#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jer s LYS 3 N 0.00 1.78 0.21 0.00 2.20 -1.26 -5.00 119.74 117.67 2jer s LYS 3 Ca 0.00 -1.18 -0.30 0.00 -0.36 0.00 0.00 55.97 54.13 2jer s LYS 3 Cb 0.00 -2.11 -0.08 0.00 -1.51 0.00 0.00 37.83 34.13 2jer s LYS 3 CO 0.00 0.48 0.95 1.03 -0.36 0.00 0.00 175.35 177.45 2jer s ARG 4 N -2.12 4.81 -0.26 4.03 1.81 -1.26 -1.79 118.95 124.17 2jer s ARG 4 Ca 0.18 1.50 -0.17 0.00 -1.72 0.00 0.00 55.73 55.52 2jer s ARG 4 Cb -0.11 -3.30 -0.03 0.00 -0.45 0.00 0.00 34.95 31.06 2jer s ARG 4 CO 0.10 0.43 0.45 0.42 -0.68 0.00 0.00 175.30 176.01 2jer s ILE 5 N -0.87 5.12 0.02 1.52 -1.09 0.29 -4.89 121.20 121.30 2jer s ILE 5 Ca 0.43 0.74 0.07 0.00 -2.23 0.00 0.00 60.65 59.66 2jer s ILE 5 Cb -0.26 -3.77 -0.02 0.00 -1.58 0.00 0.00 42.46 36.83 2jer s ILE 5 CO 0.32 0.13 -0.22 0.68 -1.23 0.00 0.00 174.94 174.62 2jer s VAL 6 N 2.13 1.75 0.00 2.92 -7.23 -1.26 -4.56 120.40 114.14 2jer s VAL 6 Ca 0.18 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 2jer s VAL 6 Cb -0.16 -1.49 0.00 0.00 0.56 0.00 0.00 36.38 35.30 2jer s VAL 6 CO 0.09 0.35 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 2jer n GLY 7 N 2.15 0.75 3.23 2.32 0.00 -1.26 -5.02 105.19 107.36 2jer n GLY 7 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.50 0.14 0.20 1.61 1.04 -1.26 -5.17 113.70 107.76 2jer s SER 8 Ca 0.00 -0.79 0.07 0.00 0.48 0.00 0.00 55.95 55.71 2jer s SER 8 Cb 0.00 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 2jer s SER 8 CO 0.00 -0.77 0.08 0.42 0.98 0.00 0.00 173.24 173.96 2jer s THR 9 N -3.91 4.07 0.24 2.02 -4.23 -1.26 -5.02 115.64 107.55 2jer s THR 9 Ca 0.10 -1.40 -0.06 0.00 -1.18 0.00 0.00 61.69 59.16 2jer s THR 9 Cb 0.05 -3.11 0.26 0.00 1.34 0.00 0.00 72.50 71.03 2jer s THR 9 CO -0.07 -0.21 1.65 -0.65 -0.54 0.00 0.00 174.62 174.81 2jer h PRO 10 N 2.21 0.15 -0.19 3.99 0.11 -1.83 -0.66 132.00 135.77 2jer h PRO 10 Ca -0.47 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.67 2jer h PRO 10 Cb 1.22 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 2jer h PRO 10 CO 0.60 0.10 -0.05 -0.22 -0.21 0.00 0.00 178.00 178.22 2jer h LYS 11 N 0.15 -0.00 -0.31 1.05 3.64 -1.41 -0.03 116.57 119.66 2jer h LYS 11 Ca 0.41 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.78 2jer h LYS 11 Cb 0.73 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2jer h LYS 11 CO -0.61 -0.00 0.12 1.96 -2.27 0.00 0.00 179.45 178.65 2jer h GLN 12 N -0.00 0.43 -0.01 1.90 4.20 -1.58 -2.40 115.11 117.64 2jer h GLN 12 Ca 0.09 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2jer h GLN 12 Cb 0.14 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2jer h GLN 12 CO -0.20 0.36 -0.07 -0.25 -0.67 0.00 0.00 178.83 178.00 2jer n ASP 13 N -4.41 1.24 0.00 1.46 8.00 -0.35 -4.94 116.55 117.55 2jer n ASP 13 Ca 0.01 -1.27 0.00 0.00 0.71 0.00 0.00 54.79 54.25 2jer n ASP 13 Cb 0.13 0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 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 1.21 0.55 3.76 0.44 0.00 -0.20 -5.04 105.19 105.92 2jer n GLY 14 Ca 0.17 -0.84 -0.32 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 -2.00 3.20 0.03 1.61 0.40 -0.20 -4.28 117.98 116.74 2jer s PHE 15 Ca 0.00 0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.45 2jer s PHE 15 Cb 0.00 -1.67 -0.02 0.00 0.51 0.00 0.00 43.02 41.84 2jer s PHE 15 CO 0.00 0.52 -0.03 -0.98 0.70 0.00 0.00 175.22 175.43 2jer s ARG 16 N -2.06 0.36 -0.28 0.44 1.70 0.16 -3.91 118.95 115.36 2jer s ARG 16 Ca 0.26 -0.69 -0.28 0.00 -0.47 0.00 0.00 55.73 54.55 2jer s ARG 16 Cb -0.12 0.08 0.01 0.00 -0.57 0.00 0.00 34.95 34.35 2jer s ARG 16 CO 0.18 -0.05 1.00 1.41 -1.08 0.00 0.00 175.30 176.76 2jer s MET 17 N -1.71 4.13 0.75 3.89 -2.45 -0.73 -0.53 119.30 122.64 2jer s MET 17 Ca -0.13 1.09 -0.11 0.00 -1.25 0.00 0.00 55.69 55.29 2jer s MET 17 Cb -0.08 -3.69 0.04 0.00 1.25 0.00 0.00 34.83 32.34 2jer s MET 17 CO -0.02 -0.74 1.08 -1.25 1.05 0.00 0.00 175.02 175.14 2jer s PRO 18 N 3.32 2.48 0.67 4.11 0.04 -1.26 -4.11 135.00 140.25 2jer s PRO 18 Ca 0.42 0.83 -0.17 0.00 0.04 0.00 0.00 61.00 62.12 2jer s PRO 18 Cb -0.14 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2jer s PRO 18 CO 0.11 -1.39 1.22 0.20 0.04 0.00 0.00 177.00 177.18 2jer s GLY 19 N -3.80 2.57 0.61 0.56 0.00 -1.26 -4.69 107.32 101.31 2jer s GLY 19 Ca 0.60 0.98 0.39 0.00 0.00 0.00 0.00 44.72 46.69 2jer s GLY 19 CO 0.55 1.39 2.19 -2.09 0.00 0.00 0.00 173.10 175.13 2jer h GLU 20 N 0.25 0.00 -0.04 2.90 4.81 -1.90 -1.18 114.58 119.42 2jer h GLU 20 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 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 0.52 0.00 0.00 1.97 -0.73 0.00 0.00 179.01 180.77 2jer n PHE 21 N -3.09 0.04 -2.45 0.92 1.16 -1.26 -4.58 117.46 108.19 2jer n PHE 21 Ca -0.01 -0.02 -0.29 0.00 -1.87 0.00 0.00 57.45 55.26 2jer n PHE 21 Cb 0.19 0.00 -0.00 0.00 -1.61 0.00 0.00 39.48 38.05 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 -1.96 3.61 0.37 3.97 2.02 -0.45 -4.89 118.70 121.37 2jer s GLU 22 Ca 0.39 0.42 -0.27 0.00 0.02 0.00 0.00 54.97 55.53 2jer s GLU 22 Cb 0.20 -2.29 -0.11 0.00 0.10 0.00 0.00 34.13 32.03 2jer s GLU 22 CO 0.32 -0.28 1.35 -2.30 0.02 0.00 0.00 175.26 174.37 2jer n PRO 23 N -2.22 2.27 -5.18 0.39 -0.02 -1.26 -4.69 135.00 124.28 2jer n PRO 23 Ca 0.03 0.80 -0.32 0.00 -2.02 0.00 0.00 63.50 61.99 2jer n PRO 23 Cb 0.55 -2.45 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 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 -2.03 2.29 -0.06 -0.52 -0.21 -1.26 -0.93 119.66 116.94 2jer s GLN 24 Ca 0.56 -0.86 -0.23 0.00 0.02 0.00 0.00 55.36 54.85 2jer s GLN 24 Cb -0.52 -2.16 -0.31 0.00 1.00 0.00 0.00 33.01 31.02 2jer s GLN 24 CO 0.62 0.55 0.88 1.49 -2.12 0.00 0.00 175.29 176.72 2jer h GLU 25 N 5.53 0.27 -3.00 2.91 4.81 -0.56 -3.42 114.58 121.12 2jer h GLU 25 Ca -0.43 -0.46 0.06 0.00 -0.13 0.00 0.00 59.36 58.41 2jer h GLU 25 Cb 1.14 0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.64 2jer h GLU 25 CO 0.48 1.22 0.23 -1.59 -0.73 0.00 0.00 179.01 178.62 2jer s LYS 26 N -2.41 1.83 0.05 1.92 -2.85 -1.13 -4.17 119.74 112.98 2jer s LYS 26 Ca -0.14 -1.03 0.05 0.00 -1.00 0.00 0.00 55.97 53.84 2jer s LYS 26 Cb 0.00 0.61 -0.02 0.00 -2.06 0.00 0.00 37.83 36.36 2jer s LYS 26 CO 0.82 -0.84 -0.14 0.08 0.10 0.00 0.00 175.35 175.37 2jer s VAL 27 N -3.77 1.08 0.16 1.79 1.01 -0.25 -0.48 120.40 119.95 2jer s VAL 27 Ca 0.11 -1.12 0.10 0.00 0.00 0.00 0.00 61.98 61.08 2jer s VAL 27 Cb -0.06 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 2jer s VAL 27 CO 0.07 -0.10 -0.19 0.26 0.00 0.00 0.00 175.10 175.15 2jer s TRP 28 N -1.03 2.47 -0.06 5.22 0.52 -0.19 -1.22 118.94 124.65 2jer s TRP 28 Ca -0.00 -0.29 -0.22 0.00 0.02 0.00 0.00 56.10 55.60 2jer s TRP 28 Cb -0.09 -1.26 0.05 0.00 -1.15 0.00 0.00 33.47 31.02 2jer s TRP 28 CO 0.02 0.45 0.50 1.41 0.02 0.00 0.00 176.95 179.34 2jer s MET 29 N -2.47 0.82 -0.08 4.98 1.75 -0.53 -1.55 119.30 122.21 2jer s MET 29 Ca 0.20 0.14 -0.04 0.00 -1.25 0.00 0.00 55.69 54.74 2jer s MET 29 Cb -0.09 0.38 -0.04 0.00 2.84 0.00 0.00 34.83 37.92 2jer s MET 29 CO 0.11 -0.23 0.08 0.42 -0.65 0.00 0.00 175.02 174.76 2jer s ILE 30 N -1.01 4.96 -0.01 10.11 1.01 -1.26 -0.80 121.20 134.20 2jer s ILE 30 Ca -0.10 -0.07 -0.30 0.00 0.00 0.00 0.00 60.65 60.18 2jer s ILE 30 Cb -0.03 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.25 2jer s ILE 30 CO 0.06 0.56 1.01 0.86 0.00 0.00 0.00 174.94 177.43 2jer s TRP 31 N -1.02 3.61 0.31 3.97 -0.11 0.13 -4.80 118.94 121.03 2jer s TRP 31 Ca 0.16 1.64 -0.15 0.00 1.22 0.00 0.00 56.10 58.97 2jer s TRP 31 Cb -0.12 -3.16 -0.09 0.00 -1.50 0.00 0.00 33.47 28.60 2jer s TRP 31 CO 0.06 -0.17 0.73 -1.25 -4.62 0.00 0.00 176.95 171.70 2jer s PRO 32 N 1.20 4.02 0.00 5.86 0.04 -1.26 -4.76 135.00 140.10 2jer s PRO 32 Ca 0.52 0.68 0.00 0.00 0.04 0.00 0.00 61.00 62.24 2jer s PRO 32 Cb -0.21 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 31.85 2jer s PRO 32 CO 0.26 0.18 0.00 -0.85 0.04 0.00 0.00 177.00 176.63 2jer n GLU 33 N -0.26 0.00 -1.82 4.56 0.28 -1.26 -4.76 120.64 117.38 2jer n GLU 33 Ca 0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.61 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 -0.38 4.17 0.00 3.44 1.70 -1.26 -4.13 118.95 122.48 2jer s ARG 34 Ca 0.00 2.47 0.27 0.00 -0.47 0.00 0.00 55.73 58.00 2jer s ARG 34 Cb 0.00 -3.46 1.38 0.00 -0.57 0.00 0.00 34.95 32.29 2jer s ARG 34 CO 0.00 -0.76 1.93 -0.35 -1.08 0.00 0.00 175.30 175.04 2jer n PRO 35 N 5.18 0.40 -0.17 3.89 -0.04 -1.26 -0.97 135.00 142.03 2jer n PRO 35 Ca 0.16 0.03 0.10 0.00 -0.04 0.00 0.00 63.50 63.75 2jer n PRO 35 Cb 0.39 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.62 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 -1.28 2.57 0.03 3.54 5.75 -1.26 -0.23 116.55 125.66 2jer n ASP 36 Ca 0.13 -1.89 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 2jer n ASP 36 Cb 0.21 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 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 0.91 0.40 -4.68 -1.12 4.05 -0.96 -4.71 115.26 109.14 2jer n ASN 37 Ca 0.17 0.09 -0.39 0.00 0.45 0.00 0.00 54.58 54.90 2jer n ASN 37 Cb 0.45 -0.10 -0.06 0.00 1.23 0.00 0.00 39.78 41.30 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 3.42 0.70 1.20 0.52 -0.14 -4.78 118.94 117.85 2jer s TRP 38 Ca 0.00 0.89 -0.16 0.00 0.02 0.00 0.00 56.10 56.85 2jer s TRP 38 Cb 0.00 -2.70 0.02 0.00 -1.15 0.00 0.00 33.47 29.64 2jer s TRP 38 CO 0.00 -0.06 1.21 -0.98 0.02 0.00 0.00 176.95 177.14 2jer s ARG 39 N 1.46 2.34 -1.40 4.98 1.70 -1.26 -3.41 118.95 123.36 2jer s ARG 39 Ca 0.27 1.78 -0.10 0.00 -0.47 0.00 0.00 55.73 57.21 2jer s ARG 39 Cb -0.16 -1.86 0.03 0.00 -0.57 0.00 0.00 34.95 32.40 2jer s ARG 39 CO 0.11 -1.68 1.13 -0.25 -1.08 0.00 0.00 175.30 173.53 2jer n ASP 40 N -2.45 -5.91 -2.12 -2.89 8.00 -0.61 -1.34 116.55 109.22 2jer n ASP 40 Ca 0.14 -0.60 -0.18 0.00 0.71 0.00 0.00 54.79 54.85 2jer n ASP 40 Cb 0.50 -4.74 -0.03 0.00 -0.02 0.00 0.00 41.12 36.83 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 -1.92 0.23 2.37 0.44 0.00 -1.22 -1.46 105.19 103.63 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 -0.75 0.66 0.05 -0.02 0.00 -0.45 -4.80 105.19 99.88 2jer n GLY 42 Ca -0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 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 1.66 0.04 -0.56 1.61 1.79 -1.35 0.98 116.57 120.74 2jer h LYS 43 Ca 0.00 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2jer h LYS 43 Cb 0.02 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 2jer h LYS 43 CO 0.00 0.08 0.31 -1.35 -1.08 0.00 0.00 179.45 177.41 2jer h PRO 44 N -0.01 0.78 0.00 3.15 0.11 -1.82 -2.77 132.00 131.44 2jer h PRO 44 Ca 0.01 -0.09 -0.10 0.00 0.11 0.00 0.00 66.00 65.93 2jer h PRO 44 Cb 0.05 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 2jer h PRO 44 CO -0.00 0.60 -0.46 -0.24 -0.21 0.00 0.00 178.00 177.69 2jer h VAL 45 N 0.76 1.31 -0.80 3.15 3.04 -1.81 -2.50 116.25 119.39 2jer h VAL 45 Ca 0.20 -1.58 -0.02 0.00 -1.01 0.00 0.00 66.70 64.30 2jer h VAL 45 Cb 0.04 1.85 -0.04 0.00 -2.01 0.00 0.00 31.29 31.14 2jer h VAL 45 CO -0.03 0.45 0.44 1.56 -1.01 0.00 0.00 177.57 178.97 2jer h GLN 46 N 0.00 1.11 -0.74 4.17 4.20 -0.54 0.12 115.11 123.43 2jer h GLN 46 Ca -0.00 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 2jer h GLN 46 Cb 0.82 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 2jer h GLN 46 CO 0.06 0.81 0.28 1.49 -0.67 0.00 0.00 178.83 180.80 2jer h GLU 47 N 1.12 1.12 -0.21 1.46 4.81 -1.20 -0.09 114.58 121.59 2jer h GLU 47 Ca 0.28 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 2jer h GLU 47 Cb 0.02 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 2jer h GLU 47 CO -0.05 0.92 -0.17 0.00 -0.73 0.00 0.00 179.01 178.99 2jer h ALA 48 N 1.21 0.31 -0.81 2.92 0.00 -1.03 -1.00 119.26 120.86 2jer h ALA 48 Ca 0.25 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2jer h ALA 48 Cb 0.23 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2jer h ALA 48 CO -0.02 0.21 0.46 0.74 0.00 0.00 0.00 179.25 180.64 2jer h PHE 49 N 0.18 1.09 -0.62 0.00 -1.00 -0.71 -0.52 116.94 115.36 2jer h PHE 49 Ca 0.04 -0.02 0.05 0.00 2.81 0.00 0.00 57.97 60.85 2jer h PHE 49 Cb 0.69 -0.35 -0.05 0.00 3.61 0.00 0.00 35.95 39.85 2jer h PHE 49 CO 0.07 0.75 0.35 1.15 -1.61 0.00 0.00 178.31 179.03 2jer h THR 50 N 1.12 0.99 -0.64 -1.55 2.02 -0.72 0.77 112.91 114.90 2jer h THR 50 Ca 0.29 -0.23 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 2jer h THR 50 Cb 0.00 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.65 2jer h THR 50 CO -0.05 0.12 0.14 0.78 0.37 0.00 0.00 175.52 176.88 2jer h ASN 51 N 0.67 0.96 -0.11 4.18 2.35 -0.60 0.01 115.58 123.03 2jer h ASN 51 Ca 0.27 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 2jer h ASN 51 Cb 0.13 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 2jer h ASN 51 CO -0.16 0.94 0.04 0.58 -1.65 0.00 0.00 177.43 177.18 2jer h VAL 52 N 0.97 1.17 -0.58 2.81 2.07 -0.70 -1.24 116.25 120.75 2jer h VAL 52 Ca 0.20 -0.53 0.07 0.00 0.82 0.00 0.00 66.70 67.26 2jer h VAL 52 Cb 0.36 1.32 -0.06 0.00 -1.52 0.00 0.00 31.29 31.39 2jer h VAL 52 CO 0.00 0.16 0.28 0.00 0.02 0.00 0.00 177.57 178.02 2jer h ALA 53 N 0.85 0.76 -0.63 1.67 0.00 -0.59 -0.86 119.26 120.46 2jer h ALA 53 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2jer h ALA 53 Cb 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2jer h ALA 53 CO -0.00 -0.09 0.35 0.87 0.00 0.00 0.00 179.25 180.37 2jer h LYS 54 N 0.51 0.87 -0.53 0.00 1.57 -0.90 -1.23 116.57 116.86 2jer h LYS 54 Ca 0.27 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2jer h LYS 54 Cb 0.23 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 2jer h LYS 54 CO -0.21 0.66 0.30 0.00 -0.57 0.00 0.00 179.45 179.62 2jer h ALA 55 N 1.17 0.68 -0.52 3.86 0.00 -0.62 -2.70 119.26 121.13 2jer h ALA 55 Ca 0.22 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2jer h ALA 55 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2jer h ALA 55 CO -0.04 0.19 0.03 0.82 0.00 0.00 0.00 179.25 180.25 2jer h ILE 56 N 0.71 1.26 -0.00 0.00 2.04 -0.97 -3.06 117.51 117.49 2jer h ILE 56 Ca 0.19 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2jer h ILE 56 Cb 0.03 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 2jer h ILE 56 CO -0.03 0.37 0.01 0.77 0.00 0.00 0.00 178.15 179.26 2jer h SER 57 N 0.77 0.00 0.94 1.72 4.64 -0.89 0.13 113.55 120.87 2jer h SER 57 Ca 0.15 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 2jer h SER 57 Cb 0.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2jer h SER 57 CO 0.02 0.00 -0.04 0.06 -0.87 0.00 0.00 176.83 176.00 2jer h GLN 58 N 0.00 0.00 0.00 4.77 3.07 -1.45 -3.32 115.11 118.18 2jer h GLN 58 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 58.65 58.52 2jer h GLN 58 Cb 0.01 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.53 2jer h GLN 58 CO -0.00 0.04 -1.84 1.19 0.09 0.00 0.00 178.83 178.32 2jer n PHE 59 N -3.17 0.00 -3.71 0.06 3.72 0.37 -5.06 117.46 109.68 2jer n PHE 59 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 2jer n PHE 59 Cb 0.32 -0.59 -0.10 0.00 -0.94 0.00 0.00 39.48 38.16 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 -2.29 -0.01 0.17 4.37 2.01 -0.63 -4.74 115.64 114.52 2jer s THR 60 Ca -0.09 0.05 -0.33 0.00 0.31 0.00 0.00 61.69 61.64 2jer s THR 60 Cb 0.04 -0.61 -0.15 0.00 0.01 0.00 0.00 72.50 71.78 2jer s THR 60 CO 0.47 0.02 1.29 -2.65 -0.69 0.00 0.00 174.62 173.06 2jer n PRO 61 N 3.70 1.44 -4.62 4.92 -0.02 -1.26 -3.72 135.00 135.43 2jer n PRO 61 Ca -0.19 0.51 -0.30 0.00 -2.02 0.00 0.00 63.50 61.50 2jer n PRO 61 Cb 0.56 -2.10 -0.13 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.11 1.84 -0.02 -0.52 1.75 -1.26 -1.09 119.30 119.89 2jer s MET 62 Ca 0.75 -1.11 -0.00 0.00 -1.25 0.00 0.00 55.69 54.07 2jer s MET 62 Cb -0.81 -2.07 0.02 0.00 2.84 0.00 0.00 34.83 34.81 2jer s MET 62 CO 0.49 0.51 0.03 -0.80 -0.65 0.00 0.00 175.02 174.60 2jer s ASN 63 N -1.60 0.01 -0.04 1.11 0.01 -0.36 -1.91 114.94 112.16 2jer s ASN 63 Ca 0.14 0.05 0.04 0.00 -0.71 0.00 0.00 52.86 52.39 2jer s ASN 63 Cb -0.10 -0.00 -0.00 0.00 0.41 0.00 0.00 41.25 41.55 2jer s ASN 63 CO 0.05 -0.07 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.72 2jer s VAL 64 N 0.55 1.37 0.07 1.60 1.01 -0.03 -1.46 120.40 123.51 2jer s VAL 64 Ca -0.04 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.32 2jer s VAL 64 Cb -0.06 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2jer s VAL 64 CO -0.02 0.40 -0.09 0.68 0.00 0.00 0.00 175.10 176.07 2jer s VAL 65 N 0.09 3.43 -0.05 2.92 -7.23 0.02 -1.19 120.40 118.40 2jer s VAL 65 Ca -0.05 -1.13 -0.21 0.00 -1.81 0.00 0.00 61.98 58.79 2jer s VAL 65 Cb -0.12 -2.57 0.04 0.00 0.56 0.00 0.00 36.38 34.30 2jer s VAL 65 CO 0.02 0.20 0.48 0.54 -0.31 0.00 0.00 175.10 176.03 2jer s VAL 66 N -1.15 0.03 0.96 1.32 0.11 -0.21 -0.70 120.40 120.76 2jer s VAL 66 Ca 0.20 -0.23 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 2jer s VAL 66 Cb -0.11 -0.77 0.13 0.00 -1.53 0.00 0.00 36.38 34.10 2jer s VAL 66 CO 0.12 -0.12 0.89 -1.54 -3.33 0.00 0.00 175.10 171.11 2jer n SER 67 N 1.36 -0.64 -0.20 3.54 3.41 -1.22 -0.31 113.62 119.57 2jer n SER 67 Ca -0.19 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2jer n SER 67 Cb 0.56 -1.36 0.09 0.00 -0.26 0.00 0.00 64.21 63.24 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 -1.90 0.09 -0.36 4.33 4.15 -1.97 -1.27 115.11 118.18 2jer h GLN 68 Ca -0.45 -0.01 -0.17 0.00 0.77 0.00 0.00 58.65 58.79 2jer h GLN 68 Cb 1.28 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.95 2jer h GLN 68 CO 0.40 0.06 -0.44 0.37 -1.93 0.00 0.00 178.83 177.29 2jer h GLN 69 N 0.09 0.92 -0.01 1.69 -0.00 -2.01 -3.08 115.11 112.72 2jer h GLN 69 Ca 0.31 -0.52 0.00 0.00 -0.00 0.00 0.00 58.65 58.44 2jer h GLN 69 Cb 0.50 0.03 0.00 0.00 0.00 0.00 0.00 27.48 28.01 2jer h GLN 69 CO -0.54 1.17 -0.17 1.04 0.00 0.00 0.00 178.83 180.33 2jer n GLN 70 N -4.05 0.89 0.00 1.69 1.13 -1.10 -4.45 117.38 111.50 2jer n GLN 70 Ca -0.03 -0.45 -0.11 0.00 -1.94 0.00 0.00 57.00 54.48 2jer n GLN 70 Cb 0.57 -1.49 -0.04 0.00 0.11 0.00 0.00 30.24 29.39 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 1.10 -0.86 -0.50 1.08 3.04 -1.14 0.14 116.94 119.79 2jer h PHE 71 Ca 0.00 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 61.98 2jer h PHE 71 Cb 0.44 0.40 -0.02 0.00 2.56 0.00 0.00 35.95 39.33 2jer h PHE 71 CO 0.00 -0.39 0.30 1.96 -2.02 0.00 0.00 178.31 178.16 2jer h GLN 72 N -0.39 0.69 -0.21 1.11 4.20 -1.81 -0.47 115.11 118.23 2jer h GLN 72 Ca 0.09 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2jer h GLN 72 Cb 0.54 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2jer h GLN 72 CO -0.34 0.51 0.13 -0.97 -0.67 0.00 0.00 178.83 177.49 2jer h ASN 73 N 0.67 0.25 -0.37 1.46 -1.24 -1.77 -1.69 115.58 112.90 2jer h ASN 73 Ca 0.18 -0.04 0.07 0.00 0.71 0.00 0.00 56.30 57.22 2jer h ASN 73 Cb 0.00 -0.06 -0.06 0.00 0.73 0.00 0.00 38.32 38.93 2jer h ASN 73 CO -0.03 0.22 0.01 0.00 -1.29 0.00 0.00 177.43 176.34 2jer h ARG 75 N 0.12 0.80 -0.49 0.00 9.65 -0.99 -1.64 114.38 121.83 2jer h ARG 75 Ca 0.18 -0.14 -0.12 0.00 -1.10 0.00 0.00 59.98 58.81 2jer h ARG 75 Cb 0.25 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.68 2jer h ARG 75 CO -0.29 0.68 -0.15 -0.09 2.80 0.00 0.00 179.97 182.93 2jer h ARG 76 N 0.78 0.97 -0.22 0.20 9.65 -0.40 -3.28 114.38 122.09 2jer h ARG 76 Ca 0.18 -0.38 -0.15 0.00 -1.10 0.00 0.00 59.98 58.52 2jer h ARG 76 Cb 0.21 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 2jer h ARG 76 CO -0.01 1.05 -0.49 1.96 2.80 0.00 0.00 179.97 185.28 2jer h GLN 77 N 0.83 0.59 -6.29 0.20 1.08 -0.49 -3.44 115.11 107.59 2jer h GLN 77 Ca 0.12 -0.34 -0.56 0.00 -1.45 0.00 0.00 58.65 56.41 2jer h GLN 77 Cb 0.71 0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.13 2jer h GLN 77 CO 0.05 0.95 -0.03 -0.51 -0.95 0.00 0.00 178.83 178.34 2jer s LEU 78 N -8.44 4.46 0.69 1.46 1.43 -0.66 -5.06 118.68 112.57 2jer s LEU 78 Ca -0.08 1.23 -0.16 0.00 -1.03 0.00 0.00 54.13 54.09 2jer s LEU 78 Cb 0.12 -3.05 0.02 0.00 0.03 0.00 0.00 46.19 43.30 2jer s LEU 78 CO 0.84 0.21 1.21 -2.16 0.23 0.00 0.00 176.35 176.68 2jer s PRO 79 N -1.40 2.38 0.56 1.29 0.04 -1.26 -4.89 135.00 131.72 2jer s PRO 79 Ca 0.32 1.77 0.30 0.00 0.04 0.00 0.00 61.00 63.43 2jer s PRO 79 Cb -0.18 -1.86 1.67 0.00 0.04 0.00 0.00 34.50 34.16 2jer s PRO 79 CO 0.19 -1.65 2.16 -1.00 0.04 0.00 0.00 177.00 176.74 2jer h PRO 80 N 0.02 0.00 0.00 0.56 0.13 -1.97 -1.54 132.00 129.20 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 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2jer h PRO 80 CO 0.51 0.07 0.00 -0.85 -0.23 0.00 0.00 178.00 177.50 2jer n GLU 81 N -3.61 0.19 -3.22 0.86 0.00 -1.26 -4.47 120.64 109.13 2jer n GLU 81 Ca -0.02 0.46 -0.40 0.00 0.00 0.00 0.00 57.16 57.20 2jer n GLU 81 Cb 0.18 -1.89 -0.07 0.00 0.00 0.00 0.00 31.44 29.66 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 -3.36 5.08 0.20 3.84 1.01 -0.58 -4.58 121.20 122.81 2jer s ILE 82 Ca 0.03 0.97 -0.29 0.00 0.00 0.00 0.00 60.65 61.36 2jer s ILE 82 Cb 0.09 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.62 2jer s ILE 82 CO 0.36 0.13 0.91 -0.89 0.00 0.00 0.00 174.94 175.46 2jer s THR 83 N 1.90 4.20 -0.10 2.92 2.01 -0.80 -4.86 115.64 120.90 2jer s THR 83 Ca 0.24 2.01 0.04 0.00 0.31 0.00 0.00 61.69 64.28 2jer s THR 83 Cb -0.15 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.07 2jer s THR 83 CO 0.09 0.48 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.58 2jer s VAL 84 N -0.99 1.98 0.04 3.82 1.01 -1.26 -0.85 120.40 124.15 2jer s VAL 84 Ca 0.41 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.50 2jer s VAL 84 Cb -0.25 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 2jer s VAL 84 CO 0.30 0.54 -0.21 -0.31 0.00 0.00 0.00 175.10 175.43 2jer s TYR 85 N 0.42 2.48 0.17 5.22 1.51 -0.33 -5.00 117.35 121.81 2jer s TYR 85 Ca -0.17 -0.31 -0.30 0.00 -1.01 0.00 0.00 57.07 55.28 2jer s TYR 85 Cb -0.18 -1.45 -0.07 0.00 -0.11 0.00 0.00 41.96 40.15 2jer s TYR 85 CO 0.07 0.20 1.13 -2.00 -1.11 0.00 0.00 175.55 173.84 2jer s GLU 86 N -1.31 4.56 -0.29 -0.62 2.12 -1.26 -1.05 118.70 120.84 2jer s GLU 86 Ca 0.13 1.75 -0.12 0.00 0.36 0.00 0.00 54.97 57.10 2jer s GLU 86 Cb -0.10 -3.28 0.12 0.00 0.26 0.00 0.00 34.13 31.13 2jer s GLU 86 CO 0.04 0.01 0.67 1.41 -0.54 0.00 0.00 175.26 176.84 2jer s MET 87 N -0.20 0.60 0.64 4.30 1.75 0.58 -4.76 119.30 122.22 2jer s MET 87 Ca 0.51 1.38 -0.17 0.00 -1.25 0.00 0.00 55.69 56.15 2jer s MET 87 Cb -0.30 0.68 -0.01 0.00 2.84 0.00 0.00 34.83 38.04 2jer s MET 87 CO 0.35 -0.18 1.20 -1.12 -0.65 0.00 0.00 175.02 174.61 2jer s SER 88 N 2.56 4.89 0.07 1.11 0.01 -1.26 -3.42 113.70 117.66 2jer s SER 88 Ca -0.07 2.34 -0.26 0.00 1.31 0.00 0.00 55.95 59.27 2jer s SER 88 Cb -0.10 -2.59 0.09 0.00 0.21 0.00 0.00 66.02 63.62 2jer s SER 88 CO -0.19 -1.79 0.81 0.54 0.41 0.00 0.00 173.24 173.01 2jer s ASN 89 N -1.83 -0.39 -0.21 2.44 2.20 -1.26 -4.61 114.94 111.27 2jer s ASN 89 Ca 0.75 -0.07 0.08 0.00 -0.94 0.00 0.00 52.86 52.68 2jer s ASN 89 Cb -0.29 0.47 -0.18 0.00 -2.00 0.00 0.00 41.25 39.25 2jer s ASN 89 CO 0.38 -0.78 -0.09 0.59 -2.94 0.00 0.00 177.10 174.25 2jer n ASN 90 N -0.32 1.54 -2.72 3.54 3.02 -1.26 -4.79 115.26 114.28 2jer n ASN 90 Ca -0.10 -0.07 -0.12 0.00 -0.03 0.00 0.00 54.58 54.25 2jer n ASN 90 Cb 0.62 0.17 -0.02 0.00 -0.61 0.00 0.00 39.78 39.95 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 -2.96 -1.38 -2.89 6.41 2.03 -1.26 -4.83 116.55 111.66 2jer n ASP 91 Ca -0.36 -2.61 -0.33 0.00 0.52 0.00 0.00 54.79 52.01 2jer n ASP 91 Cb 1.00 2.49 0.00 0.00 -0.72 0.00 0.00 41.12 43.89 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 -0.94 5.51 -3.42 -1.67 0.00 -1.26 -4.86 120.51 113.86 2jer n ALA 92 Ca -0.13 -4.42 -0.27 0.00 0.00 0.00 0.00 53.44 48.63 2jer n ALA 92 Cb 0.52 -1.22 -0.08 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.37 2.85 0.46 0.00 7.02 -1.26 -4.58 117.44 121.56 2jer n TRP 93 Ca 0.42 -4.05 0.12 0.00 -1.02 0.00 0.00 57.50 52.97 2jer n TRP 93 Cb 0.42 -0.51 0.47 0.00 -2.42 0.00 0.00 31.31 29.27 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 1.07 0.76 0.02 -0.99 3.14 -1.26 -1.04 118.33 120.04 2jer n VAL 94 Ca 0.28 0.09 0.10 0.00 -2.96 0.00 0.00 64.34 61.84 2jer n VAL 94 Cb 0.43 -1.00 0.53 0.00 -1.06 0.00 0.00 33.84 32.73 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 0.31 0.00 1.45 9.65 -1.73 -0.09 114.38 123.97 2jer h ARG 95 Ca 0.00 -0.02 -0.27 0.00 -1.10 0.00 0.00 59.98 58.59 2jer h ARG 95 Cb 0.47 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 28.93 2jer h ARG 95 CO 0.00 0.21 -2.01 -0.25 2.80 0.00 0.00 179.97 180.72 2jer n ASP 96 N -4.48 1.79 -0.53 -3.80 8.00 -0.20 -2.67 116.55 114.67 2jer n ASP 96 Ca 0.05 -0.03 0.09 0.00 0.71 0.00 0.00 54.79 55.61 2jer n ASP 96 Cb 0.24 0.50 0.03 0.00 -0.02 0.00 0.00 41.12 41.87 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 -1.91 1.60 0.40 0.00 0.00 -0.05 -3.55 107.32 103.82 2jer s GLY 98 Ca 0.17 -0.71 -0.23 0.00 0.00 0.00 0.00 44.72 43.96 2jer s GLY 98 CO 0.38 -0.02 0.98 2.56 0.00 0.00 0.00 173.10 177.00 2jer s PRO 99 N -5.33 4.26 -0.42 2.90 0.04 -1.26 -4.78 135.00 130.41 2jer s PRO 99 Ca 0.67 1.27 -0.18 0.00 0.04 0.00 0.00 61.00 62.81 2jer s PRO 99 Cb -0.13 -2.39 0.02 0.00 0.04 0.00 0.00 34.50 32.04 2jer s PRO 99 CO 0.55 -0.02 0.46 -1.12 0.04 0.00 0.00 177.00 176.91 2jer s SER 100 N -1.90 6.21 0.29 6.66 0.01 -0.48 -4.90 113.70 119.59 2jer s SER 100 Ca 0.59 -0.59 -0.28 0.00 1.31 0.00 0.00 55.95 56.97 2jer s SER 100 Cb -0.15 -2.23 -0.09 0.00 0.21 0.00 0.00 66.02 63.76 2jer s SER 100 CO 0.19 -0.59 1.00 -0.36 0.41 0.00 0.00 173.24 173.89 2jer s PHE 101 N 2.21 3.72 0.08 2.43 0.40 -1.26 -0.34 117.98 125.23 2jer s PHE 101 Ca 0.13 1.80 0.08 0.00 -0.60 0.00 0.00 56.93 58.33 2jer s PHE 101 Cb -0.17 -3.07 -0.03 0.00 0.51 0.00 0.00 43.02 40.26 2jer s PHE 101 CO 0.14 -0.01 -0.20 0.14 0.70 0.00 0.00 175.22 175.99 2jer s VAL 102 N -1.33 1.62 0.11 -0.44 -7.23 0.29 -4.40 120.40 109.02 2jer s VAL 102 Ca 0.46 -1.42 0.05 0.00 -1.81 0.00 0.00 61.98 59.25 2jer s VAL 102 Cb -0.26 -1.46 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 2jer s VAL 102 CO 0.32 -0.02 -0.12 0.27 -0.31 0.00 0.00 175.10 175.25 2jer s ILE 103 N -1.08 1.12 0.00 -0.62 -4.36 0.31 -0.69 121.20 115.88 2jer s ILE 103 Ca 0.06 -1.69 0.00 0.00 -0.26 0.00 0.00 60.65 58.75 2jer s ILE 103 Cb -0.10 -1.46 0.00 0.00 1.25 0.00 0.00 42.46 42.16 2jer s ILE 103 CO 0.03 -0.51 0.00 -0.46 0.24 0.00 0.00 174.94 174.25 2jer n ASN 104 N 0.51 0.74 -0.19 4.36 6.94 -0.96 -0.67 115.26 126.00 2jer n ASN 104 Ca -0.15 -1.00 0.06 0.00 -0.02 0.00 0.00 54.58 53.47 2jer n ASN 104 Cb 0.58 -0.00 0.30 0.00 -2.36 0.00 0.00 39.78 38.30 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 -2.26 0.56 -1.14 0.53 5.75 -1.26 -4.24 116.55 114.49 2jer n ASP 105 Ca 0.00 -1.72 0.02 0.00 -0.01 0.00 0.00 54.79 53.08 2jer n ASP 105 Cb 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 2jer n ASP 105 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jer n HIS 106 N -0.32 0.00 -0.63 2.11 1.44 -0.96 -4.14 115.22 112.73 2jer n HIS 106 Ca 0.10 -0.34 0.00 0.00 -2.01 0.00 0.00 57.72 55.47 2jer n HIS 106 Cb 0.13 -0.04 0.00 0.00 0.12 0.00 0.00 29.99 30.20 2jer n HIS 106 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2jer n GLY 107 N 0.29 0.65 3.70 -1.39 0.00 0.19 -3.70 105.19 104.93 2jer n GLY 107 Ca 0.01 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.80 2.53 -0.00 1.61 2.02 -1.26 -4.73 118.70 118.05 2jer s GLU 108 Ca 0.00 -1.12 -0.00 0.00 0.02 0.00 0.00 54.97 53.87 2jer s GLU 108 Cb 0.00 -2.39 -0.00 0.00 0.10 0.00 0.00 34.13 31.84 2jer s GLU 108 CO 0.00 0.44 0.01 -1.50 0.02 0.00 0.00 175.26 174.22 2jer s ILE 109 N -1.89 0.01 0.24 -1.63 2.07 -1.26 -2.25 121.20 116.49 2jer s ILE 109 Ca 0.29 -0.07 0.02 0.00 -1.41 0.00 0.00 60.65 59.48 2jer s ILE 109 Cb -0.09 -0.04 -0.05 0.00 0.13 0.00 0.00 42.46 42.41 2jer s ILE 109 CO 0.20 -0.04 0.06 -0.13 -1.91 0.00 0.00 174.94 173.12 2jer s ARG 110 N -0.11 1.36 0.04 3.50 0.52 0.14 -4.49 118.95 119.91 2jer s ARG 110 Ca -0.01 -1.72 0.07 0.00 -0.52 0.00 0.00 55.73 53.56 2jer s ARG 110 Cb -0.01 -0.37 -0.03 0.00 0.52 0.00 0.00 34.95 35.06 2jer s ARG 110 CO -0.00 -0.22 -0.20 0.20 0.02 0.00 0.00 175.30 175.10 2jer s GLY 111 N -3.30 1.54 -0.24 -3.53 0.00 -0.40 -0.55 107.32 100.85 2jer s GLY 111 Ca 0.34 -1.21 -0.11 0.00 0.00 0.00 0.00 44.72 43.74 2jer s GLY 111 CO 0.11 -1.10 0.18 0.14 0.00 0.00 0.00 173.10 172.44 2jer s VAL 112 N -0.90 5.34 -0.58 1.40 1.01 0.54 -0.52 120.40 126.69 2jer s VAL 112 Ca 0.14 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.28 2jer s VAL 112 Cb -0.10 -3.52 0.15 0.00 0.00 0.00 0.00 36.38 32.91 2jer s VAL 112 CO 0.05 0.33 0.43 -0.62 0.00 0.00 0.00 175.10 175.28 2jer s ASP 113 N 1.12 5.61 0.66 3.32 -1.08 0.11 -1.38 116.67 125.03 2jer s ASP 113 Ca 0.08 -2.43 -0.11 0.00 -0.52 0.00 0.00 52.55 49.57 2jer s ASP 113 Cb -0.14 -1.95 -0.02 0.00 -1.46 0.00 0.00 42.92 39.35 2jer s ASP 113 CO 0.05 -0.52 1.05 0.26 0.52 0.00 0.00 175.17 176.53 2jer s TRP 114 N 0.57 3.40 -0.00 -5.34 0.52 -1.26 -1.45 118.94 115.38 2jer s TRP 114 Ca 0.12 1.32 -0.30 0.00 0.02 0.00 0.00 56.10 57.26 2jer s TRP 114 Cb -0.21 -2.81 -0.05 0.00 -1.15 0.00 0.00 33.47 29.25 2jer s TRP 114 CO -0.04 -0.95 1.31 0.99 0.02 0.00 0.00 176.95 178.29 2jer s THR 115 N -3.14 3.90 -0.10 2.01 2.01 -0.64 -4.84 115.64 114.84 2jer s THR 115 Ca 0.56 1.29 -0.06 0.00 0.31 0.00 0.00 61.69 63.79 2jer s THR 115 Cb -0.12 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 2jer s THR 115 CO 0.54 0.02 0.14 0.12 -0.69 0.00 0.00 174.62 174.75 2jer s PHE 116 N 2.09 3.56 -0.00 4.92 5.36 -1.26 -1.86 117.98 130.79 2jer s PHE 116 Ca 0.61 0.47 0.24 0.00 -0.96 0.00 0.00 56.93 57.29 2jer s PHE 116 Cb -0.29 -1.91 0.40 0.00 -0.34 0.00 0.00 43.02 40.88 2jer s PHE 116 CO 0.26 0.70 1.16 0.27 -1.46 0.00 0.00 175.22 176.15 2jer n ASN 117 N 1.80 0.94 -3.59 6.13 6.94 -1.26 -4.85 115.26 121.36 2jer n ASN 117 Ca -0.18 -2.03 -0.22 0.00 -0.02 0.00 0.00 54.58 52.12 2jer n ASN 117 Cb 0.54 -0.30 0.07 0.00 -2.36 0.00 0.00 39.78 37.74 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 0.43 -1.57 -3.35 -2.53 0.00 -1.26 -0.08 120.51 112.16 2jer n ALA 118 Ca 0.06 0.20 -0.16 0.00 0.00 0.00 0.00 53.44 53.54 2jer n ALA 118 Cb 1.11 -4.22 0.08 0.00 0.00 0.00 0.00 19.45 16.42 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 -4.66 -2.07 0.00 0.00 8.01 -1.26 -1.16 117.44 116.30 2jer n TRP 119 Ca -0.10 0.89 0.00 0.00 -1.31 0.00 0.00 57.50 56.98 2jer n TRP 119 Cb 0.60 -4.90 0.00 0.00 -2.01 0.00 0.00 31.31 25.00 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 -1.12 0.37 7.00 6.99 0.00 -1.22 -3.65 105.19 113.55 2jer n GLY 120 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 2.95 0.12 -0.02 0.00 0.88 -1.75 105.19 107.37 2jer n GLY 121 Ca 0.00 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 45.89 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 0.43 -0.05 0.99 4.77 -1.26 -0.74 117.00 121.14 2jer n LEU 122 Ca 0.00 -0.03 -0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2jer n LEU 122 Cb 0.00 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2jer n LEU 122 CO 0.00 0.08 -0.00 0.58 -1.33 0.00 0.00 177.39 176.71 2jer h VAL 123 N 0.60 0.00 0.00 4.08 2.07 -1.68 -3.44 116.25 117.87 2jer h VAL 123 Ca 0.00 -0.98 -0.10 0.00 0.82 0.00 0.00 66.70 66.43 2jer h VAL 123 Cb 0.27 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.86 2jer h VAL 123 CO 0.00 0.00 -0.58 -0.90 0.02 0.00 0.00 177.57 176.11 2jer n ASP 124 N -4.73 0.12 -4.57 0.57 5.75 -0.77 -5.03 116.55 107.89 2jer n ASP 124 Ca -0.00 -1.86 -0.28 0.00 -0.01 0.00 0.00 54.79 52.64 2jer n ASP 124 Cb 0.00 -0.08 0.22 0.00 -1.03 0.00 0.00 41.12 40.23 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 -1.24 1.55 0.00 6.12 0.00 0.08 -4.62 107.32 109.20 2jer s GLY 125 Ca 0.13 -0.29 0.22 0.00 0.00 0.00 0.00 44.72 44.78 2jer s GLY 125 CO -0.07 0.40 0.94 1.04 0.00 0.00 0.00 173.10 175.42 2jer n LEU 126 N -4.61 0.78 -3.68 0.66 4.77 -0.31 -4.77 117.00 109.83 2jer n LEU 126 Ca 0.04 -0.32 -0.03 0.00 -0.03 0.00 0.00 56.01 55.67 2jer n LEU 126 Cb 0.56 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.59 2jer n LEU 126 CO 0.58 0.18 0.80 -0.72 -1.33 0.00 0.00 177.39 176.89 2jer s TYR 127 N -3.08 -0.14 -0.07 -1.77 -0.85 -1.23 -0.98 117.35 109.23 2jer s TYR 127 Ca 0.06 -0.09 -0.05 0.00 -0.52 0.00 0.00 57.07 56.48 2jer s TYR 127 Cb 0.16 0.60 0.03 0.00 0.38 0.00 0.00 41.96 43.13 2jer s TYR 127 CO 0.84 -0.65 0.18 0.12 -1.52 0.00 0.00 175.55 174.52 2jer s PHE 128 N -3.05 -0.21 0.71 -3.49 5.36 -1.26 -4.71 117.98 111.34 2jer s PHE 128 Ca 0.11 0.54 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 2jer s PHE 128 Cb -0.00 0.01 0.13 0.00 -0.34 0.00 0.00 43.02 42.81 2jer s PHE 128 CO -0.01 -0.15 0.98 -1.25 -1.46 0.00 0.00 175.22 173.33 2jer s PRO 129 N 0.73 1.71 -0.07 10.12 0.04 -1.26 -4.99 135.00 141.28 2jer s PRO 129 Ca -0.05 -1.19 0.13 0.00 0.04 0.00 0.00 61.00 59.93 2jer s PRO 129 Cb -0.07 -2.36 0.26 0.00 0.04 0.00 0.00 34.50 32.37 2jer s PRO 129 CO -0.04 -1.41 1.12 -2.67 0.04 0.00 0.00 177.00 174.04 2jer n TRP 130 N -2.79 0.00 -0.10 0.56 2.14 -1.26 -4.87 117.44 111.12 2jer n TRP 130 Ca 0.15 -0.63 -0.03 0.00 2.07 0.00 0.00 57.50 59.06 2jer n TRP 130 Cb 0.61 -0.14 0.19 0.00 -0.81 0.00 0.00 31.31 31.16 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 0.45 0.74 -0.03 -0.67 2.03 -1.99 -1.14 116.42 115.81 2jer h ASP 131 Ca -0.06 -0.16 -0.22 0.00 -0.73 0.00 0.00 57.03 55.86 2jer h ASP 131 Cb 1.37 -0.19 0.02 0.00 -0.83 0.00 0.00 39.33 39.69 2jer h ASP 131 CO 0.03 0.78 -0.84 1.56 -1.03 0.00 0.00 179.24 179.74 2jer h GLN 132 N 0.74 0.62 -0.85 4.15 1.08 -1.91 -3.09 115.11 115.85 2jer h GLN 132 Ca 0.15 -0.63 0.18 0.00 -1.45 0.00 0.00 58.65 56.90 2jer h GLN 132 Cb 0.38 0.17 -0.11 0.00 -0.05 0.00 0.00 27.48 27.87 2jer h GLN 132 CO 0.01 1.23 0.39 -0.44 -0.95 0.00 0.00 178.83 179.07 2jer h ASP 133 N 0.26 0.38 0.63 1.46 3.32 -1.76 -1.27 116.42 119.44 2jer h ASP 133 Ca -0.10 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2jer h ASP 133 Cb 1.50 0.08 0.00 0.00 0.22 0.00 0.00 39.33 41.14 2jer h ASP 133 CO 0.17 0.09 0.00 -0.67 -1.72 0.00 0.00 179.24 177.11 2jer n ASP 134 N -4.98 0.44 0.01 6.45 2.03 -0.45 -1.83 116.55 118.22 2jer n ASP 134 Ca 0.19 0.61 0.11 0.00 0.52 0.00 0.00 54.79 56.22 2jer n ASP 134 Cb 0.53 -0.70 -0.00 0.00 -0.72 0.00 0.00 41.12 40.23 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 -1.99 0.70 -0.28 -2.67 4.77 -0.49 -4.45 117.00 112.60 2jer n LEU 135 Ca 0.02 -0.21 0.03 0.00 -0.03 0.00 0.00 56.01 55.82 2jer n LEU 135 Cb 0.20 -0.08 0.16 0.00 -2.33 0.00 0.00 43.42 41.37 2jer n LEU 135 CO 0.17 0.14 1.11 0.58 -1.33 0.00 0.00 177.39 178.07 2jer h VAL 136 N 0.00 0.87 -0.15 4.08 2.07 -1.26 -1.88 116.25 119.98 2jer h VAL 136 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2jer h VAL 136 Cb 0.61 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2jer h VAL 136 CO 0.00 0.13 0.10 0.00 0.02 0.00 0.00 177.57 177.81 2jer h ALA 137 N 1.46 0.19 -0.67 1.67 0.00 -1.76 -0.44 119.26 119.70 2jer h ALA 137 Ca 0.39 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 2jer h ALA 137 Cb 0.39 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2jer h ALA 137 CO -0.27 -0.32 0.23 0.37 0.00 0.00 0.00 179.25 179.26 2jer h GLN 138 N 0.19 1.03 -0.62 0.00 4.15 -1.79 -1.62 115.11 116.45 2jer h GLN 138 Ca 0.05 -0.21 -0.06 0.00 0.77 0.00 0.00 58.65 59.20 2jer h GLN 138 Cb -0.01 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 27.50 2jer h GLN 138 CO -0.01 0.89 0.14 0.87 -1.93 0.00 0.00 178.83 178.79 2jer h LYS 139 N 0.97 1.00 -0.40 1.69 1.57 -0.98 0.75 116.57 121.17 2jer h LYS 139 Ca 0.22 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 2jer h LYS 139 Cb 0.27 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 2jer h LYS 139 CO -0.01 0.92 0.11 0.82 -0.57 0.00 0.00 179.45 180.72 2jer h ILE 140 N 0.92 1.22 -0.76 1.86 2.04 -1.02 -1.48 117.51 120.29 2jer h ILE 140 Ca 0.19 -0.75 0.06 0.00 1.00 0.00 0.00 64.86 65.37 2jer h ILE 140 Cb 0.37 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.34 2jer h ILE 140 CO 0.00 0.26 0.45 0.00 0.00 0.00 0.00 178.15 178.87 2jer h GLU 142 N 0.83 0.00 -0.83 0.00 4.39 -0.48 0.99 114.58 119.49 2jer h GLU 142 Ca 0.33 -0.00 0.20 0.00 0.34 0.00 0.00 59.36 60.23 2jer h GLU 142 Cb 0.17 -0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.70 2jer h GLU 142 CO -0.17 0.00 0.26 0.82 -1.16 0.00 0.00 179.01 178.75 2jer h ILE 143 N 0.00 0.45 -0.01 3.13 2.04 -0.90 -0.57 117.51 121.65 2jer h ILE 143 Ca 0.04 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2jer h ILE 143 Cb 0.06 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 2jer h ILE 143 CO -0.09 0.05 -0.03 -0.62 0.00 0.00 0.00 178.15 177.46 2jer n GLU 144 N -5.14 1.13 -3.21 2.37 -0.58 -0.76 -4.91 120.64 109.54 2jer n GLU 144 Ca 0.18 -0.40 -0.23 0.00 -0.42 0.00 0.00 57.16 56.29 2jer n GLU 144 Cb 0.58 -1.49 0.04 0.00 -0.57 0.00 0.00 31.44 29.99 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 -0.59 -2.14 -4.17 -0.32 8.25 -0.22 -4.98 115.22 111.04 2jer n HIS 145 Ca 0.19 0.63 -0.34 0.00 -0.26 0.00 0.00 57.72 57.94 2jer n HIS 145 Cb 0.24 -4.41 -0.10 0.00 1.12 0.00 0.00 29.99 26.84 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 -3.19 4.46 0.51 1.59 -7.23 0.21 -4.92 120.40 111.83 2jer s VAL 146 Ca 0.38 -0.16 -0.20 0.00 -1.81 0.00 0.00 61.98 60.20 2jer s VAL 146 Cb -0.18 -2.98 -0.07 0.00 0.56 0.00 0.00 36.38 33.72 2jer s VAL 146 CO 0.48 0.49 1.07 -1.81 -0.31 0.00 0.00 175.10 175.02 2jer s ASP 147 N 0.20 6.08 0.04 4.85 1.01 -1.26 -4.41 116.67 123.19 2jer s ASP 147 Ca 0.02 2.01 0.02 0.00 0.71 0.00 0.00 52.55 55.31 2jer s ASP 147 Cb -0.13 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.21 2jer s ASP 147 CO 0.01 -0.96 -0.07 -0.94 0.21 0.00 0.00 175.17 173.42 2jer s SER 148 N -1.94 0.78 -0.22 0.27 1.04 -0.74 -1.27 113.70 111.63 2jer s SER 148 Ca 0.69 -0.60 -0.11 0.00 0.48 0.00 0.00 55.95 56.41 2jer s SER 148 Cb -0.19 0.06 -0.05 0.00 0.10 0.00 0.00 66.02 65.94 2jer s SER 148 CO 0.23 -0.26 0.19 -0.31 0.98 0.00 0.00 173.24 174.08 2jer s TYR 149 N -1.69 3.36 -0.21 5.02 1.51 0.32 -0.54 117.35 125.11 2jer s TYR 149 Ca -0.08 0.33 -0.09 0.00 -1.01 0.00 0.00 57.07 56.22 2jer s TYR 149 Cb -0.08 -2.28 -0.05 0.00 -0.11 0.00 0.00 41.96 39.44 2jer s TYR 149 CO -0.01 0.13 0.11 0.50 -1.11 0.00 0.00 175.55 175.18 2jer s ARG 150 N 0.86 4.06 -1.03 -0.62 6.06 -1.26 0.07 118.95 127.09 2jer s ARG 150 Ca 0.10 -0.29 -0.15 0.00 -2.50 0.00 0.00 55.73 52.89 2jer s ARG 150 Cb -0.13 -3.38 0.18 0.00 0.06 0.00 0.00 34.95 31.69 2jer s ARG 150 CO 0.03 0.20 1.15 0.95 -2.50 0.00 0.00 175.30 175.13 2jer s THR 151 N 0.62 5.21 0.21 4.11 -4.23 -0.53 -4.98 115.64 116.05 2jer s THR 151 Ca 0.06 -2.38 -0.32 0.00 -1.18 0.00 0.00 61.69 57.86 2jer s THR 151 Cb -0.12 -4.73 -0.13 0.00 1.34 0.00 0.00 72.50 68.85 2jer s THR 151 CO 0.01 -1.40 1.53 0.47 -0.54 0.00 0.00 174.62 174.70 2jer n ASP 152 N 5.13 3.13 -1.46 3.99 8.00 -1.26 -2.01 116.55 132.07 2jer n ASP 152 Ca 0.26 1.11 -0.19 0.00 0.71 0.00 0.00 54.79 56.68 2jer n ASP 152 Cb 0.45 -1.46 -0.08 0.00 -0.02 0.00 0.00 41.12 40.01 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 2.90 -5.40 -3.97 -2.24 8.00 -1.26 -4.95 116.55 109.63 2jer n ASP 153 Ca 0.14 0.46 -0.30 0.00 0.71 0.00 0.00 54.79 55.80 2jer n ASP 153 Cb 0.31 -4.63 -0.16 0.00 -0.02 0.00 0.00 41.12 36.62 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 -2.58 2.25 -0.06 1.24 2.19 -0.85 -5.04 117.98 115.13 2jer s PHE 154 Ca 0.00 -1.47 -0.19 0.00 0.33 0.00 0.00 56.93 55.60 2jer s PHE 154 Cb 0.00 -1.57 -0.05 0.00 -1.31 0.00 0.00 43.02 40.09 2jer s PHE 154 CO 0.00 -0.71 0.54 0.08 1.83 0.00 0.00 175.22 176.96 2jer s VAL 155 N 1.45 5.06 0.02 3.12 1.01 -1.26 -1.63 120.40 128.17 2jer s VAL 155 Ca -0.00 1.11 -0.27 0.00 0.00 0.00 0.00 61.98 62.81 2jer s VAL 155 Cb -0.16 -3.88 0.07 0.00 0.00 0.00 0.00 36.38 32.41 2jer s VAL 155 CO -0.08 0.37 0.63 -0.22 0.00 0.00 0.00 175.10 175.80 2jer s LEU 156 N 0.20 -0.52 0.02 3.92 2.96 -0.78 -4.78 118.68 119.70 2jer s LEU 156 Ca 0.29 0.43 0.08 0.00 -0.22 0.00 0.00 54.13 54.70 2jer s LEU 156 Cb -0.17 2.47 -0.02 0.00 0.50 0.00 0.00 46.19 48.97 2jer s LEU 156 CO 0.14 -0.72 -0.23 -1.61 -1.32 0.00 0.00 176.35 172.61 2jer s GLU 157 N -2.08 1.69 0.53 1.98 8.01 -1.26 -4.57 118.70 123.00 2jer s GLU 157 Ca -0.07 -0.92 0.26 0.00 0.01 0.00 0.00 54.97 54.26 2jer s GLU 157 Cb -0.00 -1.74 1.41 0.00 -4.31 0.00 0.00 34.13 29.49 2jer s GLU 157 CO 0.02 0.46 1.98 0.78 0.01 0.00 0.00 175.26 178.51 2jer h GLY 158 N 5.19 0.00 1.96 -1.39 0.00 -1.63 -1.50 103.07 105.69 2jer h GLY 158 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2jer h GLY 158 CO 0.46 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.61 2jer n GLY 159 N -1.65 -1.23 0.19 4.60 0.00 -1.22 -3.48 105.19 102.40 2jer n GLY 159 Ca 0.11 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.48 0.77 -3.92 1.61 3.41 -0.56 -2.59 113.62 110.86 2jer n SER 160 Ca 0.06 -0.74 -0.09 0.00 -0.26 0.00 0.00 58.87 57.84 2jer n SER 160 Cb 0.25 0.04 -0.08 0.00 -0.26 0.00 0.00 64.21 64.16 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 -2.49 0.27 -0.01 7.33 -0.12 -1.23 -4.21 117.98 117.52 2jer s PHE 161 Ca 0.26 -0.71 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 2jer s PHE 161 Cb 0.20 -0.13 0.00 0.00 -0.63 0.00 0.00 43.02 42.45 2jer s PHE 161 CO 0.50 -0.53 -0.04 -1.01 -0.05 0.00 0.00 175.22 174.09 2jer s HIS 162 N -3.89 0.42 0.17 3.49 3.76 -0.14 -4.87 115.29 114.23 2jer s HIS 162 Ca 0.07 -0.08 0.09 0.00 -0.15 0.00 0.00 55.06 55.00 2jer s HIS 162 Cb 0.05 -0.30 -0.04 0.00 1.11 0.00 0.00 32.58 33.40 2jer s HIS 162 CO -0.09 -0.03 -0.12 0.14 -0.85 0.00 0.00 174.74 173.79 2jer s VAL 163 N 0.05 3.09 -1.97 -0.90 -7.23 -1.26 -0.38 120.40 111.80 2jer s VAL 163 Ca -0.00 -1.67 0.22 0.00 -1.81 0.00 0.00 61.98 58.72 2jer s VAL 163 Cb -0.04 -2.51 -0.02 0.00 0.56 0.00 0.00 36.38 34.37 2jer s VAL 163 CO -0.00 -0.09 1.07 -0.90 -0.31 0.00 0.00 175.10 174.87 2jer n ASP 164 N 0.14 1.97 0.00 4.85 5.75 -1.06 -4.48 116.55 123.72 2jer n ASP 164 Ca -0.11 -1.49 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 2jer n ASP 164 Cb 0.55 0.51 0.00 0.00 -1.03 0.00 0.00 41.12 41.15 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 1.42 0.72 2.07 6.12 0.00 -1.26 -4.32 105.19 109.95 2jer n GLY 165 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.13 1.94 -0.02 1.61 6.02 -1.26 -4.82 117.38 118.72 2jer n GLN 166 Ca 0.00 -3.40 0.00 0.00 -0.01 0.00 0.00 57.00 53.59 2jer n GLN 166 Cb 0.02 -1.51 0.00 0.00 1.02 0.00 0.00 30.24 29.77 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 -0.50 0.64 3.32 1.08 0.00 -1.26 -4.54 105.19 103.93 2jer n GLY 167 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.03 2.07 0.02 2.61 2.01 -1.26 -0.36 115.64 118.69 2jer s THR 168 Ca 0.00 -1.27 0.05 0.00 0.31 0.00 0.00 61.69 60.78 2jer s THR 168 Cb 0.00 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2jer s THR 168 CO 0.00 0.44 -0.15 0.54 -0.69 0.00 0.00 174.62 174.75 2jer s VAL 169 N -0.73 1.21 -0.09 3.82 0.11 -0.47 -2.58 120.40 121.67 2jer s VAL 169 Ca 0.11 -0.87 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 2jer s VAL 169 Cb -0.10 -1.05 -0.01 0.00 -1.53 0.00 0.00 36.38 33.69 2jer s VAL 169 CO 0.01 0.17 -0.21 -0.22 -3.33 0.00 0.00 175.10 171.52 2jer s LEU 170 N -0.80 2.29 0.00 2.54 2.96 0.49 -0.41 118.68 125.75 2jer s LEU 170 Ca 0.04 -0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 53.46 2jer s LEU 170 Cb -0.07 -1.46 0.01 0.00 0.50 0.00 0.00 46.19 45.18 2jer s LEU 170 CO 0.01 0.21 0.34 1.07 -1.32 0.00 0.00 176.35 176.65 2jer n THR 171 N 3.23 0.00 -5.00 3.68 5.66 -0.46 -0.97 114.28 120.41 2jer n THR 171 Ca -0.18 -0.96 -0.27 0.00 -3.05 0.00 0.00 64.05 59.58 2jer n THR 171 Cb 0.53 0.65 -0.16 0.00 -1.55 0.00 0.00 70.33 69.80 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 -2.62 1.62 0.27 1.09 -4.23 -1.26 -0.80 115.64 109.71 2jer s THR 172 Ca 0.16 -0.87 -0.03 0.00 -1.18 0.00 0.00 61.69 59.77 2jer s THR 172 Cb -0.01 -1.35 0.18 0.00 1.34 0.00 0.00 72.50 72.67 2jer s THR 172 CO 0.11 0.46 1.85 -0.33 -0.54 0.00 0.00 174.62 176.17 2jer h GLU 173 N 5.68 0.98 -0.97 3.99 5.08 -0.66 -2.47 114.58 126.21 2jer h GLU 173 Ca -0.38 -0.15 0.09 0.00 -1.00 0.00 0.00 59.36 57.91 2jer h GLU 173 Cb 1.14 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 30.15 2jer h GLU 173 CO 0.48 0.79 0.62 1.98 -1.00 0.00 0.00 179.01 181.88 2jer h MET 174 N 0.96 1.01 0.00 2.33 4.05 -1.62 -1.82 114.93 119.85 2jer h MET 174 Ca 0.23 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.59 2jer h MET 174 Cb 0.17 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 30.74 2jer h MET 174 CO -0.02 0.67 -0.08 0.00 0.23 0.00 0.00 176.91 177.71 2jer h LEU 176 N -0.81 0.00 -1.83 0.00 3.38 -1.43 -2.39 115.31 112.23 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 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2jer h LEU 176 CO 0.00 0.26 0.00 0.18 0.09 0.00 0.00 178.44 178.97 2jer n LEU 177 N -3.64 2.72 -4.81 1.67 4.77 -0.69 -4.50 117.00 112.53 2jer n LEU 177 Ca -0.01 -1.21 -0.33 0.00 -0.03 0.00 0.00 56.01 54.43 2jer n LEU 177 Cb 0.39 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2jer n LEU 177 CO 0.34 0.61 0.71 -0.94 -1.33 0.00 0.00 177.39 176.78 2jer s SER 178 N -1.39 5.92 0.38 -1.43 1.04 -0.90 -4.96 113.70 112.36 2jer s SER 178 Ca 0.36 1.80 0.07 0.00 0.48 0.00 0.00 55.95 58.66 2jer s SER 178 Cb 0.20 -2.53 0.79 0.00 0.10 0.00 0.00 66.02 64.58 2jer s SER 178 CO 0.28 -1.07 1.98 -0.08 0.98 0.00 0.00 173.24 175.33 2jer h GLU 179 N 0.59 0.67 -0.00 4.02 4.81 -1.92 -2.48 114.58 120.26 2jer h GLU 179 Ca -0.47 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 2jer h GLU 179 Cb 1.22 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2jer h GLU 179 CO 0.58 0.44 -0.00 0.41 -0.73 0.00 0.00 179.01 179.71 2jer n GLY 180 N -1.46 -0.90 0.00 1.92 0.00 -1.26 -4.15 105.19 99.33 2jer n GLY 180 Ca 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.88 0.00 -3.20 1.61 5.12 -0.93 -4.06 116.66 114.31 2jer n ARG 181 Ca 0.23 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.90 2jer n ARG 181 Cb 0.15 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.39 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 -0.28 2.60 0.25 0.55 4.13 -1.26 -4.65 115.26 116.61 2jer n ASN 182 Ca 0.00 -3.26 0.17 0.00 1.68 0.00 0.00 54.58 53.18 2jer n ASN 182 Cb 0.00 -0.63 0.84 0.00 -1.54 0.00 0.00 39.78 38.45 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 3.62 0.00 0.00 3.52 0.13 -1.75 -1.32 132.00 136.19 2jer h PRO 183 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2jer h PRO 183 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2jer h PRO 183 CO 0.69 0.00 -0.18 1.04 -0.23 0.00 0.00 178.00 179.32 2jer n GLN 184 N -2.79 0.21 -3.52 0.86 1.13 -1.26 -4.86 117.38 107.15 2jer n GLN 184 Ca -0.01 0.13 -0.38 0.00 -1.94 0.00 0.00 57.00 54.81 2jer n GLN 184 Cb 0.15 -1.71 -0.06 0.00 0.11 0.00 0.00 30.24 28.74 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 -4.10 4.45 0.86 1.08 1.43 -0.50 -5.08 118.68 116.82 2jer s LEU 185 Ca 0.10 0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 53.99 2jer s LEU 185 Cb 0.14 -2.55 0.11 0.00 0.03 0.00 0.00 46.19 43.92 2jer s LEU 185 CO 0.62 0.31 1.10 -0.94 0.23 0.00 0.00 176.35 177.67 2jer s SER 186 N -0.93 3.83 0.24 2.29 1.04 -1.26 -4.87 113.70 114.04 2jer s SER 186 Ca 0.23 1.34 -0.06 0.00 0.48 0.00 0.00 55.95 57.94 2jer s SER 186 Cb -0.16 -2.03 0.30 0.00 0.10 0.00 0.00 66.02 64.23 2jer s SER 186 CO 0.12 -2.39 1.88 0.50 0.98 0.00 0.00 173.24 174.33 2jer h LYS 187 N -1.38 1.08 -0.68 4.02 3.64 -1.98 -1.65 116.57 119.62 2jer h LYS 187 Ca -0.49 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 2jer h LYS 187 Cb 1.29 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.83 2jer h LYS 187 CO 0.57 0.72 0.43 0.93 -2.27 0.00 0.00 179.45 179.83 2jer h GLU 188 N 1.12 0.91 -0.75 1.90 3.07 -1.99 -0.20 114.58 118.63 2jer h GLU 188 Ca 0.37 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 59.14 2jer h GLU 188 Cb 0.04 -0.20 -0.03 0.00 -0.84 0.00 0.00 28.75 27.72 2jer h GLU 188 CO -0.13 0.62 0.38 0.00 -1.40 0.00 0.00 179.01 178.48 2jer h ALA 189 N 1.23 0.97 -0.40 3.43 0.00 -1.73 -1.39 119.26 121.37 2jer h ALA 189 Ca 0.25 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2jer h ALA 189 Cb -0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.40 2jer h ALA 189 CO -0.05 0.51 0.14 0.82 0.00 0.00 0.00 179.25 180.67 2jer h ILE 190 N 1.05 1.21 -0.80 0.00 2.04 -1.00 -2.42 117.51 117.58 2jer h ILE 190 Ca 0.26 -0.67 0.10 0.00 1.00 0.00 0.00 64.86 65.56 2jer h ILE 190 Cb 0.09 0.89 -0.08 0.00 -0.74 0.00 0.00 36.82 36.98 2jer h ILE 190 CO -0.04 0.24 0.44 -0.33 0.00 0.00 0.00 178.15 178.46 2jer h GLU 191 N 0.51 0.70 -0.64 2.37 5.08 -0.75 -1.74 114.58 120.10 2jer h GLU 191 Ca 0.13 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2jer h GLU 191 Cb 0.23 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 2jer h GLU 191 CO -0.01 0.46 0.27 1.96 -1.00 0.00 0.00 179.01 180.70 2jer h GLN 192 N 0.72 0.95 -0.65 2.33 4.20 -1.00 -0.32 115.11 121.35 2jer h GLN 192 Ca 0.40 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.95 2jer h GLN 192 Cb 0.40 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 2jer h GLN 192 CO -0.27 0.79 0.43 0.87 -0.67 0.00 0.00 178.83 179.98 2jer h LYS 193 N 0.90 0.85 -0.44 1.46 1.79 -0.89 0.19 116.57 120.42 2jer h LYS 193 Ca 0.22 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.59 2jer h LYS 193 Cb 0.18 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 2jer h LYS 193 CO -0.02 0.56 0.08 -0.07 -1.08 0.00 0.00 179.45 178.92 2jer h LEU 194 N 0.87 0.69 -0.45 2.94 3.38 -0.90 -1.12 115.31 120.73 2jer h LEU 194 Ca 0.24 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jer h LEU 194 Cb -0.09 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2jer h LEU 194 CO -0.06 0.77 0.28 0.00 0.09 0.00 0.00 178.44 179.52 2jer h ASP 196 N 0.60 1.04 0.33 0.00 3.32 -0.72 -1.56 116.42 119.42 2jer h ASP 196 Ca 0.16 -0.33 -0.22 0.00 0.02 0.00 0.00 57.03 56.66 2jer h ASP 196 Cb -0.04 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.19 2jer h ASP 196 CO -0.03 1.13 -1.86 -1.22 -1.72 0.00 0.00 179.24 175.54 2jer n TYR 197 N -4.15 0.49 0.52 4.55 4.02 -0.44 -1.58 117.16 120.57 2jer n TYR 197 Ca 0.02 0.17 0.11 0.00 -0.01 0.00 0.00 57.90 58.19 2jer n TYR 197 Cb 0.39 -0.97 -0.03 0.00 -0.02 0.00 0.00 39.34 38.72 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 -2.75 0.58 -2.91 7.72 4.32 -0.26 -4.71 117.00 118.99 2jer n LEU 198 Ca -0.17 -0.07 -0.10 0.00 -0.02 0.00 0.00 56.01 55.66 2jer n LEU 198 Cb 0.92 -0.07 0.05 0.00 -1.62 0.00 0.00 43.42 42.69 2jer n LEU 198 CO 0.44 0.06 0.08 -3.20 -1.22 0.00 0.00 177.39 173.54 2jer n ASN 199 N -1.97 -6.02 -4.40 -1.43 4.05 -0.64 -1.78 115.26 103.08 2jer n ASN 199 Ca 0.01 -0.48 -0.20 0.00 0.45 0.00 0.00 54.58 54.36 2jer n ASN 199 Cb 0.45 -4.41 -0.10 0.00 1.23 0.00 0.00 39.78 36.94 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 -3.26 1.57 0.00 3.44 -7.23 -0.89 -4.45 120.40 109.58 2jer s VAL 200 Ca 0.30 -2.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.35 2jer s VAL 200 Cb -0.04 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.54 2jer s VAL 200 CO 0.61 -0.36 0.00 -1.84 -0.31 0.00 0.00 175.10 173.20 2jer n GLU 201 N -0.52 4.89 -4.39 4.82 0.28 0.51 -4.44 120.64 121.79 2jer n GLU 201 Ca -0.06 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.70 2jer n GLU 201 Cb 0.63 -0.53 -0.17 0.00 1.43 0.00 0.00 31.44 32.80 2jer n GLU 201 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2jer s LYS 202 N -1.03 1.49 -0.27 3.44 2.20 -0.76 -5.05 119.74 119.76 2jer s LYS 202 Ca 0.00 -0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 55.23 2jer s LYS 202 Cb 0.00 -1.31 0.00 0.00 -1.51 0.00 0.00 37.83 35.01 2jer s LYS 202 CO 0.00 -0.04 0.04 0.08 -0.36 0.00 0.00 175.35 175.07 2jer s VAL 203 N 0.88 3.83 -0.33 4.02 1.01 -1.26 -1.37 120.40 127.18 2jer s VAL 203 Ca -0.11 -0.59 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 2jer s VAL 203 Cb -0.15 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.32 2jer s VAL 203 CO 0.01 0.20 0.43 -0.76 0.00 0.00 0.00 175.10 174.98 2jer s LEU 204 N 1.50 4.31 -0.40 3.92 1.43 0.45 -5.00 118.68 124.90 2jer s LEU 204 Ca 0.04 -0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 2jer s LEU 204 Cb -0.16 -2.47 0.01 0.00 0.03 0.00 0.00 46.19 43.60 2jer s LEU 204 CO 0.01 -0.36 0.31 0.26 0.23 0.00 0.00 176.35 176.80 2jer s TRP 205 N 2.19 3.23 0.75 0.29 0.52 -1.26 -1.36 118.94 123.29 2jer s TRP 205 Ca 0.16 -0.48 -0.11 0.00 0.02 0.00 0.00 56.10 55.68 2jer s TRP 205 Cb -0.16 -2.61 0.04 0.00 -1.15 0.00 0.00 33.47 29.58 2jer s TRP 205 CO 0.12 -0.56 1.09 -0.51 0.02 0.00 0.00 176.95 177.11 2jer s LEU 206 N 1.76 2.78 0.00 2.99 1.43 0.02 -4.92 118.68 122.74 2jer s LEU 206 Ca 0.06 1.24 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 2jer s LEU 206 Cb -0.18 -3.96 0.00 0.00 0.03 0.00 0.00 46.19 42.07 2jer s LEU 206 CO 0.11 -1.62 0.00 0.61 0.23 0.00 0.00 176.35 175.68 2jer n GLY 207 N -2.54 0.97 3.77 -3.19 0.00 -1.26 -0.77 105.19 102.18 2jer n GLY 207 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 7.27 0.33 1.61 -0.00 -1.26 -1.82 116.67 121.79 2jer s ASP 208 Ca 0.00 1.93 0.00 0.00 -0.00 0.00 0.00 52.55 54.48 2jer s ASP 208 Cb 0.00 -2.59 0.00 0.00 -0.00 0.00 0.00 42.92 40.33 2jer s ASP 208 CO 0.00 -0.12 0.00 0.61 -0.00 0.00 0.00 175.17 175.66 2jer n GLY 209 N 0.70 0.86 0.48 0.21 0.00 -1.25 -4.90 105.19 101.28 2jer n GLY 209 Ca 0.02 -1.96 0.07 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.25 0.00 -3.22 -0.61 -5.35 -1.26 -4.69 119.36 102.97 2jer n ILE 210 Ca 0.00 -0.44 -0.24 0.00 -0.27 0.00 0.00 62.75 61.79 2jer n ILE 210 Cb 0.00 1.25 -0.06 0.00 -1.74 0.00 0.00 39.64 39.09 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 0.43 2.06 0.12 7.28 3.85 -1.26 -4.93 116.55 124.10 2jer n ASP 211 Ca 0.07 -3.14 0.09 0.00 -0.71 0.00 0.00 54.79 51.11 2jer n ASP 211 Cb 0.34 -0.63 0.57 0.00 -1.35 0.00 0.00 41.12 40.04 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 3.71 0.19 0.00 0.11 0.13 -1.88 -2.05 132.00 132.21 2jer h PRO 212 Ca 0.12 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2jer h PRO 212 Cb 0.77 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2jer h PRO 212 CO 0.64 0.13 -0.56 0.93 -0.23 0.00 0.00 178.00 178.90 2jer h GLU 213 N 0.20 0.00 0.00 0.86 4.39 -1.95 -3.25 114.58 114.83 2jer h GLU 213 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2jer h GLU 213 Cb 0.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2jer h GLU 213 CO -0.02 0.00 0.00 -1.91 -1.16 0.00 0.00 179.01 175.92 2jer n GLU 214 N -2.80 0.00 -0.03 2.33 4.07 -0.91 -4.74 120.64 118.56 2jer n GLU 214 Ca 0.02 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.24 2jer n GLU 214 Cb 0.53 -0.08 0.32 0.00 -0.06 0.00 0.00 31.44 32.15 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 -0.89 0.09 -3.07 6.31 -2.24 -1.15 -4.89 114.28 108.44 2jer n THR 215 Ca 0.00 -0.41 -0.15 0.00 -2.27 0.00 0.00 64.05 61.22 2jer n THR 215 Cb 0.00 0.89 0.04 0.00 -2.10 0.00 0.00 70.33 69.16 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 0.76 -4.72 -0.57 3.42 3.02 -0.83 -4.27 115.26 112.07 2jer n ASN 216 Ca 0.17 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.42 2jer n ASN 216 Cb 0.47 -3.39 0.00 0.00 -0.61 0.00 0.00 39.78 36.25 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 -1.41 0.75 3.60 7.41 0.00 -0.87 -1.58 105.19 113.10 2jer n GLY 217 Ca -0.02 -0.48 -0.48 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.51 1.49 0.28 1.61 8.25 -1.26 -3.97 115.22 120.11 2jer n HIS 218 Ca 0.00 0.62 0.12 0.00 -0.26 0.00 0.00 57.72 58.20 2jer n HIS 218 Cb 0.40 -2.32 0.77 0.00 1.12 0.00 0.00 29.99 29.97 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 2.77 0.74 0.00 1.59 3.04 -1.74 -2.90 116.25 119.75 2jer h VAL 219 Ca -0.44 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 2jer h VAL 219 Cb 1.33 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.67 2jer h VAL 219 CO 0.72 0.03 0.00 -0.90 -1.01 0.00 0.00 177.57 176.40 2jer n ASP 220 N -4.10 0.00 -0.16 3.17 5.75 -1.07 -0.54 116.55 119.61 2jer n ASP 220 Ca -0.03 0.34 0.12 0.00 -0.01 0.00 0.00 54.79 55.21 2jer n ASP 220 Cb 0.11 -0.42 0.26 0.00 -1.03 0.00 0.00 41.12 40.04 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 -1.42 0.92 -0.05 -1.12 8.00 -1.09 -3.59 116.55 118.20 2jer n ASP 221 Ca 0.05 -0.72 -0.10 0.00 0.71 0.00 0.00 54.79 54.73 2jer n ASP 221 Cb 0.15 0.28 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 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 -0.98 0.58 -3.58 2.53 0.31 0.30 -4.61 118.33 112.88 2jer n VAL 222 Ca 0.09 -0.11 -0.15 0.00 -0.01 0.00 0.00 64.34 64.16 2jer n VAL 222 Cb 0.35 -1.65 -0.06 0.00 -0.91 0.00 0.00 33.84 31.57 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 -2.19 -1.41 0.25 3.52 0.00 -0.34 -1.25 121.76 120.34 2jer s ALA 223 Ca -0.13 0.84 -0.10 0.00 0.00 0.00 0.00 51.96 52.57 2jer s ALA 223 Cb 0.05 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 2jer s ALA 223 CO 0.17 -0.41 0.42 0.00 0.00 0.00 0.00 175.76 175.94 2jer s PHE 225 N -3.95 3.46 -0.09 0.00 0.08 -1.26 -1.13 117.98 115.09 2jer s PHE 225 Ca 0.26 0.90 0.15 0.00 0.12 0.00 0.00 56.93 58.36 2jer s PHE 225 Cb 0.01 -2.65 -0.19 0.00 -0.57 0.00 0.00 43.02 39.62 2jer s PHE 225 CO 0.10 0.03 0.71 0.44 -0.10 0.00 0.00 175.22 176.40 2jer n ILE 226 N 4.09 1.37 -3.66 0.64 -5.35 0.18 -4.83 119.36 111.80 2jer n ILE 226 Ca -0.05 -0.74 -0.05 0.00 -0.27 0.00 0.00 62.75 61.64 2jer n ILE 226 Cb 0.51 -0.85 -0.02 0.00 -1.74 0.00 0.00 39.64 37.54 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 -2.76 -1.76 0.18 -1.28 0.00 -1.17 -4.86 121.76 110.11 2jer s ALA 227 Ca -0.04 0.48 -0.33 0.00 0.00 0.00 0.00 51.96 52.06 2jer s ALA 227 Cb 0.08 0.54 -0.14 0.00 0.00 0.00 0.00 23.12 23.60 2jer s ALA 227 CO 0.82 -0.92 1.56 -2.30 0.00 0.00 0.00 175.76 174.91 2jer n PRO 228 N -0.39 2.19 -0.99 0.00 -0.02 -1.26 -1.31 135.00 133.22 2jer n PRO 228 Ca -0.07 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 2jer n PRO 228 Cb 0.61 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 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 3.16 0.67 2.91 -1.23 0.00 -1.26 -5.02 105.19 104.43 2jer n GLY 229 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.09 1.10 0.11 1.61 2.02 -0.43 -1.34 118.70 121.68 2jer s GLU 230 Ca 0.00 -0.17 0.08 0.00 0.02 0.00 0.00 54.97 54.90 2jer s GLU 230 Cb 0.00 -1.08 -0.04 0.00 0.10 0.00 0.00 34.13 33.12 2jer s GLU 230 CO 0.00 -0.10 -0.20 0.14 0.02 0.00 0.00 175.26 175.12 2jer s VAL 231 N 1.07 1.67 -0.03 2.63 -7.23 -0.09 -0.65 120.40 117.76 2jer s VAL 231 Ca -0.08 -1.58 -0.03 0.00 -1.81 0.00 0.00 61.98 58.48 2jer s VAL 231 Cb -0.14 -1.55 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2jer s VAL 231 CO -0.01 -0.11 0.13 0.00 -0.31 0.00 0.00 175.10 174.80 2jer s ALA 232 N -1.31 3.78 -0.02 1.32 0.00 -0.28 -0.40 121.76 124.85 2jer s ALA 232 Ca 0.07 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.25 2jer s ALA 232 Cb -0.09 -1.78 0.02 0.00 0.00 0.00 0.00 23.12 21.28 2jer s ALA 232 CO 0.04 0.70 0.02 0.00 0.00 0.00 0.00 175.76 176.52 2jer n ILE 234 N 3.96 4.36 -3.73 0.00 -5.35 -0.38 -1.10 119.36 117.12 2jer n ILE 234 Ca -0.25 -0.50 -0.13 0.00 -0.27 0.00 0.00 62.75 61.60 2jer n ILE 234 Cb 0.52 -1.44 -0.10 0.00 -1.74 0.00 0.00 39.64 36.88 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 -1.39 -0.47 -0.01 4.28 5.04 -0.43 -4.74 117.35 119.63 2jer s TYR 235 Ca 0.78 1.15 -0.23 0.00 -2.44 0.00 0.00 57.07 56.33 2jer s TYR 235 Cb -0.40 0.16 0.05 0.00 0.35 0.00 0.00 41.96 42.12 2jer s TYR 235 CO 0.44 -0.23 0.52 -0.08 -1.34 0.00 0.00 175.55 174.86 2jer s THR 236 N 0.21 0.03 -0.70 4.34 -1.32 -1.26 -3.56 115.64 113.38 2jer s THR 236 Ca -0.00 -0.23 0.07 0.00 -1.21 0.00 0.00 61.69 60.32 2jer s THR 236 Cb -0.03 -0.88 0.17 0.00 -1.51 0.00 0.00 72.50 70.25 2jer s THR 236 CO 0.01 -0.13 1.06 -0.62 -2.21 0.00 0.00 174.62 172.73 2jer n GLU 237 N 0.87 2.17 -2.60 7.08 1.02 -1.26 -4.82 120.64 123.10 2jer n GLU 237 Ca -0.20 -1.63 -0.41 0.00 -0.02 0.00 0.00 57.16 54.90 2jer n GLU 237 Cb 0.58 -1.17 -0.03 0.00 -0.02 0.00 0.00 31.44 30.80 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 -0.90 6.20 0.08 1.62 -1.08 -1.26 -4.88 116.67 116.45 2jer s ASP 238 Ca 0.14 -0.44 0.13 0.00 -0.52 0.00 0.00 52.55 51.85 2jer s ASP 238 Cb 0.08 -2.54 0.57 0.00 -1.46 0.00 0.00 42.92 39.56 2jer s ASP 238 CO 0.10 -1.74 1.40 0.00 0.52 0.00 0.00 175.17 175.45 2jer n GLN 239 N 9.04 0.05 0.08 4.34 6.02 -1.26 -0.99 117.38 134.65 2jer n GLN 239 Ca 0.03 0.39 0.13 0.00 -0.01 0.00 0.00 57.00 57.54 2jer n GLN 239 Cb 0.49 -1.62 0.30 0.00 1.02 0.00 0.00 30.24 30.43 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 -1.71 0.73 -4.77 1.08 3.02 -1.26 -4.90 115.26 107.45 2jer n ASN 240 Ca 0.02 0.35 -0.41 0.00 -0.03 0.00 0.00 54.58 54.50 2jer n ASN 240 Cb 0.12 -0.33 -0.01 0.00 -0.61 0.00 0.00 39.78 38.96 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 -4.31 6.33 0.40 6.41 0.15 -0.16 -4.87 113.70 117.64 2jer s SER 241 Ca 0.09 3.04 0.28 0.00 0.70 0.00 0.00 55.95 60.06 2jer s SER 241 Cb 0.13 -2.66 1.34 0.00 -1.71 0.00 0.00 66.02 63.13 2jer s SER 241 CO 0.65 -0.90 1.86 1.55 1.20 0.00 0.00 173.24 177.60 2jer h PRO 242 N 3.57 0.00 -0.01 5.44 0.13 -1.91 -2.43 132.00 136.79 2jer h PRO 242 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2jer h PRO 242 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2jer h PRO 242 CO 0.69 0.00 -0.35 1.19 -0.23 0.00 0.00 178.00 179.29 2jer n PHE 243 N -2.55 0.00 0.23 1.56 3.72 -1.26 -4.68 117.46 114.48 2jer n PHE 243 Ca 0.00 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.23 2jer n PHE 243 Cb 0.17 -0.10 -0.09 0.00 -0.94 0.00 0.00 39.48 38.52 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 1.40 -1.38 -0.24 1.38 3.20 -1.69 -0.23 116.97 119.40 2jer h TYR 244 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 2jer h TYR 244 Cb 0.57 0.55 -0.01 0.00 1.54 0.00 0.00 36.73 39.38 2jer h TYR 244 CO 0.00 -0.63 0.13 0.93 -1.64 0.00 0.00 178.16 176.95 2jer h GLU 245 N -0.90 0.34 -0.63 1.82 4.39 -1.83 -1.11 114.58 116.65 2jer h GLU 245 Ca -0.04 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.60 2jer h GLU 245 Cb 0.82 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 2jer h GLU 245 CO -0.13 0.31 0.30 0.00 -1.16 0.00 0.00 179.01 178.33 2jer h ALA 246 N 1.01 0.82 -0.11 3.43 0.00 -1.86 -0.63 119.26 121.92 2jer h ALA 246 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jer h ALA 246 Cb 0.07 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2jer h ALA 246 CO -0.01 0.38 0.05 0.00 0.00 0.00 0.00 179.25 179.67 2jer h ALA 247 N 1.13 0.14 -0.46 0.00 0.00 -0.85 -1.21 119.26 118.00 2jer h ALA 247 Ca 0.22 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2jer h ALA 247 Cb 0.13 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2jer h ALA 247 CO -0.03 -0.31 0.17 1.96 0.00 0.00 0.00 179.25 181.05 2jer h GLN 248 N 0.05 0.34 -0.42 0.00 1.08 -1.09 -1.45 115.11 113.63 2jer h GLN 248 Ca 0.04 -0.02 -0.14 0.00 -1.45 0.00 0.00 58.65 57.08 2jer h GLN 248 Cb 0.11 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 2jer h GLN 248 CO -0.00 0.22 -0.29 0.22 -0.95 0.00 0.00 178.83 178.03 2jer h ASP 249 N 0.35 0.94 -0.58 1.46 3.58 -1.02 -2.26 116.42 118.90 2jer h ASP 249 Ca 0.21 -0.38 -0.04 0.00 0.42 0.00 0.00 57.03 57.24 2jer h ASP 249 Cb 0.20 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 2jer h ASP 249 CO -0.21 1.16 0.20 0.00 -2.88 0.00 0.00 179.24 177.51 2jer h ALA 250 N 0.90 0.75 -0.07 -0.78 0.00 -1.06 -1.25 119.26 117.75 2jer h ALA 250 Ca 0.09 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2jer h ALA 250 Cb 0.86 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2jer h ALA 250 CO 0.08 0.39 0.03 -0.92 0.00 0.00 0.00 179.25 178.83 2jer h TYR 251 N 0.80 0.10 -0.79 0.00 3.20 -1.19 -0.32 116.97 118.78 2jer h TYR 251 Ca 0.19 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 2jer h TYR 251 Cb 0.24 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2jer h TYR 251 CO 0.01 0.19 0.42 1.96 -1.64 0.00 0.00 178.16 179.11 2jer h GLN 252 N -0.02 1.11 -0.25 1.82 1.08 -1.30 -2.45 115.11 115.10 2jer h GLN 252 Ca 0.02 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 2jer h GLN 252 Cb 0.13 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2jer h GLN 252 CO -0.00 0.82 0.10 0.00 -0.95 0.00 0.00 178.83 178.81 2jer h ARG 253 N 1.10 0.36 -0.46 1.46 3.08 -0.97 -3.20 114.38 115.75 2jer h ARG 253 Ca 0.28 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 2jer h ARG 253 Cb 0.05 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 2jer h ARG 253 CO -0.04 0.39 0.21 -0.07 -1.07 0.00 0.00 179.97 179.40 2jer h LEU 254 N 0.25 0.58 -1.78 3.04 3.38 -0.84 -2.66 115.31 117.28 2jer h LEU 254 Ca 0.08 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.10 2jer h LEU 254 Cb 0.16 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2jer h LEU 254 CO -0.01 0.51 0.35 -0.07 0.09 0.00 0.00 178.44 179.31 2jer h LEU 255 N 0.65 0.22 -1.94 1.67 3.38 -1.43 -2.36 115.31 115.50 2jer h LEU 255 Ca 0.16 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2jer h LEU 255 Cb 0.08 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2jer h LEU 255 CO -0.02 0.13 0.00 0.29 0.09 0.00 0.00 178.44 178.93 2jer n LYS 256 N -4.45 1.43 -2.72 1.13 5.02 -1.02 -4.66 118.16 112.88 2jer n LYS 256 Ca 0.08 -1.53 -0.37 0.00 -2.02 0.00 0.00 58.31 54.47 2jer n LYS 256 Cb 0.41 -1.26 -0.06 0.00 -0.02 0.00 0.00 35.03 34.10 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 -1.03 4.55 0.08 1.97 -1.94 -0.89 -4.97 119.30 117.07 2jer s MET 257 Ca 0.18 1.40 0.07 0.00 -1.71 0.00 0.00 55.69 55.63 2jer s MET 257 Cb 0.11 -2.82 -0.04 0.00 2.01 0.00 0.00 34.83 34.09 2jer s MET 257 CO 0.16 0.23 -0.15 0.95 -0.01 0.00 0.00 175.02 176.21 2jer s THR 258 N -1.56 3.06 0.53 2.05 -4.23 -1.26 -1.71 115.64 112.52 2jer s THR 258 Ca 0.50 -1.27 -0.06 0.00 -1.18 0.00 0.00 61.69 59.68 2jer s THR 258 Cb -0.21 -2.37 0.12 0.00 1.34 0.00 0.00 72.50 71.38 2jer s THR 258 CO 0.26 0.20 0.72 -0.90 -0.54 0.00 0.00 174.62 174.37 2jer n ASP 259 N 1.07 0.32 0.30 3.99 5.68 -0.53 -4.88 116.55 122.50 2jer n ASP 259 Ca -0.15 -1.42 0.17 0.00 -0.50 0.00 0.00 54.79 52.88 2jer n ASP 259 Cb 0.52 -0.53 0.95 0.00 -1.14 0.00 0.00 41.12 40.92 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 -1.41 1.31 -0.23 2.12 0.00 -1.82 -0.71 119.26 118.53 2jer h ALA 260 Ca -0.24 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2jer h ALA 260 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2jer h ALA 260 CO 0.19 0.03 0.00 1.63 0.00 0.00 0.00 179.25 181.11 2jer n LYS 261 N -3.57 2.10 -0.72 0.00 5.02 -1.26 -4.94 118.16 114.79 2jer n LYS 261 Ca -0.03 -1.65 0.00 0.00 -2.02 0.00 0.00 58.31 54.62 2jer n LYS 261 Cb 0.12 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 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 1.31 0.65 3.71 0.72 0.00 -0.27 -5.02 105.19 106.27 2jer n GLY 262 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.28 4.50 0.07 1.61 0.52 -1.26 -4.78 118.95 119.33 2jer s ARG 263 Ca 0.00 1.53 -0.31 0.00 -0.52 0.00 0.00 55.73 56.44 2jer s ARG 263 Cb 0.00 -3.44 -0.06 0.00 0.52 0.00 0.00 34.95 31.97 2jer s ARG 263 CO 0.00 -0.15 1.31 -1.14 0.02 0.00 0.00 175.30 175.34 2jer s GLN 264 N 1.16 4.36 0.23 3.54 0.74 -1.26 -1.46 119.66 126.97 2jer s GLN 264 Ca 0.54 1.92 -0.30 0.00 0.05 0.00 0.00 55.36 57.56 2jer s GLN 264 Cb -0.23 -3.35 -0.10 0.00 1.10 0.00 0.00 33.01 30.43 2jer s GLN 264 CO 0.27 -0.38 1.49 -0.51 -0.55 0.00 0.00 175.29 175.61 2jer s LEU 265 N 1.31 4.38 -0.31 3.68 1.43 -0.69 -4.95 118.68 123.53 2jer s LEU 265 Ca 0.62 2.68 -0.22 0.00 -1.03 0.00 0.00 54.13 56.18 2jer s LEU 265 Cb -0.33 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.27 2jer s LEU 265 CO 0.29 -0.75 0.71 -0.75 0.23 0.00 0.00 176.35 176.08 2jer s LYS 266 N -0.01 3.91 -0.24 1.70 2.20 -0.45 -4.82 119.74 122.05 2jer s LYS 266 Ca 0.62 0.43 -0.08 0.00 -0.36 0.00 0.00 55.97 56.59 2jer s LYS 266 Cb -0.43 -3.73 -0.03 0.00 -1.51 0.00 0.00 37.83 32.12 2jer s LYS 266 CO 0.41 -0.64 0.08 0.08 -0.36 0.00 0.00 175.35 174.91 2jer s VAL 267 N 2.80 4.52 -0.19 4.02 1.01 -1.26 -0.92 120.40 130.38 2jer s VAL 267 Ca 0.29 -0.11 -0.05 0.00 0.00 0.00 0.00 61.98 62.11 2jer s VAL 267 Cb -0.14 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 2jer s VAL 267 CO 0.12 0.36 0.01 -1.00 0.00 0.00 0.00 175.10 174.60 2jer s HIS 268 N 1.33 3.08 0.31 5.22 3.76 0.46 -4.98 115.29 124.47 2jer s HIS 268 Ca 0.05 -0.31 -0.28 0.00 -0.15 0.00 0.00 55.06 54.37 2jer s HIS 268 Cb -0.15 -2.08 -0.09 0.00 1.11 0.00 0.00 32.58 31.37 2jer s HIS 268 CO 0.04 -0.14 1.08 0.15 -0.85 0.00 0.00 174.74 175.02 2jer s LYS 269 N 0.83 4.52 -0.10 1.40 1.02 -1.26 -0.80 119.74 125.34 2jer s LYS 269 Ca 0.01 1.71 0.02 0.00 0.02 0.00 0.00 55.97 57.74 2jer s LYS 269 Cb -0.14 -3.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.17 2jer s LYS 269 CO 0.02 0.13 -0.17 -1.17 -0.92 0.00 0.00 175.35 173.24 2jer s LEU 270 N -1.77 1.82 1.16 3.17 2.96 -0.26 -4.84 118.68 120.93 2jer s LEU 270 Ca 0.48 -0.44 -0.13 0.00 -0.22 0.00 0.00 54.13 53.82 2jer s LEU 270 Cb -0.29 -1.13 0.28 0.00 0.50 0.00 0.00 46.19 45.56 2jer s LEU 270 CO 0.37 0.06 1.03 0.00 -1.32 0.00 0.00 176.35 176.49 2jer n PRO 273 N -0.21 2.18 -0.14 0.00 -0.02 -1.26 -4.87 135.00 130.67 2jer n PRO 273 Ca -0.09 0.77 -0.11 0.00 -2.02 0.00 0.00 63.50 62.05 2jer n PRO 273 Cb 0.58 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.68 1.28 -3.32 -1.45 2.07 -1.97 -3.44 116.25 112.10 2jer h VAL 274 Ca -0.46 -1.26 -0.67 0.00 0.82 0.00 0.00 66.70 65.13 2jer h VAL 274 Cb 1.28 1.21 -0.14 0.00 -1.52 0.00 0.00 31.29 32.12 2jer h VAL 274 CO 0.65 0.43 -0.63 -0.54 0.02 0.00 0.00 177.57 177.50 2jer s LYS 275 N -4.73 2.88 0.27 1.57 1.02 -1.26 -5.06 119.74 114.43 2jer s LYS 275 Ca -0.12 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.04 2jer s LYS 275 Cb 0.11 -2.73 -0.10 0.00 -0.52 0.00 0.00 37.83 34.58 2jer s LYS 275 CO 0.83 0.65 1.39 -0.80 -0.92 0.00 0.00 175.35 176.51 2jer s ASN 276 N -1.36 6.71 -0.12 2.83 0.01 -1.26 -5.01 114.94 116.74 2jer s ASN 276 Ca 0.18 2.65 -0.21 0.00 -0.71 0.00 0.00 52.86 54.76 2jer s ASN 276 Cb -0.11 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.88 2jer s ASN 276 CO 0.08 -0.64 0.61 -0.69 -1.51 0.00 0.00 177.10 174.96 2jer s VAL 277 N -0.30 5.08 0.09 1.60 1.01 -1.26 -5.02 120.40 121.60 2jer s VAL 277 Ca 0.56 1.23 0.06 0.00 0.00 0.00 0.00 61.98 63.83 2jer s VAL 277 Cb -0.41 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2jer s VAL 277 CO 0.46 0.24 -0.15 0.42 0.00 0.00 0.00 175.10 176.07 2jer s THR 278 N 1.03 1.23 0.29 3.92 -4.23 -1.26 -0.16 115.64 116.45 2jer s THR 278 Ca 0.32 -1.45 -0.29 0.00 -1.18 0.00 0.00 61.69 59.08 2jer s THR 278 Cb -0.16 -1.26 -0.10 0.00 1.34 0.00 0.00 72.50 72.32 2jer s THR 278 CO 0.14 -0.27 1.37 -0.63 -0.54 0.00 0.00 174.62 174.68 2jer s ILE 279 N -1.53 2.72 -0.11 2.99 -1.09 -0.37 -4.91 121.20 118.90 2jer s ILE 279 Ca 0.02 0.66 -0.05 0.00 -2.23 0.00 0.00 60.65 59.05 2jer s ILE 279 Cb -0.08 -3.42 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 2jer s ILE 279 CO 0.03 0.13 0.07 -0.54 -1.23 0.00 0.00 174.94 173.40 2jer s LYS 280 N -1.05 3.31 0.49 2.79 1.02 -1.26 -0.10 119.74 124.94 2jer s LYS 280 Ca 0.54 -0.27 0.22 0.00 0.02 0.00 0.00 55.97 56.47 2jer s LYS 280 Cb -0.40 -3.02 1.27 0.00 -0.52 0.00 0.00 37.83 35.15 2jer s LYS 280 CO 0.48 0.69 1.97 0.78 -0.92 0.00 0.00 175.35 178.35 2jer h GLY 281 N 5.26 0.26 2.00 -3.33 0.00 -1.90 -1.27 103.07 104.08 2jer h GLY 281 Ca -0.51 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2jer h GLY 281 CO 0.58 0.03 0.00 1.48 0.00 0.00 0.00 176.54 178.62 2jer h SER 282 N 0.16 0.00 -3.12 0.19 4.64 -1.99 -3.44 113.55 109.98 2jer h SER 282 Ca 0.29 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.09 2jer h SER 282 Cb 0.94 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.09 2jer h SER 282 CO -0.04 0.00 0.89 -0.36 -0.87 0.00 0.00 176.83 176.45 2jer s PHE 283 N -3.64 2.87 -1.02 4.77 2.99 -0.48 -4.92 117.98 118.54 2jer s PHE 283 Ca -0.01 0.70 -0.16 0.00 0.00 0.00 0.00 56.93 57.46 2jer s PHE 283 Cb 0.09 -4.03 0.15 0.00 0.00 0.00 0.00 43.02 39.23 2jer s PHE 283 CO 0.34 -3.59 1.21 0.15 -0.00 0.00 0.00 175.22 173.33 2jer s LYS 284 N 0.11 3.79 -0.05 0.44 -0.14 -1.26 -4.96 119.74 117.67 2jer s LYS 284 Ca 0.66 -2.13 0.03 0.00 -1.36 0.00 0.00 55.97 53.18 2jer s LYS 284 Cb -0.47 -4.93 0.00 0.00 -1.68 0.00 0.00 37.83 30.76 2jer s LYS 284 CO 0.41 -1.73 -0.15 0.42 -0.76 0.00 0.00 175.35 173.55 2jer s ILE 285 N 2.04 1.31 0.38 2.17 1.01 -1.26 -1.57 121.20 125.27 2jer s ILE 285 Ca 0.35 -0.63 -0.26 0.00 0.00 0.00 0.00 60.65 60.12 2jer s ILE 285 Cb -0.05 -1.15 -0.09 0.00 0.01 0.00 0.00 42.46 41.19 2jer s ILE 285 CO -0.06 0.39 1.12 -1.81 0.00 0.00 0.00 174.94 174.57 2jer s ASP 286 N 0.25 6.73 -0.17 3.58 1.11 0.68 -4.96 116.67 123.87 2jer s ASP 286 Ca -0.08 2.23 -0.12 0.00 0.18 0.00 0.00 52.55 54.76 2jer s ASP 286 Cb -0.13 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.21 2jer s ASP 286 CO 0.03 -0.52 0.23 0.12 1.18 0.00 0.00 175.17 176.21 2jer s PHE 287 N -1.45 3.44 -0.05 4.23 5.36 -1.26 -4.32 117.98 123.93 2jer s PHE 287 Ca 0.55 0.50 -0.01 0.00 -0.96 0.00 0.00 56.93 57.01 2jer s PHE 287 Cb -0.28 -2.28 0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2jer s PHE 287 CO 0.35 0.26 0.00 0.08 -1.46 0.00 0.00 175.22 174.45 2jer s VAL 288 N 0.42 0.29 0.10 3.12 1.01 -1.26 -5.09 120.40 119.00 2jer s VAL 288 Ca 0.13 0.12 -0.33 0.00 0.00 0.00 0.00 61.98 61.90 2jer s VAL 288 Cb -0.12 -0.43 -0.12 0.00 0.00 0.00 0.00 36.38 35.71 2jer s VAL 288 CO 0.02 0.22 1.75 1.21 0.00 0.00 0.00 175.10 178.29 2jer n GLU 289 N 4.75 2.45 0.00 2.72 4.07 -1.26 -1.12 120.64 132.25 2jer n GLU 289 Ca -0.14 0.89 0.00 0.00 -0.06 0.00 0.00 57.16 57.85 2jer n GLU 289 Cb 0.50 -2.73 0.00 0.00 -0.06 0.00 0.00 31.44 29.16 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 3.96 3.11 3.76 8.31 0.00 -1.26 -4.99 105.19 118.10 2jer n GLY 290 Ca 0.18 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 -2.76 5.36 -0.35 2.61 2.01 -0.27 -3.54 115.64 118.70 2jer s THR 291 Ca 0.00 0.39 -0.40 0.00 0.31 0.00 0.00 61.69 61.99 2jer s THR 291 Cb 0.00 -3.54 -0.15 0.00 0.01 0.00 0.00 72.50 68.82 2jer s THR 291 CO 0.00 0.46 1.92 0.80 -0.69 0.00 0.00 174.62 177.11 2jer n MET 292 N 3.13 0.87 -1.85 4.92 1.56 -0.15 -4.66 117.12 120.94 2jer n MET 292 Ca -0.15 0.29 -0.36 0.00 -0.27 0.00 0.00 57.70 57.22 2jer n MET 292 Cb 0.53 -2.07 0.05 0.00 2.15 0.00 0.00 33.22 33.88 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 4.64 2.74 -0.41 2.12 0.02 -1.26 -4.91 135.00 137.94 2jer s PRO 293 Ca 1.05 1.84 0.04 0.00 0.02 0.00 0.00 61.00 63.96 2jer s PRO 293 Cb -1.11 -1.90 0.11 0.00 0.02 0.00 0.00 34.50 31.62 2jer s PRO 293 CO 0.62 -1.39 0.13 1.03 -0.33 0.00 0.00 177.00 177.07 2jer s ARG 294 N -3.47 1.68 0.09 5.54 1.81 -1.26 -5.10 118.95 118.24 2jer s ARG 294 Ca 0.77 -2.16 0.05 0.00 -1.72 0.00 0.00 55.73 52.67 2jer s ARG 294 Cb -0.31 -3.26 -0.04 0.00 -0.45 0.00 0.00 34.95 30.89 2jer s ARG 294 CO 0.37 -1.01 -0.02 -1.21 -0.68 0.00 0.00 175.30 172.75 2jer s GLU 295 N 0.45 2.47 -0.09 3.54 2.02 -1.26 -4.96 118.70 120.86 2jer s GLU 295 Ca 0.13 -0.87 -0.40 0.00 0.02 0.00 0.00 54.97 53.86 2jer s GLU 295 Cb -0.22 -2.49 -0.18 0.00 0.10 0.00 0.00 34.13 31.34 2jer s GLU 295 CO -0.05 0.54 1.39 -3.47 0.02 0.00 0.00 175.26 173.68 2jer n ASP 296 N 0.63 1.29 0.00 -0.19 2.03 -1.26 -1.13 116.55 117.92 2jer n ASP 296 Ca -0.11 1.13 0.00 0.00 0.52 0.00 0.00 54.79 56.33 2jer n ASP 296 Cb 0.52 -1.06 0.00 0.00 -0.72 0.00 0.00 41.12 39.86 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 2.79 1.28 3.67 0.27 0.00 0.86 -4.89 105.19 109.17 2jer n GLY 297 Ca 0.22 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.79 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 3.19 -4.66 1.61 8.00 -0.28 -4.74 116.55 119.67 2jer n ASP 298 Ca 0.00 1.08 -0.42 0.00 0.71 0.00 0.00 54.79 56.16 2jer n ASP 298 Cb 0.00 -1.44 -0.03 0.00 -0.02 0.00 0.00 41.12 39.62 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 0.99 4.80 0.34 0.53 1.01 -1.26 -1.24 121.20 126.38 2jer s ILE 299 Ca 0.79 1.77 -0.16 0.00 0.00 0.00 0.00 60.65 63.04 2jer s ILE 299 Cb -0.66 -4.20 -0.09 0.00 0.01 0.00 0.00 42.46 37.52 2jer s ILE 299 CO 0.37 -0.07 0.77 0.00 0.00 0.00 0.00 174.94 176.02 2jer n ILE 301 N -0.44 4.05 -3.09 0.00 2.08 -1.26 -4.55 119.36 116.14 2jer n ILE 301 Ca 0.04 -4.25 -0.45 0.00 0.56 0.00 0.00 62.75 58.66 2jer n ILE 301 Cb 0.53 -2.42 -0.03 0.00 -0.75 0.00 0.00 39.64 36.97 2jer n ILE 301 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jer s ALA 302 N 2.72 3.51 -0.09 -1.39 0.00 -1.26 -4.78 121.76 120.47 2jer s ALA 302 Ca 0.48 -2.57 0.02 0.00 0.00 0.00 0.00 51.96 49.89 2jer s ALA 302 Cb 0.03 -3.69 -0.02 0.00 0.00 0.00 0.00 23.12 19.44 2jer s ALA 302 CO 0.02 -2.54 -0.14 0.45 0.00 0.00 0.00 175.76 173.56 2jer s SER 303 N 3.35 4.00 0.25 0.00 0.15 -1.26 -4.46 113.70 115.73 2jer s SER 303 Ca 0.19 -0.27 0.23 0.00 0.70 0.00 0.00 55.95 56.80 2jer s SER 303 Cb -0.16 -1.27 0.96 0.00 -1.71 0.00 0.00 66.02 63.84 2jer s SER 303 CO -0.01 0.24 1.71 -1.22 1.20 0.00 0.00 173.24 175.17 2jer n TYR 304 N 2.99 0.79 0.32 3.44 4.02 -1.26 -2.95 117.16 124.51 2jer n TYR 304 Ca -0.18 0.31 0.15 0.00 -0.01 0.00 0.00 57.90 58.17 2jer n TYR 304 Cb 0.52 -0.99 0.64 0.00 -0.02 0.00 0.00 39.34 39.49 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 -2.48 -0.72 4.05 -1.85 -3.34 114.93 110.59 2jer h MET 305 Ca 0.00 0.00 -0.51 0.00 -0.28 0.00 0.00 59.70 58.91 2jer h MET 305 Cb 0.38 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.13 2jer h MET 305 CO 0.00 0.00 1.80 -1.71 0.23 0.00 0.00 176.91 177.23 2jer n ASN 306 N -2.75 7.24 -4.87 1.39 2.85 -1.15 -4.81 115.26 113.16 2jer n ASN 306 Ca 0.01 -2.74 -0.21 0.00 -0.11 0.00 0.00 54.58 51.53 2jer n ASN 306 Cb 0.26 -1.43 -0.03 0.00 1.24 0.00 0.00 39.78 39.81 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 0.65 3.15 -0.18 1.20 -0.12 -1.25 -1.32 117.98 120.10 2jer s PHE 307 Ca 0.65 -0.13 -0.03 0.00 -0.05 0.00 0.00 56.93 57.36 2jer s PHE 307 Cb 0.25 -1.55 -0.02 0.00 -0.63 0.00 0.00 43.02 41.08 2jer s PHE 307 CO -0.07 0.41 -0.05 -1.17 -0.05 0.00 0.00 175.22 174.28 2jer s LEU 308 N -3.92 3.03 -0.15 -1.99 2.96 -0.56 -4.42 118.68 113.63 2jer s LEU 308 Ca 0.35 -0.27 -0.21 0.00 -0.22 0.00 0.00 54.13 53.79 2jer s LEU 308 Cb -0.08 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 2jer s LEU 308 CO 0.27 0.09 0.62 -0.63 -1.32 0.00 0.00 176.35 175.37 2jer s ILE 309 N 0.83 5.06 -0.28 6.68 1.01 -1.26 -0.97 121.20 132.27 2jer s ILE 309 Ca -0.01 1.21 -0.02 0.00 0.00 0.00 0.00 60.65 61.82 2jer s ILE 309 Cb -0.15 -3.94 0.12 0.00 0.01 0.00 0.00 42.46 38.50 2jer s ILE 309 CO 0.01 0.19 0.24 0.28 0.00 0.00 0.00 174.94 175.66 2jer s THR 310 N 1.38 -0.30 0.00 2.92 -1.32 0.12 -4.74 115.64 113.70 2jer s THR 310 Ca 0.30 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 60.26 2jer s THR 310 Cb -0.16 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.88 2jer s THR 310 CO 0.12 -0.51 0.00 0.59 -2.21 0.00 0.00 174.62 172.61 2jer n ASN 311 N 5.29 0.00 -0.13 8.08 5.03 -1.26 -1.26 115.26 131.01 2jer n ASN 311 Ca -0.04 0.00 0.07 0.00 0.87 0.00 0.00 54.58 55.49 2jer n ASN 311 Cb 0.45 0.00 0.38 0.00 -1.02 0.00 0.00 39.78 39.59 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 5.71 0.40 -4.36 6.41 8.00 -1.26 -4.86 116.55 126.59 2jer n ASP 312 Ca 0.00 -1.63 -0.24 0.00 0.71 0.00 0.00 54.79 53.63 2jer n ASP 312 Cb 0.00 -0.03 -0.11 0.00 -0.02 0.00 0.00 41.12 40.95 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 -1.41 1.49 -0.08 0.44 0.00 -0.39 -0.71 107.32 106.66 2jer s GLY 313 Ca 0.22 -1.53 0.01 0.00 0.00 0.00 0.00 44.72 43.42 2jer s GLY 313 CO 0.17 -1.57 -0.08 0.14 0.00 0.00 0.00 173.10 171.76 2jer s VAL 314 N -1.89 0.94 -0.33 1.40 1.01 -0.28 -0.70 120.40 120.55 2jer s VAL 314 Ca 0.17 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 61.76 2jer s VAL 314 Cb -0.07 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2jer s VAL 314 CO 0.08 0.33 0.16 -0.63 0.00 0.00 0.00 175.10 175.04 2jer s ILE 315 N 1.23 4.45 -0.08 2.22 -1.09 -0.15 -0.35 121.20 127.43 2jer s ILE 315 Ca -0.05 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.76 2jer s ILE 315 Cb -0.14 -3.36 -0.02 0.00 -1.58 0.00 0.00 42.46 37.36 2jer s ILE 315 CO -0.02 -0.05 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.79 2jer s VAL 316 N 1.57 2.85 0.39 2.92 1.01 0.17 -1.49 120.40 127.81 2jer s VAL 316 Ca 0.03 -0.78 -0.27 0.00 0.00 0.00 0.00 61.98 60.96 2jer s VAL 316 Cb -0.18 -2.13 -0.11 0.00 0.00 0.00 0.00 36.38 33.97 2jer s VAL 316 CO 0.06 0.57 1.41 -2.65 0.00 0.00 0.00 175.10 174.48 2jer n PRO 317 N 2.82 2.38 -4.44 2.72 -0.02 -1.26 -1.79 135.00 135.42 2jer n PRO 317 Ca -0.17 0.84 -0.26 0.00 -2.02 0.00 0.00 63.50 61.89 2jer n PRO 317 Cb 0.52 -2.56 -0.17 0.00 -0.02 0.00 0.00 33.50 31.28 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 -2.15 1.79 0.00 -0.52 -1.52 -0.48 -4.76 119.66 112.02 2jer s GLN 318 Ca 0.56 -0.42 0.11 0.00 -1.95 0.00 0.00 55.36 53.66 2jer s GLN 318 Cb -0.49 -1.55 0.12 0.00 -0.22 0.00 0.00 33.01 30.87 2jer s GLN 318 CO 0.61 -0.05 0.91 0.66 -0.25 0.00 0.00 175.29 177.18 2jer n TYR 319 N 4.10 0.08 -0.99 0.91 4.02 -1.26 -1.34 117.16 122.68 2jer n TYR 319 Ca -0.20 -0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.60 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 0.59 0.39 3.93 2.72 0.00 -1.26 -4.79 105.19 106.77 2jer n GLY 320 Ca 0.07 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.98 6.37 0.55 1.61 2.15 -1.26 -4.99 116.67 118.12 2jer s ASP 321 Ca 0.00 0.50 0.24 0.00 0.43 0.00 0.00 52.55 53.72 2jer s ASP 321 Cb 0.00 -2.05 1.45 0.00 -0.30 0.00 0.00 42.92 42.01 2jer s ASP 321 CO 0.00 -0.16 2.06 1.05 -0.17 0.00 0.00 175.17 177.95 2jer h GLU 322 N 1.51 0.00 -0.11 4.34 4.11 -1.97 -1.11 114.58 121.34 2jer h GLU 322 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2jer h GLU 322 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2jer h GLU 322 CO 0.65 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.82 2jer n ASN 323 N -4.24 0.98 -0.14 3.06 5.03 -1.26 -4.36 115.26 114.33 2jer n ASN 323 Ca 0.04 -1.66 -0.04 0.00 0.87 0.00 0.00 54.58 53.79 2jer n ASN 323 Cb 0.40 -0.07 0.05 0.00 -1.02 0.00 0.00 39.78 39.13 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 1.26 0.12 -0.37 6.41 3.32 -1.59 -1.04 116.42 124.53 2jer h ASP 324 Ca 0.00 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 2jer h ASP 324 Cb 0.28 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2jer h ASP 324 CO 0.00 0.10 0.05 -0.09 -1.72 0.00 0.00 179.24 177.58 2jer h ARG 325 N 0.30 0.62 -0.70 3.56 2.43 -1.82 -2.76 114.38 116.01 2jer h ARG 325 Ca 0.22 -0.17 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2jer h ARG 325 Cb 0.24 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 2jer h ARG 325 CO -0.24 0.69 0.41 1.25 -1.51 0.00 0.00 179.97 180.57 2jer h LEU 326 N 0.46 0.62 -0.42 3.80 5.85 -1.75 -0.97 115.31 122.90 2jer h LEU 326 Ca 0.11 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2jer h LEU 326 Cb 0.38 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 2jer h LEU 326 CO 0.01 0.40 0.16 0.00 -0.34 0.00 0.00 178.44 178.67 2jer h ALA 327 N 1.35 0.50 -0.78 1.25 0.00 -1.10 0.41 119.26 120.89 2jer h ALA 327 Ca 0.31 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.23 2jer h ALA 327 Cb 0.16 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2jer h ALA 327 CO -0.17 -0.22 0.34 -0.07 0.00 0.00 0.00 179.25 179.13 2jer h LEU 328 N 0.33 1.04 -0.39 0.00 3.38 -1.07 -1.34 115.31 117.27 2jer h LEU 328 Ca 0.19 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2jer h LEU 328 Cb 0.16 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2jer h LEU 328 CO -0.18 0.90 0.21 -0.33 0.09 0.00 0.00 178.44 179.12 2jer h GLU 329 N 1.12 0.55 -0.38 1.13 5.08 -0.64 -0.51 114.58 120.92 2jer h GLU 329 Ca 0.26 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 2jer h GLU 329 Cb 0.16 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2jer h GLU 329 CO -0.03 0.46 0.06 1.96 -1.00 0.00 0.00 179.01 180.46 2jer h GLN 330 N 0.50 0.64 -0.58 2.33 4.20 -0.67 -2.22 115.11 119.30 2jer h GLN 330 Ca 0.14 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.61 2jer h GLN 330 Cb 0.08 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2jer h GLN 330 CO -0.02 0.70 0.09 0.28 -0.67 0.00 0.00 178.83 179.21 2jer h VAL 331 N 0.48 1.25 -0.91 -0.54 2.07 -1.20 -2.53 116.25 114.87 2jer h VAL 331 Ca 0.12 -0.96 0.07 0.00 0.82 0.00 0.00 66.70 66.75 2jer h VAL 331 Cb 0.37 0.71 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 2jer h VAL 331 CO 0.01 0.35 0.57 -0.61 0.02 0.00 0.00 177.57 177.91 2jer h GLN 332 N 0.88 0.99 0.00 1.57 5.75 -0.78 -1.46 115.11 122.06 2jer h GLN 332 Ca 0.18 -0.06 -0.10 0.00 -0.15 0.00 0.00 58.65 58.52 2jer h GLN 332 Cb 0.39 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 2jer h GLN 332 CO 0.01 0.66 -0.48 1.79 -2.65 0.00 0.00 178.83 178.15 2jer h THR 333 N 1.02 1.32 -0.16 2.39 1.35 -1.02 -2.19 112.91 115.63 2jer h THR 333 Ca 0.40 -1.66 -0.09 0.00 -0.55 0.00 0.00 66.41 64.52 2jer h THR 333 Cb 0.21 1.90 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 2jer h THR 333 CO -0.19 0.47 -0.29 0.24 -0.25 0.00 0.00 175.52 175.51 2jer h MET 334 N 0.00 0.29 -2.15 4.72 2.86 -0.94 -3.35 114.93 116.36 2jer h MET 334 Ca -0.00 -0.11 -0.58 0.00 -2.06 0.00 0.00 59.70 56.94 2jer h MET 334 Cb 0.86 -0.02 -0.40 0.00 0.06 0.00 0.00 31.60 32.10 2jer h MET 334 CO 0.06 0.56 -0.84 1.19 1.06 0.00 0.00 176.91 178.94 2jer n PHE 335 N -4.12 1.60 0.29 -0.22 3.01 -0.63 -4.98 117.46 112.41 2jer n PHE 335 Ca -0.01 -3.85 0.15 0.00 1.01 0.00 0.00 57.45 54.74 2jer n PHE 335 Cb 0.40 -0.43 0.90 0.00 -0.01 0.00 0.00 39.48 40.33 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 4.21 0.00 -0.44 -1.08 0.13 -1.56 -1.79 132.00 131.47 2jer h PRO 336 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2jer h PRO 336 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2jer h PRO 336 CO 0.64 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.18 2jer n ASP 337 N -3.79 3.48 -4.87 1.44 10.43 -1.26 -4.95 116.55 117.03 2jer n ASP 337 Ca -0.03 -1.98 -0.22 0.00 2.57 0.00 0.00 54.79 55.13 2jer n ASP 337 Cb 0.11 -0.28 -0.04 0.00 1.84 0.00 0.00 41.12 42.75 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 -1.35 3.10 -0.21 -1.24 1.02 -0.67 -5.01 119.74 115.38 2jer s LYS 338 Ca 0.39 -0.92 -0.21 0.00 0.02 0.00 0.00 55.97 55.25 2jer s LYS 338 Cb 0.22 -2.69 -0.02 0.00 -0.52 0.00 0.00 37.83 34.82 2jer s LYS 338 CO 0.31 0.43 0.63 0.21 -0.92 0.00 0.00 175.35 176.00 2jer s LYS 339 N -3.75 4.20 -0.25 1.68 2.20 0.11 -4.95 119.74 118.98 2jer s LYS 339 Ca 0.33 0.61 -0.14 0.00 -0.36 0.00 0.00 55.97 56.41 2jer s LYS 339 Cb -0.09 -3.59 -0.04 0.00 -1.51 0.00 0.00 37.83 32.60 2jer s LYS 339 CO 0.26 -0.27 0.33 0.42 -0.36 0.00 0.00 175.35 175.74 2jer s ILE 340 N 2.01 5.22 -0.22 5.43 -1.09 -1.26 -1.12 121.20 130.16 2jer s ILE 340 Ca 0.28 0.51 0.01 0.00 -2.23 0.00 0.00 60.65 59.23 2jer s ILE 340 Cb -0.16 -3.66 0.04 0.00 -1.58 0.00 0.00 42.46 37.10 2jer s ILE 340 CO 0.10 0.21 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.19 2jer s VAL 341 N 1.73 2.21 0.22 2.92 1.01 0.52 -4.97 120.40 124.04 2jer s VAL 341 Ca 0.14 -1.22 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 2jer s VAL 341 Cb -0.15 -2.10 -0.09 0.00 0.00 0.00 0.00 36.38 34.04 2jer s VAL 341 CO 0.09 0.28 0.81 -0.83 0.00 0.00 0.00 175.10 175.44 2jer s GLY 342 N 1.22 2.81 -0.03 4.51 0.00 -1.26 -0.66 107.32 113.91 2jer s GLY 342 Ca -0.01 0.35 0.03 0.00 0.00 0.00 0.00 44.72 45.09 2jer s GLY 342 CO -0.09 0.80 -0.10 0.14 0.00 0.00 0.00 173.10 173.85 2jer s VAL 343 N -1.37 0.88 -0.40 1.40 1.01 -0.74 -4.91 120.40 116.27 2jer s VAL 343 Ca 0.42 -0.41 -0.28 0.00 0.00 0.00 0.00 61.98 61.70 2jer s VAL 343 Cb -0.20 -0.78 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 2jer s VAL 343 CO 0.24 0.27 1.71 0.20 0.00 0.00 0.00 175.10 177.53 2jer s ASN 344 N 0.17 5.89 -0.12 3.32 0.01 -1.26 -1.39 114.94 121.56 2jer s ASN 344 Ca -0.03 1.01 0.15 0.00 -0.71 0.00 0.00 52.86 53.27 2jer s ASN 344 Cb -0.09 -2.53 0.34 0.00 0.41 0.00 0.00 41.25 39.38 2jer s ASN 344 CO 0.01 -1.76 1.17 0.35 -1.51 0.00 0.00 177.10 175.35 2jer n THR 345 N 7.29 1.44 0.08 1.60 -2.24 -0.45 -4.74 114.28 117.26 2jer n THR 345 Ca 0.21 -2.17 0.05 0.00 -2.27 0.00 0.00 64.05 59.87 2jer n THR 345 Cb 0.48 0.08 0.48 0.00 -2.10 0.00 0.00 70.33 69.27 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 2.60 1.08 0.00 2.28 3.04 -1.87 -1.77 116.25 121.61 2jer h VAL 346 Ca -0.04 -0.19 -0.05 0.00 -1.01 0.00 0.00 66.70 65.40 2jer h VAL 346 Cb 1.22 0.70 -0.01 0.00 -2.01 0.00 0.00 31.29 31.19 2jer h VAL 346 CO 0.02 0.09 -0.25 -0.33 -1.01 0.00 0.00 177.57 176.09 2jer h GLU 347 N 0.38 0.00 -0.18 4.17 4.39 -1.93 -2.24 114.58 119.17 2jer h GLU 347 Ca 0.10 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.63 2jer h GLU 347 Cb -0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2jer h GLU 347 CO -0.02 0.25 -0.55 0.28 -1.16 0.00 0.00 179.01 177.81 2jer h VAL 348 N 0.00 1.31 0.00 3.13 2.07 -1.64 -3.31 116.25 117.81 2jer h VAL 348 Ca -0.00 -1.78 -0.04 0.00 0.82 0.00 0.00 66.70 65.69 2jer h VAL 348 Cb 0.48 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2jer h VAL 348 CO 0.03 0.56 -0.19 1.62 0.02 0.00 0.00 177.57 179.61 2jer h VAL 349 N 0.38 0.97 -0.08 2.57 3.04 -0.95 -0.80 116.25 121.38 2jer h VAL 349 Ca -0.02 -0.71 0.02 0.00 -1.01 0.00 0.00 66.70 64.99 2jer h VAL 349 Cb 1.17 1.40 -0.00 0.00 -2.01 0.00 0.00 31.29 31.85 2jer h VAL 349 CO 0.12 0.19 0.09 1.88 -1.01 0.00 0.00 177.57 178.84 2jer h TYR 350 N 0.00 0.00 -0.15 3.17 0.99 -1.56 -1.76 116.97 117.66 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 0.38 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.11 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 -1.38 0.82 0.00 3.88 0.00 -0.31 -4.94 105.19 103.25 2jer n GLY 351 Ca -0.01 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 1.31 1.12 0.00 -0.02 0.00 -0.66 -5.05 105.19 101.89 2jer n GLY 352 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.49 1.82 0.00 -0.02 0.00 -1.25 -4.86 105.19 100.38 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 -0.24 1.61 5.15 -1.26 -2.77 115.26 117.68 2jer n ASN 354 Ca 0.00 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 54.00 2jer n ASN 354 Cb 0.00 0.00 0.15 0.00 -0.53 0.00 0.00 39.78 39.40 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 0.80 0.00 -1.44 2.04 -1.90 -1.86 117.51 115.15 2jer h ILE 355 Ca 0.00 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2jer h ILE 355 Cb 0.00 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 2jer h ILE 355 CO 0.00 0.10 0.00 1.57 0.00 0.00 0.00 178.15 179.82 2jer n HIS 356 N -4.91 0.00 0.00 1.37 -0.00 -0.43 -3.14 115.22 108.12 2jer n HIS 356 Ca 0.12 -0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.22 2jer n HIS 356 Cb 0.31 -0.11 0.00 0.00 -0.12 0.00 0.00 29.99 30.06 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 0.88 0.00 -4.27 3.57 -5.35 -0.70 -4.56 119.36 108.92 2jer n ILE 358 Ca 0.00 0.00 -0.18 0.00 -0.27 0.00 0.00 62.75 62.30 2jer n ILE 358 Cb 0.08 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.87 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 1.44 -0.10 7.28 -4.23 -1.19 -4.26 115.64 114.59 2jer s THR 359 Ca 0.00 -1.90 -0.03 0.00 -1.18 0.00 0.00 61.69 58.58 2jer s THR 359 Cb 0.00 -1.73 0.05 0.00 1.34 0.00 0.00 72.50 72.16 2jer s THR 359 CO 0.00 -0.50 0.13 -1.58 -0.54 0.00 0.00 174.62 172.13 2jer s GLN 360 N -3.07 0.02 0.56 3.99 2.00 -0.59 -2.53 119.66 120.04 2jer s GLN 360 Ca 0.14 0.39 -0.16 0.00 -2.00 0.00 0.00 55.36 53.73 2jer s GLN 360 Cb -0.03 -0.64 -0.05 0.00 0.80 0.00 0.00 33.01 33.09 2jer s GLN 360 CO 0.04 -0.40 1.03 1.14 -0.50 0.00 0.00 175.29 176.60 2jer s GLN 361 N 2.24 3.57 -0.23 1.67 0.00 -1.26 -1.02 119.66 124.63 2jer s GLN 361 Ca 0.04 1.10 0.02 0.00 -0.00 0.00 0.00 55.36 56.51 2jer s GLN 361 Cb -0.13 -2.07 0.05 0.00 0.00 0.00 0.00 33.01 30.86 2jer s GLN 361 CO -0.06 -0.60 -0.10 -2.00 0.00 0.00 0.00 175.29 172.53 2jer s GLU 362 N -4.10 2.09 0.60 9.60 2.12 0.37 -4.69 118.70 124.69 2jer s GLU 362 Ca 0.62 -1.07 -0.18 0.00 0.36 0.00 0.00 54.97 54.70 2jer s GLU 362 Cb -0.13 -2.65 -0.03 0.00 0.26 0.00 0.00 34.13 31.58 2jer s GLU 362 CO 0.35 -0.50 1.15 -1.25 -0.54 0.00 0.00 175.26 174.46 2jer s PRO 363 N 1.27 3.01 0.46 4.30 0.04 -1.26 0.04 135.00 142.86 2jer s PRO 363 Ca -0.05 1.60 -0.24 0.00 0.04 0.00 0.00 61.00 62.35 2jer s PRO 363 Cb -0.18 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 2jer s PRO 363 CO -0.07 -1.12 1.34 0.15 0.04 0.00 0.00 177.00 177.33 2jer s LYS 364 N -3.59 3.66 0.30 4.56 1.02 -0.11 -4.23 119.74 121.36 2jer s LYS 364 Ca 0.72 2.21 -0.29 0.00 0.02 0.00 0.00 55.97 58.63 2jer s LYS 364 Cb -0.25 -2.57 -0.10 0.00 -0.52 0.00 0.00 37.83 34.40 2jer s LYS 364 CO 0.34 -0.76 1.15 1.03 -0.92 0.00 0.00 175.35 176.19 2jer s ARG 365 N -2.52 4.53 -0.01 1.68 0.52 -1.26 -4.94 118.95 116.95 2jer s ARG 365 Ca 0.62 1.90 0.04 0.00 -0.52 0.00 0.00 55.73 57.77 2jer s ARG 365 Cb -0.39 -3.11 -0.01 0.00 0.52 0.00 0.00 34.95 31.95 2jer s ARG 365 CO 0.49 0.08 -0.14 0.14 0.02 0.00 0.00 175.30 175.89 2jer s VAL 366 N -1.19 1.10 0.00 3.52 -7.23 -1.26 -4.89 120.40 110.46 2jer s VAL 366 Ca 0.47 -0.60 0.00 0.00 -1.81 0.00 0.00 61.98 60.04 2jer s VAL 366 Cb -0.33 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 35.68 2jer s VAL 366 CO 0.43 0.31 0.00 0.61 -0.31 0.00 0.00 175.10 176.15 2jer n GLY 367 N 2.74 -2.91 3.15 2.32 0.00 -1.26 0.55 105.19 109.77 2jer n GLY 367 Ca -0.14 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2jer n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93