#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jer n ALA 2 N 0.00 -1.55 -2.82 3.04 0.00 -1.26 -4.95 120.51 112.97 2jer n ALA 2 Ca 0.00 0.37 -0.26 0.00 0.00 0.00 0.00 53.44 53.54 2jer n ALA 2 Cb 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.21 2jer n ALA 2 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2jer s LYS 3 N -0.25 3.00 0.25 0.00 2.20 -1.26 -4.98 119.74 118.69 2jer s LYS 3 Ca -0.02 -0.81 -0.30 0.00 -0.36 0.00 0.00 55.97 54.48 2jer s LYS 3 Cb 0.00 -2.71 -0.09 0.00 -1.51 0.00 0.00 37.83 33.52 2jer s LYS 3 CO 0.07 0.50 0.96 1.03 -0.36 0.00 0.00 175.35 177.54 2jer s ARG 4 N -3.08 4.81 -0.26 4.03 1.81 -1.26 -1.61 118.95 123.38 2jer s ARG 4 Ca 0.32 1.52 -0.16 0.00 -1.72 0.00 0.00 55.73 55.68 2jer s ARG 4 Cb -0.10 -3.23 -0.03 0.00 -0.45 0.00 0.00 34.95 31.13 2jer s ARG 4 CO 0.24 0.46 0.45 0.42 -0.68 0.00 0.00 175.30 176.19 2jer s ILE 5 N -1.21 5.13 0.10 1.52 -1.09 0.69 -4.88 121.20 121.46 2jer s ILE 5 Ca 0.42 0.74 0.09 0.00 -2.23 0.00 0.00 60.65 59.67 2jer s ILE 5 Cb -0.26 -3.77 -0.03 0.00 -1.58 0.00 0.00 42.46 36.82 2jer s ILE 5 CO 0.33 0.13 -0.23 0.68 -1.23 0.00 0.00 174.94 174.62 2jer s VAL 6 N 2.10 1.86 0.00 2.92 -7.23 -1.26 -4.52 120.40 114.26 2jer s VAL 6 Ca 0.18 -1.53 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 2jer s VAL 6 Cb -0.16 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.13 2jer s VAL 6 CO 0.09 0.04 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 2jer n GLY 7 N 1.21 0.40 3.35 2.32 0.00 -1.26 -5.00 105.19 106.21 2jer n GLY 7 Ca -0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.70 2jer n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jer s SER 8 N -2.06 0.52 0.28 1.61 1.04 -1.26 -5.17 113.70 108.65 2jer s SER 8 Ca 0.00 -1.38 0.11 0.00 0.48 0.00 0.00 55.95 55.16 2jer s SER 8 Cb 0.00 0.50 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 2jer s SER 8 CO 0.00 -1.02 -0.17 0.42 0.98 0.00 0.00 173.24 173.45 2jer s THR 9 N -3.80 2.29 0.20 2.02 -4.23 -1.26 -5.03 115.64 105.82 2jer s THR 9 Ca 0.34 -2.34 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 2jer s THR 9 Cb 0.03 -2.32 0.18 0.00 1.34 0.00 0.00 72.50 71.73 2jer s THR 9 CO 0.16 -0.40 1.65 -0.65 -0.54 0.00 0.00 174.62 174.85 2jer h PRO 10 N 2.28 0.05 -0.50 3.99 0.11 -1.82 -1.53 132.00 134.57 2jer h PRO 10 Ca -0.40 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.75 2jer h PRO 10 Cb 1.25 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 2jer h PRO 10 CO 0.62 0.03 0.25 -0.22 -0.21 0.00 0.00 178.00 178.47 2jer h LYS 11 N 0.05 0.47 -0.01 1.05 3.64 -1.28 0.05 116.57 120.54 2jer h LYS 11 Ca 0.28 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2jer h LYS 11 Cb 0.44 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2jer h LYS 11 CO -0.53 0.31 -0.08 0.37 -2.27 0.00 0.00 179.45 177.25 2jer h GLN 12 N 0.48 0.02 -0.34 1.90 4.15 -1.71 -2.60 115.11 117.01 2jer h GLN 12 Ca 0.22 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.64 2jer h GLN 12 Cb 0.15 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2jer h GLN 12 CO -0.17 0.11 0.00 -0.25 -1.93 0.00 0.00 178.83 176.59 2jer n ASP 13 N -4.43 2.87 -0.33 -0.69 8.00 -0.62 -4.95 116.55 116.40 2jer n ASP 13 Ca -0.03 -1.91 -0.04 0.00 0.71 0.00 0.00 54.79 53.52 2jer n ASP 13 Cb 0.17 -0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 2jer n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jer n GLY 14 N 1.38 0.55 3.81 0.44 0.00 -0.63 -5.02 105.19 105.71 2jer n GLY 14 Ca 0.18 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 2jer n GLY 14 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jer s PHE 15 N -2.16 3.29 0.03 1.61 0.40 -0.09 -4.34 117.98 116.73 2jer s PHE 15 Ca 0.00 0.16 0.01 0.00 -0.60 0.00 0.00 56.93 56.50 2jer s PHE 15 Cb 0.00 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.82 2jer s PHE 15 CO 0.00 0.55 -0.06 -0.98 0.70 0.00 0.00 175.22 175.43 2jer s ARG 16 N -2.20 0.43 -0.24 0.44 1.70 0.03 -3.78 118.95 115.33 2jer s ARG 16 Ca 0.28 -0.70 -0.29 0.00 -0.47 0.00 0.00 55.73 54.56 2jer s ARG 16 Cb -0.12 -0.11 0.00 0.00 -0.57 0.00 0.00 34.95 34.15 2jer s ARG 16 CO 0.21 0.01 1.19 1.41 -1.08 0.00 0.00 175.30 177.03 2jer s MET 17 N -1.54 4.13 0.69 3.89 -2.45 -0.71 -1.00 119.30 122.31 2jer s MET 17 Ca -0.12 1.39 -0.11 0.00 -1.25 0.00 0.00 55.69 55.59 2jer s MET 17 Cb -0.10 -3.76 0.00 0.00 1.25 0.00 0.00 34.83 32.22 2jer s MET 17 CO -0.00 -0.83 1.06 -1.25 1.05 0.00 0.00 175.02 175.05 2jer s PRO 18 N 3.63 2.97 0.70 4.11 0.04 -1.26 -4.11 135.00 141.08 2jer s PRO 18 Ca 0.51 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 2jer s PRO 18 Cb -0.17 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.40 2jer s PRO 18 CO 0.15 -1.07 1.21 0.20 0.04 0.00 0.00 177.00 177.53 2jer s GLY 19 N -3.75 2.42 0.48 0.56 0.00 -1.26 -4.72 107.32 101.05 2jer s GLY 19 Ca 0.58 0.91 0.32 0.00 0.00 0.00 0.00 44.72 46.53 2jer s GLY 19 CO 0.54 1.31 1.96 -2.09 0.00 0.00 0.00 173.10 174.82 2jer h GLU 20 N -0.08 0.00 -0.01 2.90 4.81 -1.90 -1.25 114.58 119.06 2jer h GLU 20 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jer h GLU 20 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2jer h GLU 20 CO 0.51 0.00 -0.03 1.97 -0.73 0.00 0.00 179.01 180.73 2jer n PHE 21 N -2.77 0.00 -2.28 0.92 1.16 -1.26 -4.56 117.46 108.67 2jer n PHE 21 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.28 2jer n PHE 21 Cb 0.20 -0.04 0.00 0.00 -1.61 0.00 0.00 39.48 38.03 2jer n PHE 21 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2jer s GLU 22 N -2.11 3.61 0.35 3.97 2.02 -0.47 -4.88 118.70 121.18 2jer s GLU 22 Ca 0.39 0.51 -0.28 0.00 0.02 0.00 0.00 54.97 55.62 2jer s GLU 22 Cb 0.21 -2.23 -0.12 0.00 0.10 0.00 0.00 34.13 32.09 2jer s GLU 22 CO 0.38 -0.37 1.25 -2.30 0.02 0.00 0.00 175.26 174.24 2jer n PRO 23 N -2.39 2.00 -5.21 0.39 -0.02 -1.26 -4.69 135.00 123.82 2jer n PRO 23 Ca 0.04 0.70 -0.31 0.00 -2.02 0.00 0.00 63.50 61.90 2jer n PRO 23 Cb 0.54 -2.27 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 2jer n PRO 23 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2jer s GLN 24 N -1.88 2.28 -0.03 -0.52 -0.21 -1.26 -1.03 119.66 117.01 2jer s GLN 24 Ca 0.56 -0.87 -0.17 0.00 0.02 0.00 0.00 55.36 54.90 2jer s GLN 24 Cb -0.58 -2.14 -0.32 0.00 1.00 0.00 0.00 33.01 30.97 2jer s GLN 24 CO 0.61 0.54 0.85 1.49 -2.12 0.00 0.00 175.29 176.66 2jer h GLU 25 N 5.57 0.40 -3.36 2.91 4.57 -0.67 -3.42 114.58 120.58 2jer h GLU 25 Ca -0.42 -0.69 -0.04 0.00 -1.18 0.00 0.00 59.36 57.04 2jer h GLU 25 Cb 1.14 0.26 -0.12 0.00 -0.16 0.00 0.00 28.75 29.86 2jer h GLU 25 CO 0.48 1.33 -0.03 0.15 -1.18 0.00 0.00 179.01 179.76 2jer s LYS 26 N -2.52 1.19 0.06 1.92 1.02 -1.12 -4.18 119.74 116.12 2jer s LYS 26 Ca -0.13 -0.76 0.07 0.00 0.02 0.00 0.00 55.97 55.16 2jer s LYS 26 Cb 0.03 0.49 -0.03 0.00 -0.52 0.00 0.00 37.83 37.81 2jer s LYS 26 CO 0.87 -0.48 -0.18 0.08 -0.92 0.00 0.00 175.35 174.71 2jer s VAL 27 N -3.83 1.46 0.17 3.17 1.01 -0.32 -0.43 120.40 121.62 2jer s VAL 27 Ca 0.06 -1.27 0.10 0.00 0.00 0.00 0.00 61.98 60.87 2jer s VAL 27 Cb 0.01 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2jer s VAL 27 CO -0.08 0.01 -0.19 0.26 0.00 0.00 0.00 175.10 175.09 2jer s TRP 28 N -0.99 2.44 -0.07 5.22 0.52 -0.04 -0.88 118.94 125.13 2jer s TRP 28 Ca 0.04 -0.31 -0.23 0.00 0.02 0.00 0.00 56.10 55.63 2jer s TRP 28 Cb -0.09 -1.24 0.05 0.00 -1.15 0.00 0.00 33.47 31.05 2jer s TRP 28 CO 0.02 0.46 0.53 1.41 0.02 0.00 0.00 176.95 179.39 2jer s MET 29 N -2.52 0.84 -0.07 4.98 1.75 -0.52 -1.65 119.30 122.11 2jer s MET 29 Ca 0.20 0.22 -0.03 0.00 -1.25 0.00 0.00 55.69 54.83 2jer s MET 29 Cb -0.09 0.39 -0.04 0.00 2.84 0.00 0.00 34.83 37.94 2jer s MET 29 CO 0.11 -0.23 0.08 0.42 -0.65 0.00 0.00 175.02 174.75 2jer s ILE 30 N -0.91 4.88 -0.02 10.11 1.01 -1.26 -0.80 121.20 134.21 2jer s ILE 30 Ca -0.09 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.12 2jer s ILE 30 Cb -0.03 -3.15 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 2jer s ILE 30 CO 0.06 0.52 0.95 0.86 0.00 0.00 0.00 174.94 177.33 2jer s TRP 31 N -1.05 3.63 0.29 3.97 -0.11 0.19 -4.80 118.94 121.06 2jer s TRP 31 Ca 0.17 1.63 -0.14 0.00 1.22 0.00 0.00 56.10 58.99 2jer s TRP 31 Cb -0.12 -3.09 -0.09 0.00 -1.50 0.00 0.00 33.47 28.68 2jer s TRP 31 CO 0.07 -0.02 0.69 -1.25 -4.62 0.00 0.00 176.95 171.82 2jer s PRO 32 N 1.09 3.97 0.00 5.86 0.04 -1.26 -4.76 135.00 139.94 2jer s PRO 32 Ca 0.50 0.59 0.00 0.00 0.04 0.00 0.00 61.00 62.13 2jer s PRO 32 Cb -0.20 -2.51 0.00 0.00 0.04 0.00 0.00 34.50 31.83 2jer s PRO 32 CO 0.26 0.21 0.00 -0.85 0.04 0.00 0.00 177.00 176.66 2jer n GLU 33 N -0.24 0.00 -1.88 4.56 0.28 -1.26 -4.75 120.64 117.35 2jer n GLU 33 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.60 2jer n GLU 33 Cb 0.53 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 33.37 2jer n GLU 33 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 2jer s ARG 34 N -0.26 4.19 0.00 3.44 1.70 -1.26 -4.16 118.95 122.60 2jer s ARG 34 Ca 0.00 2.40 0.27 0.00 -0.47 0.00 0.00 55.73 57.94 2jer s ARG 34 Cb 0.00 -3.42 1.26 0.00 -0.57 0.00 0.00 34.95 32.22 2jer s ARG 34 CO 0.00 -0.71 1.91 -0.35 -1.08 0.00 0.00 175.30 175.06 2jer n PRO 35 N 4.99 0.15 -0.10 3.89 -0.04 -1.26 -1.00 135.00 141.62 2jer n PRO 35 Ca 0.16 0.03 0.09 0.00 -0.04 0.00 0.00 63.50 63.73 2jer n PRO 35 Cb 0.39 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.67 2jer n PRO 35 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2jer n ASP 36 N -1.42 1.67 0.00 3.54 5.75 -1.26 -0.55 116.55 124.28 2jer n ASP 36 Ca 0.09 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 2jer n ASP 36 Cb 0.28 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 2jer n ASP 36 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2jer n ASN 37 N 0.34 0.05 -4.65 -1.12 4.05 -0.94 -4.73 115.26 108.26 2jer n ASN 37 Ca 0.15 0.01 -0.38 0.00 0.45 0.00 0.00 54.58 54.81 2jer n ASN 37 Cb 0.31 -0.01 -0.09 0.00 1.23 0.00 0.00 39.78 41.22 2jer n ASN 37 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2jer s TRP 38 N -2.00 3.32 0.74 1.20 0.52 -0.17 -4.75 118.94 117.79 2jer s TRP 38 Ca 0.00 0.41 -0.15 0.00 0.02 0.00 0.00 56.10 56.38 2jer s TRP 38 Cb 0.00 -2.43 0.04 0.00 -1.15 0.00 0.00 33.47 29.93 2jer s TRP 38 CO 0.00 -0.03 1.19 -0.98 0.02 0.00 0.00 176.95 177.15 2jer s ARG 39 N 1.38 2.13 -1.47 4.98 1.70 -1.26 -3.39 118.95 123.01 2jer s ARG 39 Ca 0.13 1.70 -0.11 0.00 -0.47 0.00 0.00 55.73 56.99 2jer s ARG 39 Cb -0.15 -1.84 0.05 0.00 -0.57 0.00 0.00 34.95 32.45 2jer s ARG 39 CO 0.07 -1.83 0.95 -0.25 -1.08 0.00 0.00 175.30 173.16 2jer n ASP 40 N -2.81 -5.35 -2.09 -2.89 8.00 -0.62 -1.54 116.55 109.26 2jer n ASP 40 Ca 0.13 -0.61 -0.20 0.00 0.71 0.00 0.00 54.79 54.81 2jer n ASP 40 Cb 0.51 -4.27 -0.04 0.00 -0.02 0.00 0.00 41.12 37.30 2jer n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jer n GLY 41 N -1.72 0.45 2.34 0.44 0.00 -1.22 -1.77 105.19 103.71 2jer n GLY 41 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2jer n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 42 N -0.76 0.87 0.07 -0.02 0.00 -0.59 -4.81 105.19 99.95 2jer n GLY 42 Ca -0.23 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 2jer n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jer h LYS 43 N 3.15 0.07 -0.59 1.61 1.79 -1.46 0.13 116.57 121.27 2jer h LYS 43 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jer h LYS 43 Cb 0.00 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.61 2jer h LYS 43 CO 0.00 0.04 0.37 -1.35 -1.08 0.00 0.00 179.45 177.44 2jer h PRO 44 N 0.07 0.79 -0.05 3.15 0.11 -1.82 -2.75 132.00 131.49 2jer h PRO 44 Ca 0.04 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 2jer h PRO 44 Cb 0.02 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 2jer h PRO 44 CO -0.04 0.55 -0.46 -0.24 -0.21 0.00 0.00 178.00 177.60 2jer h VAL 45 N 0.80 1.33 -0.82 3.15 3.04 -1.79 -2.61 116.25 119.35 2jer h VAL 45 Ca 0.21 -1.61 -0.01 0.00 -1.01 0.00 0.00 66.70 64.29 2jer h VAL 45 Cb -0.05 1.80 -0.04 0.00 -2.01 0.00 0.00 31.29 30.99 2jer h VAL 45 CO -0.04 0.47 0.49 1.56 -1.01 0.00 0.00 177.57 179.03 2jer h GLN 46 N 0.10 1.12 -0.56 4.17 4.20 -0.50 0.73 115.11 124.37 2jer h GLN 46 Ca 0.01 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2jer h GLN 46 Cb 0.85 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 2jer h GLN 46 CO 0.06 0.79 0.27 1.49 -0.67 0.00 0.00 178.83 180.77 2jer h GLU 47 N 1.14 0.80 -0.20 1.46 4.81 -1.19 -0.64 114.58 120.76 2jer h GLU 47 Ca 0.29 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2jer h GLU 47 Cb -0.03 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 2jer h GLU 47 CO -0.05 0.66 0.11 0.00 -0.73 0.00 0.00 179.01 178.99 2jer h ALA 48 N 1.10 0.25 -0.82 2.92 0.00 -1.05 -1.17 119.26 120.50 2jer h ALA 48 Ca 0.19 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2jer h ALA 48 Cb 0.12 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2jer h ALA 48 CO -0.02 -0.22 0.44 0.74 0.00 0.00 0.00 179.25 180.19 2jer h PHE 49 N 0.22 1.14 -0.41 0.00 -1.00 -0.79 -0.70 116.94 115.40 2jer h PHE 49 Ca 0.07 -0.03 0.06 0.00 2.81 0.00 0.00 57.97 60.88 2jer h PHE 49 Cb 0.06 -0.36 -0.05 0.00 3.61 0.00 0.00 35.95 39.21 2jer h PHE 49 CO -0.04 0.80 0.09 1.15 -1.61 0.00 0.00 178.31 178.70 2jer h THR 50 N 1.15 0.80 -0.79 -1.55 2.02 -0.87 0.11 112.91 113.78 2jer h THR 50 Ca 0.29 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.37 2jer h THR 50 Cb 0.05 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 2jer h THR 50 CO -0.04 0.04 0.40 0.78 0.37 0.00 0.00 175.52 177.06 2jer h ASN 51 N 0.22 1.00 -0.04 4.18 2.35 -0.74 0.74 115.58 123.29 2jer h ASN 51 Ca 0.20 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2jer h ASN 51 Cb 0.23 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 2jer h ASN 51 CO -0.25 0.83 0.01 0.58 -1.65 0.00 0.00 177.43 176.95 2jer h VAL 52 N 1.11 1.20 -0.54 2.81 2.07 -0.79 -1.17 116.25 120.95 2jer h VAL 52 Ca 0.27 -0.61 0.05 0.00 0.82 0.00 0.00 66.70 67.24 2jer h VAL 52 Cb 0.08 1.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2jer h VAL 52 CO -0.04 0.17 0.27 0.00 0.02 0.00 0.00 177.57 177.99 2jer h ALA 53 N 0.77 0.69 -0.75 1.67 0.00 -0.47 -1.09 119.26 120.09 2jer h ALA 53 Ca 0.01 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2jer h ALA 53 Cb 0.26 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2jer h ALA 53 CO 0.00 -0.08 0.46 0.87 0.00 0.00 0.00 179.25 180.50 2jer h LYS 54 N 0.52 0.86 -0.61 0.00 1.57 -0.77 -1.29 116.57 116.86 2jer h LYS 54 Ca 0.24 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.90 2jer h LYS 54 Cb 0.16 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 2jer h LYS 54 CO -0.17 0.57 0.11 0.00 -0.57 0.00 0.00 179.45 179.39 2jer h ALA 55 N 1.33 0.80 -0.52 3.86 0.00 -0.59 -2.84 119.26 121.31 2jer h ALA 55 Ca 0.31 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2jer h ALA 55 Cb 0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2jer h ALA 55 CO -0.13 0.55 0.08 0.82 0.00 0.00 0.00 179.25 180.57 2jer h ILE 56 N 0.90 1.25 -0.07 0.00 2.04 -0.96 -3.03 117.51 117.64 2jer h ILE 56 Ca 0.19 -0.95 0.02 0.00 1.00 0.00 0.00 64.86 65.12 2jer h ILE 56 Cb 0.41 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2jer h ILE 56 CO 0.01 0.34 0.14 0.77 0.00 0.00 0.00 178.15 179.40 2jer h SER 57 N 0.74 0.00 0.38 1.72 4.64 -0.99 0.76 113.55 120.79 2jer h SER 57 Ca 0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 2jer h SER 57 Cb 0.41 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2jer h SER 57 CO 0.01 0.00 -0.09 -0.61 -0.87 0.00 0.00 176.83 175.27 2jer h GLN 58 N 0.00 0.00 0.00 4.77 4.15 -1.50 -3.31 115.11 119.22 2jer h GLN 58 Ca 0.03 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.30 2jer h GLN 58 Cb 0.31 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.97 2jer h GLN 58 CO -0.00 0.09 -1.58 1.19 -1.93 0.00 0.00 178.83 176.61 2jer n PHE 59 N -3.54 0.00 -3.70 3.99 3.72 0.14 -5.07 117.46 113.00 2jer n PHE 59 Ca -0.02 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.27 2jer n PHE 59 Cb 0.22 -0.41 -0.10 0.00 -0.94 0.00 0.00 39.48 38.26 2jer n PHE 59 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2jer s THR 60 N -2.20 -0.01 0.22 4.37 2.01 -0.48 -4.73 115.64 114.82 2jer s THR 60 Ca -0.06 0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.66 2jer s THR 60 Cb 0.03 -0.69 -0.14 0.00 0.01 0.00 0.00 72.50 71.71 2jer s THR 60 CO 0.32 0.02 1.28 -2.65 -0.69 0.00 0.00 174.62 172.90 2jer n PRO 61 N 3.57 1.67 -4.60 4.92 -0.02 -1.26 -3.75 135.00 135.53 2jer n PRO 61 Ca -0.18 0.59 -0.30 0.00 -2.02 0.00 0.00 63.50 61.60 2jer n PRO 61 Cb 0.56 -2.17 -0.13 0.00 -0.02 0.00 0.00 33.50 31.74 2jer n PRO 61 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jer s MET 62 N -0.54 1.68 -0.03 -0.52 1.75 -1.26 -1.17 119.30 119.20 2jer s MET 62 Ca 0.69 -1.20 -0.01 0.00 -1.25 0.00 0.00 55.69 53.92 2jer s MET 62 Cb -0.72 -1.99 0.02 0.00 2.84 0.00 0.00 34.83 34.98 2jer s MET 62 CO 0.52 0.49 0.06 -0.80 -0.65 0.00 0.00 175.02 174.63 2jer s ASN 63 N -1.70 -0.01 -0.05 1.11 0.01 -0.06 -2.12 114.94 112.12 2jer s ASN 63 Ca 0.14 0.11 0.04 0.00 -0.71 0.00 0.00 52.86 52.44 2jer s ASN 63 Cb -0.10 0.05 -0.00 0.00 0.41 0.00 0.00 41.25 41.60 2jer s ASN 63 CO 0.05 -0.08 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.70 2jer s VAL 64 N 0.62 1.43 0.06 1.60 1.01 -0.09 -1.43 120.40 123.61 2jer s VAL 64 Ca -0.05 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.28 2jer s VAL 64 Cb -0.07 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2jer s VAL 64 CO -0.02 0.41 -0.10 0.68 0.00 0.00 0.00 175.10 176.07 2jer s VAL 65 N 0.07 3.38 -0.07 2.92 -7.23 0.02 -1.25 120.40 118.24 2jer s VAL 65 Ca -0.05 -1.10 -0.21 0.00 -1.81 0.00 0.00 61.98 58.81 2jer s VAL 65 Cb -0.12 -2.53 0.05 0.00 0.56 0.00 0.00 36.38 34.34 2jer s VAL 65 CO 0.02 0.23 0.49 0.54 -0.31 0.00 0.00 175.10 176.08 2jer s VAL 66 N -1.11 0.02 0.97 1.32 0.11 0.02 -0.64 120.40 121.10 2jer s VAL 66 Ca 0.19 -0.19 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 2jer s VAL 66 Cb -0.11 -0.78 0.15 0.00 -1.53 0.00 0.00 36.38 34.11 2jer s VAL 66 CO 0.11 -0.10 0.96 -1.54 -3.33 0.00 0.00 175.10 171.19 2jer n SER 67 N 1.53 -0.49 -0.21 3.54 3.41 -1.22 -0.38 113.62 119.80 2jer n SER 67 Ca -0.19 0.30 -0.04 0.00 -0.26 0.00 0.00 58.87 58.69 2jer n SER 67 Cb 0.56 -1.38 0.03 0.00 -0.26 0.00 0.00 64.21 63.16 2jer n SER 67 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2jer h GLN 68 N -1.96 -0.11 -0.49 4.33 4.15 -1.97 -1.32 115.11 117.74 2jer h GLN 68 Ca -0.46 0.01 -0.11 0.00 0.77 0.00 0.00 58.65 58.85 2jer h GLN 68 Cb 1.28 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.98 2jer h GLN 68 CO 0.41 -0.07 -0.15 0.37 -1.93 0.00 0.00 178.83 177.46 2jer h GLN 69 N -0.12 0.93 -0.01 1.69 -0.00 -2.01 -3.10 115.11 112.50 2jer h GLN 69 Ca 0.26 -0.35 0.00 0.00 -0.00 0.00 0.00 58.65 58.56 2jer h GLN 69 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 27.48 27.96 2jer h GLN 69 CO -0.68 1.01 -0.21 1.04 0.00 0.00 0.00 178.83 179.99 2jer n GLN 70 N -4.14 0.97 -0.06 1.69 1.13 -1.08 -4.46 117.38 111.43 2jer n GLN 70 Ca 0.01 -0.56 -0.08 0.00 -1.94 0.00 0.00 57.00 54.43 2jer n GLN 70 Cb 0.41 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.26 2jer n GLN 70 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 2jer h PHE 71 N 1.36 -0.71 -0.47 1.08 3.04 -1.16 0.21 116.94 120.29 2jer h PHE 71 Ca 0.00 0.04 -0.04 0.00 3.98 0.00 0.00 57.97 61.95 2jer h PHE 71 Cb 0.50 0.35 -0.02 0.00 2.56 0.00 0.00 35.95 39.34 2jer h PHE 71 CO 0.00 -0.34 0.13 1.96 -2.02 0.00 0.00 178.31 178.05 2jer h GLN 72 N -0.25 0.74 -0.23 1.11 4.20 -1.81 -0.47 115.11 118.39 2jer h GLN 72 Ca 0.15 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2jer h GLN 72 Cb 0.48 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2jer h GLN 72 CO -0.42 0.71 0.12 -0.97 -0.67 0.00 0.00 178.83 177.60 2jer h ASN 73 N 0.63 0.29 -0.41 1.46 -1.24 -1.74 -1.81 115.58 112.76 2jer h ASN 73 Ca 0.15 -0.10 0.05 0.00 0.71 0.00 0.00 56.30 57.12 2jer h ASN 73 Cb 0.29 -0.07 -0.05 0.00 0.73 0.00 0.00 38.32 39.22 2jer h ASN 73 CO -0.00 0.30 0.12 0.00 -1.29 0.00 0.00 177.43 176.57 2jer h ARG 75 N 0.28 0.73 -0.39 0.00 9.65 -0.97 -1.70 114.38 121.98 2jer h ARG 75 Ca 0.19 -0.12 -0.15 0.00 -1.10 0.00 0.00 59.98 58.81 2jer h ARG 75 Cb 0.20 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 2jer h ARG 75 CO -0.21 0.62 -0.33 -0.09 2.80 0.00 0.00 179.97 182.76 2jer h ARG 76 N 0.72 0.91 -0.18 0.20 9.65 -0.40 -3.26 114.38 122.02 2jer h ARG 76 Ca 0.17 -0.46 -0.15 0.00 -1.10 0.00 0.00 59.98 58.44 2jer h ARG 76 Cb 0.19 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 2jer h ARG 76 CO -0.01 1.11 -0.50 1.96 2.80 0.00 0.00 179.97 185.33 2jer h GLN 77 N 0.73 0.50 -6.30 0.20 1.08 -0.53 -3.44 115.11 107.33 2jer h GLN 77 Ca 0.07 -0.29 -0.56 0.00 -1.45 0.00 0.00 58.65 56.42 2jer h GLN 77 Cb 0.91 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.33 2jer h GLN 77 CO 0.08 0.88 0.04 -0.51 -0.95 0.00 0.00 178.83 178.38 2jer s LEU 78 N -8.34 4.53 0.75 1.46 1.43 -0.69 -5.06 118.68 112.76 2jer s LEU 78 Ca -0.07 1.37 -0.15 0.00 -1.03 0.00 0.00 54.13 54.26 2jer s LEU 78 Cb 0.12 -3.03 0.05 0.00 0.03 0.00 0.00 46.19 43.35 2jer s LEU 78 CO 0.83 0.22 1.23 -2.16 0.23 0.00 0.00 176.35 176.70 2jer s PRO 79 N -0.95 1.99 0.55 1.29 0.04 -1.26 -4.90 135.00 131.77 2jer s PRO 79 Ca 0.32 1.85 0.31 0.00 0.04 0.00 0.00 61.00 63.51 2jer s PRO 79 Cb -0.20 -1.81 1.59 0.00 0.04 0.00 0.00 34.50 34.12 2jer s PRO 79 CO 0.21 -1.97 2.11 -1.00 0.04 0.00 0.00 177.00 176.39 2jer h PRO 80 N -0.37 0.00 0.00 0.56 0.13 -1.97 -1.52 132.00 128.83 2jer h PRO 80 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2jer h PRO 80 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2jer h PRO 80 CO 0.49 0.08 0.00 -0.85 -0.23 0.00 0.00 178.00 177.49 2jer n GLU 81 N -3.49 0.15 -3.31 0.86 0.00 -1.26 -4.47 120.64 109.10 2jer n GLU 81 Ca -0.02 0.47 -0.39 0.00 0.00 0.00 0.00 57.16 57.22 2jer n GLU 81 Cb 0.22 -1.83 -0.08 0.00 0.00 0.00 0.00 31.44 29.75 2jer n GLU 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2jer s ILE 82 N -3.33 5.13 0.23 3.84 1.01 -0.57 -4.59 121.20 122.93 2jer s ILE 82 Ca 0.02 0.77 -0.29 0.00 0.00 0.00 0.00 60.65 61.15 2jer s ILE 82 Cb 0.08 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 2jer s ILE 82 CO 0.30 0.16 0.92 -0.89 0.00 0.00 0.00 174.94 175.43 2jer s THR 83 N 1.89 4.11 -0.11 2.92 2.01 -0.90 -4.87 115.64 120.69 2jer s THR 83 Ca 0.19 2.04 0.03 0.00 0.31 0.00 0.00 61.69 64.26 2jer s THR 83 Cb -0.15 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.06 2jer s THR 83 CO 0.09 0.50 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.64 2jer s VAL 84 N -1.18 1.73 0.05 3.82 1.01 -1.26 -0.91 120.40 123.66 2jer s VAL 84 Ca 0.41 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.66 2jer s VAL 84 Cb -0.26 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 2jer s VAL 84 CO 0.31 0.49 -0.21 -0.31 0.00 0.00 0.00 175.10 175.38 2jer s TYR 85 N 0.70 2.48 0.19 5.22 1.51 -0.38 -5.00 117.35 122.07 2jer s TYR 85 Ca -0.12 -0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 55.34 2jer s TYR 85 Cb -0.16 -1.43 -0.08 0.00 -0.11 0.00 0.00 41.96 40.18 2jer s TYR 85 CO 0.02 0.22 1.11 -2.00 -1.11 0.00 0.00 175.55 173.80 2jer s GLU 86 N -1.41 4.59 -0.30 -0.62 2.12 -1.26 -0.80 118.70 121.03 2jer s GLU 86 Ca 0.14 1.74 -0.13 0.00 0.36 0.00 0.00 54.97 57.09 2jer s GLU 86 Cb -0.10 -3.26 0.13 0.00 0.26 0.00 0.00 34.13 31.15 2jer s GLU 86 CO 0.04 0.07 0.75 1.41 -0.54 0.00 0.00 175.26 176.99 2jer s MET 87 N -0.46 0.54 0.62 4.30 1.75 0.48 -4.74 119.30 121.79 2jer s MET 87 Ca 0.49 1.22 -0.18 0.00 -1.25 0.00 0.00 55.69 55.97 2jer s MET 87 Cb -0.30 0.59 -0.02 0.00 2.84 0.00 0.00 34.83 37.94 2jer s MET 87 CO 0.36 -0.16 1.21 -1.12 -0.65 0.00 0.00 175.02 174.65 2jer s SER 88 N 2.45 4.97 0.09 1.11 0.01 -1.26 -3.42 113.70 117.66 2jer s SER 88 Ca -0.06 2.37 -0.26 0.00 1.31 0.00 0.00 55.95 59.31 2jer s SER 88 Cb -0.09 -2.60 0.08 0.00 0.21 0.00 0.00 66.02 63.63 2jer s SER 88 CO -0.19 -1.74 0.79 0.54 0.41 0.00 0.00 173.24 173.06 2jer s ASN 89 N -1.72 -0.39 -0.23 2.44 2.20 -1.26 -4.60 114.94 111.38 2jer s ASN 89 Ca 0.77 -0.11 0.07 0.00 -0.94 0.00 0.00 52.86 52.65 2jer s ASN 89 Cb -0.30 0.50 -0.19 0.00 -2.00 0.00 0.00 41.25 39.26 2jer s ASN 89 CO 0.36 -0.83 -0.12 0.59 -2.94 0.00 0.00 177.10 174.16 2jer n ASN 90 N -0.34 1.45 -2.61 3.54 3.02 -1.26 -4.78 115.26 114.27 2jer n ASN 90 Ca -0.11 -0.08 -0.11 0.00 -0.03 0.00 0.00 54.58 54.25 2jer n ASN 90 Cb 0.62 0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.87 2jer n ASN 90 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2jer n ASP 91 N -3.04 -1.22 -2.86 6.41 2.03 -1.26 -4.83 116.55 111.79 2jer n ASP 91 Ca -0.39 -2.52 -0.33 0.00 0.52 0.00 0.00 54.79 52.07 2jer n ASP 91 Cb 1.02 2.22 0.01 0.00 -0.72 0.00 0.00 41.12 43.65 2jer n ASP 91 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jer n ALA 92 N -1.10 5.58 -3.55 -1.67 0.00 -1.26 -4.86 120.51 113.65 2jer n ALA 92 Ca -0.11 -4.38 -0.27 0.00 0.00 0.00 0.00 53.44 48.68 2jer n ALA 92 Cb 0.48 -1.25 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 2jer n ALA 92 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2jer n TRP 93 N -0.40 2.92 0.60 0.00 7.02 -1.26 -4.59 117.44 121.73 2jer n TRP 93 Ca 0.43 -4.11 0.12 0.00 -1.02 0.00 0.00 57.50 52.92 2jer n TRP 93 Cb 0.43 -0.52 0.46 0.00 -2.42 0.00 0.00 31.31 29.25 2jer n TRP 93 CO 0.00 0.00 0.00 1.55 -2.02 0.00 0.00 177.69 177.22 2jer n VAL 94 N 1.36 0.64 0.06 -0.99 3.14 -1.26 -1.39 118.33 119.89 2jer n VAL 94 Ca 0.26 0.04 0.03 0.00 -2.96 0.00 0.00 64.34 61.70 2jer n VAL 94 Cb 0.41 -0.84 0.39 0.00 -1.06 0.00 0.00 33.84 32.74 2jer n VAL 94 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 2jer h ARG 95 N 0.00 0.39 0.00 1.45 9.65 -1.73 -0.03 114.38 124.11 2jer h ARG 95 Ca 0.00 -0.06 -0.37 0.00 -1.10 0.00 0.00 59.98 58.45 2jer h ARG 95 Cb 0.48 -0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.92 2jer h ARG 95 CO 0.00 0.39 -2.36 -0.25 2.80 0.00 0.00 179.97 180.56 2jer n ASP 96 N -4.36 0.73 -0.30 -3.80 8.00 -0.48 -2.57 116.55 113.77 2jer n ASP 96 Ca 0.01 -0.01 0.08 0.00 0.71 0.00 0.00 54.79 55.59 2jer n ASP 96 Cb 0.19 0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.70 2jer n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jer s GLY 98 N -2.15 1.59 0.46 0.00 0.00 -0.03 -3.53 107.32 103.66 2jer s GLY 98 Ca 0.12 -0.72 -0.20 0.00 0.00 0.00 0.00 44.72 43.92 2jer s GLY 98 CO 0.50 0.02 0.99 2.56 0.00 0.00 0.00 173.10 177.17 2jer s PRO 99 N -5.29 4.01 -0.37 2.90 0.04 -1.26 -4.78 135.00 130.25 2jer s PRO 99 Ca 0.68 1.20 -0.14 0.00 0.04 0.00 0.00 61.00 62.79 2jer s PRO 99 Cb -0.13 -2.14 -0.00 0.00 0.04 0.00 0.00 34.50 32.27 2jer s PRO 99 CO 0.56 -0.23 0.26 -1.12 0.04 0.00 0.00 177.00 176.51 2jer s SER 100 N -2.19 6.07 0.30 6.66 0.01 -0.33 -4.89 113.70 119.33 2jer s SER 100 Ca 0.64 -0.61 -0.27 0.00 1.31 0.00 0.00 55.95 57.02 2jer s SER 100 Cb -0.12 -2.14 -0.10 0.00 0.21 0.00 0.00 66.02 63.87 2jer s SER 100 CO 0.18 -0.32 0.94 -0.36 0.41 0.00 0.00 173.24 174.08 2jer s PHE 101 N 1.70 3.76 0.07 2.43 0.40 -1.26 -0.40 117.98 124.68 2jer s PHE 101 Ca 0.06 1.80 0.06 0.00 -0.60 0.00 0.00 56.93 58.24 2jer s PHE 101 Cb -0.18 -2.93 -0.03 0.00 0.51 0.00 0.00 43.02 40.40 2jer s PHE 101 CO 0.10 0.27 -0.15 0.14 0.70 0.00 0.00 175.22 176.28 2jer s VAL 102 N -1.51 1.23 0.15 -0.44 -7.23 0.52 -4.39 120.40 108.72 2jer s VAL 102 Ca 0.48 -1.26 0.06 0.00 -1.81 0.00 0.00 61.98 59.45 2jer s VAL 102 Cb -0.20 -1.14 -0.04 0.00 0.56 0.00 0.00 36.38 35.55 2jer s VAL 102 CO 0.26 -0.13 -0.14 0.27 -0.31 0.00 0.00 175.10 175.05 2jer s ILE 103 N -1.13 1.42 0.14 -0.62 -4.36 -0.17 -0.52 121.20 115.96 2jer s ILE 103 Ca 0.01 -1.89 0.01 0.00 -0.26 0.00 0.00 60.65 58.51 2jer s ILE 103 Cb -0.09 -1.72 0.01 0.00 1.25 0.00 0.00 42.46 41.91 2jer s ILE 103 CO 0.02 -0.50 0.09 -0.46 0.24 0.00 0.00 174.94 174.33 2jer n ASN 104 N 0.20 1.55 -1.85 4.36 6.94 -1.01 -0.79 115.26 124.65 2jer n ASN 104 Ca -0.13 -1.48 -0.09 0.00 -0.02 0.00 0.00 54.58 52.86 2jer n ASN 104 Cb 0.58 0.00 0.23 0.00 -2.36 0.00 0.00 39.78 38.23 2jer n ASN 104 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2jer n ASP 105 N -1.85 4.16 -0.11 0.53 5.68 -1.26 -4.15 116.55 119.55 2jer n ASP 105 Ca -0.01 -3.08 0.07 0.00 -0.50 0.00 0.00 54.79 51.27 2jer n ASP 105 Cb 0.16 -0.73 0.10 0.00 -1.14 0.00 0.00 41.12 39.51 2jer n ASP 105 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2jer n HIS 106 N -0.27 0.00 -0.96 2.11 8.25 -1.23 -4.47 115.22 118.66 2jer n HIS 106 Ca 0.38 -0.78 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 2jer n HIS 106 Cb 1.28 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 32.27 2jer n HIS 106 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jer n GLY 107 N -1.09 0.44 3.84 -1.41 0.00 -0.21 -3.84 105.19 102.91 2jer n GLY 107 Ca 0.11 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2jer n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jer s GLU 108 N -1.43 2.95 -0.04 1.61 2.02 -1.26 -4.65 118.70 117.89 2jer s GLU 108 Ca 0.00 -1.06 -0.03 0.00 0.02 0.00 0.00 54.97 53.90 2jer s GLU 108 Cb 0.00 -2.59 0.01 0.00 0.10 0.00 0.00 34.13 31.66 2jer s GLU 108 CO 0.00 0.36 0.11 -1.50 0.02 0.00 0.00 175.26 174.24 2jer s ILE 109 N -2.14 -0.01 0.20 -1.63 2.07 -1.26 -2.41 121.20 116.01 2jer s ILE 109 Ca 0.34 0.03 0.03 0.00 -1.41 0.00 0.00 60.65 59.65 2jer s ILE 109 Cb -0.08 -0.16 -0.05 0.00 0.13 0.00 0.00 42.46 42.30 2jer s ILE 109 CO 0.26 0.01 -0.02 -0.13 -1.91 0.00 0.00 174.94 173.15 2jer s ARG 110 N 0.24 1.21 0.03 3.50 0.52 0.33 -4.44 118.95 120.34 2jer s ARG 110 Ca -0.02 -1.59 0.04 0.00 -0.52 0.00 0.00 55.73 53.65 2jer s ARG 110 Cb -0.03 -0.51 -0.04 0.00 0.52 0.00 0.00 34.95 34.90 2jer s ARG 110 CO -0.01 -0.07 -0.07 0.20 0.02 0.00 0.00 175.30 175.37 2jer s GLY 111 N -3.24 1.77 -0.25 -3.53 0.00 -0.18 -0.36 107.32 101.54 2jer s GLY 111 Ca 0.25 -1.08 -0.09 0.00 0.00 0.00 0.00 44.72 43.80 2jer s GLY 111 CO 0.06 -0.98 0.12 0.14 0.00 0.00 0.00 173.10 172.44 2jer s VAL 112 N -1.07 4.83 -0.51 1.40 1.01 0.46 -0.54 120.40 125.98 2jer s VAL 112 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 2jer s VAL 112 Cb -0.11 -3.27 0.13 0.00 0.00 0.00 0.00 36.38 33.13 2jer s VAL 112 CO 0.10 0.32 0.39 -0.62 0.00 0.00 0.00 175.10 175.28 2jer s ASP 113 N 1.49 5.77 0.60 3.32 -1.08 0.19 -1.19 116.67 125.76 2jer s ASP 113 Ca 0.06 -2.01 -0.09 0.00 -0.52 0.00 0.00 52.55 49.99 2jer s ASP 113 Cb -0.15 -2.03 -0.02 0.00 -1.46 0.00 0.00 42.92 39.26 2jer s ASP 113 CO 0.06 -0.68 0.97 0.26 0.52 0.00 0.00 175.17 176.30 2jer s TRP 114 N 1.22 3.49 -0.01 -5.34 0.52 -1.26 -1.38 118.94 116.18 2jer s TRP 114 Ca 0.07 1.03 -0.30 0.00 0.02 0.00 0.00 56.10 56.92 2jer s TRP 114 Cb -0.25 -2.70 -0.04 0.00 -1.15 0.00 0.00 33.47 29.32 2jer s TRP 114 CO -0.01 -0.72 1.21 0.99 0.02 0.00 0.00 176.95 178.44 2jer s THR 115 N -3.09 4.16 -0.12 2.01 2.01 -0.55 -4.84 115.64 115.22 2jer s THR 115 Ca 0.54 1.52 -0.07 0.00 0.31 0.00 0.00 61.69 63.99 2jer s THR 115 Cb -0.11 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2jer s THR 115 CO 0.50 0.04 0.12 0.12 -0.69 0.00 0.00 174.62 174.71 2jer s PHE 116 N 1.82 3.53 -0.02 4.92 5.36 -1.26 -1.85 117.98 130.47 2jer s PHE 116 Ca 0.57 0.47 0.23 0.00 -0.96 0.00 0.00 56.93 57.24 2jer s PHE 116 Cb -0.27 -1.94 0.40 0.00 -0.34 0.00 0.00 43.02 40.87 2jer s PHE 116 CO 0.25 0.66 1.16 0.27 -1.46 0.00 0.00 175.22 176.10 2jer n ASN 117 N 2.14 1.01 -3.66 6.13 6.94 -1.26 -4.85 115.26 121.71 2jer n ASN 117 Ca -0.19 -2.19 -0.23 0.00 -0.02 0.00 0.00 54.58 51.94 2jer n ASN 117 Cb 0.55 -0.32 0.06 0.00 -2.36 0.00 0.00 39.78 37.71 2jer n ASN 117 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jer n ALA 118 N 0.30 -1.60 -3.42 -2.53 0.00 -1.26 0.06 120.51 112.06 2jer n ALA 118 Ca 0.07 0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.48 2jer n ALA 118 Cb 1.07 -3.90 0.09 0.00 0.00 0.00 0.00 19.45 16.71 2jer n ALA 118 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2jer n TRP 119 N -4.60 -2.20 0.00 0.00 8.01 -1.26 -1.10 117.44 116.29 2jer n TRP 119 Ca -0.11 0.93 0.00 0.00 -1.31 0.00 0.00 57.50 57.01 2jer n TRP 119 Cb 0.60 -5.03 0.00 0.00 -2.01 0.00 0.00 31.31 24.87 2jer n TRP 119 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2jer n GLY 120 N -1.13 0.30 7.00 6.99 0.00 -1.23 -3.62 105.19 113.50 2jer n GLY 120 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2jer n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 121 N 0.00 2.90 0.16 -0.02 0.00 0.11 -1.51 105.19 106.83 2jer n GLY 121 Ca 0.00 -0.23 0.15 0.00 0.00 0.00 0.00 46.02 45.94 2jer n GLY 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jer n LEU 122 N 0.00 0.53 -0.06 0.99 4.77 -1.26 -0.67 117.00 121.30 2jer n LEU 122 Ca 0.00 -0.12 -0.02 0.00 -0.03 0.00 0.00 56.01 55.84 2jer n LEU 122 Cb 0.00 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 2jer n LEU 122 CO 0.00 0.09 -0.03 0.58 -1.33 0.00 0.00 177.39 176.70 2jer h VAL 123 N 0.78 0.18 0.00 4.08 2.07 -1.61 -3.44 116.25 118.30 2jer h VAL 123 Ca 0.00 -1.15 -0.12 0.00 0.82 0.00 0.00 66.70 66.25 2jer h VAL 123 Cb 0.25 0.36 -0.21 0.00 -1.52 0.00 0.00 31.29 30.17 2jer h VAL 123 CO 0.00 0.06 -0.60 -0.90 0.02 0.00 0.00 177.57 176.15 2jer n ASP 124 N -4.73 0.08 -4.63 0.57 5.75 -0.68 -5.03 116.55 107.87 2jer n ASP 124 Ca -0.03 -1.89 -0.28 0.00 -0.01 0.00 0.00 54.79 52.58 2jer n ASP 124 Cb 0.10 -0.05 0.20 0.00 -1.03 0.00 0.00 41.12 40.33 2jer n ASP 124 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2jer s GLY 125 N -1.31 1.55 0.01 6.12 0.00 0.15 -4.58 107.32 109.27 2jer s GLY 125 Ca 0.14 -0.35 0.22 0.00 0.00 0.00 0.00 44.72 44.74 2jer s GLY 125 CO -0.07 0.30 0.94 1.04 0.00 0.00 0.00 173.10 175.32 2jer n LEU 126 N -4.38 0.67 -3.71 0.66 4.32 -0.26 -4.78 117.00 109.52 2jer n LEU 126 Ca 0.04 -0.20 -0.02 0.00 -0.02 0.00 0.00 56.01 55.81 2jer n LEU 126 Cb 0.57 -0.06 -0.01 0.00 -1.62 0.00 0.00 43.42 42.29 2jer n LEU 126 CO 0.58 0.13 0.83 -0.72 -1.22 0.00 0.00 177.39 176.98 2jer s TYR 127 N -3.14 -0.10 -0.12 -1.77 -0.85 -1.23 -1.11 117.35 109.02 2jer s TYR 127 Ca 0.05 -0.13 -0.06 0.00 -0.52 0.00 0.00 57.07 56.40 2jer s TYR 127 Cb 0.15 0.61 0.05 0.00 0.38 0.00 0.00 41.96 43.15 2jer s TYR 127 CO 0.83 -0.65 0.28 0.12 -1.52 0.00 0.00 175.55 174.62 2jer s PHE 128 N -3.01 -0.39 0.76 -3.49 5.36 -1.26 -4.72 117.98 111.24 2jer s PHE 128 Ca 0.13 0.89 -0.02 0.00 -0.96 0.00 0.00 56.93 56.97 2jer s PHE 128 Cb 0.01 0.10 0.15 0.00 -0.34 0.00 0.00 43.02 42.93 2jer s PHE 128 CO 0.00 -0.25 1.05 -1.25 -1.46 0.00 0.00 175.22 173.31 2jer s PRO 129 N 1.20 1.45 -0.05 10.12 0.04 -1.26 -4.99 135.00 141.52 2jer s PRO 129 Ca -0.09 -1.17 0.07 0.00 0.04 0.00 0.00 61.00 59.86 2jer s PRO 129 Cb -0.09 -2.28 0.12 0.00 0.04 0.00 0.00 34.50 32.28 2jer s PRO 129 CO -0.09 -1.64 1.06 -2.67 0.04 0.00 0.00 177.00 173.70 2jer n TRP 130 N -2.97 0.00 -0.12 0.56 2.14 -1.26 -4.87 117.44 110.92 2jer n TRP 130 Ca 0.16 -0.37 0.00 0.00 2.07 0.00 0.00 57.50 59.37 2jer n TRP 130 Cb 0.61 -0.09 0.27 0.00 -0.81 0.00 0.00 31.31 31.29 2jer n TRP 130 CO 0.00 0.00 0.00 0.38 2.07 0.00 0.00 177.69 180.14 2jer h ASP 131 N 0.05 0.72 0.01 -0.67 2.03 -1.99 -1.26 116.42 115.32 2jer h ASP 131 Ca -0.01 -0.07 -0.16 0.00 -0.73 0.00 0.00 57.03 56.06 2jer h ASP 131 Cb 1.28 -0.18 0.01 0.00 -0.83 0.00 0.00 39.33 39.61 2jer h ASP 131 CO 0.00 0.61 -0.64 1.56 -1.03 0.00 0.00 179.24 179.74 2jer h GLN 132 N 0.80 0.41 -0.91 4.15 1.08 -1.91 -3.10 115.11 115.63 2jer h GLN 132 Ca 0.20 -0.46 0.22 0.00 -1.45 0.00 0.00 58.65 57.16 2jer h GLN 132 Cb 0.08 0.13 -0.12 0.00 -0.05 0.00 0.00 27.48 27.52 2jer h GLN 132 CO -0.03 1.13 0.43 -0.44 -0.95 0.00 0.00 178.83 178.97 2jer h ASP 133 N -0.11 0.41 0.74 1.46 3.32 -1.77 -1.45 116.42 119.01 2jer h ASP 133 Ca -0.08 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2jer h ASP 133 Cb 1.36 0.11 0.00 0.00 0.22 0.00 0.00 39.33 41.02 2jer h ASP 133 CO 0.13 0.03 0.00 -0.67 -1.72 0.00 0.00 179.24 177.00 2jer n ASP 134 N -5.01 0.30 -0.03 6.45 2.03 -0.49 -1.99 116.55 117.81 2jer n ASP 134 Ca 0.23 0.56 0.11 0.00 0.52 0.00 0.00 54.79 56.21 2jer n ASP 134 Cb 0.66 -0.63 0.06 0.00 -0.72 0.00 0.00 41.12 40.50 2jer n ASP 134 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jer n LEU 135 N -1.82 0.83 -0.30 -2.67 4.77 -0.55 -4.48 117.00 112.78 2jer n LEU 135 Ca 0.04 -0.29 -0.01 0.00 -0.03 0.00 0.00 56.01 55.72 2jer n LEU 135 Cb 0.24 -0.11 0.11 0.00 -2.33 0.00 0.00 43.42 41.33 2jer n LEU 135 CO 0.19 0.20 1.20 0.58 -1.33 0.00 0.00 177.39 178.23 2jer h VAL 136 N 0.15 1.12 -0.46 4.08 2.07 -1.30 -1.87 116.25 120.04 2jer h VAL 136 Ca 0.00 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 2jer h VAL 136 Cb 0.51 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2jer h VAL 136 CO 0.00 0.19 0.26 0.00 0.02 0.00 0.00 177.57 178.04 2jer h ALA 137 N 1.36 0.59 -0.48 1.67 0.00 -1.77 -0.13 119.26 120.50 2jer h ALA 137 Ca 0.34 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2jer h ALA 137 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2jer h ALA 137 CO -0.12 0.11 -0.11 0.37 0.00 0.00 0.00 179.25 179.50 2jer h GLN 138 N 0.61 0.88 -0.40 0.00 4.15 -1.78 -1.57 115.11 117.00 2jer h GLN 138 Ca 0.16 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.18 2jer h GLN 138 Cb 0.05 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 2jer h GLN 138 CO -0.03 0.95 -0.13 0.87 -1.93 0.00 0.00 178.83 178.56 2jer h LYS 139 N 0.79 0.80 -0.55 1.69 1.57 -0.80 0.14 116.57 120.22 2jer h LYS 139 Ca 0.13 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 2jer h LYS 139 Cb 0.63 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2jer h LYS 139 CO 0.04 0.94 0.22 0.82 -0.57 0.00 0.00 179.45 180.91 2jer h ILE 140 N 0.61 1.22 -0.80 1.86 2.04 -0.97 -1.17 117.51 120.30 2jer h ILE 140 Ca 0.10 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2jer h ILE 140 Cb 0.67 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.34 2jer h ILE 140 CO 0.05 0.26 0.50 0.00 0.00 0.00 0.00 178.15 178.96 2jer h GLU 142 N 0.95 -0.10 -0.88 0.00 4.39 -0.27 0.11 114.58 118.79 2jer h GLU 142 Ca 0.33 0.01 0.18 0.00 0.34 0.00 0.00 59.36 60.22 2jer h GLU 142 Cb 0.08 0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 28.64 2jer h GLU 142 CO -0.14 -0.06 0.45 0.82 -1.16 0.00 0.00 179.01 178.91 2jer h ILE 143 N -0.10 0.64 -0.01 3.13 2.04 -0.83 -0.20 117.51 122.19 2jer h ILE 143 Ca 0.04 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.70 2jer h ILE 143 Cb 0.15 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2jer h ILE 143 CO -0.09 0.10 0.00 -0.62 0.00 0.00 0.00 178.15 177.54 2jer n GLU 144 N -4.91 1.17 -3.11 2.37 -0.58 -0.64 -4.91 120.64 110.03 2jer n GLU 144 Ca 0.19 -0.25 -0.23 0.00 -0.42 0.00 0.00 57.16 56.46 2jer n GLU 144 Cb 0.52 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.93 2jer n GLU 144 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jer n HIS 145 N -0.69 -1.92 -4.26 -0.32 8.25 -0.09 -4.93 115.22 111.27 2jer n HIS 145 Ca 0.22 0.50 -0.34 0.00 -0.26 0.00 0.00 57.72 57.84 2jer n HIS 145 Cb 0.17 -4.05 -0.10 0.00 1.12 0.00 0.00 29.99 27.13 2jer n HIS 145 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2jer s VAL 146 N -3.10 4.33 0.54 1.59 -7.23 0.26 -4.36 120.40 112.43 2jer s VAL 146 Ca 0.33 -0.21 -0.18 0.00 -1.81 0.00 0.00 61.98 60.11 2jer s VAL 146 Cb -0.15 -2.89 -0.06 0.00 0.56 0.00 0.00 36.38 33.83 2jer s VAL 146 CO 0.40 0.52 1.03 -1.81 -0.31 0.00 0.00 175.10 174.93 2jer s ASP 147 N -0.02 6.18 0.04 4.85 1.01 -1.26 -4.12 116.67 123.34 2jer s ASP 147 Ca 0.03 1.80 0.01 0.00 0.71 0.00 0.00 52.55 55.11 2jer s ASP 147 Cb -0.13 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 2jer s ASP 147 CO 0.02 -0.90 -0.06 -0.94 0.21 0.00 0.00 175.17 173.51 2jer s SER 148 N -2.55 0.62 -0.20 0.27 1.04 -0.64 -1.01 113.70 111.23 2jer s SER 148 Ca 0.64 -0.58 -0.12 0.00 0.48 0.00 0.00 55.95 56.37 2jer s SER 148 Cb -0.15 0.07 -0.05 0.00 0.10 0.00 0.00 66.02 66.00 2jer s SER 148 CO 0.29 -0.28 0.21 -0.31 0.98 0.00 0.00 173.24 174.14 2jer s TYR 149 N -1.66 3.39 -0.20 5.02 1.51 0.30 -0.22 117.35 125.48 2jer s TYR 149 Ca -0.10 0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 56.26 2jer s TYR 149 Cb -0.08 -2.29 -0.05 0.00 -0.11 0.00 0.00 41.96 39.43 2jer s TYR 149 CO -0.01 0.17 0.14 0.50 -1.11 0.00 0.00 175.55 175.24 2jer s ARG 150 N 0.72 4.18 -1.06 -0.62 6.06 -1.26 0.53 118.95 127.50 2jer s ARG 150 Ca 0.11 -0.20 -0.15 0.00 -2.50 0.00 0.00 55.73 52.99 2jer s ARG 150 Cb -0.13 -3.43 0.18 0.00 0.06 0.00 0.00 34.95 31.62 2jer s ARG 150 CO 0.03 0.27 1.22 0.95 -2.50 0.00 0.00 175.30 175.27 2jer s THR 151 N 0.44 5.11 0.21 4.11 -4.23 -0.48 -4.97 115.64 115.83 2jer s THR 151 Ca 0.08 -2.35 -0.32 0.00 -1.18 0.00 0.00 61.69 57.92 2jer s THR 151 Cb -0.11 -4.78 -0.13 0.00 1.34 0.00 0.00 72.50 68.81 2jer s THR 151 CO -0.01 -1.47 1.55 0.47 -0.54 0.00 0.00 174.62 174.62 2jer n ASP 152 N 5.42 3.20 -1.82 3.99 8.00 -1.26 -1.85 116.55 132.23 2jer n ASP 152 Ca 0.28 1.11 -0.20 0.00 0.71 0.00 0.00 54.79 56.69 2jer n ASP 152 Cb 0.45 -1.47 -0.06 0.00 -0.02 0.00 0.00 41.12 40.02 2jer n ASP 152 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jer n ASP 153 N 2.93 -5.46 -3.86 -2.24 8.00 -1.26 -4.95 116.55 109.70 2jer n ASP 153 Ca 0.14 0.36 -0.28 0.00 0.71 0.00 0.00 54.79 55.72 2jer n ASP 153 Cb 0.31 -4.75 -0.17 0.00 -0.02 0.00 0.00 41.12 36.50 2jer n ASP 153 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2jer s PHE 154 N -2.80 1.53 -0.12 1.24 2.19 -0.77 -5.05 117.98 114.21 2jer s PHE 154 Ca 0.00 -0.98 -0.18 0.00 0.33 0.00 0.00 56.93 56.10 2jer s PHE 154 Cb 0.00 -1.23 -0.04 0.00 -1.31 0.00 0.00 43.02 40.43 2jer s PHE 154 CO 0.00 -0.59 0.48 0.08 1.83 0.00 0.00 175.22 177.02 2jer s VAL 155 N 1.69 5.18 0.03 3.12 1.01 -1.26 -1.48 120.40 128.69 2jer s VAL 155 Ca 0.01 0.96 -0.23 0.00 0.00 0.00 0.00 61.98 62.72 2jer s VAL 155 Cb -0.15 -3.82 0.05 0.00 0.00 0.00 0.00 36.38 32.46 2jer s VAL 155 CO -0.07 0.33 0.53 -0.22 0.00 0.00 0.00 175.10 175.66 2jer s LEU 156 N 0.60 -0.08 0.01 3.92 2.96 -0.77 -4.81 118.68 120.50 2jer s LEU 156 Ca 0.26 0.25 0.08 0.00 -0.22 0.00 0.00 54.13 54.50 2jer s LEU 156 Cb -0.15 2.11 -0.02 0.00 0.50 0.00 0.00 46.19 48.63 2jer s LEU 156 CO 0.10 -0.68 -0.24 -1.61 -1.32 0.00 0.00 176.35 172.61 2jer s GLU 157 N -2.14 1.77 0.45 1.98 8.01 -1.26 -4.55 118.70 122.95 2jer s GLU 157 Ca -0.07 -0.92 0.19 0.00 0.01 0.00 0.00 54.97 54.18 2jer s GLU 157 Cb -0.01 -1.80 1.15 0.00 -4.31 0.00 0.00 34.13 29.16 2jer s GLU 157 CO 0.01 0.48 1.91 0.78 0.01 0.00 0.00 175.26 178.44 2jer h GLY 158 N 5.24 0.59 1.94 -1.39 0.00 -1.62 -1.34 103.07 106.50 2jer h GLY 158 Ca -0.43 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 46.76 2jer h GLY 158 CO 0.46 0.03 0.00 0.61 0.00 0.00 0.00 176.54 177.63 2jer n GLY 159 N -1.56 -1.07 0.19 4.60 0.00 -1.22 -3.43 105.19 102.70 2jer n GLY 159 Ca 0.16 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.24 2jer n GLY 159 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jer n SER 160 N -1.47 0.89 -3.99 1.61 3.41 -0.51 -2.64 113.62 110.93 2jer n SER 160 Ca 0.05 -0.74 -0.08 0.00 -0.26 0.00 0.00 58.87 57.84 2jer n SER 160 Cb 0.20 0.15 -0.09 0.00 -0.26 0.00 0.00 64.21 64.20 2jer n SER 160 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2jer s PHE 161 N -2.61 0.35 0.01 7.33 -0.12 -1.22 -4.21 117.98 117.51 2jer s PHE 161 Ca 0.22 -0.83 0.03 0.00 -0.05 0.00 0.00 56.93 56.29 2jer s PHE 161 Cb 0.19 -0.24 -0.01 0.00 -0.63 0.00 0.00 43.02 42.32 2jer s PHE 161 CO 0.56 -0.44 -0.08 -1.01 -0.05 0.00 0.00 175.22 174.20 2jer s HIS 162 N -3.76 0.73 0.21 3.49 3.76 0.21 -4.88 115.29 115.05 2jer s HIS 162 Ca 0.05 -0.23 0.11 0.00 -0.15 0.00 0.00 55.06 54.84 2jer s HIS 162 Cb 0.06 -0.45 -0.04 0.00 1.11 0.00 0.00 32.58 33.25 2jer s HIS 162 CO -0.10 -0.02 -0.21 0.14 -0.85 0.00 0.00 174.74 173.70 2jer s VAL 163 N -0.50 2.51 -2.46 -0.90 -7.23 -1.26 -0.21 120.40 110.36 2jer s VAL 163 Ca 0.00 -2.04 0.22 0.00 -1.81 0.00 0.00 61.98 58.36 2jer s VAL 163 Cb -0.05 -2.23 0.10 0.00 0.56 0.00 0.00 36.38 34.76 2jer s VAL 163 CO 0.00 -0.17 1.15 -0.90 -0.31 0.00 0.00 175.10 174.87 2jer n ASP 164 N 0.07 2.50 0.00 4.85 5.75 -1.00 -4.53 116.55 124.18 2jer n ASP 164 Ca -0.11 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 2jer n ASP 164 Cb 0.57 0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 2jer n ASP 164 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jer n GLY 165 N 1.32 0.75 1.56 6.12 0.00 -1.26 -4.35 105.19 109.34 2jer n GLY 165 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2jer n GLY 165 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2jer n GLN 166 N -2.07 1.21 -0.02 1.61 6.02 -1.26 -4.81 117.38 118.05 2jer n GLN 166 Ca 0.00 -2.91 0.00 0.00 -0.01 0.00 0.00 57.00 54.08 2jer n GLN 166 Cb 0.02 -1.03 0.00 0.00 1.02 0.00 0.00 30.24 30.25 2jer n GLN 166 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jer n GLY 167 N -0.30 0.81 3.25 1.08 0.00 -1.26 -4.54 105.19 104.22 2jer n GLY 167 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2jer n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jer s THR 168 N -2.02 1.73 0.03 2.61 2.01 -1.26 -0.26 115.64 118.48 2jer s THR 168 Ca 0.00 -1.07 0.06 0.00 0.31 0.00 0.00 61.69 60.99 2jer s THR 168 Cb 0.00 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 71.02 2jer s THR 168 CO 0.00 0.36 -0.19 0.54 -0.69 0.00 0.00 174.62 174.65 2jer s VAL 169 N -0.65 1.48 -0.10 3.82 0.11 -0.57 -2.39 120.40 122.11 2jer s VAL 169 Ca 0.08 -1.05 0.03 0.00 -2.93 0.00 0.00 61.98 58.11 2jer s VAL 169 Cb -0.09 -1.29 -0.01 0.00 -1.53 0.00 0.00 36.38 33.47 2jer s VAL 169 CO 0.00 0.21 -0.19 -0.22 -3.33 0.00 0.00 175.10 171.57 2jer s LEU 170 N -0.99 2.39 0.00 2.54 2.96 0.71 -0.31 118.68 125.98 2jer s LEU 170 Ca 0.06 -0.43 -0.03 0.00 -0.22 0.00 0.00 54.13 53.51 2jer s LEU 170 Cb -0.08 -1.50 0.01 0.00 0.50 0.00 0.00 46.19 45.12 2jer s LEU 170 CO 0.01 0.19 0.42 1.07 -1.32 0.00 0.00 176.35 176.72 2jer n THR 171 N 3.35 0.00 -5.05 3.68 5.66 -0.54 -0.62 114.28 120.76 2jer n THR 171 Ca -0.18 -1.26 -0.28 0.00 -3.05 0.00 0.00 64.05 59.28 2jer n THR 171 Cb 0.53 0.83 -0.16 0.00 -1.55 0.00 0.00 70.33 69.98 2jer n THR 171 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2jer s THR 172 N -2.65 1.73 0.23 1.09 -4.23 -1.26 -0.88 115.64 109.67 2jer s THR 172 Ca 0.20 -0.96 -0.04 0.00 -1.18 0.00 0.00 61.69 59.71 2jer s THR 172 Cb -0.01 -1.44 0.09 0.00 1.34 0.00 0.00 72.50 72.48 2jer s THR 172 CO 0.15 0.47 1.71 -0.33 -0.54 0.00 0.00 174.62 176.08 2jer h GLU 173 N 5.54 0.89 -1.00 3.99 5.08 -0.60 -2.32 114.58 126.16 2jer h GLU 173 Ca -0.40 -0.26 0.13 0.00 -1.00 0.00 0.00 59.36 57.82 2jer h GLU 173 Cb 1.14 -0.09 -0.09 0.00 0.50 0.00 0.00 28.75 30.21 2jer h GLU 173 CO 0.47 0.89 0.63 1.98 -1.00 0.00 0.00 179.01 181.98 2jer h MET 174 N 0.82 0.93 0.00 2.33 4.05 -1.48 -2.08 114.93 119.51 2jer h MET 174 Ca 0.15 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 2jer h MET 174 Cb 0.51 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 2jer h MET 174 CO 0.03 0.62 -0.09 0.00 0.23 0.00 0.00 176.91 177.69 2jer h LEU 176 N -0.80 0.00 -1.81 0.00 3.38 -1.41 -2.59 115.31 112.07 2jer h LEU 176 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jer h LEU 176 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2jer h LEU 176 CO 0.00 0.30 0.00 0.18 0.09 0.00 0.00 178.44 179.01 2jer n LEU 177 N -3.58 2.66 -4.82 1.67 4.77 -0.78 -4.55 117.00 112.37 2jer n LEU 177 Ca -0.01 -1.27 -0.32 0.00 -0.03 0.00 0.00 56.01 54.39 2jer n LEU 177 Cb 0.44 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2jer n LEU 177 CO 0.35 0.63 0.71 -0.94 -1.33 0.00 0.00 177.39 176.81 2jer s SER 178 N -1.18 6.01 0.39 -1.43 1.04 -0.98 -4.96 113.70 112.58 2jer s SER 178 Ca 0.35 1.70 0.05 0.00 0.48 0.00 0.00 55.95 58.53 2jer s SER 178 Cb 0.19 -2.52 0.77 0.00 0.10 0.00 0.00 66.02 64.56 2jer s SER 178 CO 0.25 -1.01 2.04 -0.08 0.98 0.00 0.00 173.24 175.42 2jer h GLU 179 N 0.40 0.66 -0.04 4.02 4.81 -1.92 -2.65 114.58 119.85 2jer h GLU 179 Ca -0.46 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2jer h GLU 179 Cb 1.21 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.44 2jer h GLU 179 CO 0.59 0.43 0.00 0.41 -0.73 0.00 0.00 179.01 179.71 2jer n GLY 180 N -1.46 -0.72 0.00 1.92 0.00 -1.26 -4.16 105.19 99.50 2jer n GLY 180 Ca 0.05 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2jer n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jer n ARG 181 N -0.54 0.00 -3.15 1.61 5.12 -1.00 -4.08 116.66 114.63 2jer n ARG 181 Ca 0.14 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.83 2jer n ARG 181 Cb 0.12 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.37 2jer n ARG 181 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2jer n ASN 182 N -0.67 2.01 0.22 0.55 4.13 -1.25 -4.64 115.26 115.60 2jer n ASN 182 Ca 0.00 -3.18 0.15 0.00 1.68 0.00 0.00 54.58 53.23 2jer n ASN 182 Cb 0.00 -0.61 0.69 0.00 -1.54 0.00 0.00 39.78 38.32 2jer n ASN 182 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2jer h PRO 183 N 3.32 0.00 0.00 3.52 0.13 -1.77 -1.14 132.00 136.07 2jer h PRO 183 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2jer h PRO 183 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2jer h PRO 183 CO 0.62 0.00 -0.10 1.04 -0.23 0.00 0.00 178.00 179.32 2jer n GLN 184 N -2.64 0.08 -3.78 0.86 1.13 -1.26 -4.85 117.38 106.93 2jer n GLN 184 Ca 0.00 0.06 -0.36 0.00 -1.94 0.00 0.00 57.00 54.76 2jer n GLN 184 Cb 0.19 -1.59 -0.06 0.00 0.11 0.00 0.00 30.24 28.89 2jer n GLN 184 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2jer s LEU 185 N -3.46 4.40 0.79 1.08 1.43 -0.43 -5.11 118.68 117.38 2jer s LEU 185 Ca 0.12 0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 53.69 2jer s LEU 185 Cb 0.17 -2.34 0.06 0.00 0.03 0.00 0.00 46.19 44.11 2jer s LEU 185 CO 0.58 0.35 1.08 -0.94 0.23 0.00 0.00 176.35 177.65 2jer s SER 186 N -1.25 4.49 0.28 2.29 1.04 -1.26 -4.89 113.70 114.40 2jer s SER 186 Ca 0.20 1.60 -0.01 0.00 0.48 0.00 0.00 55.95 58.23 2jer s SER 186 Cb -0.13 -2.34 0.48 0.00 0.10 0.00 0.00 66.02 64.12 2jer s SER 186 CO 0.10 -2.01 1.88 0.50 0.98 0.00 0.00 173.24 174.69 2jer h LYS 187 N -1.11 1.06 -0.71 4.02 3.64 -1.98 -1.68 116.57 119.81 2jer h LYS 187 Ca -0.46 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 58.81 2jer h LYS 187 Cb 1.24 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 2jer h LYS 187 CO 0.55 0.70 0.26 0.93 -2.27 0.00 0.00 179.45 179.63 2jer h GLU 188 N 1.10 1.08 -0.82 1.90 3.07 -1.99 -0.01 114.58 118.91 2jer h GLU 188 Ca 0.44 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.36 59.07 2jer h GLU 188 Cb 0.25 -0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 27.96 2jer h GLU 188 CO -0.18 0.90 0.43 0.00 -1.40 0.00 0.00 179.01 178.76 2jer h ALA 189 N 1.12 1.05 -0.32 3.43 0.00 -1.76 -1.26 119.26 121.53 2jer h ALA 189 Ca 0.23 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2jer h ALA 189 Cb 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2jer h ALA 189 CO -0.02 0.58 0.01 0.82 0.00 0.00 0.00 179.25 180.65 2jer h ILE 190 N 1.15 1.25 -0.75 0.00 2.04 -0.96 -2.23 117.51 118.02 2jer h ILE 190 Ca 0.29 -0.93 0.11 0.00 1.00 0.00 0.00 64.86 65.33 2jer h ILE 190 Cb 0.06 1.23 -0.08 0.00 -0.74 0.00 0.00 36.82 37.29 2jer h ILE 190 CO -0.04 0.31 0.36 -0.33 0.00 0.00 0.00 178.15 178.44 2jer h GLU 191 N 0.37 0.55 -0.76 2.37 5.08 -0.81 -1.93 114.58 119.45 2jer h GLU 191 Ca 0.09 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2jer h GLU 191 Cb 0.43 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 2jer h GLU 191 CO 0.01 0.36 0.48 0.37 -1.00 0.00 0.00 179.01 179.24 2jer h GLN 192 N 0.57 1.01 -0.58 2.33 5.75 -0.93 -0.04 115.11 123.22 2jer h GLN 192 Ca 0.39 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.79 2jer h GLN 192 Cb 0.48 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.78 2jer h GLN 192 CO -0.32 0.69 0.29 0.87 -2.65 0.00 0.00 178.83 177.71 2jer h LYS 193 N 1.03 0.83 -0.44 1.69 1.79 -0.80 0.48 116.57 121.15 2jer h LYS 193 Ca 0.27 -0.12 -0.03 0.00 -2.18 0.00 0.00 60.65 58.60 2jer h LYS 193 Cb -0.08 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.40 2jer h LYS 193 CO -0.06 0.66 0.17 -0.07 -1.08 0.00 0.00 179.45 179.07 2jer h LEU 194 N 0.79 0.62 -0.37 2.94 3.38 -0.79 -0.80 115.31 121.07 2jer h LEU 194 Ca 0.20 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2jer h LEU 194 Cb 0.10 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2jer h LEU 194 CO -0.03 0.63 0.15 0.00 0.09 0.00 0.00 178.44 179.28 2jer h ASP 196 N 0.46 0.99 0.56 0.00 3.32 -0.75 -1.09 116.42 119.90 2jer h ASP 196 Ca 0.12 -0.44 -0.18 0.00 0.02 0.00 0.00 57.03 56.55 2jer h ASP 196 Cb 0.20 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 2jer h ASP 196 CO -0.01 1.23 -1.59 -1.22 -1.72 0.00 0.00 179.24 175.94 2jer n TYR 197 N -4.07 0.80 0.55 4.55 4.02 -0.32 -1.28 117.16 121.42 2jer n TYR 197 Ca -0.02 0.27 0.11 0.00 -0.01 0.00 0.00 57.90 58.25 2jer n TYR 197 Cb 0.53 -1.04 -0.06 0.00 -0.02 0.00 0.00 39.34 38.75 2jer n TYR 197 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2jer n LEU 198 N -2.83 0.58 -2.94 7.72 4.32 -0.25 -4.69 117.00 118.90 2jer n LEU 198 Ca -0.12 -0.15 -0.06 0.00 -0.02 0.00 0.00 56.01 55.66 2jer n LEU 198 Cb 0.87 -0.05 0.03 0.00 -1.62 0.00 0.00 43.42 42.65 2jer n LEU 198 CO 0.43 0.09 0.17 -3.20 -1.22 0.00 0.00 177.39 173.66 2jer n ASN 199 N -1.91 -6.58 -4.35 -1.43 4.05 -0.46 -1.73 115.26 102.86 2jer n ASN 199 Ca 0.01 -0.33 -0.18 0.00 0.45 0.00 0.00 54.58 54.53 2jer n ASN 199 Cb 0.44 -4.69 -0.10 0.00 1.23 0.00 0.00 39.78 36.65 2jer n ASN 199 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 2jer s VAL 200 N -3.16 1.32 0.00 3.44 -7.23 -0.93 -4.38 120.40 109.45 2jer s VAL 200 Ca 0.19 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.28 2jer s VAL 200 Cb -0.03 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2jer s VAL 200 CO 0.65 -0.42 0.00 -0.62 -0.31 0.00 0.00 175.10 174.40 2jer n GLU 201 N -0.42 1.79 -3.98 4.82 1.02 0.65 -4.46 120.64 120.06 2jer n GLU 201 Ca -0.06 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.87 2jer n GLU 201 Cb 0.63 -0.86 -0.17 0.00 -0.02 0.00 0.00 31.44 31.02 2jer n GLU 201 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2jer s LYS 202 N -1.67 0.63 -0.28 3.49 2.20 -0.85 -5.06 119.74 118.20 2jer s LYS 202 Ca 0.00 0.01 -0.07 0.00 -0.36 0.00 0.00 55.97 55.55 2jer s LYS 202 Cb 0.00 -0.80 -0.00 0.00 -1.51 0.00 0.00 37.83 35.52 2jer s LYS 202 CO 0.00 -0.17 0.08 0.08 -0.36 0.00 0.00 175.35 174.98 2jer s VAL 203 N 1.28 4.07 -0.31 4.02 1.01 -1.26 -1.50 120.40 127.71 2jer s VAL 203 Ca -0.06 -0.53 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 2jer s VAL 203 Cb -0.13 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2jer s VAL 203 CO -0.02 0.16 0.48 -0.76 0.00 0.00 0.00 175.10 174.96 2jer s LEU 204 N 1.54 4.21 -0.43 3.92 1.43 0.58 -5.00 118.68 124.92 2jer s LEU 204 Ca 0.04 0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.17 2jer s LEU 204 Cb -0.16 -2.56 0.04 0.00 0.03 0.00 0.00 46.19 43.53 2jer s LEU 204 CO 0.03 -0.36 0.33 0.26 0.23 0.00 0.00 176.35 176.83 2jer s TRP 205 N 2.29 3.24 0.77 0.29 0.52 -1.26 -1.47 118.94 123.32 2jer s TRP 205 Ca 0.18 -0.72 -0.11 0.00 0.02 0.00 0.00 56.10 55.47 2jer s TRP 205 Cb -0.16 -2.77 0.05 0.00 -1.15 0.00 0.00 33.47 29.44 2jer s TRP 205 CO 0.11 -0.66 1.09 -0.51 0.02 0.00 0.00 176.95 177.00 2jer s LEU 206 N 1.66 2.74 0.00 2.99 1.43 -0.05 -4.92 118.68 122.52 2jer s LEU 206 Ca 0.05 1.38 0.00 0.00 -1.03 0.00 0.00 54.13 54.52 2jer s LEU 206 Cb -0.21 -4.06 0.00 0.00 0.03 0.00 0.00 46.19 41.95 2jer s LEU 206 CO 0.09 -1.82 0.00 0.61 0.23 0.00 0.00 176.35 175.45 2jer n GLY 207 N -2.10 0.80 3.79 -3.19 0.00 -1.26 -0.80 105.19 102.42 2jer n GLY 207 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 2jer n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jer s ASP 208 N -1.00 7.14 0.17 1.61 -0.00 -1.26 -1.38 116.67 121.95 2jer s ASP 208 Ca 0.00 1.88 0.00 0.00 -0.00 0.00 0.00 52.55 54.43 2jer s ASP 208 Cb 0.00 -2.58 0.00 0.00 -0.00 0.00 0.00 42.92 40.34 2jer s ASP 208 CO 0.00 -0.21 0.00 0.61 -0.00 0.00 0.00 175.17 175.57 2jer n GLY 209 N 0.37 1.27 0.34 0.21 0.00 -1.26 -4.89 105.19 101.23 2jer n GLY 209 Ca 0.03 -2.01 0.06 0.00 0.00 0.00 0.00 46.02 44.10 2jer n GLY 209 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2jer n ILE 210 N -0.97 0.00 -3.23 -0.61 -5.35 -1.26 -4.72 119.36 103.23 2jer n ILE 210 Ca 0.00 -0.43 -0.25 0.00 -0.27 0.00 0.00 62.75 61.80 2jer n ILE 210 Cb 0.00 1.17 -0.06 0.00 -1.74 0.00 0.00 39.64 39.01 2jer n ILE 210 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jer n ASP 211 N 0.11 2.28 0.01 7.28 3.85 -1.26 -4.92 116.55 123.90 2jer n ASP 211 Ca 0.05 -3.18 0.08 0.00 -0.71 0.00 0.00 54.79 51.04 2jer n ASP 211 Cb 0.26 -0.63 0.50 0.00 -1.35 0.00 0.00 41.12 39.89 2jer n ASP 211 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.20 177.74 2jer h PRO 212 N 3.72 0.38 0.00 0.11 0.13 -1.88 -2.31 132.00 132.16 2jer h PRO 212 Ca 0.13 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.19 2jer h PRO 212 Cb 0.75 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 2jer h PRO 212 CO 0.66 0.25 -0.59 0.93 -0.23 0.00 0.00 178.00 179.02 2jer h GLU 213 N 0.39 0.00 0.00 0.86 4.39 -1.95 -3.22 114.58 115.04 2jer h GLU 213 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 2jer h GLU 213 Cb 0.21 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2jer h GLU 213 CO -0.04 0.16 0.00 -1.91 -1.16 0.00 0.00 179.01 176.06 2jer n GLU 214 N -2.99 0.00 -0.07 2.33 4.07 -0.91 -4.72 120.64 118.36 2jer n GLU 214 Ca 0.00 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.22 2jer n GLU 214 Cb 0.63 -0.11 0.36 0.00 -0.06 0.00 0.00 31.44 32.26 2jer n GLU 214 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2jer n THR 215 N -0.78 0.18 -3.03 6.31 -2.24 -1.16 -4.88 114.28 108.67 2jer n THR 215 Ca 0.00 -0.40 -0.19 0.00 -2.27 0.00 0.00 64.05 61.19 2jer n THR 215 Cb 0.00 0.64 0.04 0.00 -2.10 0.00 0.00 70.33 68.91 2jer n THR 215 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jer n ASN 216 N 0.60 -5.39 -0.51 3.42 3.02 -0.97 -4.28 115.26 111.15 2jer n ASN 216 Ca 0.17 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 2jer n ASN 216 Cb 0.41 -4.16 0.00 0.00 -0.61 0.00 0.00 39.78 35.43 2jer n ASN 216 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jer n GLY 217 N -1.49 0.68 3.64 7.41 0.00 -0.97 -1.70 105.19 112.75 2jer n GLY 217 Ca -0.06 -0.36 -0.47 0.00 0.00 0.00 0.00 46.02 45.13 2jer n GLY 217 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jer n HIS 218 N -1.05 1.88 0.26 1.61 8.25 -1.26 -4.06 115.22 120.85 2jer n HIS 218 Ca 0.00 0.49 0.14 0.00 -0.26 0.00 0.00 57.72 58.10 2jer n HIS 218 Cb 0.32 -2.41 0.83 0.00 1.12 0.00 0.00 29.99 29.86 2jer n HIS 218 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2jer h VAL 219 N 3.07 0.61 0.00 1.59 3.04 -1.73 -2.86 116.25 119.97 2jer h VAL 219 Ca -0.45 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.24 2jer h VAL 219 Cb 1.30 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 2jer h VAL 219 CO 0.77 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.43 2jer n ASP 220 N -3.99 0.00 -0.28 3.17 5.75 -1.08 -0.46 116.55 119.66 2jer n ASP 220 Ca -0.01 -0.04 0.12 0.00 -0.01 0.00 0.00 54.79 54.85 2jer n ASP 220 Cb 0.16 -0.27 0.12 0.00 -1.03 0.00 0.00 41.12 40.10 2jer n ASP 220 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2jer n ASP 221 N -1.27 1.38 -0.04 -1.12 8.00 -1.08 -3.54 116.55 118.88 2jer n ASP 221 Ca 0.10 -1.10 -0.08 0.00 0.71 0.00 0.00 54.79 54.42 2jer n ASP 221 Cb 0.15 0.45 -0.03 0.00 -0.02 0.00 0.00 41.12 41.67 2jer n ASP 221 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2jer n VAL 222 N -0.64 0.39 -3.54 2.53 0.31 0.39 -4.63 118.33 113.14 2jer n VAL 222 Ca 0.09 -0.10 -0.16 0.00 -0.01 0.00 0.00 64.34 64.16 2jer n VAL 222 Cb 0.39 -1.57 -0.05 0.00 -0.91 0.00 0.00 33.84 31.70 2jer n VAL 222 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jer s ALA 223 N -2.13 -1.55 0.26 3.52 0.00 -0.41 -1.21 121.76 120.24 2jer s ALA 223 Ca -0.10 0.93 -0.11 0.00 0.00 0.00 0.00 51.96 52.68 2jer s ALA 223 Cb 0.04 0.24 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 2jer s ALA 223 CO 0.13 -0.46 0.47 0.00 0.00 0.00 0.00 175.76 175.90 2jer s PHE 225 N -3.85 3.45 -0.14 0.00 0.08 -1.26 -1.16 117.98 115.10 2jer s PHE 225 Ca 0.24 0.87 0.18 0.00 0.12 0.00 0.00 56.93 58.34 2jer s PHE 225 Cb -0.00 -2.63 -0.14 0.00 -0.57 0.00 0.00 43.02 39.67 2jer s PHE 225 CO 0.11 0.03 0.76 0.44 -0.10 0.00 0.00 175.22 176.46 2jer n ILE 226 N 4.10 0.97 -3.64 0.64 -5.35 -0.15 -4.84 119.36 111.10 2jer n ILE 226 Ca -0.05 -0.66 -0.04 0.00 -0.27 0.00 0.00 62.75 61.73 2jer n ILE 226 Cb 0.51 -0.56 -0.01 0.00 -1.74 0.00 0.00 39.64 37.83 2jer n ILE 226 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jer s ALA 227 N -3.03 -1.88 0.11 -1.28 0.00 -1.18 -4.88 121.76 109.62 2jer s ALA 227 Ca -0.04 0.66 -0.34 0.00 0.00 0.00 0.00 51.96 52.25 2jer s ALA 227 Cb 0.09 0.43 -0.13 0.00 0.00 0.00 0.00 23.12 23.51 2jer s ALA 227 CO 0.82 -0.90 1.65 -2.30 0.00 0.00 0.00 175.76 175.03 2jer n PRO 228 N -0.37 2.20 -0.83 0.00 -0.02 -1.26 -1.31 135.00 133.41 2jer n PRO 228 Ca -0.06 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 2jer n PRO 228 Cb 0.61 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2jer n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jer n GLY 229 N 3.65 0.84 2.91 -1.23 0.00 -1.26 -5.02 105.19 105.08 2jer n GLY 229 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 2jer n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jer s GLU 230 N -0.17 1.12 0.16 1.61 2.02 -0.43 -1.66 118.70 121.35 2jer s GLU 230 Ca 0.00 -0.18 0.10 0.00 0.02 0.00 0.00 54.97 54.91 2jer s GLU 230 Cb 0.00 -1.10 -0.04 0.00 0.10 0.00 0.00 34.13 33.09 2jer s GLU 230 CO 0.00 -0.10 -0.22 0.14 0.02 0.00 0.00 175.26 175.10 2jer s VAL 231 N 1.08 2.08 -0.00 2.63 -7.23 0.02 -0.98 120.40 118.00 2jer s VAL 231 Ca -0.08 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 58.21 2jer s VAL 231 Cb -0.14 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 2jer s VAL 231 CO -0.01 -0.15 0.02 0.00 -0.31 0.00 0.00 175.10 174.66 2jer s ALA 232 N -1.64 3.37 -0.02 1.32 0.00 -0.31 -0.06 121.76 124.43 2jer s ALA 232 Ca 0.16 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2jer s ALA 232 Cb -0.08 -1.41 0.02 0.00 0.00 0.00 0.00 23.12 21.65 2jer s ALA 232 CO 0.08 0.66 -0.00 0.00 0.00 0.00 0.00 175.76 176.49 2jer n ILE 234 N 3.68 4.49 -3.71 0.00 -5.35 -0.35 -0.48 119.36 117.64 2jer n ILE 234 Ca -0.21 -0.49 -0.12 0.00 -0.27 0.00 0.00 62.75 61.66 2jer n ILE 234 Cb 0.54 -1.37 -0.10 0.00 -1.74 0.00 0.00 39.64 36.97 2jer n ILE 234 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2jer s TYR 235 N -1.46 -0.54 -0.01 4.28 5.04 0.28 -4.75 117.35 120.20 2jer s TYR 235 Ca 0.81 1.24 -0.19 0.00 -2.44 0.00 0.00 57.07 56.48 2jer s TYR 235 Cb -0.39 0.21 0.03 0.00 0.35 0.00 0.00 41.96 42.17 2jer s TYR 235 CO 0.43 -0.28 0.40 -0.08 -1.34 0.00 0.00 175.55 174.68 2jer s THR 236 N 0.69 0.05 -1.40 4.34 -1.32 -1.26 -3.58 115.64 113.16 2jer s THR 236 Ca -0.04 -0.38 0.12 0.00 -1.21 0.00 0.00 61.69 60.18 2jer s THR 236 Cb -0.05 -0.77 0.16 0.00 -1.51 0.00 0.00 72.50 70.33 2jer s THR 236 CO -0.05 -0.21 0.98 -0.62 -2.21 0.00 0.00 174.62 172.52 2jer n GLU 237 N 1.02 1.24 -2.22 7.08 1.02 -1.26 -4.83 120.64 122.69 2jer n GLU 237 Ca -0.20 -1.45 -0.42 0.00 -0.02 0.00 0.00 57.16 55.07 2jer n GLU 237 Cb 0.57 -1.25 -0.03 0.00 -0.02 0.00 0.00 31.44 30.72 2jer n GLU 237 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jer s ASP 238 N -1.01 5.93 0.00 1.62 -1.08 -1.26 -4.87 116.67 116.00 2jer s ASP 238 Ca 0.17 0.64 0.18 0.00 -0.52 0.00 0.00 52.55 53.03 2jer s ASP 238 Cb 0.11 -2.54 0.82 0.00 -1.46 0.00 0.00 42.92 39.86 2jer s ASP 238 CO 0.16 -1.80 1.57 0.00 0.52 0.00 0.00 175.17 175.62 2jer n GLN 239 N 8.60 0.09 0.05 4.34 6.02 -1.26 -1.82 117.38 133.41 2jer n GLN 239 Ca 0.17 0.16 0.12 0.00 -0.01 0.00 0.00 57.00 57.45 2jer n GLN 239 Cb 0.49 -1.50 0.25 0.00 1.02 0.00 0.00 30.24 30.50 2jer n GLN 239 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2jer n ASN 240 N -1.43 0.64 -4.76 1.08 3.02 -1.26 -4.91 115.26 107.64 2jer n ASN 240 Ca 0.06 0.17 -0.41 0.00 -0.03 0.00 0.00 54.58 54.36 2jer n ASN 240 Cb 0.19 -0.03 -0.01 0.00 -0.61 0.00 0.00 39.78 39.31 2jer n ASN 240 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jer s SER 241 N -4.00 6.43 0.20 6.41 0.15 -0.76 -4.88 113.70 117.25 2jer s SER 241 Ca 0.08 2.91 0.19 0.00 0.70 0.00 0.00 55.95 59.83 2jer s SER 241 Cb 0.14 -2.64 0.86 0.00 -1.71 0.00 0.00 66.02 62.67 2jer s SER 241 CO 0.68 -0.85 1.59 -0.81 1.20 0.00 0.00 173.24 175.05 2jer n PRO 242 N 1.80 0.13 0.02 5.44 -0.04 -1.26 -2.77 135.00 138.33 2jer n PRO 242 Ca 0.06 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 2jer n PRO 242 Cb 0.38 -1.78 0.16 0.00 -0.04 0.00 0.00 33.50 32.22 2jer n PRO 242 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2jer n PHE 243 N -2.03 0.21 -0.03 0.54 3.72 -1.26 -4.67 117.46 113.95 2jer n PHE 243 Ca 0.01 0.06 -0.12 0.00 -0.05 0.00 0.00 57.45 57.36 2jer n PHE 243 Cb 0.16 -0.39 -0.08 0.00 -0.94 0.00 0.00 39.48 38.23 2jer n PHE 243 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2jer h TYR 244 N 0.00 -1.28 -0.27 1.38 3.20 -1.77 0.14 116.97 118.37 2jer h TYR 244 Ca 0.00 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2jer h TYR 244 Cb 0.62 0.58 -0.01 0.00 1.54 0.00 0.00 36.73 39.45 2jer h TYR 244 CO 0.00 -0.42 0.17 0.93 -1.64 0.00 0.00 178.16 177.20 2jer h GLU 245 N -0.43 0.36 -0.72 1.82 4.39 -1.84 -0.03 114.58 118.13 2jer h GLU 245 Ca 0.03 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 2jer h GLU 245 Cb 0.52 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.06 2jer h GLU 245 CO -0.36 0.26 0.22 0.00 -1.16 0.00 0.00 179.01 177.97 2jer h ALA 246 N 1.08 0.94 -0.15 3.43 0.00 -1.84 -1.51 119.26 121.20 2jer h ALA 246 Ca 0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2jer h ALA 246 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2jer h ALA 246 CO -0.02 0.63 0.04 0.00 0.00 0.00 0.00 179.25 179.90 2jer h ALA 247 N 1.11 0.20 -0.71 0.00 0.00 -0.41 -1.45 119.26 118.00 2jer h ALA 247 Ca 0.23 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2jer h ALA 247 Cb 0.32 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2jer h ALA 247 CO -0.01 -0.16 0.47 1.96 0.00 0.00 0.00 179.25 181.51 2jer h GLN 248 N 0.05 0.92 -0.33 0.00 1.08 -0.92 -1.94 115.11 113.98 2jer h GLN 248 Ca 0.05 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 2jer h GLN 248 Cb 0.25 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2jer h GLN 248 CO 0.00 0.61 -0.23 0.22 -0.95 0.00 0.00 178.83 178.48 2jer h ASP 249 N 0.95 0.78 -0.38 1.46 3.58 -1.21 -1.47 116.42 120.12 2jer h ASP 249 Ca 0.26 -0.44 0.03 0.00 0.42 0.00 0.00 57.03 57.30 2jer h ASP 249 Cb -0.10 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 40.70 2jer h ASP 249 CO -0.06 1.05 0.19 0.00 -2.88 0.00 0.00 179.24 177.54 2jer h ALA 250 N 0.75 0.47 -0.07 -0.78 0.00 -1.21 -0.80 119.26 117.62 2jer h ALA 250 Ca 0.06 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2jer h ALA 250 Cb 0.79 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2jer h ALA 250 CO 0.06 -0.18 -0.02 -0.92 0.00 0.00 0.00 179.25 178.19 2jer h TYR 251 N 0.38 -0.04 -0.64 0.00 3.20 -1.25 -1.16 116.97 117.46 2jer h TYR 251 Ca 0.16 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.04 2jer h TYR 251 Cb 0.08 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 2jer h TYR 251 CO -0.10 -0.03 0.40 1.96 -1.64 0.00 0.00 178.16 178.74 2jer h GLN 252 N -0.00 0.87 -0.34 1.82 4.20 -1.03 -2.47 115.11 118.16 2jer h GLN 252 Ca 0.04 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.69 2jer h GLN 252 Cb 0.06 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 2jer h GLN 252 CO -0.08 0.61 0.18 0.00 -0.67 0.00 0.00 178.83 178.88 2jer h ARG 253 N 0.87 0.37 -0.30 1.46 3.08 -0.90 -3.04 114.38 115.91 2jer h ARG 253 Ca 0.23 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.21 2jer h ARG 253 Cb -0.04 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2jer h ARG 253 CO -0.05 0.24 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.01 2jer h LEU 254 N 0.38 0.44 -0.14 3.04 3.38 -0.86 -0.88 115.31 120.67 2jer h LEU 254 Ca 0.14 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jer h LEU 254 Cb 0.03 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2jer h LEU 254 CO -0.08 0.52 0.00 0.18 0.09 0.00 0.00 178.44 179.15 2jer n LEU 255 N -4.29 0.13 -0.56 1.67 4.77 -0.96 -2.14 117.00 115.63 2jer n LEU 255 Ca 0.01 0.53 0.07 0.00 -0.03 0.00 0.00 56.01 56.59 2jer n LEU 255 Cb 0.24 -0.51 0.07 0.00 -2.33 0.00 0.00 43.42 40.88 2jer n LEU 255 CO 0.39 -0.30 0.48 0.29 -1.33 0.00 0.00 177.39 176.91 2jer n LYS 256 N -1.65 1.03 -3.84 3.23 5.02 -0.36 -4.96 118.16 116.63 2jer n LYS 256 Ca 0.03 -1.37 -0.36 0.00 -2.02 0.00 0.00 58.31 54.59 2jer n LYS 256 Cb 0.19 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 2jer n LYS 256 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2jer s MET 257 N -1.13 3.49 0.06 1.97 -1.94 -0.91 -5.04 119.30 115.80 2jer s MET 257 Ca 0.17 -0.14 0.09 0.00 -1.71 0.00 0.00 55.69 54.10 2jer s MET 257 Cb 0.12 -3.14 -0.03 0.00 2.01 0.00 0.00 34.83 33.78 2jer s MET 257 CO 0.17 0.72 -0.23 0.95 -0.01 0.00 0.00 175.02 176.62 2jer s THR 258 N -1.17 2.42 0.63 2.05 -4.23 -1.26 -1.56 115.64 112.52 2jer s THR 258 Ca 0.21 -1.37 -0.10 0.00 -1.18 0.00 0.00 61.69 59.25 2jer s THR 258 Cb -0.13 -2.00 0.14 0.00 1.34 0.00 0.00 72.50 71.86 2jer s THR 258 CO 0.11 0.31 0.85 -0.90 -0.54 0.00 0.00 174.62 174.45 2jer n ASP 259 N 1.54 0.12 0.26 3.99 5.68 -0.39 -4.87 116.55 122.88 2jer n ASP 259 Ca -0.17 -1.34 0.11 0.00 -0.50 0.00 0.00 54.79 52.89 2jer n ASP 259 Cb 0.52 -0.65 0.71 0.00 -1.14 0.00 0.00 41.12 40.57 2jer n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jer h ALA 260 N -1.78 1.55 -0.36 2.12 0.00 -1.83 0.23 119.26 119.19 2jer h ALA 260 Ca -0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2jer h ALA 260 Cb 0.77 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2jer h ALA 260 CO 0.20 0.11 0.00 1.63 0.00 0.00 0.00 179.25 181.19 2jer n LYS 261 N -3.99 1.96 -0.88 0.00 5.02 -1.26 -4.93 118.16 114.08 2jer n LYS 261 Ca -0.02 -1.48 0.00 0.00 -2.02 0.00 0.00 58.31 54.78 2jer n LYS 261 Cb 0.17 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2jer n LYS 261 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jer n GLY 262 N 1.19 0.63 3.72 0.72 0.00 0.07 -5.02 105.19 106.50 2jer n GLY 262 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2jer n GLY 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jer s ARG 263 N -0.12 4.54 0.08 1.61 0.52 -1.26 -4.75 118.95 119.58 2jer s ARG 263 Ca 0.00 1.57 -0.31 0.00 -0.52 0.00 0.00 55.73 56.47 2jer s ARG 263 Cb 0.00 -3.39 -0.08 0.00 0.52 0.00 0.00 34.95 32.00 2jer s ARG 263 CO 0.00 -0.07 1.52 -1.14 0.02 0.00 0.00 175.30 175.63 2jer s GLN 264 N 0.74 4.25 0.16 3.54 2.00 -1.26 -1.26 119.66 127.83 2jer s GLN 264 Ca 0.53 2.19 -0.31 0.00 -2.00 0.00 0.00 55.36 55.77 2jer s GLN 264 Cb -0.25 -3.42 -0.10 0.00 0.80 0.00 0.00 33.01 30.04 2jer s GLN 264 CO 0.29 -0.60 1.54 -0.51 -0.50 0.00 0.00 175.29 175.51 2jer s LEU 265 N 1.93 4.37 -0.23 3.68 1.43 -0.60 -4.94 118.68 124.32 2jer s LEU 265 Ca 0.69 2.58 -0.24 0.00 -1.03 0.00 0.00 54.13 56.13 2jer s LEU 265 Cb -0.38 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.24 2jer s LEU 265 CO 0.30 -0.80 0.79 -0.75 0.23 0.00 0.00 176.35 176.12 2jer s LYS 266 N 1.10 4.19 -0.21 1.70 2.20 -0.66 -4.84 119.74 123.22 2jer s LYS 266 Ca 0.69 0.87 -0.07 0.00 -0.36 0.00 0.00 55.97 57.11 2jer s LYS 266 Cb -0.43 -3.63 -0.03 0.00 -1.51 0.00 0.00 37.83 32.23 2jer s LYS 266 CO 0.31 -0.45 0.04 0.08 -0.36 0.00 0.00 175.35 174.97 2jer s VAL 267 N 2.62 4.35 -0.20 4.02 1.01 -1.26 -0.80 120.40 130.14 2jer s VAL 267 Ca 0.34 -0.18 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 2jer s VAL 267 Cb -0.16 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 2jer s VAL 267 CO 0.08 0.40 0.04 -1.00 0.00 0.00 0.00 175.10 174.62 2jer s HIS 268 N 1.01 3.13 0.20 5.22 3.76 0.92 -4.99 115.29 124.54 2jer s HIS 268 Ca 0.03 -0.22 -0.30 0.00 -0.15 0.00 0.00 55.06 54.43 2jer s HIS 268 Cb -0.14 -2.10 -0.08 0.00 1.11 0.00 0.00 32.58 31.37 2jer s HIS 268 CO 0.03 -0.09 1.16 0.15 -0.85 0.00 0.00 174.74 175.14 2jer s LYS 269 N 0.81 4.54 -0.10 1.40 1.02 -1.26 -0.27 119.74 125.88 2jer s LYS 269 Ca 0.02 1.83 0.04 0.00 0.02 0.00 0.00 55.97 57.88 2jer s LYS 269 Cb -0.14 -3.24 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 2jer s LYS 269 CO 0.02 -0.00 -0.23 -1.17 -0.92 0.00 0.00 175.35 173.05 2jer s LEU 270 N -0.50 2.05 1.07 3.17 2.96 0.37 -4.85 118.68 122.95 2jer s LEU 270 Ca 0.51 -0.54 -0.13 0.00 -0.22 0.00 0.00 54.13 53.75 2jer s LEU 270 Cb -0.32 -1.36 0.23 0.00 0.50 0.00 0.00 46.19 45.24 2jer s LEU 270 CO 0.37 0.14 1.07 0.00 -1.32 0.00 0.00 176.35 176.61 2jer n PRO 273 N 0.18 1.66 -0.13 0.00 -0.02 -1.26 -4.86 135.00 130.56 2jer n PRO 273 Ca -0.12 0.58 -0.11 0.00 -2.02 0.00 0.00 63.50 61.83 2jer n PRO 273 Cb 0.56 -2.05 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 2jer n PRO 273 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2jer h VAL 274 N 2.30 1.28 -2.97 -1.45 2.07 -1.97 -3.44 116.25 112.06 2jer h VAL 274 Ca -0.42 -1.23 -0.67 0.00 0.82 0.00 0.00 66.70 65.20 2jer h VAL 274 Cb 1.32 1.26 -0.10 0.00 -1.52 0.00 0.00 31.29 32.24 2jer h VAL 274 CO 0.63 0.41 -0.55 -0.54 0.02 0.00 0.00 177.57 177.54 2jer s LYS 275 N -4.73 3.21 0.41 1.57 1.02 -1.26 -5.05 119.74 114.90 2jer s LYS 275 Ca -0.12 -0.32 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 2jer s LYS 275 Cb 0.10 -2.98 -0.09 0.00 -0.52 0.00 0.00 37.83 34.35 2jer s LYS 275 CO 0.82 0.72 1.28 -0.80 -0.92 0.00 0.00 175.35 176.45 2jer s ASN 276 N -1.23 6.33 -0.12 2.83 0.01 -1.26 -5.02 114.94 116.48 2jer s ASN 276 Ca 0.17 2.60 -0.18 0.00 -0.71 0.00 0.00 52.86 54.74 2jer s ASN 276 Cb -0.12 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.87 2jer s ASN 276 CO 0.07 -0.83 0.46 -0.69 -1.51 0.00 0.00 177.10 174.60 2jer s VAL 277 N -1.29 5.20 0.07 1.60 1.01 -1.26 -5.03 120.40 120.70 2jer s VAL 277 Ca 0.57 0.91 0.06 0.00 0.00 0.00 0.00 61.98 63.52 2jer s VAL 277 Cb -0.37 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2jer s VAL 277 CO 0.47 0.34 -0.16 0.42 0.00 0.00 0.00 175.10 176.17 2jer s THR 278 N 0.56 1.25 0.27 3.92 -4.23 -1.26 -0.10 115.64 116.05 2jer s THR 278 Ca 0.25 -1.33 -0.30 0.00 -1.18 0.00 0.00 61.69 59.14 2jer s THR 278 Cb -0.15 -1.17 -0.10 0.00 1.34 0.00 0.00 72.50 72.41 2jer s THR 278 CO 0.10 -0.16 1.42 -0.63 -0.54 0.00 0.00 174.62 174.80 2jer s ILE 279 N -1.20 2.63 -0.10 2.99 -1.09 -0.56 -4.91 121.20 118.95 2jer s ILE 279 Ca 0.00 0.55 -0.15 0.00 -2.23 0.00 0.00 60.65 58.82 2jer s ILE 279 Cb -0.10 -3.35 -0.05 0.00 -1.58 0.00 0.00 42.46 37.38 2jer s ILE 279 CO 0.03 0.10 0.38 -0.54 -1.23 0.00 0.00 174.94 173.68 2jer s LYS 280 N -0.77 4.17 4.73 2.79 -0.14 -1.26 -0.82 119.74 128.44 2jer s LYS 280 Ca 0.57 0.29 0.00 0.00 -1.36 0.00 0.00 55.97 55.47 2jer s LYS 280 Cb -0.42 -3.37 0.00 0.00 -1.68 0.00 0.00 37.83 32.37 2jer s LYS 280 CO 0.47 0.35 0.00 0.41 -0.76 0.00 0.00 175.35 175.81 2jer n GLY 281 N 2.88 0.94 0.00 -3.33 0.00 -1.26 -1.37 105.19 103.05 2jer n GLY 281 Ca -0.11 0.40 0.13 0.00 0.00 0.00 0.00 46.02 46.44 2jer n GLY 281 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jer n SER 282 N 9.17 0.00 -4.75 1.61 3.41 -1.26 -4.85 113.62 116.95 2jer n SER 282 Ca 0.00 -0.32 -0.41 0.00 -0.26 0.00 0.00 58.87 57.88 2jer n SER 282 Cb 0.00 -0.19 -0.02 0.00 -0.26 0.00 0.00 64.21 63.74 2jer n SER 282 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2jer s PHE 283 N -2.38 3.00 -0.94 7.33 2.99 -0.47 -4.93 117.98 122.59 2jer s PHE 283 Ca 0.29 1.14 -0.16 0.00 0.00 0.00 0.00 56.93 58.20 2jer s PHE 283 Cb 0.17 -3.79 0.18 0.00 0.00 0.00 0.00 43.02 39.58 2jer s PHE 283 CO 0.36 -2.46 1.03 0.15 -0.00 0.00 0.00 175.22 174.29 2jer s LYS 284 N -0.83 3.70 -0.05 0.44 -0.14 -1.26 -4.97 119.74 116.62 2jer s LYS 284 Ca 0.56 -2.22 0.03 0.00 -1.36 0.00 0.00 55.97 52.99 2jer s LYS 284 Cb -0.41 -4.73 0.00 0.00 -1.68 0.00 0.00 37.83 31.01 2jer s LYS 284 CO 0.47 -1.56 -0.15 0.42 -0.76 0.00 0.00 175.35 173.77 2jer s ILE 285 N 1.35 1.33 0.32 2.17 1.01 -1.26 -1.58 121.20 124.54 2jer s ILE 285 Ca 0.28 -0.63 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 2jer s ILE 285 Cb -0.07 -1.17 -0.09 0.00 0.01 0.00 0.00 42.46 41.14 2jer s ILE 285 CO -0.08 0.39 1.14 -1.81 0.00 0.00 0.00 174.94 174.58 2jer s ASP 286 N 0.28 6.99 -0.16 3.58 1.11 0.28 -4.97 116.67 123.79 2jer s ASP 286 Ca -0.09 2.34 -0.15 0.00 0.18 0.00 0.00 52.55 54.83 2jer s ASP 286 Cb -0.13 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.19 2jer s ASP 286 CO 0.03 -0.34 0.35 0.12 1.18 0.00 0.00 175.17 176.51 2jer s PHE 287 N -1.25 3.46 -0.06 4.23 5.36 -1.26 -4.32 117.98 124.14 2jer s PHE 287 Ca 0.49 0.67 0.00 0.00 -0.96 0.00 0.00 56.93 57.13 2jer s PHE 287 Cb -0.32 -2.42 0.02 0.00 -0.34 0.00 0.00 43.02 39.96 2jer s PHE 287 CO 0.41 0.18 -0.03 0.08 -1.46 0.00 0.00 175.22 174.41 2jer s VAL 288 N 0.63 0.47 0.09 3.12 1.01 -1.26 -5.09 120.40 119.37 2jer s VAL 288 Ca 0.19 -0.03 -0.33 0.00 0.00 0.00 0.00 61.98 61.82 2jer s VAL 288 Cb -0.14 -0.55 -0.12 0.00 0.00 0.00 0.00 36.38 35.57 2jer s VAL 288 CO 0.06 0.24 1.77 1.21 0.00 0.00 0.00 175.10 178.38 2jer n GLU 289 N 4.48 2.48 0.00 2.72 4.07 -1.26 -0.86 120.64 132.28 2jer n GLU 289 Ca -0.18 0.90 0.00 0.00 -0.06 0.00 0.00 57.16 57.82 2jer n GLU 289 Cb 0.50 -2.75 0.00 0.00 -0.06 0.00 0.00 31.44 29.13 2jer n GLU 289 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jer n GLY 290 N 4.03 2.44 3.77 8.31 0.00 -1.26 -4.99 105.19 117.49 2jer n GLY 290 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2jer n GLY 290 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jer s THR 291 N -2.64 5.36 -0.35 2.61 2.01 -0.04 -3.53 115.64 119.06 2jer s THR 291 Ca 0.00 0.38 -0.40 0.00 0.31 0.00 0.00 61.69 61.97 2jer s THR 291 Cb 0.00 -3.53 -0.16 0.00 0.01 0.00 0.00 72.50 68.82 2jer s THR 291 CO 0.00 0.47 1.89 0.80 -0.69 0.00 0.00 174.62 177.09 2jer n MET 292 N 3.06 0.84 -1.95 4.92 1.56 -0.27 -4.67 117.12 120.62 2jer n MET 292 Ca -0.15 0.29 -0.37 0.00 -0.27 0.00 0.00 57.70 57.20 2jer n MET 292 Cb 0.53 -2.03 0.04 0.00 2.15 0.00 0.00 33.22 33.90 2jer n MET 292 CO 0.00 0.00 0.00 -2.14 -0.73 0.00 0.00 175.97 173.10 2jer s PRO 293 N 4.47 3.02 -0.46 2.12 0.02 -1.26 -4.92 135.00 138.00 2jer s PRO 293 Ca 1.05 1.94 0.02 0.00 0.02 0.00 0.00 61.00 64.03 2jer s PRO 293 Cb -1.13 -2.03 0.12 0.00 0.02 0.00 0.00 34.50 31.48 2jer s PRO 293 CO 0.64 -1.19 0.20 1.03 -0.33 0.00 0.00 177.00 177.35 2jer s ARG 294 N -3.18 1.89 0.16 5.54 1.81 -1.26 -5.10 118.95 118.81 2jer s ARG 294 Ca 0.76 -2.24 0.07 0.00 -1.72 0.00 0.00 55.73 52.60 2jer s ARG 294 Cb -0.33 -3.38 -0.04 0.00 -0.45 0.00 0.00 34.95 30.75 2jer s ARG 294 CO 0.37 -1.05 -0.01 -1.21 -0.68 0.00 0.00 175.30 172.72 2jer s GLU 295 N 0.36 2.40 0.14 3.54 2.02 -1.26 -4.87 118.70 121.02 2jer s GLU 295 Ca 0.14 -1.07 -0.35 0.00 0.02 0.00 0.00 54.97 53.72 2jer s GLU 295 Cb -0.22 -2.38 -0.15 0.00 0.10 0.00 0.00 34.13 31.48 2jer s GLU 295 CO -0.04 0.47 1.45 -3.47 0.02 0.00 0.00 175.26 173.69 2jer n ASP 296 N 0.04 2.43 0.00 -0.19 2.03 -1.26 -1.46 116.55 118.14 2jer n ASP 296 Ca -0.10 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.31 2jer n ASP 296 Cb 0.54 -1.33 0.00 0.00 -0.72 0.00 0.00 41.12 39.62 2jer n ASP 296 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jer n GLY 297 N 2.89 1.71 3.66 0.27 0.00 0.00 -4.86 105.19 108.87 2jer n GLY 297 Ca 0.17 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 2jer n GLY 297 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jer n ASP 298 N 0.00 2.98 -4.66 1.61 8.00 -0.53 -4.75 116.55 119.19 2jer n ASP 298 Ca 0.00 1.07 -0.43 0.00 0.71 0.00 0.00 54.79 56.14 2jer n ASP 298 Cb 0.00 -1.39 -0.02 0.00 -0.02 0.00 0.00 41.12 39.69 2jer n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jer s ILE 299 N 1.45 4.71 0.22 0.53 1.01 -1.26 -1.50 121.20 126.37 2jer s ILE 299 Ca 0.82 2.00 -0.16 0.00 0.00 0.00 0.00 60.65 63.30 2jer s ILE 299 Cb -0.72 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 37.38 2jer s ILE 299 CO 0.42 -0.13 0.66 0.00 0.00 0.00 0.00 174.94 175.89 2jer s ILE 301 N -1.62 4.25 -0.67 0.00 -1.09 -1.26 -4.52 121.20 116.29 2jer s ILE 301 Ca 0.44 -1.95 -0.17 0.00 -2.23 0.00 0.00 60.65 56.74 2jer s ILE 301 Cb -0.14 -5.14 0.14 0.00 -1.58 0.00 0.00 42.46 35.74 2jer s ILE 301 CO 0.20 -1.96 0.71 0.00 -1.23 0.00 0.00 174.94 172.66 2jer s ALA 302 N 3.86 3.64 -0.07 9.38 0.00 -1.26 -4.77 121.76 132.54 2jer s ALA 302 Ca 0.52 -2.65 0.04 0.00 0.00 0.00 0.00 51.96 49.87 2jer s ALA 302 Cb 0.03 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 2jer s ALA 302 CO 0.05 -2.31 -0.18 0.45 0.00 0.00 0.00 175.76 173.77 2jer s SER 303 N 3.25 3.63 0.17 0.00 0.15 -1.26 -4.44 113.70 115.21 2jer s SER 303 Ca 0.13 -0.36 0.22 0.00 0.70 0.00 0.00 55.95 56.64 2jer s SER 303 Cb -0.20 -1.04 0.88 0.00 -1.71 0.00 0.00 66.02 63.96 2jer s SER 303 CO -0.00 0.26 1.67 -1.22 1.20 0.00 0.00 173.24 175.15 2jer n TYR 304 N 2.88 0.57 0.31 3.44 4.02 -1.26 -3.08 117.16 124.03 2jer n TYR 304 Ca -0.17 0.21 0.16 0.00 -0.01 0.00 0.00 57.90 58.09 2jer n TYR 304 Cb 0.52 -0.84 0.68 0.00 -0.02 0.00 0.00 39.34 39.68 2jer n TYR 304 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 176.86 177.83 2jer h MET 305 N 0.00 0.00 -2.39 -0.72 4.05 -1.85 -3.33 114.93 110.68 2jer h MET 305 Ca 0.00 0.00 -0.47 0.00 -0.28 0.00 0.00 59.70 58.95 2jer h MET 305 Cb 0.40 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.13 2jer h MET 305 CO 0.00 0.00 1.42 -1.71 0.23 0.00 0.00 176.91 176.85 2jer n ASN 306 N -2.90 6.92 -4.91 1.39 2.85 -1.18 -4.80 115.26 112.63 2jer n ASN 306 Ca 0.01 -2.73 -0.21 0.00 -0.11 0.00 0.00 54.58 51.54 2jer n ASN 306 Cb 0.27 -1.42 -0.02 0.00 1.24 0.00 0.00 39.78 39.85 2jer n ASN 306 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 2jer s PHE 307 N 0.55 3.12 -0.18 1.20 -0.12 -1.25 -1.40 117.98 119.91 2jer s PHE 307 Ca 0.65 -0.18 -0.03 0.00 -0.05 0.00 0.00 56.93 57.32 2jer s PHE 307 Cb 0.27 -1.73 -0.01 0.00 -0.63 0.00 0.00 43.02 40.91 2jer s PHE 307 CO -0.07 0.24 -0.07 -1.17 -0.05 0.00 0.00 175.22 174.10 2jer s LEU 308 N -4.02 2.91 -0.12 -1.99 0.20 -0.59 -4.38 118.68 110.68 2jer s LEU 308 Ca 0.39 -0.31 -0.24 0.00 0.69 0.00 0.00 54.13 54.66 2jer s LEU 308 Cb -0.08 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 43.95 2jer s LEU 308 CO 0.28 0.09 0.77 -0.63 -0.29 0.00 0.00 176.35 176.57 2jer s ILE 309 N 0.85 4.95 -0.30 6.68 1.01 -1.26 -0.91 121.20 132.21 2jer s ILE 309 Ca -0.02 1.55 -0.00 0.00 0.00 0.00 0.00 60.65 62.17 2jer s ILE 309 Cb -0.15 -4.09 0.13 0.00 0.01 0.00 0.00 42.46 38.36 2jer s ILE 309 CO 0.01 0.13 0.28 0.28 0.00 0.00 0.00 174.94 175.63 2jer s THR 310 N 1.56 -0.32 0.00 2.92 -1.32 0.16 -4.73 115.64 113.91 2jer s THR 310 Ca 0.38 -0.66 0.00 0.00 -1.21 0.00 0.00 61.69 60.20 2jer s THR 310 Cb -0.17 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 2jer s THR 310 CO 0.15 -0.55 0.00 0.59 -2.21 0.00 0.00 174.62 172.60 2jer n ASN 311 N 5.09 0.00 -0.44 8.08 5.03 -1.26 -1.51 115.26 130.25 2jer n ASN 311 Ca -0.00 0.00 0.06 0.00 0.87 0.00 0.00 54.58 55.51 2jer n ASN 311 Cb 0.45 0.00 0.20 0.00 -1.02 0.00 0.00 39.78 39.41 2jer n ASN 311 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2jer n ASP 312 N 6.88 1.29 -4.30 6.41 8.00 -1.26 -4.88 116.55 128.69 2jer n ASP 312 Ca 0.00 -1.89 -0.18 0.00 0.71 0.00 0.00 54.79 53.43 2jer n ASP 312 Cb 0.00 -0.14 -0.10 0.00 -0.02 0.00 0.00 41.12 40.86 2jer n ASP 312 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2jer s GLY 313 N -1.17 1.28 -0.07 0.44 0.00 -0.57 -0.68 107.32 106.56 2jer s GLY 313 Ca 0.21 -1.52 0.01 0.00 0.00 0.00 0.00 44.72 43.43 2jer s GLY 313 CO 0.15 -1.60 -0.08 0.14 0.00 0.00 0.00 173.10 171.72 2jer s VAL 314 N -2.67 0.86 -0.32 1.40 1.01 -0.25 -0.67 120.40 119.78 2jer s VAL 314 Ca 0.17 -0.29 -0.09 0.00 0.00 0.00 0.00 61.98 61.78 2jer s VAL 314 Cb -0.02 -0.85 0.01 0.00 0.00 0.00 0.00 36.38 35.52 2jer s VAL 314 CO 0.05 0.31 0.14 -0.63 0.00 0.00 0.00 175.10 174.96 2jer s ILE 315 N 1.01 4.35 -0.09 2.22 -1.09 -0.09 -0.54 121.20 126.97 2jer s ILE 315 Ca -0.09 -0.62 0.02 0.00 -2.23 0.00 0.00 60.65 57.73 2jer s ILE 315 Cb -0.14 -3.28 -0.02 0.00 -1.58 0.00 0.00 42.46 37.44 2jer s ILE 315 CO -0.00 0.00 -0.13 -0.69 -1.23 0.00 0.00 174.94 172.89 2jer s VAL 316 N 1.56 3.11 0.47 2.92 1.01 0.34 -1.55 120.40 128.26 2jer s VAL 316 Ca 0.03 -0.68 -0.24 0.00 0.00 0.00 0.00 61.98 61.10 2jer s VAL 316 Cb -0.18 -2.26 -0.08 0.00 0.00 0.00 0.00 36.38 33.86 2jer s VAL 316 CO 0.05 0.56 1.23 -2.65 0.00 0.00 0.00 175.10 174.29 2jer n PRO 317 N 2.85 1.71 -4.42 2.72 -0.02 -1.26 -1.68 135.00 134.89 2jer n PRO 317 Ca -0.18 0.62 -0.23 0.00 -2.02 0.00 0.00 63.50 61.69 2jer n PRO 317 Cb 0.52 -2.38 -0.17 0.00 -0.02 0.00 0.00 33.50 31.46 2jer n PRO 317 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2jer s GLN 318 N -2.42 1.43 0.00 -0.52 -1.52 -0.44 -4.74 119.66 111.45 2jer s GLN 318 Ca 0.65 -0.31 0.09 0.00 -1.95 0.00 0.00 55.36 53.84 2jer s GLN 318 Cb -0.48 -1.25 0.06 0.00 -0.22 0.00 0.00 33.01 31.12 2jer s GLN 318 CO 0.55 -0.02 0.75 0.66 -0.25 0.00 0.00 175.29 176.97 2jer n TYR 319 N 3.95 0.00 -0.86 0.91 4.02 -1.26 -1.23 117.16 122.68 2jer n TYR 319 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 2jer n TYR 319 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 2jer n TYR 319 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jer n GLY 320 N 0.61 0.47 3.94 2.72 0.00 -1.26 -4.77 105.19 106.90 2jer n GLY 320 Ca 0.05 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.89 2jer n GLY 320 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jer s ASP 321 N -2.85 6.34 0.55 1.61 2.15 -1.26 -4.99 116.67 118.21 2jer s ASP 321 Ca 0.00 0.36 0.22 0.00 0.43 0.00 0.00 52.55 53.56 2jer s ASP 321 Cb 0.00 -1.99 1.45 0.00 -0.30 0.00 0.00 42.92 42.09 2jer s ASP 321 CO 0.00 -0.15 2.13 1.05 -0.17 0.00 0.00 175.17 178.03 2jer h GLU 322 N 1.31 0.00 -0.17 4.34 4.11 -1.97 -1.25 114.58 120.94 2jer h GLU 322 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 2jer h GLU 322 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2jer h GLU 322 CO 0.64 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.81 2jer n ASN 323 N -4.27 1.17 -0.15 3.06 5.03 -1.26 -4.33 115.26 114.51 2jer n ASN 323 Ca -0.00 -1.81 -0.04 0.00 0.87 0.00 0.00 54.58 53.60 2jer n ASN 323 Cb 0.22 -0.11 0.05 0.00 -1.02 0.00 0.00 39.78 38.91 2jer n ASN 323 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 2jer h ASP 324 N 1.41 0.25 -0.32 6.41 3.32 -1.62 -0.67 116.42 125.20 2jer h ASP 324 Ca 0.00 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 56.97 2jer h ASP 324 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2jer h ASP 324 CO 0.00 0.18 -0.29 -0.09 -1.72 0.00 0.00 179.24 177.32 2jer h ARG 325 N 0.40 0.76 -0.78 3.56 2.43 -1.83 -2.71 114.38 116.21 2jer h ARG 325 Ca 0.21 -0.39 0.10 0.00 -0.81 0.00 0.00 59.98 59.09 2jer h ARG 325 Cb 0.17 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.65 2jer h ARG 325 CO -0.18 1.01 0.41 1.25 -1.51 0.00 0.00 179.97 180.95 2jer h LEU 326 N 0.52 0.55 -0.28 3.80 5.85 -1.77 -0.88 115.31 123.10 2jer h LEU 326 Ca 0.05 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.86 2jer h LEU 326 Cb 0.86 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 2jer h LEU 326 CO 0.07 0.30 0.12 0.00 -0.34 0.00 0.00 178.44 178.59 2jer h ALA 327 N 1.46 0.33 -0.93 1.25 0.00 -0.95 -0.31 119.26 120.10 2jer h ALA 327 Ca 0.39 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.33 2jer h ALA 327 Cb 0.41 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 2jer h ALA 327 CO -0.28 -0.28 0.62 -0.07 0.00 0.00 0.00 179.25 179.24 2jer h LEU 328 N 0.25 1.07 -0.35 0.00 3.38 -1.05 -1.11 115.31 117.50 2jer h LEU 328 Ca 0.12 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jer h LEU 328 Cb 0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2jer h LEU 328 CO -0.11 0.77 0.20 -0.33 0.09 0.00 0.00 178.44 179.07 2jer h GLU 329 N 1.26 0.48 -0.54 1.13 5.08 -0.76 -0.84 114.58 120.38 2jer h GLU 329 Ca 0.34 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.59 2jer h GLU 329 Cb -0.14 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 2jer h GLU 329 CO -0.08 0.38 0.09 1.96 -1.00 0.00 0.00 179.01 180.37 2jer h GLN 330 N 0.45 0.90 -0.39 2.33 4.20 -0.80 -2.08 115.11 119.72 2jer h GLN 330 Ca 0.12 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.48 2jer h GLN 330 Cb 0.03 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2jer h GLN 330 CO -0.02 0.87 -0.21 0.28 -0.67 0.00 0.00 178.83 179.08 2jer h VAL 331 N 0.79 1.27 -0.89 -0.54 2.07 -1.12 -2.52 116.25 115.31 2jer h VAL 331 Ca 0.16 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.39 2jer h VAL 331 Cb 0.41 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.33 2jer h VAL 331 CO 0.01 0.44 0.58 -0.61 0.02 0.00 0.00 177.57 178.01 2jer h GLN 332 N 0.67 1.12 0.00 1.57 5.75 -0.86 -1.54 115.11 121.82 2jer h GLN 332 Ca 0.09 -0.07 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 2jer h GLN 332 Cb 0.71 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 2jer h GLN 332 CO 0.05 0.74 -0.37 1.79 -2.65 0.00 0.00 178.83 178.40 2jer h THR 333 N 1.16 1.12 -0.18 2.39 1.35 -1.06 -2.23 112.91 115.46 2jer h THR 333 Ca 0.34 -1.32 -0.12 0.00 -0.55 0.00 0.00 66.41 64.76 2jer h THR 333 Cb -0.06 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 68.09 2jer h THR 333 CO -0.10 0.36 -0.41 0.24 -0.25 0.00 0.00 175.52 175.36 2jer h MET 334 N 0.00 0.42 -2.27 4.72 2.86 -0.91 -3.35 114.93 116.40 2jer h MET 334 Ca -0.00 -0.21 -0.59 0.00 -2.06 0.00 0.00 59.70 56.83 2jer h MET 334 Cb 0.71 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 31.97 2jer h MET 334 CO 0.05 0.77 -0.76 1.19 1.06 0.00 0.00 176.91 179.21 2jer n PHE 335 N -4.02 2.12 0.29 -0.22 3.01 -0.67 -4.98 117.46 112.99 2jer n PHE 335 Ca -0.02 -3.95 0.14 0.00 1.01 0.00 0.00 57.45 54.64 2jer n PHE 335 Cb 0.51 -0.45 0.87 0.00 -0.01 0.00 0.00 39.48 40.40 2jer n PHE 335 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2jer h PRO 336 N 4.40 0.00 -0.42 -1.08 0.13 -1.56 -1.99 132.00 131.47 2jer h PRO 336 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2jer h PRO 336 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2jer h PRO 336 CO 0.68 0.01 0.00 -0.25 -0.23 0.00 0.00 178.00 178.21 2jer n ASP 337 N -3.90 3.53 -4.85 1.44 10.43 -1.26 -4.95 116.55 116.99 2jer n ASP 337 Ca -0.03 -2.00 -0.23 0.00 2.57 0.00 0.00 54.79 55.10 2jer n ASP 337 Cb 0.10 -0.27 -0.04 0.00 1.84 0.00 0.00 41.12 42.74 2jer n ASP 337 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2jer s LYS 338 N -1.45 3.05 -0.21 -1.24 1.02 -0.75 -5.00 119.74 115.16 2jer s LYS 338 Ca 0.40 -0.92 -0.21 0.00 0.02 0.00 0.00 55.97 55.26 2jer s LYS 338 Cb 0.23 -2.67 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2jer s LYS 338 CO 0.32 0.44 0.64 0.21 -0.92 0.00 0.00 175.35 176.04 2jer s LYS 339 N -3.64 4.19 -0.25 1.68 2.20 0.14 -4.95 119.74 119.11 2jer s LYS 339 Ca 0.33 0.63 -0.13 0.00 -0.36 0.00 0.00 55.97 56.43 2jer s LYS 339 Cb -0.09 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 2jer s LYS 339 CO 0.26 -0.30 0.29 0.42 -0.36 0.00 0.00 175.35 175.66 2jer s ILE 340 N 2.11 5.25 -0.21 5.43 -1.09 -1.26 -1.09 121.20 130.34 2jer s ILE 340 Ca 0.29 0.43 0.01 0.00 -2.23 0.00 0.00 60.65 59.15 2jer s ILE 340 Cb -0.16 -3.63 0.03 0.00 -1.58 0.00 0.00 42.46 37.13 2jer s ILE 340 CO 0.10 0.23 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.18 2jer s VAL 341 N 1.67 2.13 0.22 2.92 1.01 0.29 -4.96 120.40 123.68 2jer s VAL 341 Ca 0.12 -1.15 -0.22 0.00 0.00 0.00 0.00 61.98 60.74 2jer s VAL 341 Cb -0.15 -2.01 -0.08 0.00 0.00 0.00 0.00 36.38 34.13 2jer s VAL 341 CO 0.09 0.36 0.77 -0.83 0.00 0.00 0.00 175.10 175.48 2jer s GLY 342 N 1.24 2.73 -0.03 4.51 0.00 -1.26 -0.50 107.32 114.00 2jer s GLY 342 Ca 0.01 0.26 0.02 0.00 0.00 0.00 0.00 44.72 45.02 2jer s GLY 342 CO -0.10 0.68 -0.09 0.14 0.00 0.00 0.00 173.10 173.72 2jer s VAL 343 N -1.42 0.82 -0.40 1.40 1.01 -0.68 -4.91 120.40 116.22 2jer s VAL 343 Ca 0.42 -0.38 -0.28 0.00 0.00 0.00 0.00 61.98 61.74 2jer s VAL 343 Cb -0.19 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 2jer s VAL 343 CO 0.23 0.26 1.72 0.20 0.00 0.00 0.00 175.10 177.50 2jer s ASN 344 N 0.24 5.89 -0.12 3.32 0.01 -1.26 -1.33 114.94 121.68 2jer s ASN 344 Ca -0.04 1.02 0.14 0.00 -0.71 0.00 0.00 52.86 53.27 2jer s ASN 344 Cb -0.09 -2.53 0.30 0.00 0.41 0.00 0.00 41.25 39.34 2jer s ASN 344 CO 0.01 -1.76 1.15 0.35 -1.51 0.00 0.00 177.10 175.34 2jer n THR 345 N 7.30 1.45 -0.07 1.60 -2.24 -0.36 -4.75 114.28 117.21 2jer n THR 345 Ca 0.21 -2.07 0.09 0.00 -2.27 0.00 0.00 64.05 60.01 2jer n THR 345 Cb 0.48 0.04 0.47 0.00 -2.10 0.00 0.00 70.33 69.21 2jer n THR 345 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2jer h VAL 346 N 2.32 0.96 0.00 2.28 3.04 -1.86 -1.44 116.25 121.56 2jer h VAL 346 Ca -0.03 -0.16 -0.04 0.00 -1.01 0.00 0.00 66.70 65.46 2jer h VAL 346 Cb 1.18 0.44 -0.01 0.00 -2.01 0.00 0.00 31.29 30.90 2jer h VAL 346 CO 0.01 0.09 -0.18 -0.33 -1.01 0.00 0.00 177.57 176.15 2jer h GLU 347 N 0.48 0.00 -0.05 4.17 4.39 -1.93 -2.04 114.58 119.61 2jer h GLU 347 Ca 0.25 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.69 2jer h GLU 347 Cb 0.35 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.02 2jer h GLU 347 CO -0.07 0.18 -0.95 0.28 -1.16 0.00 0.00 179.01 177.29 2jer h VAL 348 N 0.00 1.28 0.00 3.13 2.07 -1.58 -3.32 116.25 117.83 2jer h VAL 348 Ca -0.00 -2.15 -0.04 0.00 0.82 0.00 0.00 66.70 65.33 2jer h VAL 348 Cb 0.35 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 2jer h VAL 348 CO 0.02 0.67 -0.17 1.62 0.02 0.00 0.00 177.57 179.74 2jer h VAL 349 N 0.44 0.89 -0.05 2.57 3.04 -0.82 -1.23 116.25 121.08 2jer h VAL 349 Ca -0.10 -0.62 0.02 0.00 -1.01 0.00 0.00 66.70 64.98 2jer h VAL 349 Cb 1.60 1.36 -0.00 0.00 -2.01 0.00 0.00 31.29 32.23 2jer h VAL 349 CO 0.19 0.16 0.04 1.88 -1.01 0.00 0.00 177.57 178.84 2jer h TYR 350 N 0.00 0.00 -0.06 3.17 0.99 -1.56 -1.79 116.97 117.72 2jer h TYR 350 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2jer h TYR 350 Cb 0.35 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.08 2jer h TYR 350 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2jer n GLY 351 N -1.46 0.30 0.00 3.88 0.00 -0.47 -4.95 105.19 102.50 2jer n GLY 351 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2jer n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 352 N 1.21 1.05 0.00 -0.02 0.00 -0.67 -5.06 105.19 101.70 2jer n GLY 352 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2jer n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 353 N -0.52 1.94 0.00 -0.02 0.00 -1.25 -4.86 105.19 100.47 2jer n GLY 353 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2jer n GLY 353 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jer n ASN 354 N -0.06 0.00 -0.26 1.61 5.15 -1.26 -2.79 115.26 117.65 2jer n ASN 354 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2jer n ASN 354 Cb 0.00 0.00 0.12 0.00 -0.53 0.00 0.00 39.78 39.37 2jer n ASN 354 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 2jer h ILE 355 N 0.00 0.96 0.00 -1.44 2.04 -1.91 -2.00 117.51 115.17 2jer h ILE 355 Ca 0.00 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2jer h ILE 355 Cb 0.00 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.21 2jer h ILE 355 CO 0.00 0.14 0.00 1.57 0.00 0.00 0.00 178.15 179.86 2jer n HIS 356 N -4.75 0.00 0.00 1.37 -0.00 -0.49 -3.17 115.22 108.18 2jer n HIS 356 Ca 0.10 -0.09 0.00 0.00 0.46 0.00 0.00 57.72 58.20 2jer n HIS 356 Cb 0.20 -0.13 0.00 0.00 -0.12 0.00 0.00 29.99 29.94 2jer n HIS 356 CO 0.00 0.00 0.00 0.44 0.46 0.00 0.00 176.34 177.24 2jer n ILE 358 N 0.97 0.00 -4.30 3.57 -5.35 -0.75 -4.54 119.36 108.95 2jer n ILE 358 Ca 0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 2jer n ILE 358 Cb 0.08 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 37.88 2jer n ILE 358 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2jer s THR 359 N 0.00 1.38 -0.16 7.28 -4.23 -1.19 -4.25 115.64 114.47 2jer s THR 359 Ca 0.00 -2.12 -0.05 0.00 -1.18 0.00 0.00 61.69 58.34 2jer s THR 359 Cb 0.00 -2.00 0.08 0.00 1.34 0.00 0.00 72.50 71.91 2jer s THR 359 CO 0.00 -0.62 0.31 -1.58 -0.54 0.00 0.00 174.62 172.18 2jer s GLN 360 N -3.72 0.21 0.53 3.99 2.00 -0.66 -2.55 119.66 119.46 2jer s GLN 360 Ca 0.21 0.78 -0.16 0.00 -2.00 0.00 0.00 55.36 54.19 2jer s GLN 360 Cb 0.02 -0.02 -0.07 0.00 0.80 0.00 0.00 33.01 33.73 2jer s GLN 360 CO 0.04 -0.32 1.00 1.14 -0.50 0.00 0.00 175.29 176.65 2jer s GLN 361 N 2.47 3.87 -0.20 1.67 0.00 -1.26 -0.86 119.66 125.35 2jer s GLN 361 Ca 0.01 0.95 0.01 0.00 -0.00 0.00 0.00 55.36 56.33 2jer s GLN 361 Cb -0.12 -2.12 0.04 0.00 0.00 0.00 0.00 33.01 30.80 2jer s GLN 361 CO -0.10 -0.34 -0.12 -2.00 0.00 0.00 0.00 175.29 172.73 2jer s GLU 362 N -4.20 2.21 0.63 9.60 2.12 0.42 -4.70 118.70 124.79 2jer s GLU 362 Ca 0.59 -0.89 -0.15 0.00 0.36 0.00 0.00 54.97 54.87 2jer s GLU 362 Cb -0.10 -2.48 -0.01 0.00 0.26 0.00 0.00 34.13 31.79 2jer s GLU 362 CO 0.34 -0.41 1.09 -1.25 -0.54 0.00 0.00 175.26 174.50 2jer s PRO 363 N 1.35 3.00 0.38 4.30 0.04 -1.26 -0.10 135.00 142.70 2jer s PRO 363 Ca -0.01 1.32 -0.27 0.00 0.04 0.00 0.00 61.00 62.08 2jer s PRO 363 Cb -0.16 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 2jer s PRO 363 CO -0.09 -1.08 1.30 0.15 0.04 0.00 0.00 177.00 177.32 2jer s LYS 364 N -4.08 4.13 0.39 4.56 1.02 -0.20 -4.20 119.74 121.37 2jer s LYS 364 Ca 0.66 2.16 -0.26 0.00 0.02 0.00 0.00 55.97 58.55 2jer s LYS 364 Cb -0.19 -2.88 -0.09 0.00 -0.52 0.00 0.00 37.83 34.15 2jer s LYS 364 CO 0.40 -0.36 1.28 1.03 -0.92 0.00 0.00 175.35 176.77 2jer s ARG 365 N -2.06 4.04 -0.03 1.68 0.52 -1.26 -4.95 118.95 116.89 2jer s ARG 365 Ca 0.54 2.11 0.01 0.00 -0.52 0.00 0.00 55.73 57.86 2jer s ARG 365 Cb -0.38 -2.79 0.02 0.00 0.52 0.00 0.00 34.95 32.31 2jer s ARG 365 CO 0.50 -0.41 -0.04 0.08 0.02 0.00 0.00 175.30 175.45 2jer s VAL 366 N -1.27 0.46 0.00 3.52 1.01 -1.26 -4.89 120.40 117.97 2jer s VAL 366 Ca 0.56 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.42 2jer s VAL 366 Cb -0.37 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.53 2jer s VAL 366 CO 0.48 0.19 0.00 0.61 0.00 0.00 0.00 175.10 176.38 2jer n GLY 367 N 3.83 0.84 0.00 4.51 0.00 -1.26 -1.05 105.19 112.06 2jer n GLY 367 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2jer n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93