET 327 Ca 0.29 -0.61 -0.20 0.00 -1.71 0.00 0.00 55.69 53.46 2wes s MET 327 Cb -0.18 -2.68 0.02 0.00 2.01 0.00 0.00 34.83 34.00 2wes s MET 327 CO 0.18 0.36 0.61 0.50 -0.01 0.00 0.00 175.02 176.66 2wes s ARG 328 N -0.01 3.27 -0.27 2.03 3.52 -1.26 -4.80 118.95 121.44 2wes s ARG 328 Ca -0.02 -0.41 -0.08 0.00 -0.13 0.00 0.00 55.73 55.09 2wes s ARG 328 Cb -0.14 -3.94 -0.02 0.00 -1.56 0.00 0.00 34.95 29.28 2wes s ARG 328 CO 0.03 -0.97 0.10 0.42 -0.81 0.00 0.00 175.30 174.08 2wes s ILE 329 N 2.71 4.47 -5.00 4.11 -1.09 -1.26 -4.29 121.20 120.84 2wes s ILE 329 Ca 0.21 -0.21 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 2wes s ILE 329 Cb -0.15 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 37.59 2wes s ILE 329 CO 0.18 0.26 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 2wes n GLY 330 N 4.95 0.44 3.34 6.18 0.00 0.51 -1.82 105.19 118.79 2wes n GLY 330 Ca -0.15 -1.46 -0.15 0.00 0.00 0.00 0.00 46.02 44.26 2wes n GLY 330 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wes s ARG 331 N -2.00 0.81 0.37 1.61 1.70 -0.38 -0.46 118.95 120.60 2wes s ARG 331 Ca 0.00 -0.05 -0.28 0.00 -0.47 0.00 0.00 55.73 54.93 2wes s ARG 331 Cb 0.00 0.37 -0.11 0.00 -0.57 0.00 0.00 34.95 34.64 2wes s ARG 331 CO 0.00 -0.24 1.49 -0.80 -1.08 0.00 0.00 175.30 174.67 2wes s ASN 332 N -1.31 6.37 0.20 -2.89 0.01 -0.46 -0.08 114.94 116.77 2wes s ASN 332 Ca -0.12 3.02 -0.13 0.00 -0.71 0.00 0.00 52.86 54.92 2wes s ASN 332 Cb -0.03 -2.66 0.22 0.00 0.41 0.00 0.00 41.25 39.19 2wes s ASN 332 CO 0.06 -0.86 1.68 -0.33 -1.51 0.00 0.00 177.10 176.14 2wes h GLU 333 N 3.21 0.12 -4.29 -0.60 4.39 -1.41 -3.40 114.58 112.60 2wes h GLU 333 Ca -0.50 -0.01 -0.48 0.00 0.34 0.00 0.00 59.36 58.71 2wes h GLU 333 Cb 1.24 -0.03 -0.34 0.00 -0.10 0.00 0.00 28.75 29.52 2wes h GLU 333 CO 0.66 0.08 -0.80 1.03 -1.16 0.00 0.00 179.01 178.82 2wes s ARG 334 N -6.16 1.32 0.04 2.33 0.52 -1.26 -4.87 118.95 110.87 2wes s ARG 334 Ca -0.13 -0.26 0.24 0.00 -0.52 0.00 0.00 55.73 55.06 2wes s ARG 334 Cb 0.17 -1.21 0.38 0.00 0.52 0.00 0.00 34.95 34.81 2wes s ARG 334 CO 0.73 -0.06 1.32 0.25 0.02 0.00 0.00 175.30 177.56 2wes n THR 335 N 4.09 0.13 -4.03 0.02 -2.24 -1.26 -4.71 114.28 106.27 2wes n THR 335 Ca -0.22 -0.11 -0.33 0.00 -2.27 0.00 0.00 64.05 61.12 2wes n THR 335 Cb 0.51 0.14 -0.15 0.00 -2.10 0.00 0.00 70.33 68.74 2wes n THR 335 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2wes s TRP 336 N -3.08 3.23 -0.05 4.78 -0.11 -1.26 0.19 118.94 122.64 2wes s TRP 336 Ca 0.08 -2.16 0.02 0.00 1.22 0.00 0.00 56.10 55.27 2wes s TRP 336 Cb 0.16 -1.97 0.01 0.00 -1.50 0.00 0.00 33.47 30.17 2wes s TRP 336 CO 0.72 -0.85 -0.11 0.42 -4.62 0.00 0.00 176.95 172.50 2wes s ILE 337 N 1.15 1.04 0.00 5.86 1.01 0.33 -4.98 121.20 125.61 2wes s ILE 337 Ca -0.07 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2wes s ILE 337 Cb -0.19 -0.94 0.00 0.00 0.01 0.00 0.00 42.46 41.33 2wes s ILE 337 CO -0.05 0.33 0.00 0.59 0.00 0.00 0.00 174.94 175.81 2wes n ASN 338 N 3.62 0.00 -1.83 3.58 3.02 -1.26 -0.45 115.26 121.93 2wes n ASN 338 Ca -0.21 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.20 2wes n ASN 338 Cb 0.52 0.00 0.21 0.00 -0.61 0.00 0.00 39.78 39.91 2wes n ASN 338 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2wes n ASN 339 N 4.74 3.63 -4.17 6.41 6.94 -1.26 -4.93 115.26 126.62 2wes n ASN 339 Ca 0.00 -3.55 -0.31 0.00 -0.02 0.00 0.00 54.58 50.70 2wes n ASN 339 Cb 0.00 -0.75 -0.17 0.00 -2.36 0.00 0.00 39.78 36.50 2wes n ASN 339 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wes s VAL 341 N 0.50 2.48 -0.07 0.00 1.01 -0.39 -0.51 120.40 123.41 2wes s VAL 341 Ca -0.16 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 2wes s VAL 341 Cb -0.17 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 2wes s VAL 341 CO 0.06 0.55 0.44 0.00 0.00 0.00 0.00 175.10 176.15 2wes s ALA 342 N 0.22 3.57 -0.07 5.51 0.00 0.13 -0.13 121.76 130.99 2wes s ALA 342 Ca -0.12 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.63 2wes s ALA 342 Cb -0.16 -2.53 0.02 0.00 0.00 0.00 0.00 23.12 20.45 2wes s ALA 342 CO 0.07 0.21 -0.07 0.08 0.00 0.00 0.00 175.76 176.05 2wes s VAL 343 N -0.11 0.78 0.00 0.00 1.01 -0.79 -4.59 120.40 116.70 2wes s VAL 343 Ca 0.24 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2wes s VAL 343 Cb -0.16 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.43 2wes s VAL 343 CO 0.11 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2wes n GLY 344 N 4.31 -0.27 0.32 4.51 0.00 -1.26 -4.42 105.19 108.38 2wes n GLY 344 Ca -0.19 -1.82 0.15 0.00 0.00 0.00 0.00 46.02 44.16 2wes n GLY 344 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wes h LEU 345 N 0.00 0.00 -1.39 0.99 3.38 -1.87 0.26 115.31 116.69 2wes h LEU 345 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2wes h LEU 345 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2wes h LEU 345 CO 0.00 0.00 -0.14 0.77 0.09 0.00 0.00 178.44 179.16 2wes h SER 346 N 0.00 0.23 0.01 -0.43 4.64 -1.72 -3.25 113.55 113.03 2wes h SER 346 Ca 0.08 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.28 2wes h SER 346 Cb 0.37 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 2wes h SER 346 CO -0.00 0.39 -0.34 0.00 -0.87 0.00 0.00 176.83 176.01 2wes h ALA 347 N 1.64 0.05 -2.19 5.18 0.00 -0.76 -3.45 119.26 119.73 2wes h ALA 347 Ca 0.05 -0.67 0.17 0.00 0.00 0.00 0.00 54.91 54.45 2wes h ALA 347 Cb 0.39 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 18.22 2wes h ALA 347 CO 0.02 0.19 0.54 0.00 0.00 0.00 0.00 179.25 180.00 2wes s ALA 348 N -2.27 -1.80 -0.27 0.00 0.00 -0.80 -1.36 121.76 115.26 2wes s ALA 348 Ca -0.21 0.64 -0.26 0.00 0.00 0.00 0.00 51.96 52.14 2wes s ALA 348 Cb -0.01 0.48 0.13 0.00 0.00 0.00 0.00 23.12 23.72 2wes s ALA 348 CO 0.68 -0.87 1.09 0.12 0.00 0.00 0.00 175.76 176.78 2wes s PHE 349 N -3.09 -0.41 0.19 0.00 5.36 0.40 -3.90 117.98 116.53 2wes s PHE 349 Ca 0.09 0.97 0.07 0.00 -0.96 0.00 0.00 56.93 57.10 2wes s PHE 349 Cb -0.01 0.39 -0.05 0.00 -0.34 0.00 0.00 43.02 43.01 2wes s PHE 349 CO -0.03 -0.21 -0.14 0.14 -1.46 0.00 0.00 175.22 173.52 2wes s VAL 350 N 0.07 1.64 0.58 3.12 -7.23 -1.26 -0.36 120.40 116.95 2wes s VAL 350 Ca 0.03 -2.16 -0.19 0.00 -1.81 0.00 0.00 61.98 57.85 2wes s VAL 350 Cb -0.05 -1.99 -0.05 0.00 0.56 0.00 0.00 36.38 34.85 2wes s VAL 350 CO -0.07 -0.61 0.98 -1.84 -0.31 0.00 0.00 175.10 173.26 2wes n GLU 351 N -0.30 0.98 -0.01 4.82 0.28 -1.26 -4.80 120.64 120.34 2wes n GLU 351 Ca -0.09 0.37 0.00 0.00 -0.16 0.00 0.00 57.16 57.29 2wes n GLU 351 Cb 0.60 -2.17 0.00 0.00 1.43 0.00 0.00 31.44 31.30 2wes n GLU 351 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2wes n PRO 352 N -0.88 0.88 0.23 3.44 -0.04 -1.26 -4.32 135.00 133.05 2wes n PRO 352 Ca 0.13 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.70 2wes n PRO 352 Cb 0.46 -1.06 0.70 0.00 -0.04 0.00 0.00 33.50 33.57 2wes n PRO 352 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2wes h LEU 353 N 1.18 0.00 -2.89 1.53 5.85 -2.02 -2.43 115.31 116.53 2wes h LEU 353 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2wes h LEU 353 Cb 0.88 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 2wes h LEU 353 CO 0.00 0.00 -0.41 -0.62 -0.34 0.00 0.00 178.44 177.07 2wes n GLU 354 N -4.36 1.08 -3.65 1.25 -0.58 -1.26 -5.03 120.64 108.09 2wes n GLU 354 Ca -0.01 -2.62 -0.29 0.00 -0.42 0.00 0.00 57.16 53.82 2wes n GLU 354 Cb 0.18 -1.22 0.03 0.00 -0.57 0.00 0.00 31.44 29.86 2wes n GLU 354 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2wes n SER 355 N -0.87 -5.48 -0.00 1.62 7.64 -0.92 -4.89 113.62 110.72 2wes n SER 355 Ca 0.14 -0.94 0.07 0.00 1.01 0.00 0.00 58.87 59.16 2wes n SER 355 Cb 0.74 -3.30 -0.09 0.00 -1.01 0.00 0.00 64.21 60.54 2wes n SER 355 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2wes n THR 356 N -3.83 0.00 -0.05 0.44 -2.24 -1.26 -4.00 114.28 103.34 2wes n THR 356 Ca -0.11 -0.20 -0.09 0.00 -2.27 0.00 0.00 64.05 61.39 2wes n THR 356 Cb 0.59 0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 69.57 2wes n THR 356 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2wes h GLY 357 N 3.36 -0.23 1.86 3.38 0.00 -1.90 0.33 103.07 109.87 2wes h GLY 357 Ca 0.00 0.34 -0.15 0.00 0.00 0.00 0.00 47.33 47.52 2wes h GLY 357 CO 0.00 -0.21 -0.66 -2.22 0.00 0.00 0.00 176.54 173.45 2wes h ILE 358 N -0.28 1.43 -0.11 2.60 2.04 -1.88 -2.18 117.51 119.13 2wes h ILE 358 Ca 0.13 -2.17 0.01 0.00 1.00 0.00 0.00 64.86 63.83 2wes h ILE 358 Cb 0.49 2.15 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2wes h ILE 358 CO -0.40 0.63 0.05 0.15 0.00 0.00 0.00 178.15 178.58 2wes h PHE 359 N 0.10 0.10 -0.96 1.37 3.57 -1.62 0.18 116.94 119.67 2wes h PHE 359 Ca -0.01 0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.62 2wes h PHE 359 Cb 1.18 -0.03 -0.08 0.00 2.79 0.00 0.00 35.95 39.81 2wes h PHE 359 CO 0.01 0.06 0.61 0.74 -2.23 0.00 0.00 178.31 177.50 2wes h PHE 360 N 0.12 1.03 0.23 0.41 0.04 -0.14 -0.38 116.94 118.26 2wes h PHE 360 Ca 0.04 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 2wes h PHE 360 Cb 0.01 -0.33 0.00 0.00 2.20 0.00 0.00 35.95 37.83 2wes h PHE 360 CO -0.09 0.40 -0.11 0.82 -0.60 0.00 0.00 178.31 178.73 2wes h ILE 361 N 0.89 0.82 -0.50 -0.55 2.04 -0.77 -1.09 117.51 118.35 2wes h ILE 361 Ca 0.48 -0.68 0.08 0.00 1.00 0.00 0.00 64.86 65.74 2wes h ILE 361 Cb 0.57 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 2wes h ILE 361 CO -0.25 0.14 0.14 -0.61 0.00 0.00 0.00 178.15 177.58 2wes h GLN 362 N -0.68 0.29 -0.31 2.37 4.15 -0.84 -1.08 115.11 119.01 2wes h GLN 362 Ca -0.03 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.22 2wes h GLN 362 Cb 0.48 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 2wes h GLN 362 CO 0.05 0.19 -0.39 1.25 -1.93 0.00 0.00 178.83 178.00 2wes h HIS 363 N 0.30 0.90 -0.33 3.99 2.76 -1.04 1.00 115.15 122.72 2wes h HIS 363 Ca 0.25 -0.27 -0.03 0.00 -2.20 0.00 0.00 60.37 58.12 2wes h HIS 363 Cb 0.30 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.05 2wes h HIS 363 CO -0.19 1.03 0.07 0.00 -1.30 0.00 0.00 177.93 177.53 2wes h ALA 364 N 0.94 1.51 0.11 5.26 0.00 -0.83 -1.35 119.26 124.90 2wes h ALA 364 Ca 0.05 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 2wes h ALA 364 Cb 0.94 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.61 2wes h ALA 364 CO 0.09 0.36 -0.72 0.82 0.00 0.00 0.00 179.25 179.80 2wes h ILE 365 N 0.47 1.51 -0.71 0.00 2.04 -0.72 -1.23 117.51 118.87 2wes h ILE 365 Ca 0.11 -2.43 0.09 0.00 1.00 0.00 0.00 64.86 63.64 2wes h ILE 365 Cb 0.20 3.09 -0.07 0.00 -0.74 0.00 0.00 36.82 39.30 2wes h ILE 365 CO -0.00 0.69 0.35 -0.33 0.00 0.00 0.00 178.15 178.86 2wes h GLU 366 N -0.36 0.58 0.00 2.37 5.08 -0.75 -1.36 114.58 120.14 2wes h GLU 366 Ca -0.12 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 2wes h GLU 366 Cb 1.53 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 2wes h GLU 366 CO 0.14 0.38 -0.33 1.96 -1.00 0.00 0.00 179.01 180.16 2wes h GLN 367 N 0.60 0.00 -0.35 2.33 1.08 -1.28 -2.19 115.11 115.29 2wes h GLN 367 Ca 0.35 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.48 2wes h GLN 367 Cb 0.38 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 2wes h GLN 367 CO -0.27 0.33 -0.04 1.25 -0.95 0.00 0.00 178.83 179.15 2wes h LEU 368 N 0.00 0.65 -0.61 1.46 5.85 -0.46 0.14 115.31 122.34 2wes h LEU 368 Ca -0.00 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 2wes h LEU 368 Cb 1.09 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 2wes h LEU 368 CO 0.04 0.83 0.37 0.58 -0.34 0.00 0.00 178.44 179.92 2wes h VAL 369 N 0.45 1.18 -0.54 1.05 2.07 -1.04 0.23 116.25 119.65 2wes h VAL 369 Ca 0.10 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 2wes h VAL 369 Cb 0.52 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2wes h VAL 369 CO 0.03 0.19 0.16 0.11 0.02 0.00 0.00 177.57 178.07 2wes h LYS 370 N 0.82 0.81 -0.67 1.57 1.79 -1.17 -2.68 116.57 117.05 2wes h LYS 370 Ca 0.22 -0.15 -0.23 0.00 -2.18 0.00 0.00 60.65 58.31 2wes h LYS 370 Cb -0.02 -0.13 -0.14 0.00 -1.58 0.00 0.00 32.23 30.36 2wes h LYS 370 CO -0.04 0.71 0.25 0.72 -1.08 0.00 0.00 179.45 180.01 2wes n HIS 371 N -4.30 2.18 -1.71 -1.35 8.25 0.47 -5.01 115.22 113.75 2wes n HIS 371 Ca 0.04 -1.32 -0.43 0.00 -0.26 0.00 0.00 57.72 55.75 2wes n HIS 371 Cb 0.20 -0.66 -0.02 0.00 1.12 0.00 0.00 29.99 30.63 2wes n HIS 371 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2wes n PHE 372 N -0.49 2.55 -2.67 4.41 7.35 0.77 -4.88 117.46 124.50 2wes n PHE 372 Ca 0.41 0.34 -0.36 0.00 -0.76 0.00 0.00 57.45 57.08 2wes n PHE 372 Cb 1.33 -2.53 -0.05 0.00 0.35 0.00 0.00 39.48 38.57 2wes n PHE 372 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2wes s PRO 373 N -0.54 4.29 0.17 -7.13 0.04 -1.26 -5.06 135.00 125.50 2wes s PRO 373 Ca 0.65 1.38 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2wes s PRO 373 Cb -0.56 -2.54 0.03 0.00 0.04 0.00 0.00 34.50 31.47 2wes s PRO 373 CO 0.50 -0.00 0.24 0.41 0.04 0.00 0.00 177.00 178.18 2wes n GLY 374 N 0.20 1.75 0.22 0.56 0.00 -1.26 -4.49 105.19 102.17 2wes n GLY 374 Ca 0.05 -2.13 0.16 0.00 0.00 0.00 0.00 46.02 44.09 2wes n GLY 374 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wes h GLU 375 N 0.00 0.00 0.00 1.61 4.81 -1.98 -2.52 114.58 116.51 2wes h GLU 375 Ca -0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2wes h GLU 375 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2wes h GLU 375 CO 0.11 0.00 0.00 0.54 -0.73 0.00 0.00 179.01 178.93 2wes n ARG 376 N -2.70 0.06 -3.59 1.92 1.74 -1.26 -4.96 116.66 107.87 2wes n ARG 376 Ca 0.00 0.09 -0.29 0.00 -0.77 0.00 0.00 57.85 56.88 2wes n ARG 376 Cb 0.22 -1.58 0.02 0.00 -1.02 0.00 0.00 32.46 30.10 2wes n ARG 376 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2wes n TRP 377 N -1.68 -2.44 -1.96 -1.55 7.02 -0.95 -4.74 117.44 111.14 2wes n TRP 377 Ca 0.06 1.01 -0.43 0.00 -1.02 0.00 0.00 57.50 57.12 2wes n TRP 377 Cb 0.33 -2.46 -0.03 0.00 -2.42 0.00 0.00 31.31 26.74 2wes n TRP 377 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2wes s ASP 378 N -2.31 5.91 0.52 -0.99 -1.08 -1.26 -4.85 116.67 112.61 2wes s ASP 378 Ca 0.18 1.42 0.25 0.00 -0.52 0.00 0.00 52.55 53.88 2wes s ASP 378 Cb -0.02 -2.52 1.40 0.00 -1.46 0.00 0.00 42.92 40.32 2wes s ASP 378 CO 0.88 -1.67 2.08 1.55 0.52 0.00 0.00 175.17 178.52 2wes h PRO 379 N 12.83 0.00 -0.21 4.34 0.14 -2.00 -1.53 132.00 145.57 2wes h PRO 379 Ca -0.35 0.00 -0.17 0.00 0.14 0.00 0.00 66.00 65.62 2wes h PRO 379 Cb 1.17 0.00 -0.00 0.00 0.14 0.00 0.00 31.00 32.31 2wes h PRO 379 CO 1.02 0.11 -0.56 0.28 0.14 0.00 0.00 178.00 178.99 2wes h VAL 380 N 0.00 1.31 -0.41 1.56 2.07 -1.99 -0.09 116.25 118.71 2wes h VAL 380 Ca -0.00 -1.80 -0.14 0.00 0.82 0.00 0.00 66.70 65.58 2wes h VAL 380 Cb 0.28 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2wes h VAL 380 CO 0.01 0.57 -0.30 0.25 0.02 0.00 0.00 177.57 178.12 2wes h LEU 381 N 0.49 0.98 -0.44 2.57 5.85 -1.71 -1.87 115.31 121.18 2wes h LEU 381 Ca 0.01 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 2wes h LEU 381 Cb 1.12 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 2wes h LEU 381 CO 0.11 1.21 0.24 0.40 -0.34 0.00 0.00 178.44 180.06 2wes h ILE 382 N 0.75 1.16 -0.32 4.05 2.04 -1.18 -1.79 117.51 122.23 2wes h ILE 382 Ca 0.08 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 2wes h ILE 382 Cb 0.89 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 2wes h ILE 382 CO 0.08 0.16 0.04 -1.28 0.00 0.00 0.00 178.15 177.16 2wes h SER 383 N 0.57 0.43 -0.44 1.72 0.87 -0.89 0.05 113.55 115.85 2wes h SER 383 Ca 0.15 -0.06 -0.11 0.00 -1.23 0.00 0.00 61.79 60.54 2wes h SER 383 Cb 0.05 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 2wes h SER 383 CO -0.03 0.47 -0.14 0.00 -0.53 0.00 0.00 176.83 176.61 2wes h ALA 384 N 1.59 0.84 -0.31 6.23 0.00 -0.95 -1.76 119.26 124.90 2wes h ALA 384 Ca 0.11 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2wes h ALA 384 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2wes h ALA 384 CO 0.00 0.65 0.19 -0.92 0.00 0.00 0.00 179.25 179.17 2wes h TYR 385 N 0.82 0.40 -0.55 0.00 3.20 -0.39 -2.21 116.97 118.25 2wes h TYR 385 Ca 0.13 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 2wes h TYR 385 Cb 0.68 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 2wes h TYR 385 CO 0.04 0.28 0.21 -0.91 -1.64 0.00 0.00 178.16 176.14 2wes h ASN 386 N 0.40 0.76 -0.39 -2.11 2.35 -0.83 -1.06 115.58 114.70 2wes h ASN 386 Ca 0.11 -0.18 0.05 0.00 -0.55 0.00 0.00 56.30 55.73 2wes h ASN 386 Cb -0.01 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.12 2wes h ASN 386 CO -0.02 0.74 0.13 -0.33 -1.65 0.00 0.00 177.43 176.29 2wes h GLU 387 N 0.75 0.28 -0.60 0.81 4.39 -1.26 -0.24 114.58 118.70 2wes h GLU 387 Ca 0.18 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.88 2wes h GLU 387 Cb 0.22 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 2wes h GLU 387 CO -0.01 0.18 0.38 0.00 -1.16 0.00 0.00 179.01 178.40 2wes h ARG 388 N 0.28 0.75 -0.54 2.33 3.08 -0.93 -0.90 114.38 118.46 2wes h ARG 388 Ca 0.18 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 2wes h ARG 388 Cb 0.17 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2wes h ARG 388 CO -0.19 0.49 0.08 0.52 -1.07 0.00 0.00 179.97 179.80 2wes h MET 389 N 0.77 0.85 -0.46 0.04 2.86 -0.86 -1.43 114.93 116.71 2wes h MET 389 Ca 0.23 -0.20 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 2wes h MET 389 Cb -0.03 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 2wes h MET 389 CO -0.08 0.81 0.01 0.00 1.06 0.00 0.00 176.91 178.70 2wes h ALA 390 N 1.27 0.62 -0.58 6.32 0.00 -0.60 -2.97 119.26 123.32 2wes h ALA 390 Ca 0.17 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 2wes h ALA 390 Cb 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2wes h ALA 390 CO 0.01 0.41 -0.01 0.45 0.00 0.00 0.00 179.25 180.10 2wes h HIS 391 N 0.65 1.11 -0.43 0.00 -0.00 -1.01 0.02 115.15 115.49 2wes h HIS 391 Ca 0.13 -0.19 0.04 0.00 -0.00 0.00 0.00 60.37 60.35 2wes h HIS 391 Cb 0.49 -0.29 -0.04 0.00 -0.00 0.00 0.00 27.41 27.57 2wes h HIS 391 CO 0.04 0.99 0.21 1.98 -0.00 0.00 0.00 177.93 181.14 2wes h MET 392 N 0.93 0.41 0.18 2.45 -1.53 -1.11 -0.84 114.93 115.43 2wes h MET 392 Ca 0.17 -0.02 -0.28 0.00 -3.44 0.00 0.00 59.70 56.12 2wes h MET 392 Cb 0.55 -0.09 0.03 0.00 -0.55 0.00 0.00 31.60 31.54 2wes h MET 392 CO 0.03 0.27 -1.22 0.28 0.14 0.00 0.00 176.91 176.41 2wes h VAL 393 N 0.42 1.34 -0.11 -5.77 2.07 -1.46 -3.16 116.25 109.59 2wes h VAL 393 Ca 0.19 -2.57 -0.03 0.00 0.82 0.00 0.00 66.70 65.11 2wes h VAL 393 Cb 0.11 2.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2wes h VAL 393 CO -0.14 0.76 -0.08 0.44 0.02 0.00 0.00 177.57 178.57 2wes h ASP 394 N 0.04 0.14 -0.30 0.57 3.32 -0.82 0.37 116.42 119.75 2wes h ASP 394 Ca -0.21 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 2wes h ASP 394 Cb 1.94 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 41.45 2wes h ASP 394 CO 0.23 0.25 0.02 1.23 -1.72 0.00 0.00 179.24 179.25 2wes h GLY 395 N 0.53 0.56 1.45 2.75 0.00 -1.21 -2.17 103.07 104.98 2wes h GLY 395 Ca 0.03 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 2wes h GLY 395 CO 0.01 0.37 -0.37 -2.08 0.00 0.00 0.00 176.54 174.48 2wes h VAL 396 N 0.33 1.29 -0.55 4.60 2.07 -1.40 -1.17 116.25 121.42 2wes h VAL 396 Ca 0.09 -1.51 0.02 0.00 0.82 0.00 0.00 66.70 66.12 2wes h VAL 396 Cb 0.40 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 2wes h VAL 396 CO 0.01 0.48 0.34 0.50 0.02 0.00 0.00 177.57 178.92 2wes h LYS 397 N 0.51 0.65 -0.19 1.57 3.64 -0.80 0.25 116.57 122.20 2wes h LYS 397 Ca 0.05 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 2wes h LYS 397 Cb 0.87 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2wes h LYS 397 CO 0.07 0.43 -0.08 1.49 -2.27 0.00 0.00 179.45 179.09 2wes h GLU 398 N 0.67 0.39 -0.64 1.90 4.81 -1.04 -1.43 114.58 119.24 2wes h GLU 398 Ca 0.22 -0.17 0.13 0.00 -0.13 0.00 0.00 59.36 59.41 2wes h GLU 398 Cb 0.01 -0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.27 2wes h GLU 398 CO -0.09 0.68 0.08 0.35 -0.73 0.00 0.00 179.01 179.31 2wes h PHE 399 N 0.09 0.11 -0.86 0.92 3.57 -0.81 -2.07 116.94 117.89 2wes h PHE 399 Ca 0.04 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 2wes h PHE 399 Cb 0.56 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 2wes h PHE 399 CO 0.06 -0.10 0.43 -0.07 -2.23 0.00 0.00 178.31 176.40 2wes h LEU 400 N 0.20 1.10 -1.08 0.59 3.38 -0.07 -2.11 115.31 117.32 2wes h LEU 400 Ca 0.34 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 2wes h LEU 400 Cb 0.55 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2wes h LEU 400 CO -0.48 0.92 0.12 0.58 0.09 0.00 0.00 178.44 179.66 2wes h VAL 401 N 1.21 1.22 -0.85 1.22 2.07 -0.79 -0.52 116.25 119.80 2wes h VAL 401 Ca 0.30 -0.79 0.09 0.00 0.82 0.00 0.00 66.70 67.12 2wes h VAL 401 Cb 0.09 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 2wes h VAL 401 CO -0.04 0.29 0.55 0.25 0.02 0.00 0.00 177.57 178.64 2wes h LEU 402 N 0.75 0.75 -0.08 2.57 5.85 -0.71 0.26 115.31 124.71 2wes h LEU 402 Ca 0.17 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.92 2wes h LEU 402 Cb 0.28 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2wes h LEU 402 CO -0.00 0.44 -0.03 0.45 -0.34 0.00 0.00 178.44 178.97 2wes h HIS 403 N 0.83 -0.06 -0.26 1.25 3.86 -0.90 0.94 115.15 120.82 2wes h HIS 403 Ca 0.39 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.52 2wes h HIS 403 Cb 0.41 0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 2wes h HIS 403 CO -0.00 -0.04 -0.23 1.88 0.86 0.00 0.00 177.93 180.40 2wes h TYR 404 N -0.01 0.54 0.00 2.45 0.05 -1.21 -1.62 116.97 117.17 2wes h TYR 404 Ca 0.04 -0.11 -0.11 0.00 0.05 0.00 0.00 58.73 58.61 2wes h TYR 404 Cb 0.07 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 2wes h TYR 404 CO -0.14 0.68 -0.51 0.87 -1.05 0.00 0.00 178.16 178.02 2wes h LYS 405 N 0.43 0.00 0.00 4.88 1.79 -0.64 -3.13 116.57 119.90 2wes h LYS 405 Ca 0.07 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.40 2wes h LYS 405 Cb 0.64 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 2wes h LYS 405 CO 0.05 0.51 -0.68 0.78 -1.08 0.00 0.00 179.45 179.03 2wes h GLY 406 N 2.39 0.00 -5.11 3.86 0.00 -0.45 -3.45 103.07 100.31 2wes h GLY 406 Ca -0.01 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.76 2wes h GLY 406 CO 0.07 0.00 1.00 0.00 0.00 0.00 0.00 176.54 177.61 2wes n ALA 407 N -2.27 1.73 0.26 3.60 0.00 -0.64 -4.45 120.51 118.73 2wes n ALA 407 Ca 0.01 0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.92 2wes n ALA 407 Cb 0.79 -2.49 0.05 0.00 0.00 0.00 0.00 19.45 17.80 2wes n ALA 407 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2wes h GLN 408 N 7.69 0.00 -6.94 0.00 4.20 -1.74 -3.48 115.11 114.84 2wes h GLN 408 Ca -0.46 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 57.72 2wes h GLN 408 Cb 1.24 0.00 0.09 0.00 0.30 0.00 0.00 27.48 29.11 2wes h GLN 408 CO 0.93 0.00 0.68 -0.98 -0.67 0.00 0.00 178.83 178.79 2wes s ARG 409 N -3.30 4.01 -0.23 1.46 1.70 -1.10 -4.95 118.95 116.53 2wes s ARG 409 Ca 0.02 2.32 0.23 0.00 -0.47 0.00 0.00 55.73 57.83 2wes s ARG 409 Cb 0.11 -2.84 0.50 0.00 -0.57 0.00 0.00 34.95 32.15 2wes s ARG 409 CO 0.77 -0.52 1.12 0.39 -1.08 0.00 0.00 175.30 175.98 2wes n GLU 410 N 0.25 1.54 0.00 3.89 1.02 -1.26 -4.70 120.64 121.38 2wes n GLU 410 Ca 0.03 -3.32 0.11 0.00 -0.02 0.00 0.00 57.16 53.95 2wes n GLU 410 Cb 0.42 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 2wes n GLU 410 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2wes n ASP 411 N -0.49 0.85 -4.29 1.62 5.75 -1.26 -4.61 116.55 114.12 2wes n ASP 411 Ca 0.07 -0.79 -0.16 0.00 -0.01 0.00 0.00 54.79 53.91 2wes n ASP 411 Cb 0.84 0.85 -0.10 0.00 -1.03 0.00 0.00 41.12 41.67 2wes n ASP 411 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2wes s THR 412 N -3.02 1.05 0.44 2.12 -4.23 -1.26 -5.03 115.64 105.72 2wes s THR 412 Ca 0.08 -2.04 0.16 0.00 -1.18 0.00 0.00 61.69 58.72 2wes s THR 412 Cb 0.16 -2.12 0.36 0.00 1.34 0.00 0.00 72.50 72.24 2wes s THR 412 CO 0.83 -0.51 1.94 -0.65 -0.54 0.00 0.00 174.62 175.69 2wes h PRO 413 N 2.62 0.35 0.04 3.99 0.11 -1.91 -1.78 132.00 135.43 2wes h PRO 413 Ca -0.37 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.72 2wes h PRO 413 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2wes h PRO 413 CO 0.64 0.23 -0.08 -0.92 -0.21 0.00 0.00 178.00 177.67 2wes h TYR 414 N 0.36 -0.20 0.00 0.65 3.20 -1.95 -0.46 116.97 118.59 2wes h TYR 414 Ca 0.34 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 62.10 2wes h TYR 414 Cb 0.81 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.15 2wes h TYR 414 CO -0.00 -0.12 -0.53 -1.49 -1.64 0.00 0.00 178.16 174.38 2wes h TRP 415 N -0.16 0.00 -0.48 -3.82 4.06 -1.64 -0.84 115.95 113.07 2wes h TRP 415 Ca 0.02 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.84 2wes h TRP 415 Cb 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 2wes h TRP 415 CO -0.12 0.53 -0.20 0.87 -3.56 0.00 0.00 178.44 175.95 2wes h LYS 416 N 0.00 0.99 -0.23 0.49 1.57 -1.16 -2.89 116.57 115.35 2wes h LYS 416 Ca -0.01 -0.42 -0.14 0.00 -1.87 0.00 0.00 60.65 58.22 2wes h LYS 416 Cb 1.01 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 2wes h LYS 416 CO 0.07 1.10 -0.43 0.00 -0.57 0.00 0.00 179.45 179.61 2wes h ALA 417 N 0.87 0.82 -0.30 3.86 0.00 -0.56 -2.85 119.26 121.10 2wes h ALA 417 Ca 0.11 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 2wes h ALA 417 Cb 0.78 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2wes h ALA 417 CO 0.06 0.65 0.12 0.00 0.00 0.00 0.00 179.25 180.09 2wes h ALA 418 N 1.07 1.65 -0.07 0.00 0.00 -1.08 -1.54 119.26 119.29 2wes h ALA 418 Ca 0.03 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2wes h ALA 418 Cb 0.94 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2wes h ALA 418 CO 0.08 0.28 -0.37 -0.22 0.00 0.00 0.00 179.25 179.02 2wes h LYS 419 N 0.42 0.14 -0.01 0.00 3.64 -1.29 -3.26 116.57 116.22 2wes h LYS 419 Ca 0.11 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2wes h LYS 419 Cb 0.09 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2wes h LYS 419 CO -0.01 0.50 -0.43 0.25 -2.27 0.00 0.00 179.45 177.49 2wes n THR 420 N -4.07 0.00 -1.88 1.00 -2.24 -0.94 -5.02 114.28 101.12 2wes n THR 420 Ca -0.01 -0.29 -0.39 0.00 -2.27 0.00 0.00 64.05 61.09 2wes n THR 420 Cb 0.43 1.09 0.02 0.00 -2.10 0.00 0.00 70.33 69.77 2wes n THR 420 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2wes s ARG 421 N -1.93 3.55 0.66 -0.78 3.52 -0.62 -4.95 118.95 118.40 2wes s ARG 421 Ca 0.09 2.25 -0.17 0.00 -0.13 0.00 0.00 55.73 57.76 2wes s ARG 421 Cb 0.11 -2.51 -0.05 0.00 -1.56 0.00 0.00 34.95 30.94 2wes s ARG 421 CO 0.43 -0.87 0.62 0.00 -0.81 0.00 0.00 175.30 174.67 2wes n ALA 422 N -0.46 -1.08 -2.49 6.12 0.00 -1.26 -5.04 120.51 116.31 2wes n ALA 422 Ca 0.07 -0.14 -0.26 0.00 0.00 0.00 0.00 53.44 53.10 2wes n ALA 422 Cb 0.44 -1.90 -0.11 0.00 0.00 0.00 0.00 19.45 17.88 2wes n ALA 422 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2wes s MET 423 N -2.61 1.75 0.61 0.00 1.00 -1.26 -4.63 119.30 114.15 2wes s MET 423 Ca 0.69 -1.45 -0.19 0.00 0.00 0.00 0.00 55.69 54.73 2wes s MET 423 Cb -0.39 -1.96 -0.03 0.00 0.00 0.00 0.00 34.83 32.45 2wes s MET 423 CO 0.55 0.40 1.22 -2.30 0.00 0.00 0.00 175.02 174.90 2wes n PRO 424 N 0.07 1.21 -1.59 2.03 -0.02 -1.26 -4.94 135.00 130.50 2wes n PRO 424 Ca -0.11 0.46 -0.49 0.00 -2.02 0.00 0.00 63.50 61.35 2wes n PRO 424 Cb 0.56 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.56 2wes n PRO 424 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2wes n ASP 425 N -1.34 1.52 0.00 2.55 10.43 -1.26 -2.42 116.55 126.03 2wes n ASP 425 Ca 0.14 1.14 0.00 0.00 2.57 0.00 0.00 54.79 58.64 2wes n ASP 425 Cb 0.47 -1.24 0.00 0.00 1.84 0.00 0.00 41.12 42.19 2wes n ASP 425 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2wes n GLY 426 N 2.06 3.02 0.28 0.44 0.00 -1.26 -4.90 105.19 104.83 2wes n GLY 426 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 2wes n GLY 426 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wes h LEU 427 N 0.00 0.97 -0.58 0.99 5.85 -1.85 -2.77 115.31 117.92 2wes h LEU 427 Ca 0.00 -0.38 0.08 0.00 0.84 0.00 0.00 57.88 58.42 2wes h LEU 427 Cb 0.00 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.70 2wes h LEU 427 CO 0.00 1.16 0.24 0.00 -0.34 0.00 0.00 178.44 179.50 2wes h ALA 428 N 0.91 0.75 -0.60 1.25 0.00 -1.91 0.40 119.26 120.06 2wes h ALA 428 Ca 0.10 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2wes h ALA 428 Cb 0.81 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2wes h ALA 428 CO 0.07 -0.15 0.34 -0.09 0.00 0.00 0.00 179.25 179.42 2wes h ARG 429 N 0.45 0.84 -0.70 0.00 9.65 -1.93 -0.73 114.38 121.94 2wes h ARG 429 Ca 0.28 -0.09 -0.03 0.00 -1.10 0.00 0.00 59.98 59.04 2wes h ARG 429 Cb 0.31 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.69 2wes h ARG 429 CO -0.26 0.63 0.31 0.87 2.80 0.00 0.00 179.97 184.31 2wes h LYS 430 N 0.82 1.02 -0.43 0.20 1.57 -0.90 -1.36 116.57 117.48 2wes h LYS 430 Ca 0.21 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 2wes h LYS 430 Cb 0.03 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 2wes h LYS 430 CO -0.04 0.81 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.41 2wes h LEU 431 N 1.01 0.90 -0.70 2.94 3.38 -0.50 -1.61 115.31 120.72 2wes h LEU 431 Ca 0.24 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.86 2wes h LEU 431 Cb 0.15 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 2wes h LEU 431 CO -0.03 1.09 0.44 -0.33 0.09 0.00 0.00 178.44 179.70 2wes h GLU 432 N 0.71 0.82 -0.76 1.13 5.08 -0.88 -2.09 114.58 118.59 2wes h GLU 432 Ca 0.10 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2wes h GLU 432 Cb 0.73 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2wes h GLU 432 CO 0.06 0.54 0.35 -0.07 -1.00 0.00 0.00 179.01 178.89 2wes h LEU 433 N 0.84 1.01 -1.88 1.33 3.38 -1.05 -2.96 115.31 115.98 2wes h LEU 433 Ca 0.29 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2wes h LEU 433 Cb 0.05 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 2wes h LEU 433 CO -0.12 0.87 -0.04 0.28 0.09 0.00 0.00 178.44 179.52 2wes h SER 434 N 1.08 0.00 1.52 -0.43 0.02 -0.62 0.32 113.55 115.44 2wes h SER 434 Ca 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 2wes h SER 434 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2wes h SER 434 CO -0.03 0.04 -0.14 0.00 -1.14 0.00 0.00 176.83 175.55 2wes h ALA 435 N 1.96 0.91 0.00 3.77 0.00 -1.29 -3.18 119.26 121.44 2wes h ALA 435 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 2wes h ALA 435 Cb 0.38 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 2wes h ALA 435 CO 0.00 0.00 -2.06 0.45 0.00 0.00 0.00 179.25 177.65 2wes n SER 436 N -2.52 2.55 -3.81 0.00 2.88 -0.12 -1.61 113.62 111.00 2wes n SER 436 Ca 0.04 -0.10 -0.06 0.00 -1.33 0.00 0.00 58.87 57.42 2wes n SER 436 Cb 0.47 -0.29 -0.02 0.00 -0.75 0.00 0.00 64.21 63.62 2wes n SER 436 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2wes s HIS 437 N -2.37 -0.19 0.30 0.66 0.00 0.94 -4.53 115.29 110.11 2wes s HIS 437 Ca -0.25 -0.22 -0.29 0.00 -3.00 0.00 0.00 55.06 51.30 2wes s HIS 437 Cb 0.06 0.68 -0.10 0.00 -4.00 0.00 0.00 32.58 29.23 2wes s HIS 437 CO 0.43 -1.10 1.32 -0.51 -1.00 0.00 0.00 174.74 173.87 2wes s LEU 438 N -2.91 4.42 0.82 5.38 1.43 -1.26 -3.52 118.68 123.04 2wes s LEU 438 Ca 0.11 2.64 -0.14 0.00 -1.03 0.00 0.00 54.13 55.71 2wes s LEU 438 Cb -0.04 -3.64 0.03 0.00 0.03 0.00 0.00 46.19 42.57 2wes s LEU 438 CO 0.05 -0.54 0.77 0.18 0.23 0.00 0.00 176.35 177.04 2wes n LEU 439 N 1.21 2.00 0.00 1.79 4.77 -1.26 -4.97 117.00 120.54 2wes n LEU 439 Ca 0.01 0.52 -0.08 0.00 -0.03 0.00 0.00 56.01 56.43 2wes n LEU 439 Cb 0.42 -1.33 -0.02 0.00 -2.33 0.00 0.00 43.42 40.15 2wes n LEU 439 CO 0.59 -2.68 0.06 -0.90 -1.33 0.00 0.00 177.39 173.13 2wes n ASP 440 N -1.79 -0.67 -0.25 -1.43 5.68 -1.26 -4.91 116.55 111.92 2wes n ASP 440 Ca 0.11 -2.06 0.29 0.00 -0.50 0.00 0.00 54.79 52.63 2wes n ASP 440 Cb 0.51 1.29 0.69 0.00 -1.14 0.00 0.00 41.12 42.47 2wes n ASP 440 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2wes h GLU 441 N 0.00 0.08 0.00 0.11 3.07 -1.96 0.25 114.58 116.13 2wes h GLU 441 Ca -0.14 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 2wes h GLU 441 Cb 0.65 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2wes h GLU 441 CO 0.20 0.05 -0.55 1.96 -1.40 0.00 0.00 179.01 179.27 2wes h GLN 442 N 0.09 0.00 -0.00 2.33 1.08 -1.98 -3.38 115.11 113.25 2wes h GLN 442 Ca 0.50 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.70 2wes h GLN 442 Cb 1.82 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.25 2wes h GLN 442 CO -0.06 0.00 -0.17 0.25 -0.95 0.00 0.00 178.83 177.90 2wes n THR 443 N -2.44 0.00 -1.16 -0.54 -2.24 0.77 -4.97 114.28 103.71 2wes n THR 443 Ca 0.03 -0.42 -0.11 0.00 -2.27 0.00 0.00 64.05 61.28 2wes n THR 443 Cb 0.48 1.04 0.08 0.00 -2.10 0.00 0.00 70.33 69.83 2wes n THR 443 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2wes n ILE 444 N -0.65 0.00 -1.92 2.28 -5.35 -0.49 -4.85 119.36 108.39 2wes n ILE 444 Ca 0.02 -0.30 -0.42 0.00 -0.27 0.00 0.00 62.75 61.77 2wes n ILE 444 Cb 0.10 -1.62 -0.03 0.00 -1.74 0.00 0.00 39.64 36.36 2wes n ILE 444 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2wes s TYR 445 N -1.96 2.81 -0.59 4.28 5.04 -1.26 -4.91 117.35 120.77 2wes s TYR 445 Ca 0.27 0.50 0.24 0.00 -2.44 0.00 0.00 57.07 55.64 2wes s TYR 445 Cb -0.01 -3.95 0.49 0.00 0.35 0.00 0.00 41.96 38.83 2wes s TYR 445 CO 0.19 -3.64 1.53 -1.00 -1.34 0.00 0.00 175.55 171.30 2wes h PRO 446 N 7.38 0.00 -6.28 4.97 0.13 -1.93 -3.46 132.00 132.82 2wes h PRO 446 Ca -0.43 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.24 2wes h PRO 446 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2wes h PRO 446 CO 0.92 0.00 -0.37 0.71 -0.23 0.00 0.00 178.00 179.03 2wes s TYR 447 N -3.17 3.46 0.10 1.56 2.02 -1.26 -5.02 117.35 115.05 2wes s TYR 447 Ca 0.07 0.08 -0.31 0.00 -0.37 0.00 0.00 57.07 56.54 2wes s TYR 447 Cb 0.11 -1.66 -0.09 0.00 -0.40 0.00 0.00 41.96 39.92 2wes s TYR 447 CO 0.67 0.36 1.68 -0.47 -1.57 0.00 0.00 175.55 176.22 2wes s TYR 448 N -2.07 2.48 0.00 2.71 5.04 -1.26 -4.84 117.35 119.42 2wes s TYR 448 Ca 0.36 0.29 0.17 0.00 -2.44 0.00 0.00 57.07 55.45 2wes s TYR 448 Cb -0.09 -4.01 0.28 0.00 0.35 0.00 0.00 41.96 38.49 2wes s TYR 448 CO 0.31 -4.04 1.09 -2.39 -1.34 0.00 0.00 175.55 169.18 2wes n HIS 449 N 5.29 0.00 0.00 4.97 1.44 -1.26 -3.53 115.22 122.12 2wes n HIS 449 Ca 0.16 -0.39 0.00 0.00 -2.01 0.00 0.00 57.72 55.48 2wes n HIS 449 Cb 0.39 -0.04 0.00 0.00 0.12 0.00 0.00 29.99 30.47 2wes n HIS 449 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2wes n GLY 450 N 0.33 1.72 3.77 -1.39 0.00 -1.26 -4.65 105.19 103.71 2wes n GLY 450 Ca 0.01 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 2wes n GLY 450 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wes s PHE 451 N 0.00 3.63 0.50 1.61 0.40 -1.26 -5.06 117.98 117.79 2wes s PHE 451 Ca 0.00 1.76 0.09 0.00 -0.60 0.00 0.00 56.93 58.18 2wes s PHE 451 Cb 0.00 -3.02 0.05 0.00 0.51 0.00 0.00 43.02 40.56 2wes s PHE 451 CO 0.00 -0.03 0.66 -1.21 0.70 0.00 0.00 175.22 175.34 2wes s GLU 452 N -1.96 2.55 0.26 0.44 2.02 -1.26 -5.02 118.70 115.73 2wes s GLU 452 Ca 0.50 -1.47 -0.01 0.00 0.02 0.00 0.00 54.97 54.01 2wes s GLU 452 Cb -0.22 -2.66 0.56 0.00 0.10 0.00 0.00 34.13 31.91 2wes s GLU 452 CO 0.28 -0.55 1.71 1.15 0.02 0.00 0.00 175.26 177.87 2wes h THR 453 N 0.45 0.58 -0.25 3.63 2.02 -1.97 -2.14 112.91 115.22 2wes h THR 453 Ca -0.35 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 2wes h THR 453 Cb 1.28 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2wes h THR 453 CO 0.44 0.08 0.05 0.10 0.37 0.00 0.00 175.52 176.56 2wes h TYR 454 N 0.42 0.36 -0.41 3.16 -0.00 -1.96 -1.48 116.97 117.06 2wes h TYR 454 Ca 0.47 -0.02 -0.03 0.00 0.00 0.00 0.00 58.73 59.16 2wes h TYR 454 Cb 0.79 -0.11 -0.02 0.00 0.00 0.00 0.00 36.73 37.39 2wes h TYR 454 CO -0.17 0.33 0.16 0.77 -0.00 0.00 0.00 178.16 179.25 2wes h SER 455 N 0.36 0.58 -0.45 0.10 0.02 -1.76 0.23 113.55 112.62 2wes h SER 455 Ca 0.09 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 2wes h SER 455 Cb 0.17 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 2wes h SER 455 CO -0.00 0.60 0.15 -0.50 -1.14 0.00 0.00 176.83 175.93 2wes h TRP 456 N 0.52 0.72 -0.00 3.45 4.06 -1.36 -2.29 115.95 121.05 2wes h TRP 456 Ca 0.14 -0.07 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 2wes h TRP 456 Cb 0.21 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.16 2wes h TRP 456 CO 0.00 0.64 0.00 0.82 -3.56 0.00 0.00 178.44 176.34 2wes h ILE 457 N 0.59 1.14 -0.53 1.49 2.04 -1.08 -2.28 117.51 118.87 2wes h ILE 457 Ca 0.15 -0.40 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2wes h ILE 457 Cb 0.25 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 2wes h ILE 457 CO -0.01 0.10 0.28 0.74 0.00 0.00 0.00 178.15 179.27 2wes h THR 458 N -0.17 0.98 -0.32 -0.27 2.02 -0.52 0.06 112.91 114.69 2wes h THR 458 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 2wes h THR 458 Cb 0.17 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 2wes h THR 458 CO -0.00 0.10 0.14 0.24 0.37 0.00 0.00 175.52 176.37 2wes h MET 459 N 0.55 0.48 -0.10 6.66 2.86 -1.38 0.48 114.93 124.48 2wes h MET 459 Ca 0.23 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.81 2wes h MET 459 Cb 0.11 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 2wes h MET 459 CO -0.14 0.47 -0.08 -0.91 1.06 0.00 0.00 176.91 177.31 2wes h ASN 460 N 0.38 -0.24 -0.54 1.22 2.35 -0.93 -0.74 115.58 117.07 2wes h ASN 460 Ca 0.11 0.05 -0.10 0.00 -0.55 0.00 0.00 56.30 55.81 2wes h ASN 460 Cb 0.16 0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2wes h ASN 460 CO -0.01 -0.11 -0.04 -0.07 -1.65 0.00 0.00 177.43 175.55 2wes h LEU 461 N -0.09 0.98 -0.64 1.61 3.38 -0.87 0.61 115.31 120.30 2wes h LEU 461 Ca 0.07 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2wes h LEU 461 Cb 0.18 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2wes h LEU 461 CO -0.16 1.07 0.12 1.23 0.09 0.00 0.00 178.44 180.79 2wes h GLY 462 N 0.87 1.13 1.88 0.83 0.00 -0.83 -3.13 103.07 103.81 2wes h GLY 462 Ca 0.15 -0.74 -0.13 0.00 0.00 0.00 0.00 47.33 46.61 2wes h GLY 462 CO 0.04 0.69 -0.68 1.41 0.00 0.00 0.00 176.54 177.99 2wes h LEU 463 N 0.96 0.00 0.00 3.11 3.38 -1.03 -3.47 115.31 118.26 2wes h LEU 463 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2wes h LEU 463 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2wes h LEU 463 CO 0.01 0.58 0.00 0.61 0.09 0.00 0.00 178.44 179.73 2wes n GLY 464 N 1.26 1.64 3.36 0.83 0.00 -0.35 -4.44 105.19 107.49 2wes n GLY 464 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.57 2wes n GLY 464 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wes s ILE 465 N -2.00 5.21 -0.02 -0.61 1.01 0.20 -4.99 121.20 120.00 2wes s ILE 465 Ca 0.00 -1.80 0.07 0.00 0.00 0.00 0.00 60.65 58.92 2wes s ILE 465 Cb 0.00 -4.50 -0.02 0.00 0.01 0.00 0.00 42.46 37.95 2wes s ILE 465 CO 0.00 -1.10 -0.24 -0.69 0.00 0.00 0.00 174.94 172.91 2wes s VAL 466 N 1.43 2.24 0.55 2.92 1.01 -1.26 -3.95 120.40 123.33 2wes s VAL 466 Ca 0.16 -1.07 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 2wes s VAL 466 Cb -0.16 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 2wes s VAL 466 CO -0.03 0.56 1.37 -2.84 0.00 0.00 0.00 175.10 174.16 2wes s PRO 467 N -0.70 3.10 0.22 2.72 0.02 -1.20 -4.62 135.00 134.54 2wes s PRO 467 Ca 0.10 2.26 -0.08 0.00 0.02 0.00 0.00 61.00 63.31 2wes s PRO 467 Cb -0.10 -2.24 0.28 0.00 0.02 0.00 0.00 34.50 32.46 2wes s PRO 467 CO -0.00 -1.23 1.81 1.49 -0.33 0.00 0.00 177.00 178.74 2wes h GLU 468 N 1.41 0.73 -4.76 5.54 4.81 -1.53 -3.44 114.58 117.33 2wes h GLU 468 Ca -0.51 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 58.40 2wes h GLU 468 Cb 1.30 -0.16 -0.15 0.00 0.63 0.00 0.00 28.75 30.37 2wes h GLU 468 CO 0.57 0.48 -0.66 1.03 -0.73 0.00 0.00 179.01 179.70 2wes s ARG 469 N -6.08 1.07 0.97 1.92 0.52 -1.26 -5.15 118.95 110.94 2wes s ARG 469 Ca -0.13 -1.51 -0.11 0.00 -0.52 0.00 0.00 55.73 53.46 2wes s ARG 469 Cb 0.17 -0.22 0.17 0.00 0.52 0.00 0.00 34.95 35.59 2wes s ARG 469 CO 0.77 -0.13 1.09 -2.14 0.02 0.00 0.00 175.30 174.91 2wes s PRO 470 N -3.92 0.64 -0.00 3.54 0.02 -1.26 -4.90 135.00 129.12 2wes s PRO 470 Ca 0.23 1.12 -0.30 0.00 0.02 0.00 0.00 61.00 62.07 2wes s PRO 470 Cb 0.06 -1.72 -0.07 0.00 0.02 0.00 0.00 34.50 32.80 2wes s PRO 470 CO 0.03 -2.75 1.73 0.50 -0.33 0.00 0.00 177.00 176.18 2wes s ARG 471 N -4.70 4.18 0.45 5.54 3.52 -1.26 -4.89 118.95 121.79 2wes s ARG 471 Ca 0.66 2.33 0.16 0.00 -0.13 0.00 0.00 55.73 58.75 2wes s ARG 471 Cb -0.22 -3.93 1.11 0.00 -1.56 0.00 0.00 34.95 30.35 2wes s ARG 471 CO 0.59 -0.84 1.98 -1.35 -0.81 0.00 0.00 175.30 174.87 2wes h PRO 472 N 9.48 0.31 -0.96 5.12 0.11 -1.98 0.22 132.00 144.31 2wes h PRO 472 Ca -0.43 -0.02 0.21 0.00 0.11 0.00 0.00 66.00 65.88 2wes h PRO 472 Cb 1.20 -0.07 -0.08 0.00 0.11 0.00 0.00 31.00 32.16 2wes h PRO 472 CO 0.94 0.21 0.62 0.00 -0.21 0.00 0.00 178.00 179.56 2wes h ALA 473 N 1.71 2.08 -0.03 -0.75 0.00 -2.01 -2.30 119.26 117.95 2wes h ALA 473 Ca 0.28 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.17 2wes h ALA 473 Cb 0.66 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2wes h ALA 473 CO -0.07 -0.41 -0.27 -0.07 0.00 0.00 0.00 179.25 178.44 2wes h LEU 474 N 0.50 0.06 -1.95 0.00 3.38 -1.33 -0.96 115.31 115.01 2wes h LEU 474 Ca 0.52 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.46 2wes h LEU 474 Cb 1.16 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 2wes h LEU 474 CO -0.25 0.33 -0.08 -0.07 0.09 0.00 0.00 178.44 178.46 2wes h LEU 475 N 0.05 0.00 -0.97 1.67 3.38 -1.55 -1.83 115.31 116.06 2wes h LEU 475 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2wes h LEU 475 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2wes h LEU 475 CO 0.04 0.08 0.00 1.41 0.09 0.00 0.00 178.44 180.06 2wes n HIS 476 N -3.40 0.29 -4.40 1.13 8.25 -0.37 -4.94 115.22 111.78 2wes n HIS 476 Ca -0.01 -0.15 -0.23 0.00 -0.26 0.00 0.00 57.72 57.07 2wes n HIS 476 Cb 0.24 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.24 2wes n HIS 476 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2wes s MET 477 N -1.71 1.47 -0.21 -0.41 -1.94 -0.69 -5.09 119.30 110.72 2wes s MET 477 Ca 0.24 -1.59 -0.29 0.00 -1.71 0.00 0.00 55.69 52.34 2wes s MET 477 Cb 0.12 -1.53 -0.02 0.00 2.01 0.00 0.00 34.83 35.41 2wes s MET 477 CO 0.18 0.30 1.45 0.34 -0.01 0.00 0.00 175.02 177.28 2wes s ASP 478 N -3.08 6.63 0.00 3.03 2.15 -1.26 -4.91 116.67 119.22 2wes s ASP 478 Ca 0.23 1.61 0.24 0.00 0.43 0.00 0.00 52.55 55.05 2wes s ASP 478 Cb -0.05 -2.54 1.05 0.00 -0.30 0.00 0.00 42.92 41.09 2wes s ASP 478 CO 0.10 -1.05 1.77 -0.81 -0.17 0.00 0.00 175.17 175.01 2wes n PRO 479 N 7.25 0.06 -0.05 4.34 -0.04 -1.26 -4.31 135.00 140.99 2wes n PRO 479 Ca 0.16 0.08 -0.09 0.00 -0.04 0.00 0.00 63.50 63.62 2wes n PRO 479 Cb 0.45 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 2wes n PRO 479 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wes h ALA 480 N 2.88 0.26 -1.00 0.55 0.00 -1.99 -1.77 119.26 118.19 2wes h ALA 480 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2wes h ALA 480 Cb 0.38 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2wes h ALA 480 CO 0.00 -0.31 0.65 -1.35 0.00 0.00 0.00 179.25 178.24 2wes h PRO 481 N 0.22 1.19 -0.26 0.00 0.11 -2.00 -0.19 132.00 131.07 2wes h PRO 481 Ca 0.09 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 2wes h PRO 481 Cb 0.04 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 2wes h PRO 481 CO -0.08 0.79 0.05 0.00 -0.21 0.00 0.00 178.00 178.55 2wes h ALA 482 N 1.43 0.34 -0.98 -0.75 0.00 -1.75 -0.50 119.26 117.04 2wes h ALA 482 Ca 0.41 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.22 2wes h ALA 482 Cb 0.07 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 2wes h ALA 482 CO -0.14 0.01 0.63 -0.07 0.00 0.00 0.00 179.25 179.67 2wes h LEU 483 N 0.24 1.00 -0.80 0.00 3.38 -0.87 0.01 115.31 118.26 2wes h LEU 483 Ca 0.08 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2wes h LEU 483 Cb 0.31 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2wes h LEU 483 CO 0.00 0.63 0.26 0.00 0.09 0.00 0.00 178.44 179.42 2wes h ALA 484 N 1.45 1.04 -0.45 1.53 0.00 -0.74 -2.50 119.26 119.59 2wes h ALA 484 Ca 0.43 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2wes h ALA 484 Cb 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2wes h ALA 484 CO -0.18 0.66 0.04 1.49 0.00 0.00 0.00 179.25 181.26 2wes h GLU 485 N 1.11 0.77 -0.99 0.00 4.57 0.12 0.30 114.58 120.45 2wes h GLU 485 Ca 0.25 -0.22 0.08 0.00 -1.18 0.00 0.00 59.36 58.28 2wes h GLU 485 Cb 0.27 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.71 2wes h GLU 485 CO -0.01 0.80 0.64 0.74 -1.18 0.00 0.00 179.01 180.00 2wes h PHE 486 N 0.62 1.17 -0.33 0.92 0.05 -0.93 -0.95 116.94 117.48 2wes h PHE 486 Ca 0.13 0.03 -0.08 0.00 3.82 0.00 0.00 57.97 61.87 2wes h PHE 486 Cb 0.43 -0.38 -0.01 0.00 2.00 0.00 0.00 35.95 37.99 2wes h PHE 486 CO 0.03 0.57 -0.12 0.93 -0.18 0.00 0.00 178.31 179.54 2wes h GLU 487 N 1.12 0.67 -0.62 1.51 4.39 -1.04 -2.13 114.58 118.47 2wes h GLU 487 Ca 0.44 -0.28 0.09 0.00 0.34 0.00 0.00 59.36 59.96 2wes h GLU 487 Cb 0.25 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 2wes h GLU 487 CO -0.19 0.86 0.25 0.00 -1.16 0.00 0.00 179.01 178.77 2wes h ARG 488 N 0.44 0.43 -0.60 2.33 3.08 -0.44 -0.60 114.38 119.03 2wes h ARG 488 Ca 0.08 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 2wes h ARG 488 Cb 0.64 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 2wes h ARG 488 CO 0.04 0.29 0.17 -0.07 -1.07 0.00 0.00 179.97 179.33 2wes h LEU 489 N 0.45 0.89 -0.49 3.04 3.38 -1.00 0.37 115.31 121.94 2wes h LEU 489 Ca 0.31 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2wes h LEU 489 Cb 0.36 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2wes h LEU 489 CO -0.29 0.87 0.11 -0.09 0.09 0.00 0.00 178.44 179.13 2wes h ARG 490 N 0.86 0.80 0.43 1.13 2.43 -1.10 -1.21 114.38 117.71 2wes h ARG 490 Ca 0.19 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2wes h ARG 490 Cb 0.31 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 2wes h ARG 490 CO -0.00 0.78 -0.21 -0.09 -1.51 0.00 0.00 179.97 178.94 2wes h ARG 491 N 0.68 -0.56 -0.84 0.20 2.43 -0.68 -1.75 114.38 113.85 2wes h ARG 491 Ca 0.15 0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 2wes h ARG 491 Cb 0.35 0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 2wes h ARG 491 CO 0.00 -0.31 0.56 0.93 -1.51 0.00 0.00 179.97 179.64 2wes h GLU 492 N -0.70 1.02 0.19 0.20 5.08 -0.30 -1.61 114.58 118.47 2wes h GLU 492 Ca -0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 2wes h GLU 492 Cb 0.51 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2wes h GLU 492 CO 0.10 0.68 -0.18 0.78 -1.00 0.00 0.00 179.01 179.38 2wes h GLY 493 N 1.05 -0.40 -0.08 -3.84 0.00 -1.13 -1.30 103.07 97.37 2wes h GLY 493 Ca 0.33 0.21 0.12 0.00 0.00 0.00 0.00 47.33 47.99 2wes h GLY 493 CO -0.10 -0.18 -0.08 -0.55 0.00 0.00 0.00 176.54 175.63 2wes h ASP 494 N -0.41 -0.42 -0.30 0.19 3.32 -0.67 -2.20 116.42 115.94 2wes h ASP 494 Ca -0.00 0.16 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 2wes h ASP 494 Cb 0.38 0.31 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2wes h ASP 494 CO -0.04 -0.16 -0.22 -0.33 -1.72 0.00 0.00 179.24 176.77 2wes h GLU 495 N 0.04 0.78 -0.44 3.56 5.08 -1.11 -2.89 114.58 119.60 2wes h GLU 495 Ca 0.29 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 2wes h GLU 495 Cb 0.45 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2wes h GLU 495 CO -0.55 0.93 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.23 2wes h LEU 496 N 0.68 0.84 -1.42 1.33 3.38 -0.85 -2.43 115.31 116.84 2wes h LEU 496 Ca 0.09 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2wes h LEU 496 Cb 0.73 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2wes h LEU 496 CO 0.06 1.00 -0.23 0.16 0.09 0.00 0.00 178.44 179.52 2wes h ILE 497 N 0.67 0.71 0.00 1.22 3.07 -1.32 -0.65 117.51 121.22 2wes h ILE 497 Ca 0.11 -0.98 -0.16 0.00 1.55 0.00 0.00 64.86 65.38 2wes h ILE 497 Cb 0.62 1.62 -0.02 0.00 -0.27 0.00 0.00 36.82 38.77 2wes h ILE 497 CO 0.04 0.23 -0.76 0.00 -1.05 0.00 0.00 178.15 176.60 2wes h ALA 498 N 1.77 0.66 0.00 0.16 0.00 -1.38 -3.35 119.26 117.12 2wes h ALA 498 Ca -0.00 -0.69 -0.29 0.00 0.00 0.00 0.00 54.91 53.93 2wes h ALA 498 Cb 0.60 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2wes h ALA 498 CO 0.03 0.95 -1.98 0.00 0.00 0.00 0.00 179.25 178.25 2wes n ALA 499 N -2.36 1.65 -2.10 0.00 0.00 -0.91 -4.97 120.51 111.83 2wes n ALA 499 Ca -0.00 -0.97 -0.36 0.00 0.00 0.00 0.00 53.44 52.11 2wes n ALA 499 Cb 0.77 -0.57 -0.06 0.00 0.00 0.00 0.00 19.45 19.59 2wes n ALA 499 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wes s LEU 500 N -5.67 4.37 0.89 0.00 1.43 -0.30 -4.91 118.68 114.49 2wes s LEU 500 Ca -0.07 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.34 2wes s LEU 500 Cb 0.08 -3.53 0.12 0.00 0.03 0.00 0.00 46.19 42.89 2wes s LEU 500 CO 0.83 0.06 1.11 -2.16 0.23 0.00 0.00 176.35 176.41 2wes s PRO 501 N -1.87 1.34 0.86 1.29 0.04 -1.26 -4.89 135.00 130.51 2wes s PRO 501 Ca 0.42 0.56 -0.11 0.00 0.04 0.00 0.00 61.00 61.90 2wes s PRO 501 Cb -0.17 -1.84 0.11 0.00 0.04 0.00 0.00 34.50 32.63 2wes s PRO 501 CO 0.21 -2.12 1.09 -1.54 0.04 0.00 0.00 177.00 174.69 2wes s SER 502 N -3.76 3.84 0.13 6.66 1.04 -1.26 -1.34 113.70 119.01 2wes s SER 502 Ca 0.63 1.47 -0.24 0.00 0.48 0.00 0.00 55.95 58.29 2wes s SER 502 Cb -0.16 -2.17 -0.03 0.00 0.10 0.00 0.00 66.02 63.77 2wes s SER 502 CO 0.55 -2.40 1.64 0.00 0.98 0.00 0.00 173.24 174.01 2wes h TYR 504 N -0.32 0.53 -0.34 0.00 3.20 -1.84 -2.57 116.97 115.64 2wes h TYR 504 Ca 0.09 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.03 2wes h TYR 504 Cb 0.44 -0.18 -0.08 0.00 1.54 0.00 0.00 36.73 38.45 2wes h TYR 504 CO -0.31 0.37 -0.24 0.93 -1.64 0.00 0.00 178.16 177.27 2wes h GLU 505 N 0.54 -0.19 -0.49 1.82 5.08 -1.85 0.20 114.58 119.68 2wes h GLU 505 Ca 0.15 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 2wes h GLU 505 Cb -0.01 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2wes h GLU 505 CO -0.03 -0.13 0.19 -0.92 -1.00 0.00 0.00 179.01 177.12 2wes h TYR 506 N -0.20 0.75 -0.63 4.33 3.20 -1.33 -2.39 116.97 120.70 2wes h TYR 506 Ca 0.17 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 2wes h TYR 506 Cb 0.47 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 2wes h TYR 506 CO -0.44 0.64 0.30 -0.07 -1.64 0.00 0.00 178.16 176.94 2wes h LEU 507 N 0.65 0.82 -1.15 2.82 3.38 -1.00 -2.20 115.31 118.63 2wes h LEU 507 Ca 0.16 -0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.08 2wes h LEU 507 Cb 0.21 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2wes h LEU 507 CO -0.01 0.73 0.59 0.00 0.09 0.00 0.00 178.44 179.83 2wes h ALA 508 N 1.13 1.55 0.00 1.53 0.00 -0.45 -2.28 119.26 120.74 2wes h ALA 508 Ca 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2wes h ALA 508 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2wes h ALA 508 CO -0.03 0.29 0.00 -1.13 0.00 0.00 0.00 179.25 178.39 2wes n SER 509 N -4.51 0.14 -0.20 0.00 3.41 -0.83 -2.67 113.62 108.95 2wes n SER 509 Ca 0.14 0.53 0.03 0.00 -0.26 0.00 0.00 58.87 59.31 2wes n SER 509 Cb 0.24 -0.56 0.02 0.00 -0.26 0.00 0.00 64.21 63.65 2wes n SER 509 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2wes n ILE 510 N -1.64 0.00 0.00 -1.33 -5.35 -0.88 -5.11 119.36 105.05 2wes n ILE 510 Ca 0.04 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 62.03 2wes n ILE 510 Cb 0.23 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.24 2wes n ILE 510 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79