#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 1.87 0.17 0.00 -2.85 -1.26 -4.99 119.74 112.67 2jer s LYS 3 Ca 0.00 -1.63 -0.26 0.00 -1.00 0.00 0.00 55.97 53.08 2jer s LYS 3 Cb 0.00 -1.91 -0.08 0.00 -2.06 0.00 0.00 37.83 33.78 2jer s LYS 3 CO 0.00 0.35 0.80 1.03 0.10 0.00 0.00 175.35 177.62 2jer s ARG 4 N -3.48 4.60 -0.27 1.78 1.81 -1.26 -1.87 118.95 120.26 2jer s ARG 4 Ca 0.30 1.19 -0.18 0.00 -1.72 0.00 0.00 55.73 55.32 2jer s ARG 4 Cb -0.06 -3.27 -0.02 0.00 -0.45 0.00 0.00 34.95 31.15 2jer s ARG 4 CO 0.16 0.55 0.52 0.42 -0.68 0.00 0.00 175.30 176.27 2jer s ILE 5 N -1.08 5.06 0.12 1.52 -1.09 0.53 -4.88 121.20 121.37 2jer s ILE 5 Ca 0.37 0.81 0.11 0.00 -2.23 0.00 0.00 60.65 59.71 2jer s ILE 5 Cb -0.23 -3.85 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 2jer s ILE 5 CO 0.27 0.04 -0.27 0.68 -1.23 0.00 0.00 174.94 174.43 2jer s VAL 6 N 2.34 2.23 0.00 2.92 -7.23 -1.26 -4.52 120.40 114.88 2jer s VAL 6 Ca 0.21 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 2jer s VAL 6 Cb -0.16 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.82 2jer s VAL 6 CO 0.10 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.62 2jer n GLY 7 N 1.02 0.52 3.40 2.32 0.00 -1.26 -4.99 105.19 106.21 2jer n GLY 7 Ca -0.18 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.20 0.31 0.20 1.61 1.04 -1.26 -5.17 113.70 108.22 2jer s SER 8 Ca 0.00 -1.26 0.07 0.00 0.48 0.00 0.00 55.95 55.24 2jer s SER 8 Cb 0.00 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 2jer s SER 8 CO 0.00 -1.05 -0.14 0.42 0.98 0.00 0.00 173.24 173.45 2jer s THR 9 N -3.85 1.66 0.22 2.02 -4.23 -1.26 -5.04 115.64 105.15 2jer s THR 9 Ca 0.31 -2.19 -0.09 0.00 -1.18 0.00 0.00 61.69 58.55 2jer s THR 9 Cb 0.03 -2.03 0.21 0.00 1.34 0.00 0.00 72.50 72.04 2jer s THR 9 CO 0.13 -0.61 1.68 -0.65 -0.54 0.00 0.00 174.62 174.63 2jer h PRO 10 N 2.58 0.18 -0.61 3.99 0.11 -1.82 -1.13 132.00 135.31 2jer h PRO 10 Ca -0.38 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.78 2jer h PRO 10 Cb 1.22 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 2jer h PRO 10 CO 0.62 0.12 0.31 -0.22 -0.21 0.00 0.00 178.00 178.63 2jer h LYS 11 N 0.19 0.57 -0.15 1.05 3.64 -1.25 0.18 116.57 120.79 2jer h LYS 11 Ca 0.35 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.63 2jer h LYS 11 Cb 0.58 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 2jer h LYS 11 CO -0.51 0.38 -0.23 0.37 -2.27 0.00 0.00 179.45 177.19 2jer h GLN 12 N 0.59 0.26 -0.17 1.90 4.15 -1.66 -2.83 115.11 117.33 2jer h GLN 12 Ca 0.28 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.61 2jer h GLN 12 Cb 0.20 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2jer h GLN 12 CO -0.19 0.48 0.00 -0.25 -1.93 0.00 0.00 178.83 176.94 2jer n ASP 13 N -4.18 2.13 -0.21 -0.69 8.00 -0.49 -4.96 116.55 116.16 2jer n ASP 13 Ca -0.01 -1.76 -0.02 0.00 0.71 0.00 0.00 54.79 53.71 2jer n ASP 13 Cb 0.35 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 41.34 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 1.24 0.45 3.76 0.44 0.00 -0.66 -5.03 105.19 105.38 2jer n GLY 14 Ca 0.17 -0.90 -0.31 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.10 3.17 0.01 1.61 0.40 -0.04 -4.27 117.98 116.76 2jer s PHE 15 Ca 0.00 0.08 -0.01 0.00 -0.60 0.00 0.00 56.93 56.40 2jer s PHE 15 Cb 0.00 -1.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.90 2jer s PHE 15 CO 0.00 0.52 -0.00 -0.98 0.70 0.00 0.00 175.22 175.45 2jer s ARG 16 N -2.28 0.20 -0.20 0.44 1.70 -0.39 -3.80 118.95 114.61 2jer s ARG 16 Ca 0.28 -0.33 -0.29 0.00 -0.47 0.00 0.00 55.73 54.91 2jer s ARG 16 Cb -0.12 0.07 -0.01 0.00 -0.57 0.00 0.00 34.95 34.33 2jer s ARG 16 CO 0.20 -0.03 1.21 1.41 -1.08 0.00 0.00 175.30 177.01 2jer s MET 17 N -0.84 4.19 0.69 3.89 -2.45 -0.72 -0.57 119.30 123.49 2jer s MET 17 Ca -0.09 1.52 -0.11 0.00 -1.25 0.00 0.00 55.69 55.76 2jer s MET 17 Cb -0.06 -3.75 0.01 0.00 1.25 0.00 0.00 34.83 32.28 2jer s MET 17 CO -0.00 -0.75 1.06 -1.25 1.05 0.00 0.00 175.02 175.12 2jer s PRO 18 N 3.53 2.95 0.72 4.11 0.04 -1.26 -4.16 135.00 140.94 2jer s PRO 18 Ca 0.52 0.95 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 2jer s PRO 18 Cb -0.19 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.39 2jer s PRO 18 CO 0.14 -1.09 1.24 0.20 0.04 0.00 0.00 177.00 177.53 2jer s GLY 19 N -3.80 2.50 0.58 0.56 0.00 -1.26 -4.72 107.32 101.18 2jer s GLY 19 Ca 0.58 1.01 0.35 0.00 0.00 0.00 0.00 44.72 46.66 2jer s GLY 19 CO 0.55 1.43 2.13 -2.09 0.00 0.00 0.00 173.10 175.12 2jer h GLU 20 N -0.12 0.00 -0.01 2.90 4.81 -1.90 -1.50 114.58 118.76 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 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2jer h GLU 20 CO 0.50 0.04 -0.03 1.97 -0.73 0.00 0.00 179.01 180.76 2jer n PHE 21 N -3.27 0.00 -2.45 0.92 1.16 -1.26 -4.58 117.46 107.97 2jer n PHE 21 Ca -0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.26 2jer n PHE 21 Cb 0.21 -0.06 -0.02 0.00 -1.61 0.00 0.00 39.48 38.00 2jer n PHE 21 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2jer s GLU 22 N -2.15 3.82 0.35 3.97 2.02 -0.57 -4.89 118.70 121.26 2jer s GLU 22 Ca 0.39 0.75 -0.27 0.00 0.02 0.00 0.00 54.97 55.86 2jer s GLU 22 Cb 0.21 -2.21 -0.12 0.00 0.10 0.00 0.00 34.13 32.11 2jer s GLU 22 CO 0.39 -0.25 1.18 -2.30 0.02 0.00 0.00 175.26 174.30 2jer n PRO 23 N -1.73 1.80 -5.28 0.39 -0.02 -1.26 -4.70 135.00 124.20 2jer n PRO 23 Ca 0.05 0.63 -0.31 0.00 -2.02 0.00 0.00 63.50 61.85 2jer n PRO 23 Cb 0.54 -2.18 -0.16 0.00 -0.02 0.00 0.00 33.50 31.68 2jer n PRO 23 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2jer s GLN 24 N -1.88 2.24 -0.02 -0.52 -0.21 -1.26 -1.23 119.66 116.78 2jer s GLN 24 Ca 0.58 -0.92 -0.18 0.00 0.02 0.00 0.00 55.36 54.87 2jer s GLN 24 Cb -0.59 -2.08 -0.33 0.00 1.00 0.00 0.00 33.01 31.01 2jer s GLN 24 CO 0.60 0.52 0.89 1.49 -2.12 0.00 0.00 175.29 176.67 2jer h GLU 25 N 5.63 0.42 -3.32 2.91 4.81 -0.24 -3.42 114.58 121.38 2jer h GLU 25 Ca -0.40 -0.72 -0.03 0.00 -0.13 0.00 0.00 59.36 58.08 2jer h GLU 25 Cb 1.14 0.27 -0.10 0.00 0.63 0.00 0.00 28.75 30.68 2jer h GLU 25 CO 0.47 1.34 0.02 0.15 -0.73 0.00 0.00 179.01 180.26 2jer s LYS 26 N -2.53 1.35 0.07 1.92 1.02 -1.10 -4.15 119.74 116.32 2jer s LYS 26 Ca -0.12 -0.85 0.06 0.00 0.02 0.00 0.00 55.97 55.07 2jer s LYS 26 Cb 0.03 0.52 -0.03 0.00 -0.52 0.00 0.00 37.83 37.83 2jer s LYS 26 CO 0.88 -0.57 -0.16 0.08 -0.92 0.00 0.00 175.35 174.66 2jer s VAL 27 N -3.87 1.26 0.19 3.17 1.01 -0.21 -0.30 120.40 121.65 2jer s VAL 27 Ca 0.09 -1.28 0.11 0.00 0.00 0.00 0.00 61.98 60.90 2jer s VAL 27 Cb -0.01 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 2jer s VAL 27 CO -0.04 -0.12 -0.20 0.26 0.00 0.00 0.00 175.10 175.00 2jer s TRP 28 N -1.13 2.38 -0.12 5.22 0.52 -0.08 -1.22 118.94 124.51 2jer s TRP 28 Ca 0.01 -0.32 -0.26 0.00 0.02 0.00 0.00 56.10 55.54 2jer s TRP 28 Cb -0.09 -1.18 0.06 0.00 -1.15 0.00 0.00 33.47 31.11 2jer s TRP 28 CO 0.02 0.50 0.63 1.41 0.02 0.00 0.00 176.95 179.53 2jer s MET 29 N -2.70 0.91 -0.10 4.98 1.75 -0.58 -1.90 119.30 121.65 2jer s MET 29 Ca 0.22 0.44 -0.05 0.00 -1.25 0.00 0.00 55.69 55.05 2jer s MET 29 Cb -0.08 0.43 -0.04 0.00 2.84 0.00 0.00 34.83 37.98 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 -0.65 5.01 -0.03 10.11 1.01 -1.26 -0.66 121.20 134.73 2jer s ILE 30 Ca -0.07 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.29 2jer s ILE 30 Cb -0.02 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.26 2jer s ILE 30 CO 0.06 0.61 1.06 0.86 0.00 0.00 0.00 174.94 177.53 2jer s TRP 31 N -0.97 3.51 0.30 3.97 -0.11 0.11 -4.81 118.94 120.94 2jer s TRP 31 Ca 0.14 1.53 -0.14 0.00 1.22 0.00 0.00 56.10 58.85 2jer s TRP 31 Cb -0.12 -3.24 -0.09 0.00 -1.50 0.00 0.00 33.47 28.53 2jer s TRP 31 CO 0.03 -0.49 0.70 -1.25 -4.62 0.00 0.00 176.95 171.33 2jer s PRO 32 N 1.49 3.98 0.00 5.86 0.04 -1.26 -4.77 135.00 140.34 2jer s PRO 32 Ca 0.53 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2jer s PRO 32 Cb -0.22 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.83 2jer s PRO 32 CO 0.24 0.20 0.00 -0.85 0.04 0.00 0.00 177.00 176.63 2jer n GLU 33 N -0.27 0.00 -1.81 4.56 0.28 -1.26 -4.76 120.64 117.37 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 -0.31 4.17 0.00 3.44 1.70 -1.26 -4.18 118.95 122.51 2jer s ARG 34 Ca 0.00 2.48 0.25 0.00 -0.47 0.00 0.00 55.73 57.99 2jer s ARG 34 Cb 0.00 -3.48 1.10 0.00 -0.57 0.00 0.00 34.95 32.00 2jer s ARG 34 CO 0.00 -0.77 1.81 -0.35 -1.08 0.00 0.00 175.30 174.91 2jer n PRO 35 N 5.25 0.06 -0.11 3.89 -0.04 -1.26 -0.82 135.00 141.98 2jer n PRO 35 Ca 0.16 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.79 2jer n PRO 35 Cb 0.39 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.67 2jer n PRO 35 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2jer n ASP 36 N -1.46 1.75 0.01 3.54 5.75 -1.26 -0.46 116.55 124.41 2jer n ASP 36 Ca 0.07 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.07 2jer n ASP 36 Cb 0.28 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.23 2jer n ASP 36 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2jer n ASN 37 N 0.39 0.19 -4.67 -1.12 4.05 -0.92 -4.73 115.26 108.45 2jer n ASN 37 Ca 0.15 0.03 -0.37 0.00 0.45 0.00 0.00 54.58 54.84 2jer n ASN 37 Cb 0.33 -0.05 -0.08 0.00 1.23 0.00 0.00 39.78 41.20 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 3.36 0.69 1.20 0.52 -0.00 -4.77 118.94 117.93 2jer s TRP 38 Ca 0.00 0.47 -0.16 0.00 0.02 0.00 0.00 56.10 56.43 2jer s TRP 38 Cb 0.00 -2.42 0.02 0.00 -1.15 0.00 0.00 33.47 29.92 2jer s TRP 38 CO 0.00 0.03 1.21 -0.98 0.02 0.00 0.00 176.95 177.24 2jer s ARG 39 N 1.17 2.37 -1.42 4.98 1.70 -1.26 -3.39 118.95 123.09 2jer s ARG 39 Ca 0.15 1.80 -0.09 0.00 -0.47 0.00 0.00 55.73 57.11 2jer s ARG 39 Cb -0.14 -1.86 0.03 0.00 -0.57 0.00 0.00 34.95 32.41 2jer s ARG 39 CO 0.06 -1.67 1.04 -0.25 -1.08 0.00 0.00 175.30 173.40 2jer n ASP 40 N -2.40 -6.01 -2.02 -2.89 8.00 -0.49 -1.29 116.55 109.45 2jer n ASP 40 Ca 0.14 -0.54 -0.18 0.00 0.71 0.00 0.00 54.79 54.92 2jer n ASP 40 Cb 0.50 -4.76 -0.04 0.00 -0.02 0.00 0.00 41.12 36.80 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 -1.86 0.48 2.20 0.44 0.00 -1.23 -1.71 105.19 103.51 2jer n GLY 41 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.67 0.73 0.06 -0.02 0.00 -0.41 -4.79 105.19 100.08 2jer n GLY 42 Ca -0.20 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 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 2.14 -0.02 -0.59 1.61 1.79 -1.44 0.78 116.57 120.84 2jer h LYS 43 Ca 0.00 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jer h LYS 43 Cb 0.00 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 2jer h LYS 43 CO 0.00 -0.01 0.37 -1.35 -1.08 0.00 0.00 179.45 177.37 2jer h PRO 44 N -0.02 0.80 -0.05 3.15 0.11 -1.82 -2.79 132.00 131.38 2jer h PRO 44 Ca 0.02 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.97 2jer h PRO 44 Cb 0.04 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 2jer h PRO 44 CO -0.03 0.56 -0.37 -0.24 -0.21 0.00 0.00 178.00 177.71 2jer h VAL 45 N 0.80 1.28 -0.59 3.15 3.04 -1.79 -2.48 116.25 119.66 2jer h VAL 45 Ca 0.21 -1.35 -0.05 0.00 -1.01 0.00 0.00 66.70 64.51 2jer h VAL 45 Cb -0.04 1.66 -0.03 0.00 -2.01 0.00 0.00 31.29 30.87 2jer h VAL 45 CO -0.04 0.39 0.18 1.56 -1.01 0.00 0.00 177.57 178.65 2jer h GLN 46 N 0.09 0.88 -0.55 4.17 4.20 -0.59 0.12 115.11 123.43 2jer h GLN 46 Ca 0.01 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.52 2jer h GLN 46 Cb 0.70 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2jer h GLN 46 CO 0.05 0.76 0.23 1.49 -0.67 0.00 0.00 178.83 180.69 2jer h GLU 47 N 0.86 0.82 -0.15 1.46 4.81 -1.21 -0.96 114.58 120.20 2jer h GLU 47 Ca 0.19 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2jer h GLU 47 Cb 0.25 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 2jer h GLU 47 CO -0.01 0.71 0.05 0.00 -0.73 0.00 0.00 179.01 179.02 2jer h ALA 48 N 1.07 0.20 -0.85 2.92 0.00 -1.01 -1.08 119.26 120.52 2jer h ALA 48 Ca 0.18 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2jer h ALA 48 Cb 0.19 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2jer h ALA 48 CO -0.02 -0.18 0.53 0.74 0.00 0.00 0.00 179.25 180.32 2jer h PHE 49 N 0.07 0.99 -0.53 0.00 -1.00 -0.72 -0.67 116.94 115.07 2jer h PHE 49 Ca 0.05 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.88 2jer h PHE 49 Cb 0.22 -0.32 -0.04 0.00 3.61 0.00 0.00 35.95 39.43 2jer h PHE 49 CO -0.00 0.52 0.32 1.15 -1.61 0.00 0.00 178.31 178.69 2jer h THR 50 N 0.99 1.06 -0.42 -1.55 2.02 -0.91 0.15 112.91 114.24 2jer h THR 50 Ca 0.36 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.25 2jer h THR 50 Cb 0.12 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 2jer h THR 50 CO -0.15 0.12 -0.02 0.78 0.37 0.00 0.00 175.52 176.61 2jer h ASN 51 N 0.64 0.66 -0.02 4.18 2.35 -0.55 0.08 115.58 122.92 2jer h ASN 51 Ca 0.21 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 2jer h ASN 51 Cb 0.02 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 2jer h ASN 51 CO -0.09 0.74 -0.00 0.58 -1.65 0.00 0.00 177.43 177.00 2jer h VAL 52 N 0.64 1.29 -0.52 2.81 2.07 -0.61 -1.76 116.25 120.17 2jer h VAL 52 Ca 0.13 -0.85 0.09 0.00 0.82 0.00 0.00 66.70 66.88 2jer h VAL 52 Cb 0.44 1.83 -0.07 0.00 -1.52 0.00 0.00 31.29 31.97 2jer h VAL 52 CO 0.02 0.22 0.12 0.00 0.02 0.00 0.00 177.57 177.96 2jer h ALA 53 N 0.65 0.60 -0.61 1.67 0.00 -0.50 -1.13 119.26 119.95 2jer h ALA 53 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.02 2jer h ALA 53 Cb 0.37 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2jer h ALA 53 CO 0.00 -0.29 0.41 0.87 0.00 0.00 0.00 179.25 180.24 2jer h LYS 54 N 0.26 0.81 -0.59 0.00 1.57 -0.96 -1.31 116.57 116.35 2jer h LYS 54 Ca 0.26 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2jer h LYS 54 Cb 0.35 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2jer h LYS 54 CO -0.33 0.54 0.25 0.00 -0.57 0.00 0.00 179.45 179.34 2jer h ALA 55 N 1.22 0.76 -0.49 3.86 0.00 -0.75 -2.84 119.26 121.03 2jer h ALA 55 Ca 0.22 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2jer h ALA 55 Cb -0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 2jer h ALA 55 CO -0.05 0.36 0.13 0.82 0.00 0.00 0.00 179.25 180.51 2jer h ILE 56 N 0.81 1.23 -0.08 0.00 2.04 -1.04 -2.98 117.51 117.49 2jer h ILE 56 Ca 0.20 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.27 2jer h ILE 56 Cb 0.17 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2jer h ILE 56 CO -0.02 0.29 0.17 0.77 0.00 0.00 0.00 178.15 179.37 2jer h SER 57 N 0.67 0.00 0.25 1.72 4.64 -0.99 0.90 113.55 120.73 2jer h SER 57 Ca 0.16 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 2jer h SER 57 Cb 0.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2jer h SER 57 CO -0.00 0.00 -0.10 1.56 -0.87 0.00 0.00 176.83 177.42 2jer h GLN 58 N 0.00 0.00 0.00 4.77 1.08 -1.48 -3.31 115.11 116.16 2jer h GLN 58 Ca 0.04 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.08 2jer h GLN 58 Cb 0.38 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 2jer h GLN 58 CO -0.00 0.10 -1.60 1.19 -0.95 0.00 0.00 178.83 177.58 2jer n PHE 59 N -3.81 0.00 -3.71 2.96 3.72 0.19 -5.07 117.46 111.74 2jer n PHE 59 Ca -0.02 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.26 2jer n PHE 59 Cb 0.20 -0.42 -0.10 0.00 -0.94 0.00 0.00 39.48 38.22 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 -2.21 -0.01 0.20 4.37 2.01 -0.46 -4.74 115.64 114.80 2jer s THR 60 Ca -0.08 0.04 -0.32 0.00 0.31 0.00 0.00 61.69 61.64 2jer s THR 60 Cb 0.03 -0.60 -0.15 0.00 0.01 0.00 0.00 72.50 71.79 2jer s THR 60 CO 0.31 0.02 1.30 -2.65 -0.69 0.00 0.00 174.62 172.91 2jer n PRO 61 N 3.51 1.60 -4.60 4.92 -0.02 -1.26 -3.72 135.00 135.43 2jer n PRO 61 Ca -0.18 0.57 -0.30 0.00 -2.02 0.00 0.00 63.50 61.57 2jer n PRO 61 Cb 0.56 -2.16 -0.13 0.00 -0.02 0.00 0.00 33.50 31.75 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 -0.29 1.85 -0.04 -0.52 1.75 -1.26 -1.04 119.30 119.75 2jer s MET 62 Ca 0.72 -1.11 -0.02 0.00 -1.25 0.00 0.00 55.69 54.03 2jer s MET 62 Cb -0.76 -2.08 0.03 0.00 2.84 0.00 0.00 34.83 34.86 2jer s MET 62 CO 0.50 0.51 0.09 -0.80 -0.65 0.00 0.00 175.02 174.67 2jer s ASN 63 N -1.64 -0.05 -0.05 1.11 0.01 -0.36 -2.09 114.94 111.87 2jer s ASN 63 Ca 0.15 0.18 0.04 0.00 -0.71 0.00 0.00 52.86 52.52 2jer s ASN 63 Cb -0.10 0.11 -0.00 0.00 0.41 0.00 0.00 41.25 41.66 2jer s ASN 63 CO 0.06 -0.10 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.68 2jer s VAL 64 N 0.76 1.46 0.06 1.60 1.01 0.02 -1.53 120.40 123.78 2jer s VAL 64 Ca -0.06 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.25 2jer s VAL 64 Cb -0.08 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2jer s VAL 64 CO -0.03 0.42 -0.07 0.68 0.00 0.00 0.00 175.10 176.10 2jer s VAL 65 N 0.12 3.58 -0.09 2.92 -7.23 0.16 -1.50 120.40 118.37 2jer s VAL 65 Ca -0.06 -1.01 -0.21 0.00 -1.81 0.00 0.00 61.98 58.89 2jer s VAL 65 Cb -0.12 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.23 2jer s VAL 65 CO 0.03 0.23 0.49 0.54 -0.31 0.00 0.00 175.10 176.08 2jer s VAL 66 N -1.14 0.02 0.94 1.32 0.11 -0.05 -0.71 120.40 120.89 2jer s VAL 66 Ca 0.20 -0.17 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 2jer s VAL 66 Cb -0.11 -0.76 0.14 0.00 -1.53 0.00 0.00 36.38 34.11 2jer s VAL 66 CO 0.12 -0.09 1.02 -1.54 -3.33 0.00 0.00 175.10 171.28 2jer n SER 67 N 1.71 -0.14 -0.19 3.54 3.41 -1.22 -0.52 113.62 120.21 2jer n SER 67 Ca -0.18 0.38 -0.03 0.00 -0.26 0.00 0.00 58.87 58.78 2jer n SER 67 Cb 0.56 -1.43 0.04 0.00 -0.26 0.00 0.00 64.21 63.13 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 -1.89 -0.08 -0.59 4.33 4.15 -1.98 -0.86 115.11 118.20 2jer h GLN 68 Ca -0.44 0.01 -0.10 0.00 0.77 0.00 0.00 58.65 58.88 2jer h GLN 68 Cb 1.27 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.96 2jer h GLN 68 CO 0.40 -0.05 -0.03 0.37 -1.93 0.00 0.00 178.83 177.60 2jer h GLN 69 N -0.08 1.06 -0.01 1.69 -0.00 -2.01 -3.13 115.11 112.64 2jer h GLN 69 Ca 0.26 -0.35 0.00 0.00 -0.00 0.00 0.00 58.65 58.56 2jer h GLN 69 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 27.48 27.88 2jer h GLN 69 CO -0.63 1.05 -0.25 1.04 0.00 0.00 0.00 178.83 180.04 2jer n GLN 70 N -4.17 0.80 -0.08 1.69 1.13 -1.04 -4.46 117.38 111.25 2jer n GLN 70 Ca 0.03 -0.45 -0.11 0.00 -1.94 0.00 0.00 57.00 54.53 2jer n GLN 70 Cb 0.36 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 29.17 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 -1.22 -0.54 1.08 3.04 -1.10 0.13 116.94 119.43 2jer h PHE 71 Ca 0.00 0.06 -0.02 0.00 3.98 0.00 0.00 57.97 61.99 2jer h PHE 71 Cb 0.49 0.58 -0.02 0.00 2.56 0.00 0.00 35.95 39.55 2jer h PHE 71 CO 0.00 -0.45 0.24 1.96 -2.02 0.00 0.00 178.31 178.04 2jer h GLN 72 N -0.39 0.79 -0.22 1.11 4.20 -1.81 -0.18 115.11 118.60 2jer h GLN 72 Ca 0.11 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2jer h GLN 72 Cb 0.60 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 2jer h GLN 72 CO -0.50 0.66 0.14 -0.97 -0.67 0.00 0.00 178.83 177.49 2jer h ASN 73 N 0.73 0.26 -0.35 1.46 -1.24 -1.76 -1.88 115.58 112.79 2jer h ASN 73 Ca 0.18 -0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.21 2jer h ASN 73 Cb 0.15 -0.07 -0.04 0.00 0.73 0.00 0.00 38.32 39.09 2jer h ASN 73 CO -0.02 0.21 0.12 0.00 -1.29 0.00 0.00 177.43 176.45 2jer h ARG 75 N 0.26 0.85 -0.51 0.00 9.65 -0.93 -1.96 114.38 121.74 2jer h ARG 75 Ca 0.16 -0.12 -0.10 0.00 -1.10 0.00 0.00 59.98 58.82 2jer h ARG 75 Cb 0.14 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 2jer h ARG 75 CO -0.17 0.68 -0.09 -0.09 2.80 0.00 0.00 179.97 183.10 2jer h ARG 76 N 0.84 0.95 -0.26 0.20 9.65 -0.59 -3.26 114.38 121.91 2jer h ARG 76 Ca 0.20 -0.35 -0.14 0.00 -1.10 0.00 0.00 59.98 58.60 2jer h ARG 76 Cb 0.14 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 2jer h ARG 76 CO -0.02 1.02 -0.40 1.96 2.80 0.00 0.00 179.97 185.32 2jer h GLN 77 N 0.82 0.62 -6.17 0.20 1.08 -0.56 -3.44 115.11 107.64 2jer h GLN 77 Ca 0.13 -0.31 -0.58 0.00 -1.45 0.00 0.00 58.65 56.43 2jer h GLN 77 Cb 0.64 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 28.03 2jer h GLN 77 CO 0.04 0.91 -0.11 -0.51 -0.95 0.00 0.00 178.83 178.21 2jer s LEU 78 N -8.57 4.46 0.69 1.46 1.43 -0.77 -5.06 118.68 112.32 2jer s LEU 78 Ca -0.08 1.09 -0.16 0.00 -1.03 0.00 0.00 54.13 53.95 2jer s LEU 78 Cb 0.12 -2.88 0.02 0.00 0.03 0.00 0.00 46.19 43.48 2jer s LEU 78 CO 0.83 0.25 1.23 -2.16 0.23 0.00 0.00 176.35 176.73 2jer s PRO 79 N -1.34 2.35 0.56 1.29 0.04 -1.26 -4.90 135.00 131.74 2jer s PRO 79 Ca 0.29 1.86 0.26 0.00 0.04 0.00 0.00 61.00 63.45 2jer s PRO 79 Cb -0.17 -1.85 1.61 0.00 0.04 0.00 0.00 34.50 34.14 2jer s PRO 79 CO 0.17 -1.70 2.19 -1.00 0.04 0.00 0.00 177.00 176.70 2jer h PRO 80 N 0.08 0.00 0.00 0.56 0.13 -1.97 -1.31 132.00 129.50 2jer h PRO 80 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jer h PRO 80 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2jer h PRO 80 CO 0.51 0.03 0.00 1.05 -0.23 0.00 0.00 178.00 179.37 2jer h GLU 81 N 0.00 0.00 -5.38 0.86 9.09 -1.98 -3.40 114.58 113.77 2jer h GLU 81 Ca -0.00 0.00 -0.61 0.00 0.05 0.00 0.00 59.36 58.80 2jer h GLU 81 Cb 0.08 0.00 -0.12 0.00 -1.65 0.00 0.00 28.75 27.05 2jer h GLU 81 CO 0.00 0.00 -0.05 0.42 0.05 0.00 0.00 179.01 179.43 2jer s ILE 82 N -3.49 5.09 0.24 -1.06 1.01 -0.49 -4.60 121.20 117.90 2jer s ILE 82 Ca 0.01 0.86 -0.30 0.00 0.00 0.00 0.00 60.65 61.22 2jer s ILE 82 Cb 0.09 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 2jer s ILE 82 CO 0.35 0.12 0.97 -0.89 0.00 0.00 0.00 174.94 175.49 2jer s THR 83 N 2.07 4.00 -0.08 2.92 2.01 -0.89 -4.86 115.64 120.81 2jer s THR 83 Ca 0.21 1.99 0.03 0.00 0.31 0.00 0.00 61.69 64.23 2jer s THR 83 Cb -0.16 -4.27 0.01 0.00 0.01 0.00 0.00 72.50 68.09 2jer s THR 83 CO 0.09 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.60 2jer s VAL 84 N -1.09 1.67 -0.00 3.82 1.01 -1.26 -0.79 120.40 123.76 2jer s VAL 84 Ca 0.42 -0.79 0.08 0.00 0.00 0.00 0.00 61.98 61.68 2jer s VAL 84 Cb -0.27 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 2jer s VAL 84 CO 0.33 0.47 -0.24 -0.31 0.00 0.00 0.00 175.10 175.36 2jer s TYR 85 N 0.47 2.11 0.20 5.22 1.51 -0.56 -5.00 117.35 121.29 2jer s TYR 85 Ca -0.17 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.19 2jer s TYR 85 Cb -0.17 -1.33 -0.08 0.00 -0.11 0.00 0.00 41.96 40.26 2jer s TYR 85 CO 0.07 0.00 1.21 -2.00 -1.11 0.00 0.00 175.55 173.72 2jer s GLU 86 N -0.71 4.48 -0.30 -0.62 2.12 -1.26 -0.88 118.70 121.54 2jer s GLU 86 Ca 0.09 1.91 -0.12 0.00 0.36 0.00 0.00 54.97 57.21 2jer s GLU 86 Cb -0.09 -3.22 0.13 0.00 0.26 0.00 0.00 34.13 31.21 2jer s GLU 86 CO -0.00 -0.09 0.72 1.41 -0.54 0.00 0.00 175.26 176.76 2jer s MET 87 N -0.38 0.54 0.62 4.30 1.75 0.32 -4.74 119.30 121.71 2jer s MET 87 Ca 0.53 1.29 -0.18 0.00 -1.25 0.00 0.00 55.69 56.07 2jer s MET 87 Cb -0.33 0.70 -0.02 0.00 2.84 0.00 0.00 34.83 38.01 2jer s MET 87 CO 0.38 -0.17 1.23 -1.12 -0.65 0.00 0.00 175.02 174.69 2jer s SER 88 N 2.63 4.97 0.08 1.11 0.01 -1.26 -3.39 113.70 117.85 2jer s SER 88 Ca -0.06 2.45 -0.26 0.00 1.31 0.00 0.00 55.95 59.40 2jer s SER 88 Cb -0.10 -2.60 0.08 0.00 0.21 0.00 0.00 66.02 63.61 2jer s SER 88 CO -0.19 -1.75 0.72 0.54 0.41 0.00 0.00 173.24 172.98 2jer s ASN 89 N -1.56 -0.49 -0.20 2.44 2.20 -1.26 -4.61 114.94 111.46 2jer s ASN 89 Ca 0.79 0.03 0.03 0.00 -0.94 0.00 0.00 52.86 52.77 2jer s ASN 89 Cb -0.32 0.51 -0.21 0.00 -2.00 0.00 0.00 41.25 39.22 2jer s ASN 89 CO 0.36 -0.81 0.03 0.59 -2.94 0.00 0.00 177.10 174.33 2jer n ASN 90 N -0.26 1.65 -2.27 3.54 3.02 -1.26 -4.79 115.26 114.89 2jer n ASN 90 Ca -0.14 0.01 -0.09 0.00 -0.03 0.00 0.00 54.58 54.33 2jer n ASN 90 Cb 0.63 -0.29 -0.02 0.00 -0.61 0.00 0.00 39.78 39.49 2jer n ASN 90 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2jer n ASP 91 N -3.23 -0.93 -2.73 6.41 -0.08 -1.26 -4.82 116.55 109.91 2jer n ASP 91 Ca -0.38 -2.20 -0.33 0.00 -1.51 0.00 0.00 54.79 50.37 2jer n ASP 91 Cb 1.03 1.71 0.01 0.00 2.34 0.00 0.00 41.12 46.21 2jer n ASP 91 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jer n ALA 92 N -1.52 5.64 -3.44 -1.67 0.00 -1.26 -4.86 120.51 113.41 2jer n ALA 92 Ca -0.09 -4.29 -0.27 0.00 0.00 0.00 0.00 53.44 48.79 2jer n ALA 92 Cb 0.38 -1.18 -0.08 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.47 3.31 0.42 0.00 7.02 -1.26 -4.59 117.44 121.87 2jer n TRP 93 Ca 0.45 -4.12 0.12 0.00 -1.02 0.00 0.00 57.50 52.93 2jer n TRP 93 Cb 0.46 -0.54 0.49 0.00 -2.42 0.00 0.00 31.31 29.30 2jer n TRP 93 CO 0.00 0.00 0.00 -0.24 -2.02 0.00 0.00 177.69 175.43 2jer h VAL 94 N 3.18 0.00 -0.35 -0.99 3.04 -1.85 -0.52 116.25 118.76 2jer h VAL 94 Ca 0.19 -0.29 0.03 0.00 -1.01 0.00 0.00 66.70 65.61 2jer h VAL 94 Cb 0.68 1.08 -0.02 0.00 -2.01 0.00 0.00 31.29 31.02 2jer h VAL 94 CO 0.80 0.00 0.23 -0.09 -1.01 0.00 0.00 177.57 177.50 2jer h ARG 95 N 0.00 0.36 0.00 4.17 9.65 -1.74 0.10 114.38 126.92 2jer h ARG 95 Ca 0.00 -0.02 -0.28 0.00 -1.10 0.00 0.00 59.98 58.58 2jer h ARG 95 Cb 0.43 -0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.87 2jer h ARG 95 CO 0.00 0.24 -2.06 -0.25 2.80 0.00 0.00 179.97 180.70 2jer n ASP 96 N -4.49 1.50 -0.42 -3.80 8.00 -0.26 -2.60 116.55 114.49 2jer n ASP 96 Ca 0.03 -0.02 0.09 0.00 0.71 0.00 0.00 54.79 55.60 2jer n ASP 96 Cb 0.15 0.63 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 2jer n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jer s GLY 98 N -2.01 1.63 0.45 0.00 0.00 0.02 -3.45 107.32 103.96 2jer s GLY 98 Ca 0.15 -0.82 -0.21 0.00 0.00 0.00 0.00 44.72 43.84 2jer s GLY 98 CO 0.43 -0.10 1.01 2.56 0.00 0.00 0.00 173.10 177.00 2jer s PRO 99 N -5.45 4.03 -0.37 2.90 0.04 -1.26 -4.78 135.00 130.10 2jer s PRO 99 Ca 0.69 1.31 -0.15 0.00 0.04 0.00 0.00 61.00 62.89 2jer s PRO 99 Cb -0.11 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.21 2jer s PRO 99 CO 0.54 -0.23 0.31 -1.12 0.04 0.00 0.00 177.00 176.54 2jer s SER 100 N -1.96 6.11 0.28 6.66 0.01 -0.37 -4.90 113.70 119.55 2jer s SER 100 Ca 0.63 -0.58 -0.28 0.00 1.31 0.00 0.00 55.95 57.04 2jer s SER 100 Cb -0.15 -2.17 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 2jer s SER 100 CO 0.19 -0.37 0.94 -0.36 0.41 0.00 0.00 173.24 174.06 2jer s PHE 101 N 1.81 3.84 0.07 2.43 0.40 -1.26 -0.55 117.98 124.71 2jer s PHE 101 Ca 0.07 1.85 0.08 0.00 -0.60 0.00 0.00 56.93 58.33 2jer s PHE 101 Cb -0.18 -2.95 -0.03 0.00 0.51 0.00 0.00 43.02 40.37 2jer s PHE 101 CO 0.11 0.33 -0.21 0.14 0.70 0.00 0.00 175.22 176.30 2jer s VAL 102 N -1.40 1.67 0.15 -0.44 -7.23 0.33 -4.39 120.40 109.08 2jer s VAL 102 Ca 0.46 -1.33 0.08 0.00 -1.81 0.00 0.00 61.98 59.38 2jer s VAL 102 Cb -0.22 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.20 2jer s VAL 102 CO 0.28 0.10 -0.18 0.27 -0.31 0.00 0.00 175.10 175.26 2jer s ILE 103 N -0.94 1.70 0.12 -0.62 -4.36 0.26 -0.74 121.20 116.63 2jer s ILE 103 Ca 0.07 -1.82 0.02 0.00 -0.26 0.00 0.00 60.65 58.66 2jer s ILE 103 Cb -0.09 -1.73 0.02 0.00 1.25 0.00 0.00 42.46 41.90 2jer s ILE 103 CO 0.03 -0.29 0.13 -0.46 0.24 0.00 0.00 174.94 174.58 2jer n ASN 104 N 0.47 0.93 -0.27 4.36 6.94 -0.91 -1.26 115.26 125.52 2jer n ASN 104 Ca -0.15 -1.38 0.09 0.00 -0.02 0.00 0.00 54.58 53.12 2jer n ASN 104 Cb 0.56 -0.05 0.41 0.00 -2.36 0.00 0.00 39.78 38.34 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 -2.40 0.82 -0.09 0.53 5.75 -1.26 -4.22 116.55 115.68 2jer n ASP 105 Ca 0.02 -1.63 0.08 0.00 -0.01 0.00 0.00 54.79 53.25 2jer n ASP 105 Cb 0.13 -0.06 0.11 0.00 -1.03 0.00 0.00 41.12 40.28 2jer n ASP 105 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2jer n HIS 106 N -0.22 0.00 -1.24 2.11 8.25 -1.23 -4.55 115.22 118.34 2jer n HIS 106 Ca 0.14 -0.85 -0.05 0.00 -0.26 0.00 0.00 57.72 56.70 2jer n HIS 106 Cb 0.18 -0.13 -0.02 0.00 1.12 0.00 0.00 29.99 31.15 2jer n HIS 106 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2jer n GLY 107 N -1.20 0.68 3.83 -1.41 0.00 0.11 -4.80 105.19 102.40 2jer n GLY 107 Ca 0.13 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.59 3.02 -0.00 1.61 2.02 -1.26 -4.75 118.70 116.74 2jer s GLU 108 Ca 0.00 -0.84 0.00 0.00 0.02 0.00 0.00 54.97 54.15 2jer s GLU 108 Cb 0.00 -2.70 0.00 0.00 0.10 0.00 0.00 34.13 31.53 2jer s GLU 108 CO 0.00 0.48 -0.00 -1.50 0.02 0.00 0.00 175.26 174.26 2jer s ILE 109 N -1.80 0.05 0.23 -1.63 2.07 -1.26 -2.15 121.20 116.70 2jer s ILE 109 Ca 0.32 -0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.58 2jer s ILE 109 Cb -0.10 -0.07 -0.05 0.00 0.13 0.00 0.00 42.46 42.37 2jer s ILE 109 CO 0.25 0.03 0.01 -0.13 -1.91 0.00 0.00 174.94 173.19 2jer s ARG 110 N 0.11 1.32 0.04 3.50 0.52 0.08 -4.49 118.95 120.03 2jer s ARG 110 Ca -0.01 -1.67 0.06 0.00 -0.52 0.00 0.00 55.73 53.59 2jer s ARG 110 Cb -0.02 -0.52 -0.03 0.00 0.52 0.00 0.00 34.95 34.90 2jer s ARG 110 CO -0.00 -0.13 -0.13 0.20 0.02 0.00 0.00 175.30 175.25 2jer s GLY 111 N -3.29 1.67 -0.22 -3.53 0.00 -0.32 -0.51 107.32 101.12 2jer s GLY 111 Ca 0.29 -1.14 -0.08 0.00 0.00 0.00 0.00 44.72 43.79 2jer s GLY 111 CO 0.09 -1.04 0.08 0.14 0.00 0.00 0.00 173.10 172.37 2jer s VAL 112 N -0.99 4.70 -0.53 1.40 1.01 0.28 -0.57 120.40 125.71 2jer s VAL 112 Ca 0.16 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 2jer s VAL 112 Cb -0.11 -3.16 0.14 0.00 0.00 0.00 0.00 36.38 33.25 2jer s VAL 112 CO 0.07 0.40 0.37 -0.62 0.00 0.00 0.00 175.10 175.32 2jer s ASP 113 N 0.93 5.55 0.69 3.32 -1.08 0.13 -1.23 116.67 124.98 2jer s ASP 113 Ca 0.04 -2.27 -0.11 0.00 -0.52 0.00 0.00 52.55 49.70 2jer s ASP 113 Cb -0.14 -1.94 0.00 0.00 -1.46 0.00 0.00 42.92 39.39 2jer s ASP 113 CO 0.03 -0.56 1.06 0.26 0.52 0.00 0.00 175.17 176.49 2jer s TRP 114 N 0.81 3.29 -0.01 -5.34 0.52 -1.26 -1.52 118.94 115.44 2jer s TRP 114 Ca 0.10 1.24 -0.30 0.00 0.02 0.00 0.00 56.10 57.17 2jer s TRP 114 Cb -0.22 -2.91 -0.05 0.00 -1.15 0.00 0.00 33.47 29.14 2jer s TRP 114 CO -0.03 -1.12 1.30 0.99 0.02 0.00 0.00 176.95 178.11 2jer s THR 115 N -3.18 3.94 -0.10 2.01 2.01 -0.68 -4.84 115.64 114.79 2jer s THR 115 Ca 0.57 1.32 -0.05 0.00 0.31 0.00 0.00 61.69 63.84 2jer s THR 115 Cb -0.12 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 2jer s THR 115 CO 0.54 0.02 0.11 0.12 -0.69 0.00 0.00 174.62 174.72 2jer s PHE 116 N 2.11 3.50 -0.01 4.92 5.36 -1.26 -1.80 117.98 130.79 2jer s PHE 116 Ca 0.60 0.44 0.22 0.00 -0.96 0.00 0.00 56.93 57.24 2jer s PHE 116 Cb -0.29 -1.90 0.38 0.00 -0.34 0.00 0.00 43.02 40.88 2jer s PHE 116 CO 0.25 0.68 1.15 0.27 -1.46 0.00 0.00 175.22 176.11 2jer n ASN 117 N 1.92 0.95 -3.68 6.13 6.94 -1.26 -4.85 115.26 121.40 2jer n ASN 117 Ca -0.19 -2.13 -0.24 0.00 -0.02 0.00 0.00 54.58 52.01 2jer n ASN 117 Cb 0.54 -0.30 0.05 0.00 -2.36 0.00 0.00 39.78 37.71 2jer n ASN 117 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jer n ALA 118 N 0.33 -1.64 -3.43 -2.53 0.00 -1.26 -0.23 120.51 111.76 2jer n ALA 118 Ca 0.06 0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.43 2jer n ALA 118 Cb 1.07 -3.64 0.09 0.00 0.00 0.00 0.00 19.45 16.97 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 -4.55 -2.19 0.00 0.00 8.01 -1.26 -0.93 117.44 116.52 2jer n TRP 119 Ca -0.13 0.94 0.00 0.00 -1.31 0.00 0.00 57.50 57.00 2jer n TRP 119 Cb 0.60 -5.08 0.00 0.00 -2.01 0.00 0.00 31.31 24.82 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 -1.14 0.47 7.00 6.99 0.00 -1.22 -3.63 105.19 113.66 2jer n GLY 120 Ca -0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 3.05 0.11 -0.02 0.00 0.68 -1.79 105.19 107.23 2jer n GLY 121 Ca 0.00 -0.25 0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 0.46 -0.06 0.99 4.77 -1.26 -0.99 117.00 120.91 2jer n LEU 122 Ca 0.00 0.01 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 2jer n LEU 122 Cb 0.00 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 40.87 2jer n LEU 122 CO 0.00 0.08 0.11 0.58 -1.33 0.00 0.00 177.39 176.83 2jer h VAL 123 N 0.56 0.55 0.00 4.08 2.07 -1.69 -3.44 116.25 118.38 2jer h VAL 123 Ca 0.00 -1.41 -0.09 0.00 0.82 0.00 0.00 66.70 66.02 2jer h VAL 123 Cb 0.35 1.04 -0.14 0.00 -1.52 0.00 0.00 31.29 31.01 2jer h VAL 123 CO 0.00 0.19 -0.48 -0.90 0.02 0.00 0.00 177.57 176.40 2jer n ASP 124 N -4.72 -0.00 -4.59 0.57 5.75 -0.74 -5.03 116.55 107.78 2jer n ASP 124 Ca -0.03 -1.78 -0.29 0.00 -0.01 0.00 0.00 54.79 52.67 2jer n ASP 124 Cb 0.15 -0.04 0.20 0.00 -1.03 0.00 0.00 41.12 40.41 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 -1.06 1.60 0.04 6.12 0.00 -0.16 -4.60 107.32 109.26 2jer s GLY 125 Ca 0.09 0.11 0.23 0.00 0.00 0.00 0.00 44.72 45.15 2jer s GLY 125 CO -0.05 0.69 1.08 1.04 0.00 0.00 0.00 173.10 175.86 2jer n LEU 126 N -4.52 0.63 -3.71 0.66 4.32 -0.11 -4.75 117.00 109.52 2jer n LEU 126 Ca 0.06 -0.05 -0.02 0.00 -0.02 0.00 0.00 56.01 55.99 2jer n LEU 126 Cb 0.54 -0.11 -0.01 0.00 -1.62 0.00 0.00 43.42 42.21 2jer n LEU 126 CO 0.54 0.07 0.81 -0.72 -1.22 0.00 0.00 177.39 176.88 2jer s TYR 127 N -3.15 -0.11 -0.09 -1.77 -0.85 -1.24 -0.85 117.35 109.28 2jer s TYR 127 Ca 0.05 -0.13 -0.05 0.00 -0.52 0.00 0.00 57.07 56.42 2jer s TYR 127 Cb 0.15 0.61 0.04 0.00 0.38 0.00 0.00 41.96 43.14 2jer s TYR 127 CO 0.79 -0.67 0.22 0.12 -1.52 0.00 0.00 175.55 174.49 2jer s PHE 128 N -3.04 -0.27 0.72 -3.49 5.36 -1.26 -4.69 117.98 111.30 2jer s PHE 128 Ca 0.13 0.67 0.00 0.00 -0.96 0.00 0.00 56.93 56.77 2jer s PHE 128 Cb 0.00 0.03 0.13 0.00 -0.34 0.00 0.00 43.02 42.84 2jer s PHE 128 CO 0.00 -0.19 0.99 -1.25 -1.46 0.00 0.00 175.22 173.31 2jer s PRO 129 N 1.01 1.66 -0.07 10.12 0.04 -1.26 -4.99 135.00 141.51 2jer s PRO 129 Ca -0.07 -1.21 0.10 0.00 0.04 0.00 0.00 61.00 59.86 2jer s PRO 129 Cb -0.09 -2.35 0.17 0.00 0.04 0.00 0.00 34.50 32.27 2jer s PRO 129 CO -0.06 -1.45 1.08 -2.67 0.04 0.00 0.00 177.00 173.94 2jer n TRP 130 N -2.81 0.00 -0.12 0.56 2.14 -1.26 -4.86 117.44 111.08 2jer n TRP 130 Ca 0.16 -0.53 0.01 0.00 2.07 0.00 0.00 57.50 59.21 2jer n TRP 130 Cb 0.61 -0.11 0.29 0.00 -0.81 0.00 0.00 31.31 31.29 2jer n TRP 130 CO 0.00 0.00 0.00 0.38 2.07 0.00 0.00 177.69 180.14 2jer h ASP 131 N 0.11 0.71 0.20 -0.67 2.03 -1.99 -1.33 116.42 115.48 2jer h ASP 131 Ca -0.01 -0.04 -0.30 0.00 -0.73 0.00 0.00 57.03 55.94 2jer h ASP 131 Cb 1.24 -0.18 0.03 0.00 -0.83 0.00 0.00 39.33 39.59 2jer h ASP 131 CO 0.01 0.56 -1.28 1.56 -1.03 0.00 0.00 179.24 179.06 2jer h GLN 132 N 0.81 0.58 -0.92 4.15 1.08 -1.91 -3.09 115.11 115.81 2jer h GLN 132 Ca 0.21 -0.81 0.16 0.00 -1.45 0.00 0.00 58.65 56.76 2jer h GLN 132 Cb -0.01 0.27 -0.10 0.00 -0.05 0.00 0.00 27.48 27.60 2jer h GLN 132 CO -0.04 1.37 0.52 -0.44 -0.95 0.00 0.00 178.83 179.29 2jer h ASP 133 N 0.24 0.67 0.63 1.46 3.32 -1.77 -1.32 116.42 119.66 2jer h ASP 133 Ca -0.19 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2jer h ASP 133 Cb 1.95 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 41.48 2jer h ASP 133 CO 0.24 0.27 0.00 -0.67 -1.72 0.00 0.00 179.24 177.36 2jer n ASP 134 N -4.80 0.00 0.00 6.45 2.03 -0.52 -1.95 116.55 117.76 2jer n ASP 134 Ca 0.19 0.43 0.11 0.00 0.52 0.00 0.00 54.79 56.04 2jer n ASP 134 Cb 0.47 -0.47 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 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 -1.47 0.81 -0.27 -2.67 4.77 -0.50 -4.47 117.00 113.20 2jer n LEU 135 Ca 0.05 -0.31 -0.02 0.00 -0.03 0.00 0.00 56.01 55.71 2jer n LEU 135 Cb 0.22 -0.09 0.10 0.00 -2.33 0.00 0.00 43.42 41.33 2jer n LEU 135 CO 0.18 0.20 1.15 0.58 -1.33 0.00 0.00 177.39 178.16 2jer h VAL 136 N 0.00 1.05 -0.32 4.08 2.07 -1.31 -1.82 116.25 119.99 2jer h VAL 136 Ca 0.00 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2jer h VAL 136 Cb 0.52 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2jer h VAL 136 CO 0.00 0.16 0.21 0.00 0.02 0.00 0.00 177.57 177.95 2jer h ALA 137 N 1.35 0.41 -0.67 1.67 0.00 -1.76 -0.28 119.26 119.98 2jer h ALA 137 Ca 0.32 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 2jer h ALA 137 Cb 0.11 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2jer h ALA 137 CO -0.15 -0.12 0.10 0.37 0.00 0.00 0.00 179.25 179.45 2jer h GLN 138 N 0.43 1.11 -0.55 0.00 4.15 -1.79 -1.75 115.11 116.71 2jer h GLN 138 Ca 0.12 -0.30 -0.08 0.00 0.77 0.00 0.00 58.65 59.16 2jer h GLN 138 Cb -0.03 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 2jer h GLN 138 CO -0.02 1.02 0.04 0.87 -1.93 0.00 0.00 178.83 178.80 2jer h LYS 139 N 1.03 0.94 -0.62 1.69 1.57 -0.88 0.73 116.57 121.03 2jer h LYS 139 Ca 0.20 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 2jer h LYS 139 Cb 0.45 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 2jer h LYS 139 CO 0.01 0.93 0.23 0.82 -0.57 0.00 0.00 179.45 180.88 2jer h ILE 140 N 0.82 1.24 -0.84 1.86 2.04 -0.97 -1.60 117.51 120.07 2jer h ILE 140 Ca 0.16 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 2jer h ILE 140 Cb 0.49 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 2jer h ILE 140 CO 0.02 0.30 0.47 0.00 0.00 0.00 0.00 178.15 178.94 2jer h GLU 142 N 1.16 0.16 -0.83 0.00 4.39 -0.51 0.13 114.58 119.08 2jer h GLU 142 Ca 0.30 -0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.14 2jer h GLU 142 Cb 0.01 -0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 28.53 2jer h GLU 142 CO -0.05 0.10 0.40 0.82 -1.16 0.00 0.00 179.01 179.12 2jer h ILE 143 N 0.16 0.69 -0.00 3.13 2.04 -0.91 -0.96 117.51 121.66 2jer h ILE 143 Ca 0.10 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2jer h ILE 143 Cb 0.08 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2jer h ILE 143 CO -0.12 0.10 -0.02 -0.62 0.00 0.00 0.00 178.15 177.49 2jer n GLU 144 N -4.92 1.02 -3.51 2.37 -0.58 -0.69 -4.91 120.64 109.42 2jer n GLU 144 Ca 0.17 -0.26 -0.25 0.00 -0.42 0.00 0.00 57.16 56.40 2jer n GLU 144 Cb 0.45 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.88 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 -0.77 -2.54 -4.42 -0.32 8.25 -0.28 -4.99 115.22 110.15 2jer n HIS 145 Ca 0.20 0.86 -0.34 0.00 -0.26 0.00 0.00 57.72 58.19 2jer n HIS 145 Cb 0.21 -4.66 -0.12 0.00 1.12 0.00 0.00 29.99 26.55 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 -3.27 3.89 0.55 1.59 -7.23 0.28 -4.92 120.40 111.29 2jer s VAL 146 Ca 0.53 -0.36 -0.18 0.00 -1.81 0.00 0.00 61.98 60.16 2jer s VAL 146 Cb -0.24 -2.69 -0.05 0.00 0.56 0.00 0.00 36.38 33.95 2jer s VAL 146 CO 0.66 0.51 1.07 -1.81 -0.31 0.00 0.00 175.10 175.21 2jer s ASP 147 N 0.20 5.92 0.03 4.85 1.01 -1.26 -4.40 116.67 123.02 2jer s ASP 147 Ca -0.02 1.94 0.01 0.00 0.71 0.00 0.00 52.55 55.18 2jer s ASP 147 Cb -0.14 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.22 2jer s ASP 147 CO 0.03 -1.07 -0.05 -0.94 0.21 0.00 0.00 175.17 173.35 2jer s SER 148 N -2.29 0.49 -0.21 0.27 1.04 -0.78 -1.18 113.70 111.05 2jer s SER 148 Ca 0.67 -0.54 -0.12 0.00 0.48 0.00 0.00 55.95 56.44 2jer s SER 148 Cb -0.18 0.08 -0.05 0.00 0.10 0.00 0.00 66.02 65.97 2jer s SER 148 CO 0.29 -0.27 0.23 -0.31 0.98 0.00 0.00 173.24 174.16 2jer s TYR 149 N -1.52 3.38 -0.20 5.02 1.51 0.26 -0.35 117.35 125.45 2jer s TYR 149 Ca -0.13 0.41 -0.10 0.00 -1.01 0.00 0.00 57.07 56.25 2jer s TYR 149 Cb -0.09 -2.32 -0.05 0.00 -0.11 0.00 0.00 41.96 39.39 2jer s TYR 149 CO -0.01 0.13 0.12 0.50 -1.11 0.00 0.00 175.55 175.19 2jer s ARG 150 N 0.84 4.15 -1.03 -0.62 6.06 -1.26 0.19 118.95 127.27 2jer s ARG 150 Ca 0.12 -0.24 -0.13 0.00 -2.50 0.00 0.00 55.73 52.98 2jer s ARG 150 Cb -0.13 -3.39 0.21 0.00 0.06 0.00 0.00 34.95 31.70 2jer s ARG 150 CO 0.04 0.29 1.10 0.95 -2.50 0.00 0.00 175.30 175.18 2jer s THR 151 N 0.39 5.45 0.16 4.11 -4.23 -0.57 -4.98 115.64 115.98 2jer s THR 151 Ca 0.07 -2.67 -0.34 0.00 -1.18 0.00 0.00 61.69 57.57 2jer s THR 151 Cb -0.11 -4.68 -0.14 0.00 1.34 0.00 0.00 72.50 68.91 2jer s THR 151 CO -0.01 -1.31 1.51 0.47 -0.54 0.00 0.00 174.62 174.74 2jer n ASP 152 N 4.41 2.81 -1.70 3.99 8.00 -1.26 -1.83 116.55 130.97 2jer n ASP 152 Ca 0.24 1.10 -0.20 0.00 0.71 0.00 0.00 54.79 56.64 2jer n ASP 152 Cb 0.44 -1.39 -0.07 0.00 -0.02 0.00 0.00 41.12 40.07 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 3.06 -5.50 -3.85 -2.24 8.00 -1.26 -4.96 116.55 109.80 2jer n ASP 153 Ca 0.16 0.40 -0.28 0.00 0.71 0.00 0.00 54.79 55.79 2jer n ASP 153 Cb 0.28 -4.74 -0.16 0.00 -0.02 0.00 0.00 41.12 36.48 2jer n ASP 153 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2jer s PHE 154 N -2.80 1.53 -0.10 1.24 2.19 -0.76 -5.03 117.98 114.24 2jer s PHE 154 Ca 0.00 -1.01 -0.18 0.00 0.33 0.00 0.00 56.93 56.07 2jer s PHE 154 Cb 0.00 -1.23 -0.04 0.00 -1.31 0.00 0.00 43.02 40.43 2jer s PHE 154 CO 0.00 -0.60 0.48 0.08 1.83 0.00 0.00 175.22 177.01 2jer s VAL 155 N 1.69 5.15 0.02 3.12 1.01 -1.26 -1.69 120.40 128.44 2jer s VAL 155 Ca 0.00 0.96 -0.26 0.00 0.00 0.00 0.00 61.98 62.69 2jer s VAL 155 Cb -0.16 -3.82 0.06 0.00 0.00 0.00 0.00 36.38 32.47 2jer s VAL 155 CO -0.07 0.36 0.59 -0.22 0.00 0.00 0.00 175.10 175.76 2jer s LEU 156 N 0.41 -0.37 0.02 3.92 2.96 -0.75 -4.79 118.68 120.08 2jer s LEU 156 Ca 0.26 0.38 0.08 0.00 -0.22 0.00 0.00 54.13 54.63 2jer s LEU 156 Cb -0.15 2.34 -0.02 0.00 0.50 0.00 0.00 46.19 48.86 2jer s LEU 156 CO 0.11 -0.70 -0.23 -1.61 -1.32 0.00 0.00 176.35 172.60 2jer s GLU 157 N -2.06 1.67 0.41 1.98 8.01 -1.26 -4.59 118.70 122.86 2jer s GLU 157 Ca -0.07 -0.92 0.19 0.00 0.01 0.00 0.00 54.97 54.18 2jer s GLU 157 Cb -0.01 -1.73 1.11 0.00 -4.31 0.00 0.00 34.13 29.20 2jer s GLU 157 CO 0.02 0.46 1.80 0.78 0.01 0.00 0.00 175.26 178.32 2jer h GLY 158 N 5.17 1.06 1.47 -1.39 0.00 -1.63 -1.41 103.07 106.33 2jer h GLY 158 Ca -0.42 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.71 2jer h GLY 158 CO 0.45 -0.09 0.00 0.61 0.00 0.00 0.00 176.54 177.52 2jer n GLY 159 N -1.50 -1.01 0.23 4.60 0.00 -1.22 -3.39 105.19 102.90 2jer n GLY 159 Ca 0.23 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.23 0.98 -3.94 1.61 3.41 -0.53 -2.55 113.62 111.36 2jer n SER 160 Ca 0.12 -0.86 -0.08 0.00 -0.26 0.00 0.00 58.87 57.79 2jer n SER 160 Cb 0.17 0.12 -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 -2.51 0.30 0.01 7.33 -0.12 -1.22 -4.19 117.98 117.59 2jer s PHE 161 Ca 0.24 -0.77 0.02 0.00 -0.05 0.00 0.00 56.93 56.37 2jer s PHE 161 Cb 0.19 -0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.39 2jer s PHE 161 CO 0.52 -0.49 -0.05 -1.01 -0.05 0.00 0.00 175.22 174.13 2jer s HIS 162 N -3.89 0.48 0.18 3.49 3.76 -0.01 -4.87 115.29 114.43 2jer s HIS 162 Ca 0.06 -0.26 0.11 0.00 -0.15 0.00 0.00 55.06 54.82 2jer s HIS 162 Cb 0.06 -0.30 -0.04 0.00 1.11 0.00 0.00 32.58 33.41 2jer s HIS 162 CO -0.10 -0.05 -0.24 0.14 -0.85 0.00 0.00 174.74 173.65 2jer s VAL 163 N -0.65 2.25 -1.21 -0.90 -7.23 -1.26 -0.40 120.40 111.00 2jer s VAL 163 Ca -0.04 -1.97 0.22 0.00 -1.81 0.00 0.00 61.98 58.38 2jer s VAL 163 Cb -0.05 -2.05 -0.16 0.00 0.56 0.00 0.00 36.38 34.68 2jer s VAL 163 CO -0.00 -0.12 1.00 -0.90 -0.31 0.00 0.00 175.10 174.77 2jer n ASP 164 N 0.37 1.14 0.00 4.85 5.75 -1.02 -4.53 116.55 123.11 2jer n ASP 164 Ca -0.13 -1.02 0.00 0.00 -0.01 0.00 0.00 54.79 53.62 2jer n ASP 164 Cb 0.56 0.82 0.00 0.00 -1.03 0.00 0.00 41.12 41.46 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 1.48 0.47 1.61 6.12 0.00 -1.26 -4.26 105.19 109.35 2jer n GLY 165 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.35 1.30 -0.04 1.61 6.02 -1.26 -4.81 117.38 117.84 2jer n GLN 166 Ca 0.00 -2.97 0.00 0.00 -0.01 0.00 0.00 57.00 54.02 2jer n GLN 166 Cb 0.07 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.24 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 -0.33 0.72 3.36 1.08 0.00 -1.26 -4.56 105.19 104.21 2jer n GLY 167 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.05 2.35 0.03 2.61 2.01 -1.26 -0.22 115.64 119.12 2jer s THR 168 Ca 0.00 -1.07 0.06 0.00 0.31 0.00 0.00 61.69 61.00 2jer s THR 168 Cb 0.00 -1.87 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 2jer s THR 168 CO 0.00 0.53 -0.19 0.54 -0.69 0.00 0.00 174.62 174.81 2jer s VAL 169 N -0.69 1.51 -0.10 3.82 0.11 -0.67 -2.43 120.40 121.95 2jer s VAL 169 Ca 0.11 -1.06 0.03 0.00 -2.93 0.00 0.00 61.98 58.13 2jer s VAL 169 Cb -0.10 -1.31 -0.01 0.00 -1.53 0.00 0.00 36.38 33.43 2jer s VAL 169 CO 0.00 0.22 -0.21 -0.22 -3.33 0.00 0.00 175.10 171.56 2jer s LEU 170 N -0.99 2.29 0.00 2.54 2.96 0.46 -0.43 118.68 125.51 2jer s LEU 170 Ca 0.06 -0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 53.48 2jer s LEU 170 Cb -0.08 -1.46 0.01 0.00 0.50 0.00 0.00 46.19 45.15 2jer s LEU 170 CO 0.01 0.19 0.32 1.07 -1.32 0.00 0.00 176.35 176.62 2jer n THR 171 N 3.34 0.00 -4.94 3.68 5.66 -0.56 -0.83 114.28 120.64 2jer n THR 171 Ca -0.18 -0.93 -0.27 0.00 -3.05 0.00 0.00 64.05 59.62 2jer n THR 171 Cb 0.53 0.62 -0.16 0.00 -1.55 0.00 0.00 70.33 69.77 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 1.56 0.21 1.09 -4.23 -1.26 -0.70 115.64 109.68 2jer s THR 172 Ca 0.15 -0.82 -0.09 0.00 -1.18 0.00 0.00 61.69 59.76 2jer s THR 172 Cb -0.01 -1.31 0.16 0.00 1.34 0.00 0.00 72.50 72.68 2jer s THR 172 CO 0.11 0.44 1.81 -0.33 -0.54 0.00 0.00 174.62 176.11 2jer h GLU 173 N 5.89 1.13 -0.93 3.99 5.08 -0.64 -2.40 114.58 126.69 2jer h GLU 173 Ca -0.36 -0.16 0.20 0.00 -1.00 0.00 0.00 59.36 58.04 2jer h GLU 173 Cb 1.16 -0.21 -0.11 0.00 0.50 0.00 0.00 28.75 30.09 2jer h GLU 173 CO 0.48 0.87 0.50 1.98 -1.00 0.00 0.00 179.01 181.83 2jer h MET 174 N 1.11 0.56 0.00 2.33 4.05 -1.54 -1.69 114.93 119.75 2jer h MET 174 Ca 0.27 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.65 2jer h MET 174 Cb 0.11 -0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 30.78 2jer h MET 174 CO -0.04 0.37 -0.18 0.00 0.23 0.00 0.00 176.91 177.29 2jer h LEU 176 N -1.00 0.00 -1.81 0.00 3.38 -1.39 -2.43 115.31 112.07 2jer h LEU 176 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jer h LEU 176 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2jer h LEU 176 CO -0.01 0.30 0.00 0.18 0.09 0.00 0.00 178.44 179.00 2jer n LEU 177 N -3.51 2.68 -4.82 1.67 4.77 -0.64 -4.53 117.00 112.63 2jer n LEU 177 Ca -0.00 -1.22 -0.32 0.00 -0.03 0.00 0.00 56.01 54.44 2jer n LEU 177 Cb 0.45 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2jer n LEU 177 CO 0.35 0.61 0.71 -0.94 -1.33 0.00 0.00 177.39 176.79 2jer s SER 178 N -1.33 5.82 0.41 -1.43 1.04 -0.92 -4.95 113.70 112.35 2jer s SER 178 Ca 0.35 1.71 0.08 0.00 0.48 0.00 0.00 55.95 58.57 2jer s SER 178 Cb 0.19 -2.52 0.87 0.00 0.10 0.00 0.00 66.02 64.67 2jer s SER 178 CO 0.27 -1.14 2.05 -0.08 0.98 0.00 0.00 173.24 175.32 2jer h GLU 179 N 0.16 0.54 -0.01 4.02 4.81 -1.92 -2.59 114.58 119.59 2jer h GLU 179 Ca -0.46 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2jer h GLU 179 Cb 1.21 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.47 2jer h GLU 179 CO 0.58 0.36 0.00 0.41 -0.73 0.00 0.00 179.01 179.63 2jer n GLY 180 N -1.48 -0.64 0.00 1.92 0.00 -1.26 -4.14 105.19 99.59 2jer n GLY 180 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.58 0.00 -3.15 1.61 5.12 -0.97 -4.13 116.66 114.56 2jer n ARG 181 Ca 0.22 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.89 2jer n ARG 181 Cb 0.19 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.44 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 2.70 0.22 0.55 4.13 -1.25 -4.67 115.26 116.65 2jer n ASN 182 Ca 0.00 -3.30 0.15 0.00 1.68 0.00 0.00 54.58 53.11 2jer n ASN 182 Cb 0.00 -0.61 0.72 0.00 -1.54 0.00 0.00 39.78 38.35 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 3.42 0.00 0.00 3.52 0.13 -1.77 -0.92 132.00 136.38 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 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2jer h PRO 183 CO 0.68 0.00 -0.14 1.04 -0.23 0.00 0.00 178.00 179.36 2jer n GLN 184 N -2.61 0.08 -3.66 0.86 6.02 -1.26 -4.86 117.38 111.96 2jer n GLN 184 Ca -0.00 0.06 -0.37 0.00 -0.01 0.00 0.00 57.00 56.67 2jer n GLN 184 Cb 0.16 -1.58 -0.06 0.00 1.02 0.00 0.00 30.24 29.77 2jer n GLN 184 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2jer s LEU 185 N -3.45 4.43 0.80 1.08 1.43 -0.35 -5.10 118.68 117.52 2jer s LEU 185 Ca 0.12 0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 53.85 2jer s LEU 185 Cb 0.17 -2.47 0.07 0.00 0.03 0.00 0.00 46.19 43.99 2jer s LEU 185 CO 0.59 0.33 1.09 -0.94 0.23 0.00 0.00 176.35 177.65 2jer s SER 186 N -1.20 4.50 0.24 2.29 1.04 -1.26 -4.89 113.70 114.43 2jer s SER 186 Ca 0.22 1.33 -0.05 0.00 0.48 0.00 0.00 55.95 57.94 2jer s SER 186 Cb -0.15 -2.07 0.41 0.00 0.10 0.00 0.00 66.02 64.32 2jer s SER 186 CO 0.11 -1.97 1.77 0.50 0.98 0.00 0.00 173.24 174.64 2jer h LYS 187 N -1.09 0.58 -0.68 4.02 3.64 -1.98 -1.91 116.57 119.17 2jer h LYS 187 Ca -0.47 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 58.83 2jer h LYS 187 Cb 1.27 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.93 2jer h LYS 187 CO 0.59 0.38 0.24 0.93 -2.27 0.00 0.00 179.45 179.32 2jer h GLU 188 N 0.60 1.03 -0.85 1.90 3.07 -1.99 -0.21 114.58 118.13 2jer h GLU 188 Ca 0.39 -0.21 -0.01 0.00 -0.50 0.00 0.00 59.36 59.04 2jer h GLU 188 Cb 0.49 -0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 28.20 2jer h GLU 188 CO -0.31 0.88 0.50 0.00 -1.40 0.00 0.00 179.01 178.67 2jer h ALA 189 N 1.10 1.09 -0.37 3.43 0.00 -1.78 -1.18 119.26 121.56 2jer h ALA 189 Ca 0.22 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2jer h ALA 189 Cb 0.25 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2jer h ALA 189 CO -0.01 0.57 -0.12 0.82 0.00 0.00 0.00 179.25 180.50 2jer h ILE 190 N 1.18 1.28 -0.81 0.00 2.04 -1.01 -2.00 117.51 118.19 2jer h ILE 190 Ca 0.30 -1.22 0.13 0.00 1.00 0.00 0.00 64.86 65.07 2jer h ILE 190 Cb -0.02 1.31 -0.09 0.00 -0.74 0.00 0.00 36.82 37.27 2jer h ILE 190 CO -0.05 0.40 0.41 -0.33 0.00 0.00 0.00 178.15 178.57 2jer h GLU 191 N 0.53 0.60 -0.50 2.37 5.08 -0.73 -1.84 114.58 120.08 2jer h GLU 191 Ca 0.09 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 2jer h GLU 191 Cb 0.65 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2jer h GLU 191 CO 0.04 0.40 -0.12 0.37 -1.00 0.00 0.00 179.01 178.70 2jer h GLN 192 N 0.62 0.93 -0.48 2.33 4.15 -0.88 -0.25 115.11 121.53 2jer h GLN 192 Ca 0.42 -0.33 0.02 0.00 0.77 0.00 0.00 58.65 59.53 2jer h GLN 192 Cb 0.55 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 2jer h GLN 192 CO -0.33 0.99 0.28 0.87 -1.93 0.00 0.00 178.83 178.71 2jer h LYS 193 N 0.83 0.55 -0.37 1.69 1.79 -0.76 -0.18 116.57 120.12 2jer h LYS 193 Ca 0.13 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.54 2jer h LYS 193 Cb 0.65 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.16 2jer h LYS 193 CO 0.05 0.36 0.12 -0.07 -1.08 0.00 0.00 179.45 178.83 2jer h LEU 194 N 0.56 0.53 -0.44 2.94 3.38 -0.94 -0.94 115.31 120.41 2jer h LEU 194 Ca 0.19 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2jer h LEU 194 Cb 0.02 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jer h LEU 194 CO -0.09 0.59 0.27 0.00 0.09 0.00 0.00 178.44 179.30 2jer h ASP 196 N 0.55 0.88 0.32 0.00 3.32 -0.80 -1.08 116.42 119.60 2jer h ASP 196 Ca 0.17 -0.39 -0.17 0.00 0.02 0.00 0.00 57.03 56.66 2jer h ASP 196 Cb -0.01 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.26 2jer h ASP 196 CO -0.07 1.15 -1.84 -1.22 -1.72 0.00 0.00 179.24 175.54 2jer n TYR 197 N -4.05 0.43 0.35 4.55 4.02 -0.38 -1.20 117.16 120.88 2jer n TYR 197 Ca -0.02 0.14 0.11 0.00 -0.01 0.00 0.00 57.90 58.13 2jer n TYR 197 Cb 0.53 -0.90 -0.03 0.00 -0.02 0.00 0.00 39.34 38.92 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 -2.67 0.55 -2.96 7.72 4.32 -0.05 -4.67 117.00 119.24 2jer n LEU 198 Ca -0.15 0.06 -0.04 0.00 -0.02 0.00 0.00 56.01 55.86 2jer n LEU 198 Cb 0.85 -0.07 0.02 0.00 -1.62 0.00 0.00 43.42 42.60 2jer n LEU 198 CO 0.44 -0.02 0.23 -3.20 -1.22 0.00 0.00 177.39 173.62 2jer n ASN 199 N -2.19 -6.92 -4.29 -1.43 4.05 -0.48 -1.75 115.26 102.25 2jer n ASN 199 Ca 0.00 -0.24 -0.16 0.00 0.45 0.00 0.00 54.58 54.64 2jer n ASN 199 Cb 0.49 -4.85 -0.10 0.00 1.23 0.00 0.00 39.78 36.55 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 -3.11 1.11 0.00 3.44 -7.23 -0.81 -4.41 120.40 109.39 2jer s VAL 200 Ca 0.12 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 2jer s VAL 200 Cb -0.02 -2.09 0.00 0.00 0.56 0.00 0.00 36.38 34.83 2jer s VAL 200 CO 0.67 -0.54 0.04 -1.84 -0.31 0.00 0.00 175.10 173.13 2jer n GLU 201 N -0.31 4.96 -4.08 4.82 0.28 0.69 -4.45 120.64 122.56 2jer n GLU 201 Ca -0.08 -0.04 -0.21 0.00 -0.16 0.00 0.00 57.16 56.67 2jer n GLU 201 Cb 0.62 -0.45 -0.17 0.00 1.43 0.00 0.00 31.44 32.87 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 -0.72 0.87 -0.28 3.44 2.20 -0.76 -5.05 119.74 119.44 2jer s LYS 202 Ca 0.00 -0.08 -0.07 0.00 -0.36 0.00 0.00 55.97 55.46 2jer s LYS 202 Cb 0.00 -0.95 -0.01 0.00 -1.51 0.00 0.00 37.83 35.36 2jer s LYS 202 CO 0.00 -0.14 0.07 0.08 -0.36 0.00 0.00 175.35 175.00 2jer s VAL 203 N 1.20 4.09 -0.32 4.02 1.01 -1.26 -1.67 120.40 127.46 2jer s VAL 203 Ca -0.07 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.28 2jer s VAL 203 Cb -0.14 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2jer s VAL 203 CO -0.02 0.19 0.40 -0.76 0.00 0.00 0.00 175.10 174.92 2jer s LEU 204 N 1.55 4.30 -0.40 3.92 1.43 0.43 -5.00 118.68 124.90 2jer s LEU 204 Ca 0.04 -0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.97 2jer s LEU 204 Cb -0.16 -2.42 0.01 0.00 0.03 0.00 0.00 46.19 43.65 2jer s LEU 204 CO 0.03 -0.32 0.30 0.26 0.23 0.00 0.00 176.35 176.84 2jer s TRP 205 N 2.12 3.23 0.71 0.29 0.52 -1.26 -1.49 118.94 123.06 2jer s TRP 205 Ca 0.14 -0.50 -0.11 0.00 0.02 0.00 0.00 56.10 55.65 2jer s TRP 205 Cb -0.16 -2.59 0.02 0.00 -1.15 0.00 0.00 33.47 29.59 2jer s TRP 205 CO 0.12 -0.55 1.09 -0.51 0.02 0.00 0.00 176.95 177.11 2jer s LEU 206 N 1.72 2.88 0.00 2.99 1.43 0.12 -4.92 118.68 122.90 2jer s LEU 206 Ca 0.06 1.06 0.00 0.00 -1.03 0.00 0.00 54.13 54.22 2jer s LEU 206 Cb -0.19 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.21 2jer s LEU 206 CO 0.10 -1.38 0.00 0.61 0.23 0.00 0.00 176.35 175.91 2jer n GLY 207 N -3.01 0.70 3.79 -3.19 0.00 -1.26 -0.69 105.19 101.53 2jer n GLY 207 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 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 7.28 0.38 1.61 -0.00 -1.26 -1.56 116.67 122.12 2jer s ASP 208 Ca 0.00 1.71 -0.00 0.00 -0.00 0.00 0.00 52.55 54.26 2jer s ASP 208 Cb 0.00 -2.53 0.00 0.00 -0.00 0.00 0.00 42.92 40.39 2jer s ASP 208 CO 0.00 0.00 0.02 0.61 -0.00 0.00 0.00 175.17 175.80 2jer n GLY 209 N 0.76 0.79 0.32 0.21 0.00 -1.25 -4.88 105.19 101.13 2jer n GLY 209 Ca -0.00 -1.96 0.06 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.40 0.00 -3.22 -0.61 -5.35 -1.26 -4.70 119.36 102.81 2jer n ILE 210 Ca 0.00 -0.38 -0.25 0.00 -0.27 0.00 0.00 62.75 61.86 2jer n ILE 210 Cb 0.01 1.17 -0.06 0.00 -1.74 0.00 0.00 39.64 39.02 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 -0.09 2.52 0.03 7.28 3.85 -1.26 -4.91 116.55 123.97 2jer n ASP 211 Ca 0.06 -3.23 0.08 0.00 -0.71 0.00 0.00 54.79 50.99 2jer n ASP 211 Cb 0.28 -0.63 0.51 0.00 -1.35 0.00 0.00 41.12 39.93 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 3.70 0.35 0.00 0.11 0.13 -1.88 -2.24 132.00 132.16 2jer h PRO 212 Ca 0.14 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2jer h PRO 212 Cb 0.73 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2jer h PRO 212 CO 0.68 0.23 -0.39 0.93 -0.23 0.00 0.00 178.00 179.22 2jer h GLU 213 N 0.36 0.00 0.00 0.86 4.39 -1.96 -3.21 114.58 115.02 2jer h GLU 213 Ca 0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.86 2jer h GLU 213 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2jer h GLU 213 CO -0.04 0.00 0.00 -1.91 -1.16 0.00 0.00 179.01 175.90 2jer n GLU 214 N -2.90 0.00 -0.18 2.33 4.07 -0.89 -4.72 120.64 118.34 2jer n GLU 214 Ca 0.02 0.00 0.11 0.00 -0.06 0.00 0.00 57.16 57.24 2jer n GLU 214 Cb 0.53 -0.08 0.26 0.00 -0.06 0.00 0.00 31.44 32.09 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 -1.08 0.47 -3.49 6.31 -2.24 -1.13 -4.88 114.28 108.24 2jer n THR 215 Ca 0.00 -0.65 -0.21 0.00 -2.27 0.00 0.00 64.05 60.91 2jer n THR 215 Cb 0.00 0.75 0.07 0.00 -2.10 0.00 0.00 70.33 69.06 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 1.17 -5.86 -0.70 3.42 3.02 -0.92 -4.26 115.26 111.14 2jer n ASN 216 Ca 0.19 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 2jer n ASN 216 Cb 0.53 -4.61 0.00 0.00 -0.61 0.00 0.00 39.78 35.09 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 -1.85 0.69 3.61 7.41 0.00 -0.92 -1.65 105.19 112.49 2jer n GLY 217 Ca 0.00 -0.52 -0.48 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.56 1.64 0.24 1.61 8.25 -1.26 -3.96 115.22 120.18 2jer n HIS 218 Ca 0.00 0.57 0.13 0.00 -0.26 0.00 0.00 57.72 58.16 2jer n HIS 218 Cb 0.46 -2.36 0.75 0.00 1.12 0.00 0.00 29.99 29.96 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 2.94 0.76 0.00 1.59 3.04 -1.74 -2.82 116.25 120.03 2jer h VAL 219 Ca -0.44 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 2jer h VAL 219 Cb 1.32 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 31.55 2jer h VAL 219 CO 0.74 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.40 2jer n ASP 220 N -4.22 0.00 -0.42 3.17 5.75 -1.06 -0.42 116.55 119.35 2jer n ASP 220 Ca -0.01 -0.09 0.12 0.00 -0.01 0.00 0.00 54.79 54.80 2jer n ASP 220 Cb 0.18 -0.23 0.11 0.00 -1.03 0.00 0.00 41.12 40.15 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 -1.23 1.72 -0.02 -1.12 8.00 -1.06 -3.48 116.55 119.36 2jer n ASP 221 Ca 0.09 -1.32 -0.04 0.00 0.71 0.00 0.00 54.79 54.23 2jer n ASP 221 Cb 0.12 0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 41.59 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 -0.22 0.20 -3.56 2.53 0.31 0.44 -4.64 118.33 113.39 2jer n VAL 222 Ca 0.10 -0.05 -0.16 0.00 -0.01 0.00 0.00 64.34 64.22 2jer n VAL 222 Cb 0.43 -1.51 -0.06 0.00 -0.91 0.00 0.00 33.84 31.79 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 -2.07 -1.50 0.27 3.52 0.00 -0.35 -1.37 121.76 120.27 2jer s ALA 223 Ca -0.05 0.90 -0.12 0.00 0.00 0.00 0.00 51.96 52.70 2jer s ALA 223 Cb 0.02 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.34 2jer s ALA 223 CO 0.06 -0.43 0.51 0.00 0.00 0.00 0.00 175.76 175.90 2jer s PHE 225 N -3.74 3.46 -0.12 0.00 0.08 -1.26 -0.83 117.98 115.56 2jer s PHE 225 Ca 0.23 0.77 0.17 0.00 0.12 0.00 0.00 56.93 58.22 2jer s PHE 225 Cb -0.01 -2.53 -0.17 0.00 -0.57 0.00 0.00 43.02 39.74 2jer s PHE 225 CO 0.11 0.10 0.69 0.44 -0.10 0.00 0.00 175.22 176.47 2jer n ILE 226 N 3.92 1.13 -3.63 0.64 -5.35 -0.45 -4.84 119.36 110.79 2jer n ILE 226 Ca -0.08 -0.70 -0.05 0.00 -0.27 0.00 0.00 62.75 61.65 2jer n ILE 226 Cb 0.51 -0.66 -0.02 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.91 -1.83 0.14 -1.28 0.00 -1.19 -4.87 121.76 109.82 2jer s ALA 227 Ca -0.04 0.66 -0.34 0.00 0.00 0.00 0.00 51.96 52.24 2jer s ALA 227 Cb 0.09 0.46 -0.13 0.00 0.00 0.00 0.00 23.12 23.53 2jer s ALA 227 CO 0.82 -0.87 1.65 -2.30 0.00 0.00 0.00 175.76 175.06 2jer n PRO 228 N -0.36 2.27 -0.91 0.00 -0.02 -1.26 -1.47 135.00 133.25 2jer n PRO 228 Ca -0.07 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2jer n PRO 228 Cb 0.61 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2jer n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jer n GLY 229 N 3.65 0.82 2.99 -1.23 0.00 -1.26 -5.02 105.19 105.15 2jer n GLY 229 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 1.38 0.17 1.61 2.02 -0.55 -1.54 118.70 121.69 2jer s GLU 230 Ca 0.00 -0.33 0.09 0.00 0.02 0.00 0.00 54.97 54.75 2jer s GLU 230 Cb 0.00 -1.19 -0.04 0.00 0.10 0.00 0.00 34.13 33.00 2jer s GLU 230 CO 0.00 0.02 -0.19 0.14 0.02 0.00 0.00 175.26 175.26 2jer s VAL 231 N 0.62 1.84 -0.05 2.63 -7.23 -0.60 -1.34 120.40 116.27 2jer s VAL 231 Ca -0.12 -1.92 -0.01 0.00 -1.81 0.00 0.00 61.98 58.12 2jer s VAL 231 Cb -0.14 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.91 2jer s VAL 231 CO 0.02 -0.30 0.04 0.00 -0.31 0.00 0.00 175.10 174.55 2jer s ALA 232 N -2.02 3.44 0.00 1.32 0.00 -0.01 -0.94 121.76 123.55 2jer s ALA 232 Ca 0.16 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2jer s ALA 232 Cb -0.06 -1.53 -0.00 0.00 0.00 0.00 0.00 23.12 21.53 2jer s ALA 232 CO 0.07 0.63 -0.02 0.00 0.00 0.00 0.00 175.76 176.44 2jer s ILE 234 N -0.11 2.83 -0.14 0.00 -4.36 -0.47 -0.87 121.20 118.08 2jer s ILE 234 Ca -0.00 0.45 -0.14 0.00 -0.26 0.00 0.00 60.65 60.70 2jer s ILE 234 Cb -0.01 -3.07 0.04 0.00 1.25 0.00 0.00 42.46 40.67 2jer s ILE 234 CO -0.00 -0.17 0.39 -0.47 0.24 0.00 0.00 174.94 174.93 2jer s TYR 235 N -1.92 -0.42 -0.20 1.37 5.04 -0.20 -4.78 117.35 116.24 2jer s TYR 235 Ca 0.73 1.01 -0.24 0.00 -2.44 0.00 0.00 57.07 56.13 2jer s TYR 235 Cb -0.26 0.15 0.06 0.00 0.35 0.00 0.00 41.96 42.26 2jer s TYR 235 CO 0.37 -0.23 0.64 -0.08 -1.34 0.00 0.00 175.55 174.92 2jer s THR 236 N 0.08 0.00 -2.62 4.34 -1.32 -1.26 -3.66 115.64 111.21 2jer s THR 236 Ca -0.01 -0.02 0.22 0.00 -1.21 0.00 0.00 61.69 60.67 2jer s THR 236 Cb -0.03 -0.91 0.15 0.00 -1.51 0.00 0.00 72.50 70.20 2jer s THR 236 CO 0.01 -0.01 1.17 -0.62 -2.21 0.00 0.00 174.62 172.96 2jer n GLU 237 N 2.38 1.94 -2.22 7.08 1.02 -1.26 -4.87 120.64 124.71 2jer n GLU 237 Ca -0.15 -1.70 -0.40 0.00 -0.02 0.00 0.00 57.16 54.89 2jer n GLU 237 Cb 0.56 -1.42 -0.03 0.00 -0.02 0.00 0.00 31.44 30.53 2jer n GLU 237 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jer s ASP 238 N -1.87 5.73 0.37 1.62 -1.08 -1.26 -4.86 116.67 115.32 2jer s ASP 238 Ca 0.24 0.33 0.27 0.00 -0.52 0.00 0.00 52.55 52.88 2jer s ASP 238 Cb 0.18 -2.54 1.17 0.00 -1.46 0.00 0.00 42.92 40.27 2jer s ASP 238 CO 0.30 -2.02 1.82 1.56 0.52 0.00 0.00 175.17 177.35 2jer h GLN 239 N 12.82 0.00 -0.01 4.34 4.20 -1.99 -2.26 115.11 132.21 2jer h GLN 239 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 2jer h GLN 239 Cb 1.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.91 2jer h GLN 239 CO 1.19 0.00 -0.17 0.09 -0.67 0.00 0.00 178.83 179.27 2jer n ASN 240 N -2.53 1.44 -4.74 1.46 3.02 -1.26 -4.89 115.26 107.75 2jer n ASN 240 Ca 0.01 -1.25 -0.41 0.00 -0.03 0.00 0.00 54.58 52.90 2jer n ASN 240 Cb 0.23 0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 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 -2.29 6.73 0.62 6.41 0.15 -0.85 -4.89 113.70 119.58 2jer s SER 241 Ca 0.29 2.59 0.33 0.00 0.70 0.00 0.00 55.95 59.86 2jer s SER 241 Cb 0.20 -2.62 1.90 0.00 -1.71 0.00 0.00 66.02 63.78 2jer s SER 241 CO 0.44 -0.64 2.18 1.55 1.20 0.00 0.00 173.24 177.96 2jer h PRO 242 N 5.10 0.00 -0.00 5.44 0.13 -1.92 -1.82 132.00 138.93 2jer h PRO 242 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2jer h PRO 242 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2jer h PRO 242 CO 0.77 0.00 -0.37 1.19 -0.23 0.00 0.00 178.00 179.36 2jer n PHE 243 N -3.48 0.00 0.36 1.56 3.72 -1.26 -4.72 117.46 113.64 2jer n PHE 243 Ca -0.01 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.20 2jer n PHE 243 Cb 0.22 -0.18 -0.10 0.00 -0.94 0.00 0.00 39.48 38.48 2jer n PHE 243 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2jer h TYR 244 N 0.62 -1.28 -0.57 1.38 3.20 -1.59 0.12 116.97 118.85 2jer h TYR 244 Ca 0.00 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.89 2jer h TYR 244 Cb 0.50 0.47 -0.04 0.00 1.54 0.00 0.00 36.73 39.21 2jer h TYR 244 CO 0.00 -0.68 0.36 0.93 -1.64 0.00 0.00 178.16 177.13 2jer h GLU 245 N -1.07 0.69 -0.38 1.82 5.08 -1.84 -0.29 114.58 118.58 2jer h GLU 245 Ca -0.08 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2jer h GLU 245 Cb 0.89 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2jer h GLU 245 CO 0.03 0.45 0.18 0.00 -1.00 0.00 0.00 179.01 178.68 2jer h ALA 246 N 1.24 0.49 -0.49 3.43 0.00 -1.83 -1.23 119.26 120.86 2jer h ALA 246 Ca 0.23 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2jer h ALA 246 Cb -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2jer h ALA 246 CO -0.09 0.04 0.17 0.00 0.00 0.00 0.00 179.25 179.38 2jer h ALA 247 N 1.03 0.64 -0.54 0.00 0.00 -0.53 -1.26 119.26 118.60 2jer h ALA 247 Ca 0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2jer h ALA 247 Cb 0.11 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2jer h ALA 247 CO -0.02 0.28 0.19 1.96 0.00 0.00 0.00 179.25 181.67 2jer h GLN 248 N 0.66 0.82 -0.26 0.00 1.08 -0.98 -2.60 115.11 113.83 2jer h GLN 248 Ca 0.16 -0.16 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 2jer h GLN 248 Cb 0.24 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2jer h GLN 248 CO -0.01 0.74 -0.53 0.22 -0.95 0.00 0.00 178.83 178.30 2jer h ASP 249 N 0.74 0.92 -0.42 1.46 3.58 -1.09 -2.55 116.42 119.05 2jer h ASP 249 Ca 0.18 -0.54 0.00 0.00 0.42 0.00 0.00 57.03 57.09 2jer h ASP 249 Cb 0.24 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.01 2jer h ASP 249 CO -0.01 1.29 0.28 0.00 -2.88 0.00 0.00 179.24 177.92 2jer h ALA 250 N 0.65 0.53 -0.54 -0.78 0.00 -1.23 -0.52 119.26 117.38 2jer h ALA 250 Ca 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2jer h ALA 250 Cb 1.14 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2jer h ALA 250 CO 0.12 -0.01 0.21 -0.92 0.00 0.00 0.00 179.25 178.65 2jer h TYR 251 N 0.57 0.82 -0.48 0.00 3.20 -1.47 -0.48 116.97 119.13 2jer h TYR 251 Ca 0.15 -0.06 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 2jer h TYR 251 Cb -0.06 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 37.95 2jer h TYR 251 CO -0.05 0.67 -0.05 1.96 -1.64 0.00 0.00 178.16 179.06 2jer h GLN 252 N 0.73 0.88 -0.33 1.82 4.20 -1.25 -0.92 115.11 120.24 2jer h GLN 252 Ca 0.18 -0.31 0.02 0.00 0.06 0.00 0.00 58.65 58.60 2jer h GLN 252 Cb 0.20 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 2jer h GLN 252 CO -0.01 0.95 0.17 0.00 -0.67 0.00 0.00 178.83 179.27 2jer h ARG 253 N 0.73 0.35 -0.48 1.46 3.08 -0.93 -2.95 114.38 115.64 2jer h ARG 253 Ca 0.13 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 2jer h ARG 253 Cb 0.58 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 2jer h ARG 253 CO 0.03 0.23 0.14 -0.07 -1.07 0.00 0.00 179.97 179.24 2jer h LEU 254 N 0.36 0.65 -1.28 3.04 3.38 -0.80 -1.57 115.31 119.09 2jer h LEU 254 Ca 0.14 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2jer h LEU 254 Cb 0.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2jer h LEU 254 CO -0.08 0.63 0.00 -0.07 0.09 0.00 0.00 178.44 179.00 2jer h LEU 255 N 0.69 0.00 -1.66 1.67 3.38 -0.99 -2.23 115.31 116.18 2jer h LEU 255 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2jer h LEU 255 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2jer h LEU 255 CO -0.01 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.81 2jer n LYS 256 N -2.31 1.10 -3.75 1.13 5.02 -0.61 -4.95 118.16 113.78 2jer n LYS 256 Ca -0.00 -1.41 -0.36 0.00 -2.02 0.00 0.00 58.31 54.52 2jer n LYS 256 Cb 0.10 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.79 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 -1.14 3.60 0.02 1.97 -1.94 -0.84 -5.04 119.30 115.92 2jer s MET 257 Ca 0.17 0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.22 2jer s MET 257 Cb 0.12 -3.16 -0.03 0.00 2.01 0.00 0.00 34.83 33.77 2jer s MET 257 CO 0.18 0.72 -0.14 0.95 -0.01 0.00 0.00 175.02 176.71 2jer s THR 258 N -1.13 3.09 0.54 2.05 -4.23 -1.26 -1.83 115.64 112.87 2jer s THR 258 Ca 0.21 -0.99 -0.09 0.00 -1.18 0.00 0.00 61.69 59.64 2jer s THR 258 Cb -0.13 -2.30 0.13 0.00 1.34 0.00 0.00 72.50 71.53 2jer s THR 258 CO 0.10 0.39 0.64 -0.90 -0.54 0.00 0.00 174.62 174.31 2jer n ASP 259 N 1.65 -0.46 0.24 3.99 5.68 -0.20 -4.86 116.55 122.59 2jer n ASP 259 Ca -0.16 -1.12 0.09 0.00 -0.50 0.00 0.00 54.79 53.10 2jer n ASP 259 Cb 0.52 -0.52 0.58 0.00 -1.14 0.00 0.00 41.12 40.57 2jer n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jer h ALA 260 N -2.05 1.38 -0.21 2.12 0.00 -1.83 -0.88 119.26 117.79 2jer h ALA 260 Ca -0.22 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2jer h ALA 260 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jer h ALA 260 CO 0.15 0.24 0.00 1.63 0.00 0.00 0.00 179.25 181.27 2jer n LYS 261 N -3.87 1.69 -0.90 0.00 5.02 -1.26 -4.92 118.16 113.92 2jer n LYS 261 Ca -0.02 -1.05 0.00 0.00 -2.02 0.00 0.00 58.31 55.22 2jer n LYS 261 Cb 0.28 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 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 1.07 0.63 3.71 0.72 0.00 -0.34 -5.02 105.19 105.97 2jer n GLY 262 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.10 4.50 0.10 1.61 0.52 -1.26 -4.76 118.95 119.55 2jer s ARG 263 Ca 0.00 1.64 -0.31 0.00 -0.52 0.00 0.00 55.73 56.54 2jer s ARG 263 Cb 0.00 -3.38 -0.09 0.00 0.52 0.00 0.00 34.95 31.99 2jer s ARG 263 CO 0.00 -0.14 1.77 -1.14 0.02 0.00 0.00 175.30 175.81 2jer s GLN 264 N 0.89 4.16 0.23 3.54 2.00 -1.26 -1.04 119.66 128.18 2jer s GLN 264 Ca 0.55 2.50 -0.30 0.00 -2.00 0.00 0.00 55.36 56.11 2jer s GLN 264 Cb -0.26 -3.62 -0.10 0.00 0.80 0.00 0.00 33.01 29.82 2jer s GLN 264 CO 0.29 -0.81 1.43 -0.51 -0.50 0.00 0.00 175.29 175.19 2jer s LEU 265 N 2.79 4.39 -0.25 3.68 1.43 -0.76 -4.92 118.68 125.04 2jer s LEU 265 Ca 0.79 2.61 -0.16 0.00 -1.03 0.00 0.00 54.13 56.34 2jer s LEU 265 Cb -0.44 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 2jer s LEU 265 CO 0.35 -0.68 0.42 -0.75 0.23 0.00 0.00 176.35 175.92 2jer s LYS 266 N -0.17 4.06 -0.27 1.70 2.20 -0.59 -4.88 119.74 121.80 2jer s LYS 266 Ca 0.60 0.15 -0.08 0.00 -0.36 0.00 0.00 55.97 56.28 2jer s LYS 266 Cb -0.41 -3.63 -0.02 0.00 -1.51 0.00 0.00 37.83 32.26 2jer s LYS 266 CO 0.41 -0.25 0.09 0.08 -0.36 0.00 0.00 175.35 175.33 2jer s VAL 267 N 1.98 4.40 -0.25 4.02 1.01 -1.26 -1.56 120.40 128.73 2jer s VAL 267 Ca 0.17 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.81 2jer s VAL 267 Cb -0.16 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 2jer s VAL 267 CO 0.09 0.26 0.13 -1.00 0.00 0.00 0.00 175.10 174.58 2jer s HIS 268 N 1.61 3.20 0.34 5.22 3.76 -0.11 -4.97 115.29 124.34 2jer s HIS 268 Ca 0.06 -0.02 -0.27 0.00 -0.15 0.00 0.00 55.06 54.68 2jer s HIS 268 Cb -0.16 -2.27 -0.09 0.00 1.11 0.00 0.00 32.58 31.17 2jer s HIS 268 CO 0.04 -0.13 1.10 0.15 -0.85 0.00 0.00 174.74 175.05 2jer s LYS 269 N 1.38 4.38 -0.05 1.40 1.02 -1.26 -0.84 119.74 125.76 2jer s LYS 269 Ca 0.06 1.72 0.03 0.00 0.02 0.00 0.00 55.97 57.80 2jer s LYS 269 Cb -0.15 -2.88 0.01 0.00 -0.52 0.00 0.00 37.83 34.29 2jer s LYS 269 CO 0.06 -0.00 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.19 2jer s LEU 270 N -2.03 1.72 1.07 3.17 2.96 -0.05 -4.85 118.68 120.66 2jer s LEU 270 Ca 0.51 -0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 54.01 2jer s LEU 270 Cb -0.28 -0.80 0.23 0.00 0.50 0.00 0.00 46.19 45.83 2jer s LEU 270 CO 0.36 0.06 1.07 0.00 -1.32 0.00 0.00 176.35 176.52 2jer s PRO 273 N -3.45 3.45 0.10 0.00 0.02 -1.26 -4.86 135.00 129.00 2jer s PRO 273 Ca 0.29 2.36 -0.14 0.00 0.02 0.00 0.00 61.00 63.53 2jer s PRO 273 Cb -0.05 -2.49 -0.10 0.00 0.02 0.00 0.00 34.50 31.88 2jer s PRO 273 CO 0.14 -0.99 1.39 0.28 -0.33 0.00 0.00 177.00 177.49 2jer h VAL 274 N 1.95 1.30 -3.11 3.83 2.07 -1.97 -3.45 116.25 116.87 2jer h VAL 274 Ca -0.51 -1.60 -0.67 0.00 0.82 0.00 0.00 66.70 64.75 2jer h VAL 274 Cb 1.28 1.67 -0.11 0.00 -1.52 0.00 0.00 31.29 32.61 2jer h VAL 274 CO 0.59 0.51 -0.58 -0.75 0.02 0.00 0.00 177.57 177.37 2jer s LYS 275 N -4.19 3.09 0.35 1.57 2.20 -1.26 -5.08 119.74 116.42 2jer s LYS 275 Ca -0.12 -0.39 -0.28 0.00 -0.36 0.00 0.00 55.97 54.82 2jer s LYS 275 Cb 0.09 -2.89 -0.10 0.00 -1.51 0.00 0.00 37.83 33.42 2jer s LYS 275 CO 0.85 0.69 1.37 -0.80 -0.36 0.00 0.00 175.35 177.10 2jer s ASN 276 N -1.25 6.58 -0.09 1.43 0.01 -1.26 -5.02 114.94 115.34 2jer s ASN 276 Ca 0.17 2.81 -0.17 0.00 -0.71 0.00 0.00 52.86 54.97 2jer s ASN 276 Cb -0.12 -2.65 -0.05 0.00 0.41 0.00 0.00 41.25 38.84 2jer s ASN 276 CO 0.07 -0.68 0.44 -0.69 -1.51 0.00 0.00 177.10 174.74 2jer s VAL 277 N -1.14 5.15 0.07 1.60 1.01 -1.26 -5.02 120.40 120.81 2jer s VAL 277 Ca 0.51 0.89 0.07 0.00 0.00 0.00 0.00 61.98 63.45 2jer s VAL 277 Cb -0.42 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 2jer s VAL 277 CO 0.56 0.40 -0.20 0.42 0.00 0.00 0.00 175.10 176.28 2jer s THR 278 N 0.18 1.59 0.23 3.92 -4.23 -1.26 -0.07 115.64 115.99 2jer s THR 278 Ca 0.24 -1.35 -0.31 0.00 -1.18 0.00 0.00 61.69 59.10 2jer s THR 278 Cb -0.15 -1.42 -0.10 0.00 1.34 0.00 0.00 72.50 72.16 2jer s THR 278 CO 0.10 0.03 1.54 -0.63 -0.54 0.00 0.00 174.62 175.12 2jer s ILE 279 N -1.01 2.48 0.33 2.99 -1.09 -0.62 -4.91 121.20 119.37 2jer s ILE 279 Ca 0.06 0.38 -0.04 0.00 -2.23 0.00 0.00 60.65 58.81 2jer s ILE 279 Cb -0.09 -3.24 -0.05 0.00 -1.58 0.00 0.00 42.46 37.50 2jer s ILE 279 CO 0.03 0.05 0.59 -0.54 -1.23 0.00 0.00 174.94 173.83 2jer s LYS 280 N 0.25 3.59 4.24 2.79 1.02 -1.26 -0.87 119.74 129.49 2jer s LYS 280 Ca 0.65 -0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.60 2jer s LYS 280 Cb -0.44 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 2jer s LYS 280 CO 0.39 0.14 0.00 0.41 -0.92 0.00 0.00 175.35 175.37 2jer n GLY 281 N -1.32 1.23 0.17 -3.33 0.00 -1.26 -2.70 105.19 97.98 2jer n GLY 281 Ca -0.02 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.27 2jer n GLY 281 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jer h SER 282 N 0.00 0.00 -3.03 1.61 4.64 -2.02 -3.47 113.55 111.29 2jer h SER 282 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2jer h SER 282 Cb 0.00 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.15 2jer h SER 282 CO 0.00 0.00 0.87 -0.36 -0.87 0.00 0.00 176.83 176.47 2jer s PHE 283 N -3.58 2.98 -0.80 4.77 2.99 -1.10 -4.93 117.98 118.30 2jer s PHE 283 Ca -0.03 0.71 -0.11 0.00 0.00 0.00 0.00 56.93 57.51 2jer s PHE 283 Cb 0.07 -3.95 0.21 0.00 0.00 0.00 0.00 43.02 39.34 2jer s PHE 283 CO 0.21 -3.38 0.72 0.15 -0.00 0.00 0.00 175.22 172.92 2jer s LYS 284 N 0.49 3.43 -0.04 0.44 -0.14 -1.26 -5.00 119.74 117.66 2jer s LYS 284 Ca 0.67 -2.53 0.03 0.00 -1.36 0.00 0.00 55.97 52.77 2jer s LYS 284 Cb -0.45 -4.29 0.01 0.00 -1.68 0.00 0.00 37.83 31.42 2jer s LYS 284 CO 0.37 -1.27 -0.12 0.42 -0.76 0.00 0.00 175.35 174.00 2jer s ILE 285 N 0.01 1.06 0.42 2.17 1.01 -1.26 -1.40 121.20 123.20 2jer s ILE 285 Ca 0.19 -0.48 -0.25 0.00 0.00 0.00 0.00 60.65 60.11 2jer s ILE 285 Cb -0.12 -0.94 -0.08 0.00 0.01 0.00 0.00 42.46 41.33 2jer s ILE 285 CO -0.08 0.32 1.18 -1.81 0.00 0.00 0.00 174.94 174.55 2jer s ASP 286 N 0.35 6.41 -0.19 3.58 1.11 0.39 -4.96 116.67 123.36 2jer s ASP 286 Ca -0.08 2.36 -0.12 0.00 0.18 0.00 0.00 52.55 54.89 2jer s ASP 286 Cb -0.12 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.21 2jer s ASP 286 CO 0.02 -0.75 0.21 0.12 1.18 0.00 0.00 175.17 175.95 2jer s PHE 287 N -1.44 3.42 -0.05 4.23 5.36 -1.26 -4.30 117.98 123.94 2jer s PHE 287 Ca 0.59 0.44 -0.01 0.00 -0.96 0.00 0.00 56.93 56.99 2jer s PHE 287 Cb -0.31 -2.25 0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2jer s PHE 287 CO 0.38 0.24 0.00 0.08 -1.46 0.00 0.00 175.22 174.47 2jer s VAL 288 N 0.48 0.26 0.14 3.12 1.01 -1.26 -5.09 120.40 119.06 2jer s VAL 288 Ca 0.12 0.12 -0.32 0.00 0.00 0.00 0.00 61.98 61.90 2jer s VAL 288 Cb -0.12 -0.39 -0.12 0.00 0.00 0.00 0.00 36.38 35.75 2jer s VAL 288 CO 0.01 0.20 1.73 1.21 0.00 0.00 0.00 175.10 178.26 2jer n GLU 289 N 4.67 2.55 0.00 2.72 4.07 -1.26 -0.83 120.64 132.56 2jer n GLU 289 Ca -0.16 0.92 0.00 0.00 -0.06 0.00 0.00 57.16 57.87 2jer n GLU 289 Cb 0.50 -2.76 0.00 0.00 -0.06 0.00 0.00 31.44 29.12 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 3.93 3.42 3.76 8.31 0.00 -1.26 -4.98 105.19 118.38 2jer n GLY 290 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.96 5.30 -0.34 2.61 2.01 -0.01 -3.62 115.64 118.62 2jer s THR 291 Ca 0.00 0.53 -0.40 0.00 0.31 0.00 0.00 61.69 62.13 2jer s THR 291 Cb 0.00 -3.61 -0.15 0.00 0.01 0.00 0.00 72.50 68.75 2jer s THR 291 CO 0.00 0.45 1.88 0.80 -0.69 0.00 0.00 174.62 177.05 2jer n MET 292 N 3.13 0.92 -2.02 4.92 1.56 -0.03 -4.66 117.12 120.94 2jer n MET 292 Ca -0.13 0.31 -0.37 0.00 -0.27 0.00 0.00 57.70 57.24 2jer n MET 292 Cb 0.52 -2.07 0.02 0.00 2.15 0.00 0.00 33.22 33.85 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 4.38 3.33 -0.45 2.12 0.02 -1.26 -4.90 135.00 138.24 2jer s PRO 293 Ca 1.04 1.96 -0.01 0.00 0.02 0.00 0.00 61.00 64.01 2jer s PRO 293 Cb -1.11 -2.23 0.12 0.00 0.02 0.00 0.00 34.50 31.30 2jer s PRO 293 CO 0.64 -0.96 0.23 1.03 -0.33 0.00 0.00 177.00 177.61 2jer s ARG 294 N -2.93 2.01 0.17 5.54 1.81 -1.26 -5.10 118.95 119.19 2jer s ARG 294 Ca 0.70 -2.03 0.07 0.00 -1.72 0.00 0.00 55.73 52.74 2jer s ARG 294 Cb -0.34 -3.53 -0.04 0.00 -0.45 0.00 0.00 34.95 30.60 2jer s ARG 294 CO 0.39 -1.07 0.02 -1.21 -0.68 0.00 0.00 175.30 172.75 2jer s GLU 295 N 0.75 2.47 0.12 3.54 2.02 -1.26 -4.99 118.70 121.35 2jer s GLU 295 Ca 0.11 -1.06 -0.35 0.00 0.02 0.00 0.00 54.97 53.69 2jer s GLU 295 Cb -0.22 -2.40 -0.15 0.00 0.10 0.00 0.00 34.13 31.46 2jer s GLU 295 CO -0.04 0.46 1.50 -3.47 0.02 0.00 0.00 175.26 173.73 2jer n ASP 296 N -0.09 2.54 0.00 -0.19 2.03 -1.26 -1.76 116.55 117.81 2jer n ASP 296 Ca -0.10 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.31 2jer n ASP 296 Cb 0.55 -1.33 0.00 0.00 -0.72 0.00 0.00 41.12 39.62 2jer n ASP 296 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jer n GLY 297 N 3.12 1.37 3.68 0.27 0.00 -0.05 -4.97 105.19 108.60 2jer n GLY 297 Ca 0.18 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.74 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 3.30 -4.67 1.61 8.00 -0.72 -4.77 116.55 119.30 2jer n ASP 298 Ca 0.00 1.06 -0.43 0.00 0.71 0.00 0.00 54.79 56.13 2jer n ASP 298 Cb 0.00 -1.44 -0.02 0.00 -0.02 0.00 0.00 41.12 39.64 2jer n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jer s ILE 299 N 1.57 4.62 0.18 0.53 1.01 -1.26 -1.58 121.20 126.26 2jer s ILE 299 Ca 0.81 1.94 -0.17 0.00 0.00 0.00 0.00 60.65 63.23 2jer s ILE 299 Cb -0.65 -4.25 -0.08 0.00 0.01 0.00 0.00 42.46 37.49 2jer s ILE 299 CO 0.39 -0.12 0.63 0.00 0.00 0.00 0.00 174.94 175.84 2jer s ILE 301 N -1.47 4.23 -0.63 0.00 1.01 -1.26 -4.41 121.20 118.66 2jer s ILE 301 Ca 0.40 -1.73 -0.18 0.00 0.00 0.00 0.00 60.65 59.13 2jer s ILE 301 Cb -0.16 -5.11 0.12 0.00 0.01 0.00 0.00 42.46 37.32 2jer s ILE 301 CO 0.20 -1.93 0.72 0.00 0.00 0.00 0.00 174.94 173.93 2jer s ALA 302 N 3.96 3.50 -0.08 9.38 0.00 -1.26 -4.77 121.76 132.49 2jer s ALA 302 Ca 0.50 -2.40 0.03 0.00 0.00 0.00 0.00 51.96 50.09 2jer s ALA 302 Cb 0.02 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.59 2jer s ALA 302 CO 0.02 -2.35 -0.19 0.45 0.00 0.00 0.00 175.76 173.68 2jer s SER 303 N 3.50 3.55 0.18 0.00 0.15 -1.26 -4.43 113.70 115.39 2jer s SER 303 Ca 0.13 -0.40 0.22 0.00 0.70 0.00 0.00 55.95 56.60 2jer s SER 303 Cb -0.22 -1.14 0.89 0.00 -1.71 0.00 0.00 66.02 63.84 2jer s SER 303 CO 0.03 0.23 1.67 -1.22 1.20 0.00 0.00 173.24 175.16 2jer n TYR 304 N 3.05 0.60 0.29 3.44 4.02 -1.26 -3.10 117.16 124.21 2jer n TYR 304 Ca -0.18 0.22 0.16 0.00 -0.01 0.00 0.00 57.90 58.10 2jer n TYR 304 Cb 0.52 -0.86 0.64 0.00 -0.02 0.00 0.00 39.34 39.62 2jer n TYR 304 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 176.86 177.83 2jer h MET 305 N 0.00 0.00 -2.39 -0.72 4.05 -1.85 -3.34 114.93 110.68 2jer h MET 305 Ca 0.00 0.00 -0.39 0.00 -0.28 0.00 0.00 59.70 59.03 2jer h MET 305 Cb 0.39 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.15 2jer h MET 305 CO 0.00 0.00 1.29 -1.71 0.23 0.00 0.00 176.91 176.72 2jer n ASN 306 N -2.98 6.66 -4.92 1.39 2.85 -1.18 -4.80 115.26 112.29 2jer n ASN 306 Ca 0.01 -2.54 -0.21 0.00 -0.11 0.00 0.00 54.58 51.73 2jer n ASN 306 Cb 0.31 -1.47 -0.03 0.00 1.24 0.00 0.00 39.78 39.83 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 1.35 3.24 -0.19 1.20 -0.12 -1.25 -1.49 117.98 120.72 2jer s PHE 307 Ca 0.68 -0.11 -0.05 0.00 -0.05 0.00 0.00 56.93 57.40 2jer s PHE 307 Cb 0.27 -1.61 -0.03 0.00 -0.63 0.00 0.00 43.02 41.03 2jer s PHE 307 CO -0.03 0.37 -0.01 -1.17 -0.05 0.00 0.00 175.22 174.33 2jer s LEU 308 N -3.97 3.26 -0.13 -1.99 0.20 -0.65 -4.42 118.68 110.98 2jer s LEU 308 Ca 0.36 -0.18 -0.22 0.00 0.69 0.00 0.00 54.13 54.78 2jer s LEU 308 Cb -0.08 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.83 2jer s LEU 308 CO 0.28 0.09 0.67 -0.63 -0.29 0.00 0.00 176.35 176.47 2jer s ILE 309 N 0.84 5.03 -0.30 6.68 1.01 -1.26 -1.03 121.20 132.16 2jer s ILE 309 Ca 0.00 1.33 -0.01 0.00 0.00 0.00 0.00 60.65 61.98 2jer s ILE 309 Cb -0.14 -4.00 0.13 0.00 0.01 0.00 0.00 42.46 38.46 2jer s ILE 309 CO 0.02 0.18 0.27 0.28 0.00 0.00 0.00 174.94 175.68 2jer s THR 310 N 1.36 -0.30 0.00 2.92 -1.32 0.05 -4.73 115.64 113.63 2jer s THR 310 Ca 0.33 -0.66 0.00 0.00 -1.21 0.00 0.00 61.69 60.15 2jer s THR 310 Cb -0.17 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 2jer s THR 310 CO 0.14 -0.56 0.00 0.59 -2.21 0.00 0.00 174.62 172.58 2jer n ASN 311 N 5.12 0.00 -0.10 8.08 5.03 -1.26 -1.50 115.26 130.63 2jer n ASN 311 Ca -0.01 0.00 0.13 0.00 0.87 0.00 0.00 54.58 55.57 2jer n ASN 311 Cb 0.45 0.00 0.70 0.00 -1.02 0.00 0.00 39.78 39.91 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 5.52 0.30 -4.40 6.41 8.00 -1.26 -4.86 116.55 126.26 2jer n ASP 312 Ca 0.00 -1.28 -0.23 0.00 0.71 0.00 0.00 54.79 53.99 2jer n ASP 312 Cb 0.00 -0.01 -0.11 0.00 -0.02 0.00 0.00 41.12 40.98 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 -1.80 1.65 -0.07 0.44 0.00 -0.56 -0.59 107.32 106.38 2jer s GLY 313 Ca 0.38 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.42 2jer s GLY 313 CO 0.30 -1.75 -0.07 0.14 0.00 0.00 0.00 173.10 171.72 2jer s VAL 314 N -2.23 0.81 -0.34 1.40 1.01 -0.46 -0.77 120.40 119.82 2jer s VAL 314 Ca 0.23 -0.23 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 2jer s VAL 314 Cb -0.05 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.52 2jer s VAL 314 CO 0.10 0.30 0.19 -0.63 0.00 0.00 0.00 175.10 175.06 2jer s ILE 315 N 1.21 4.68 -0.09 2.22 -1.09 -0.20 -0.54 121.20 127.40 2jer s ILE 315 Ca -0.05 -0.59 0.02 0.00 -2.23 0.00 0.00 60.65 57.80 2jer s ILE 315 Cb -0.14 -3.49 -0.02 0.00 -1.58 0.00 0.00 42.46 37.23 2jer s ILE 315 CO -0.02 -0.08 -0.13 -0.69 -1.23 0.00 0.00 174.94 172.80 2jer s VAL 316 N 1.60 3.14 0.52 2.92 1.01 0.09 -1.64 120.40 128.04 2jer s VAL 316 Ca 0.04 -0.66 -0.23 0.00 0.00 0.00 0.00 61.98 61.13 2jer s VAL 316 Cb -0.18 -2.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 2jer s VAL 316 CO 0.07 0.56 1.32 -2.65 0.00 0.00 0.00 175.10 174.40 2jer n PRO 317 N 2.86 1.73 -4.16 2.72 -0.02 -1.26 -1.84 135.00 135.03 2jer n PRO 317 Ca -0.18 0.63 -0.21 0.00 -2.02 0.00 0.00 63.50 61.72 2jer n PRO 317 Cb 0.52 -2.51 -0.17 0.00 -0.02 0.00 0.00 33.50 31.33 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 -2.70 0.97 0.00 -0.52 -1.52 -0.37 -4.75 119.66 110.77 2jer s GLN 318 Ca 0.69 -0.13 0.08 0.00 -1.95 0.00 0.00 55.36 54.04 2jer s GLN 318 Cb -0.44 -0.99 0.08 0.00 -0.22 0.00 0.00 33.01 31.44 2jer s GLN 318 CO 0.52 -0.11 0.79 0.66 -0.25 0.00 0.00 175.29 176.90 2jer n TYR 319 N 4.21 0.03 -1.06 0.91 4.02 -1.26 -1.25 117.16 122.76 2jer n TYR 319 Ca -0.21 -0.05 -0.01 0.00 -0.01 0.00 0.00 57.90 57.62 2jer n TYR 319 Cb 0.51 -0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.82 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 0.41 0.43 3.92 2.72 0.00 -1.26 -4.79 105.19 106.63 2jer n GLY 320 Ca 0.05 -1.06 -0.27 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 -2.99 6.37 0.56 1.61 2.15 -1.26 -4.99 116.67 118.12 2jer s ASP 321 Ca 0.00 0.57 0.26 0.00 0.43 0.00 0.00 52.55 53.81 2jer s ASP 321 Cb 0.00 -2.08 1.51 0.00 -0.30 0.00 0.00 42.92 42.05 2jer s ASP 321 CO 0.00 -0.22 2.08 1.05 -0.17 0.00 0.00 175.17 177.90 2jer h GLU 322 N 1.33 0.00 -0.19 4.34 4.11 -1.98 -1.62 114.58 120.57 2jer h GLU 322 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 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 0.64 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.81 2jer n ASN 323 N -4.09 1.27 -0.18 3.06 5.03 -1.26 -4.34 115.26 114.76 2jer n ASN 323 Ca 0.03 -1.83 -0.04 0.00 0.87 0.00 0.00 54.58 53.61 2jer n ASN 323 Cb 0.37 -0.13 0.05 0.00 -1.02 0.00 0.00 39.78 39.06 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 1.52 0.41 -0.23 6.41 5.19 -1.68 -0.93 116.42 127.10 2jer h ASP 324 Ca 0.00 0.02 -0.09 0.00 -0.62 0.00 0.00 57.03 56.35 2jer h ASP 324 Cb 0.34 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 39.79 2jer h ASP 324 CO 0.00 0.29 -0.19 0.03 -3.12 0.00 0.00 179.24 176.25 2jer h ARG 325 N 0.54 0.54 -0.84 3.56 -0.00 -1.83 -2.83 114.38 113.52 2jer h ARG 325 Ca 0.23 -0.27 0.07 0.00 -0.50 0.00 0.00 59.98 59.51 2jer h ARG 325 Cb 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 29.97 30.03 2jer h ARG 325 CO -0.15 0.85 0.51 1.25 0.00 0.00 0.00 179.97 182.43 2jer h LEU 326 N 0.24 0.80 -0.51 3.04 5.85 -1.76 -1.11 115.31 121.85 2jer h LEU 326 Ca 0.04 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.83 2jer h LEU 326 Cb 0.73 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.57 2jer h LEU 326 CO 0.05 0.50 0.25 0.00 -0.34 0.00 0.00 178.44 178.90 2jer h ALA 327 N 1.41 0.65 -0.61 1.25 0.00 -1.02 -0.08 119.26 120.86 2jer h ALA 327 Ca 0.37 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.22 2jer h ALA 327 Cb 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2jer h ALA 327 CO -0.19 -0.10 0.05 -0.07 0.00 0.00 0.00 179.25 178.94 2jer h LEU 328 N 0.49 1.01 -0.15 0.00 3.38 -1.11 -1.29 115.31 117.64 2jer h LEU 328 Ca 0.23 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2jer h LEU 328 Cb 0.15 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2jer h LEU 328 CO -0.17 1.03 0.08 -0.33 0.09 0.00 0.00 178.44 179.15 2jer h GLU 329 N 0.96 0.20 -0.46 1.13 5.08 -0.73 -0.87 114.58 119.89 2jer h GLU 329 Ca 0.18 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2jer h GLU 329 Cb 0.49 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2jer h GLU 329 CO 0.02 0.20 0.22 1.96 -1.00 0.00 0.00 179.01 180.41 2jer h GLN 330 N 0.15 0.67 -0.68 2.33 4.20 -0.86 -2.33 115.11 118.59 2jer h GLN 330 Ca 0.05 -0.10 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 2jer h GLN 330 Cb 0.05 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2jer h GLN 330 CO -0.01 0.57 0.18 0.28 -0.67 0.00 0.00 178.83 179.18 2jer h VAL 331 N 0.61 1.25 -0.81 -0.54 2.07 -1.20 -2.48 116.25 115.15 2jer h VAL 331 Ca 0.16 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 66.83 2jer h VAL 331 Cb 0.12 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.36 2jer h VAL 331 CO -0.02 0.35 0.48 -0.61 0.02 0.00 0.00 177.57 177.79 2jer h GLN 332 N 1.02 0.83 0.00 1.57 5.75 -0.93 -1.42 115.11 121.92 2jer h GLN 332 Ca 0.22 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.58 2jer h GLN 332 Cb 0.33 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2jer h GLN 332 CO -0.00 0.55 -0.43 1.79 -2.65 0.00 0.00 178.83 178.08 2jer h THR 333 N 0.85 1.16 -0.20 2.39 1.35 -1.09 -2.10 112.91 115.27 2jer h THR 333 Ca 0.37 -1.57 -0.11 0.00 -0.55 0.00 0.00 66.41 64.55 2jer h THR 333 Cb 0.24 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 2jer h THR 333 CO -0.20 0.43 -0.34 0.24 -0.25 0.00 0.00 175.52 175.39 2jer h MET 334 N 0.00 0.43 -2.19 4.72 2.86 -0.92 -3.35 114.93 116.48 2jer h MET 334 Ca -0.00 -0.19 -0.59 0.00 -2.06 0.00 0.00 59.70 56.86 2jer h MET 334 Cb 0.85 -0.01 -0.41 0.00 0.06 0.00 0.00 31.60 32.08 2jer h MET 334 CO 0.06 0.72 -0.77 1.19 1.06 0.00 0.00 176.91 179.16 2jer n PHE 335 N -4.07 2.15 0.29 -0.22 3.01 -0.61 -4.97 117.46 113.04 2jer n PHE 335 Ca -0.01 -3.94 0.14 0.00 1.01 0.00 0.00 57.45 54.65 2jer n PHE 335 Cb 0.46 -0.47 0.87 0.00 -0.01 0.00 0.00 39.48 40.34 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 4.24 0.00 -0.40 -1.08 0.13 -1.55 -1.89 132.00 131.46 2jer h PRO 336 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2jer h PRO 336 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2jer h PRO 336 CO 0.69 0.03 0.00 -0.25 -0.23 0.00 0.00 178.00 178.24 2jer n ASP 337 N -3.81 3.51 -4.91 1.44 10.43 -1.26 -4.95 116.55 116.99 2jer n ASP 337 Ca -0.03 -2.00 -0.21 0.00 2.57 0.00 0.00 54.79 55.13 2jer n ASP 337 Cb 0.11 -0.26 -0.03 0.00 1.84 0.00 0.00 41.12 42.79 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 -1.48 3.05 -0.25 -1.24 1.02 -0.71 -5.01 119.74 115.11 2jer s LYS 338 Ca 0.39 -1.03 -0.17 0.00 0.02 0.00 0.00 55.97 55.18 2jer s LYS 338 Cb 0.23 -2.69 -0.03 0.00 -0.52 0.00 0.00 37.83 34.82 2jer s LYS 338 CO 0.32 0.24 0.46 0.21 -0.92 0.00 0.00 175.35 175.66 2jer s LYS 339 N -4.00 4.07 -0.23 1.68 2.20 0.24 -4.96 119.74 118.74 2jer s LYS 339 Ca 0.38 0.22 -0.14 0.00 -0.36 0.00 0.00 55.97 56.07 2jer s LYS 339 Cb -0.08 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.56 2jer s LYS 339 CO 0.28 -0.29 0.34 0.42 -0.36 0.00 0.00 175.35 175.74 2jer s ILE 340 N 2.10 5.22 -0.20 5.43 -1.09 -1.26 -1.35 121.20 130.05 2jer s ILE 340 Ca 0.19 0.55 0.01 0.00 -2.23 0.00 0.00 60.65 59.17 2jer s ILE 340 Cb -0.16 -3.67 0.04 0.00 -1.58 0.00 0.00 42.46 37.09 2jer s ILE 340 CO 0.09 0.24 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.22 2jer s VAL 341 N 1.52 1.87 0.22 2.92 1.01 0.30 -4.96 120.40 123.28 2jer s VAL 341 Ca 0.15 -1.10 -0.25 0.00 0.00 0.00 0.00 61.98 60.78 2jer s VAL 341 Cb -0.15 -1.86 -0.09 0.00 0.00 0.00 0.00 36.38 34.28 2jer s VAL 341 CO 0.08 0.25 0.83 -0.83 0.00 0.00 0.00 175.10 175.43 2jer s GLY 342 N 1.31 2.86 -0.03 4.51 0.00 -1.26 -0.73 107.32 113.98 2jer s GLY 342 Ca -0.01 0.39 0.03 0.00 0.00 0.00 0.00 44.72 45.13 2jer s GLY 342 CO -0.09 0.86 -0.10 0.14 0.00 0.00 0.00 173.10 173.91 2jer s VAL 343 N -1.33 0.87 -0.40 1.40 1.01 -0.77 -4.91 120.40 116.26 2jer s VAL 343 Ca 0.41 -0.41 -0.28 0.00 0.00 0.00 0.00 61.98 61.70 2jer s VAL 343 Cb -0.21 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.39 2jer s VAL 343 CO 0.25 0.27 1.64 0.20 0.00 0.00 0.00 175.10 177.46 2jer s ASN 344 N 0.17 6.01 -0.09 3.32 0.01 -1.26 -1.24 114.94 121.86 2jer s ASN 344 Ca -0.03 0.97 0.13 0.00 -0.71 0.00 0.00 52.86 53.21 2jer s ASN 344 Cb -0.09 -2.53 0.24 0.00 0.41 0.00 0.00 41.25 39.28 2jer s ASN 344 CO 0.01 -1.68 1.12 0.35 -1.51 0.00 0.00 177.10 175.39 2jer n THR 345 N 7.24 1.20 -0.08 1.60 -2.24 -0.38 -4.75 114.28 116.87 2jer n THR 345 Ca 0.20 -1.64 0.08 0.00 -2.27 0.00 0.00 64.05 60.41 2jer n THR 345 Cb 0.48 0.10 0.43 0.00 -2.10 0.00 0.00 70.33 69.24 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 2.90 1.01 0.00 2.28 3.04 -1.87 -0.98 116.25 122.63 2jer h VAL 346 Ca -0.02 -0.19 -0.04 0.00 -1.01 0.00 0.00 66.70 65.44 2jer h VAL 346 Cb 1.21 0.40 -0.01 0.00 -2.01 0.00 0.00 31.29 30.89 2jer h VAL 346 CO 0.01 0.10 -0.19 -0.33 -1.01 0.00 0.00 177.57 176.15 2jer h GLU 347 N 0.55 0.00 -0.04 4.17 4.39 -1.93 -1.91 114.58 119.81 2jer h GLU 347 Ca 0.24 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.70 2jer h GLU 347 Cb 0.24 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.90 2jer h GLU 347 CO -0.07 0.19 -0.93 0.28 -1.16 0.00 0.00 179.01 177.33 2jer h VAL 348 N 0.00 1.32 0.00 3.13 2.07 -1.50 -3.31 116.25 117.96 2jer h VAL 348 Ca -0.00 -2.22 -0.06 0.00 0.82 0.00 0.00 66.70 65.24 2jer h VAL 348 Cb 0.37 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.40 2jer h VAL 348 CO 0.03 0.68 -0.28 1.62 0.02 0.00 0.00 177.57 179.64 2jer h VAL 349 N 0.38 1.11 -0.33 2.57 3.04 -0.78 -1.42 116.25 120.82 2jer h VAL 349 Ca -0.09 -0.99 0.09 0.00 -1.01 0.00 0.00 66.70 64.71 2jer h VAL 349 Cb 1.57 1.55 -0.01 0.00 -2.01 0.00 0.00 31.29 32.38 2jer h VAL 349 CO 0.18 0.27 0.29 1.88 -1.01 0.00 0.00 177.57 179.18 2jer h TYR 350 N 0.00 0.00 -0.22 3.17 0.99 -1.56 -1.99 116.97 117.36 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 0.52 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.25 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 -1.51 1.11 0.00 3.88 0.00 -0.54 -4.95 105.19 103.18 2jer n GLY 351 Ca 0.05 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 1.37 1.00 0.00 -0.02 0.00 -0.75 -5.06 105.19 101.73 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 -0.56 1.98 0.00 -0.02 0.00 -1.25 -4.86 105.19 100.48 2jer n GLY 353 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.09 0.00 -0.29 1.61 5.15 -1.26 -2.84 115.26 117.54 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 0.97 0.00 -1.44 2.04 -1.91 -1.45 117.51 115.72 2jer h ILE 355 Ca 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.57 2jer h ILE 355 Cb 0.00 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.12 2jer h ILE 355 CO 0.00 0.16 0.00 1.57 0.00 0.00 0.00 178.15 179.88 2jer n HIS 356 N -4.69 0.00 0.00 1.37 -0.00 -0.56 -3.11 115.22 108.22 2jer n HIS 356 Ca 0.13 -0.14 0.00 0.00 0.46 0.00 0.00 57.72 58.17 2jer n HIS 356 Cb 0.22 -0.13 0.00 0.00 -0.12 0.00 0.00 29.99 29.96 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 0.77 0.00 -4.26 3.57 -5.35 -0.55 -4.55 119.36 109.00 2jer n ILE 358 Ca 0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 2jer n ILE 358 Cb 0.15 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 37.95 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 1.30 -0.12 7.28 -4.23 -1.18 -4.25 115.64 114.43 2jer s THR 359 Ca 0.00 -1.97 -0.04 0.00 -1.18 0.00 0.00 61.69 58.50 2jer s THR 359 Cb 0.00 -1.76 0.06 0.00 1.34 0.00 0.00 72.50 72.14 2jer s THR 359 CO 0.00 -0.62 0.21 -1.58 -0.54 0.00 0.00 174.62 172.10 2jer s GLN 360 N -3.37 0.10 0.51 3.99 2.00 -0.80 -2.61 119.66 119.49 2jer s GLN 360 Ca 0.15 0.59 -0.19 0.00 -2.00 0.00 0.00 55.36 53.91 2jer s GLN 360 Cb -0.00 -0.31 -0.07 0.00 0.80 0.00 0.00 33.01 33.42 2jer s GLN 360 CO 0.02 -0.35 1.03 1.14 -0.50 0.00 0.00 175.29 176.63 2jer s GLN 361 N 2.35 3.73 -0.22 1.67 0.00 -1.26 -0.91 119.66 125.03 2jer s GLN 361 Ca 0.03 1.23 0.02 0.00 -0.00 0.00 0.00 55.36 56.64 2jer s GLN 361 Cb -0.13 -2.09 0.04 0.00 0.00 0.00 0.00 33.01 30.83 2jer s GLN 361 CO -0.08 -0.47 -0.15 -2.00 0.00 0.00 0.00 175.29 172.59 2jer s GLU 362 N -3.59 2.57 0.57 9.60 2.12 0.59 -4.68 118.70 125.89 2jer s GLU 362 Ca 0.64 -1.10 -0.17 0.00 0.36 0.00 0.00 54.97 54.70 2jer s GLU 362 Cb -0.14 -2.74 -0.05 0.00 0.26 0.00 0.00 34.13 31.46 2jer s GLU 362 CO 0.26 -0.40 1.07 -1.25 -0.54 0.00 0.00 175.26 174.39 2jer s PRO 363 N 1.19 3.37 0.45 4.30 0.04 -1.26 0.40 135.00 143.49 2jer s PRO 363 Ca -0.03 1.33 -0.24 0.00 0.04 0.00 0.00 61.00 62.11 2jer s PRO 363 Cb -0.17 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.27 2jer s PRO 363 CO -0.09 -0.78 1.26 0.15 0.04 0.00 0.00 177.00 177.58 2jer s LYS 364 N -3.74 3.74 0.19 4.56 1.02 -0.37 -4.25 119.74 120.90 2jer s LYS 364 Ca 0.66 2.02 -0.30 0.00 0.02 0.00 0.00 55.97 58.38 2jer s LYS 364 Cb -0.18 -2.54 -0.08 0.00 -0.52 0.00 0.00 37.83 34.51 2jer s LYS 364 CO 0.32 -0.64 1.25 1.03 -0.92 0.00 0.00 175.35 176.39 2jer s ARG 365 N -2.52 4.44 -0.15 1.68 0.52 -1.26 -4.94 118.95 116.72 2jer s ARG 365 Ca 0.62 1.96 0.00 0.00 -0.52 0.00 0.00 55.73 57.79 2jer s ARG 365 Cb -0.35 -3.22 -0.01 0.00 0.52 0.00 0.00 34.95 31.90 2jer s ARG 365 CO 0.43 -0.16 -0.14 0.08 0.02 0.00 0.00 175.30 175.53 2jer s VAL 366 N -0.01 2.82 -2.00 3.52 1.01 -1.26 -4.91 120.40 119.57 2jer s VAL 366 Ca 0.54 -0.73 0.22 0.00 0.00 0.00 0.00 61.98 62.01 2jer s VAL 366 Cb -0.34 -2.19 0.62 0.00 0.00 0.00 0.00 36.38 34.46 2jer s VAL 366 CO 0.38 0.52 1.67 0.61 0.00 0.00 0.00 175.10 178.27