#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 2.28 0.08 0.00 2.20 -1.26 -5.00 119.74 118.03 2jer s LYS 3 Ca 0.00 -0.98 -0.24 0.00 -0.36 0.00 0.00 55.97 54.39 2jer s LYS 3 Cb 0.00 -2.38 -0.06 0.00 -1.51 0.00 0.00 37.83 33.88 2jer s LYS 3 CO 0.00 0.51 0.75 1.03 -0.36 0.00 0.00 175.35 177.28 2jer s ARG 4 N -2.32 4.49 -0.25 4.03 0.52 -1.26 -1.77 118.95 122.40 2jer s ARG 4 Ca 0.23 1.06 -0.19 0.00 -0.52 0.00 0.00 55.73 56.31 2jer s ARG 4 Cb -0.11 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 32.01 2jer s ARG 4 CO 0.16 0.40 0.55 0.42 0.02 0.00 0.00 175.30 176.84 2jer s ILE 5 N -0.46 5.05 -0.04 1.52 -1.09 0.13 -4.87 121.20 121.44 2jer s ILE 5 Ca 0.37 0.97 0.05 0.00 -2.23 0.00 0.00 60.65 59.81 2jer s ILE 5 Cb -0.21 -3.86 -0.01 0.00 -1.58 0.00 0.00 42.46 36.80 2jer s ILE 5 CO 0.23 0.08 -0.20 0.68 -1.23 0.00 0.00 174.94 174.50 2jer s VAL 6 N 2.25 1.67 0.00 2.92 -7.23 -1.26 -4.55 120.40 114.20 2jer s VAL 6 Ca 0.23 -0.86 0.00 0.00 -1.81 0.00 0.00 61.98 59.54 2jer s VAL 6 Cb -0.16 -1.41 0.00 0.00 0.56 0.00 0.00 36.38 35.37 2jer s VAL 6 CO 0.09 0.47 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 2jer n GLY 7 N 2.94 0.76 3.12 2.32 0.00 -1.26 -5.04 105.19 108.04 2jer n GLY 7 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 2jer n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jer s SER 8 N -2.61 0.39 0.18 1.61 1.04 -1.26 -5.17 113.70 107.88 2jer s SER 8 Ca 0.00 -0.91 0.07 0.00 0.48 0.00 0.00 55.95 55.59 2jer s SER 8 Cb 0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 2jer s SER 8 CO 0.00 -0.64 0.05 0.42 0.98 0.00 0.00 173.24 174.05 2jer s THR 9 N -3.91 3.95 0.24 2.02 -4.23 -1.26 -5.02 115.64 107.44 2jer s THR 9 Ca 0.07 -1.35 -0.08 0.00 -1.18 0.00 0.00 61.69 59.14 2jer s THR 9 Cb 0.07 -3.01 0.28 0.00 1.34 0.00 0.00 72.50 71.19 2jer s THR 9 CO -0.10 -0.13 1.63 -0.65 -0.54 0.00 0.00 174.62 174.82 2jer h PRO 10 N 2.54 0.06 -0.51 3.99 0.11 -1.82 -0.94 132.00 135.43 2jer h PRO 10 Ca -0.47 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.72 2jer h PRO 10 Cb 1.21 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 2jer h PRO 10 CO 0.60 0.04 0.12 -0.22 -0.21 0.00 0.00 178.00 178.33 2jer h LYS 11 N 0.07 0.25 -0.11 1.05 3.64 -1.30 -0.06 116.57 120.11 2jer h LYS 11 Ca 0.39 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.70 2jer h LYS 11 Cb 0.67 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2jer h LYS 11 CO -0.69 0.17 -0.21 1.96 -2.27 0.00 0.00 179.45 178.40 2jer h GLN 12 N 0.26 0.18 -0.02 1.90 4.20 -1.51 -2.72 115.11 117.41 2jer h GLN 12 Ca 0.25 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2jer h GLN 12 Cb 0.33 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2jer h GLN 12 CO -0.32 0.39 -0.06 -0.25 -0.67 0.00 0.00 178.83 177.93 2jer n ASP 13 N -4.22 1.57 0.00 1.46 8.00 -0.48 -4.94 116.55 117.95 2jer n ASP 13 Ca -0.01 -1.43 0.00 0.00 0.71 0.00 0.00 54.79 54.06 2jer n ASP 13 Cb 0.32 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 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 1.23 0.47 3.76 0.44 0.00 -0.36 -5.04 105.19 105.69 2jer n GLY 14 Ca 0.17 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 2jer n GLY 14 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jer s PHE 15 N -2.00 3.21 0.02 1.61 0.40 -0.18 -4.37 117.98 116.66 2jer s PHE 15 Ca 0.00 0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.46 2jer s PHE 15 Cb 0.00 -1.67 -0.01 0.00 0.51 0.00 0.00 43.02 41.85 2jer s PHE 15 CO 0.00 0.52 -0.03 -0.98 0.70 0.00 0.00 175.22 175.44 2jer s ARG 16 N -2.05 0.26 -0.24 0.44 1.70 0.58 -3.84 118.95 115.79 2jer s ARG 16 Ca 0.26 -0.45 -0.29 0.00 -0.47 0.00 0.00 55.73 54.78 2jer s ARG 16 Cb -0.12 0.01 0.00 0.00 -0.57 0.00 0.00 34.95 34.27 2jer s ARG 16 CO 0.18 -0.02 1.21 1.41 -1.08 0.00 0.00 175.30 176.99 2jer s MET 17 N -1.03 4.11 0.67 3.89 -2.45 -0.80 -0.68 119.30 123.02 2jer s MET 17 Ca -0.10 1.39 -0.12 0.00 -1.25 0.00 0.00 55.69 55.60 2jer s MET 17 Cb -0.07 -3.77 -0.00 0.00 1.25 0.00 0.00 34.83 32.23 2jer s MET 17 CO -0.01 -0.85 1.06 -1.25 1.05 0.00 0.00 175.02 175.02 2jer s PRO 18 N 3.68 3.03 0.76 4.11 0.04 -1.26 -4.31 135.00 141.05 2jer s PRO 18 Ca 0.52 1.01 -0.15 0.00 0.04 0.00 0.00 61.00 62.41 2jer s PRO 18 Cb -0.17 -2.00 0.05 0.00 0.04 0.00 0.00 34.50 32.41 2jer s PRO 18 CO 0.16 -1.02 1.17 0.41 0.04 0.00 0.00 177.00 177.76 2jer n GLY 19 N -1.78 0.02 0.25 0.56 0.00 -1.26 -4.74 105.19 98.24 2jer n GLY 19 Ca 0.08 -0.39 0.17 0.00 0.00 0.00 0.00 46.02 45.88 2jer n GLY 19 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2jer h GLU 20 N -0.47 0.00 -0.02 1.61 4.81 -1.91 -1.61 114.58 117.00 2jer h GLU 20 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jer h GLU 20 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2jer h GLU 20 CO 0.48 0.00 0.00 1.97 -0.73 0.00 0.00 179.01 180.73 2jer n PHE 21 N -2.87 0.02 -2.52 0.92 1.16 -1.26 -4.57 117.46 108.35 2jer n PHE 21 Ca 0.00 -0.01 -0.30 0.00 -1.87 0.00 0.00 57.45 55.27 2jer n PHE 21 Cb 0.24 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.10 2jer n PHE 21 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 2jer s GLU 22 N -1.98 3.71 0.35 3.97 2.02 -0.61 -4.89 118.70 121.27 2jer s GLU 22 Ca 0.40 0.54 -0.27 0.00 0.02 0.00 0.00 54.97 55.66 2jer s GLU 22 Cb 0.20 -2.28 -0.12 0.00 0.10 0.00 0.00 34.13 32.03 2jer s GLU 22 CO 0.33 -0.23 1.22 -2.30 0.02 0.00 0.00 175.26 174.30 2jer n PRO 23 N -1.89 1.91 -5.28 0.39 -0.02 -1.26 -4.70 135.00 124.15 2jer n PRO 23 Ca 0.03 0.67 -0.31 0.00 -2.02 0.00 0.00 63.50 61.87 2jer n PRO 23 Cb 0.54 -2.23 -0.16 0.00 -0.02 0.00 0.00 33.50 31.63 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 2.25 -0.00 -0.52 -0.21 -1.26 -1.04 119.66 117.01 2jer s GLN 24 Ca 0.57 -0.91 -0.19 0.00 0.02 0.00 0.00 55.36 54.85 2jer s GLN 24 Cb -0.58 -2.09 -0.33 0.00 1.00 0.00 0.00 33.01 31.01 2jer s GLN 24 CO 0.61 0.51 0.97 1.49 -2.12 0.00 0.00 175.29 176.75 2jer h GLU 25 N 5.64 0.44 -2.86 2.91 4.81 -0.31 -3.42 114.58 121.80 2jer h GLU 25 Ca -0.40 -0.72 0.08 0.00 -0.13 0.00 0.00 59.36 58.18 2jer h GLU 25 Cb 1.14 0.26 -0.07 0.00 0.63 0.00 0.00 28.75 30.71 2jer h GLU 25 CO 0.47 1.34 0.28 -1.59 -0.73 0.00 0.00 179.01 178.78 2jer s LYS 26 N -2.59 1.58 0.05 1.92 -2.85 -1.06 -4.18 119.74 112.60 2jer s LYS 26 Ca -0.11 -0.84 0.06 0.00 -1.00 0.00 0.00 55.97 54.08 2jer s LYS 26 Cb 0.03 0.56 -0.03 0.00 -2.06 0.00 0.00 37.83 36.34 2jer s LYS 26 CO 0.89 -0.72 -0.16 0.08 0.10 0.00 0.00 175.35 175.54 2jer s VAL 27 N -3.75 1.30 0.18 1.79 1.01 -0.30 -0.08 120.40 120.54 2jer s VAL 27 Ca 0.10 -1.16 0.09 0.00 0.00 0.00 0.00 61.98 61.01 2jer s VAL 27 Cb -0.04 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2jer s VAL 27 CO 0.03 -0.00 -0.14 0.26 0.00 0.00 0.00 175.10 175.25 2jer s TRP 28 N -0.95 2.55 -0.09 5.22 0.52 -0.16 -1.04 118.94 124.98 2jer s TRP 28 Ca 0.03 -0.26 -0.25 0.00 0.02 0.00 0.00 56.10 55.64 2jer s TRP 28 Cb -0.09 -1.26 0.06 0.00 -1.15 0.00 0.00 33.47 31.03 2jer s TRP 28 CO 0.02 0.50 0.57 1.41 0.02 0.00 0.00 176.95 179.47 2jer s MET 29 N -2.71 0.88 -0.08 4.98 1.75 -0.51 -1.63 119.30 121.98 2jer s MET 29 Ca 0.23 0.30 -0.04 0.00 -1.25 0.00 0.00 55.69 54.93 2jer s MET 29 Cb -0.09 0.41 -0.04 0.00 2.84 0.00 0.00 34.83 37.96 2jer s MET 29 CO 0.13 -0.23 0.10 0.42 -0.65 0.00 0.00 175.02 174.79 2jer s ILE 30 N -0.85 5.10 0.01 10.11 1.01 -1.26 -0.88 121.20 134.44 2jer s ILE 30 Ca -0.09 -0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.22 2jer s ILE 30 Cb -0.02 -3.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.17 2jer s ILE 30 CO 0.06 0.54 1.03 0.86 0.00 0.00 0.00 174.94 177.43 2jer s TRP 31 N -1.06 3.60 0.31 3.97 -0.11 0.34 -4.81 118.94 121.19 2jer s TRP 31 Ca 0.17 1.61 -0.14 0.00 1.22 0.00 0.00 56.10 58.97 2jer s TRP 31 Cb -0.12 -3.18 -0.09 0.00 -1.50 0.00 0.00 33.47 28.58 2jer s TRP 31 CO 0.07 -0.28 0.71 -1.25 -4.62 0.00 0.00 176.95 171.58 2jer s PRO 32 N 1.09 3.97 0.00 5.86 0.04 -1.26 -4.76 135.00 139.94 2jer s PRO 32 Ca 0.53 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2jer s PRO 32 Cb -0.22 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 31.85 2jer s PRO 32 CO 0.28 0.18 0.00 -0.85 0.04 0.00 0.00 177.00 176.64 2jer n GLU 33 N -0.35 0.00 -1.77 4.56 0.28 -1.26 -4.77 120.64 117.33 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 -0.59 4.15 0.03 3.44 1.70 -1.26 -4.10 118.95 122.31 2jer s ARG 34 Ca 0.00 2.53 0.25 0.00 -0.47 0.00 0.00 55.73 58.04 2jer s ARG 34 Cb 0.00 -3.53 1.05 0.00 -0.57 0.00 0.00 34.95 31.90 2jer s ARG 34 CO 0.00 -0.80 1.80 -0.35 -1.08 0.00 0.00 175.30 174.87 2jer n PRO 35 N 5.42 0.03 -0.09 3.89 -0.04 -1.26 -1.24 135.00 141.71 2jer n PRO 35 Ca 0.17 0.09 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 2jer n PRO 35 Cb 0.38 -1.54 0.33 0.00 -0.04 0.00 0.00 33.50 32.64 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 -1.59 1.54 0.01 3.54 5.75 -1.26 -0.61 116.55 123.93 2jer n ASP 36 Ca 0.06 -1.75 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 2jer n ASP 36 Cb 0.30 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 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 0.26 0.14 -4.65 -1.12 4.05 -0.97 -4.72 115.26 108.25 2jer n ASN 37 Ca 0.15 0.04 -0.39 0.00 0.45 0.00 0.00 54.58 54.82 2jer n ASN 37 Cb 0.29 -0.03 -0.07 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 3.35 0.67 1.20 0.52 -0.37 -4.76 118.94 117.55 2jer s TRP 38 Ca 0.00 0.71 -0.17 0.00 0.02 0.00 0.00 56.10 56.65 2jer s TRP 38 Cb 0.00 -2.65 0.00 0.00 -1.15 0.00 0.00 33.47 29.68 2jer s TRP 38 CO 0.00 -0.12 1.26 -0.98 0.02 0.00 0.00 176.95 177.13 2jer s ARG 39 N 1.71 2.43 -1.43 4.98 1.70 -1.26 -3.46 118.95 123.62 2jer s ARG 39 Ca 0.22 1.96 -0.11 0.00 -0.47 0.00 0.00 55.73 57.34 2jer s ARG 39 Cb -0.15 -1.84 0.04 0.00 -0.57 0.00 0.00 34.95 32.42 2jer s ARG 39 CO 0.09 -1.66 1.08 -0.25 -1.08 0.00 0.00 175.30 173.48 2jer n ASP 40 N -2.15 -5.81 -2.05 -2.89 8.00 -0.64 -1.59 116.55 109.42 2jer n ASP 40 Ca 0.15 -0.61 -0.21 0.00 0.71 0.00 0.00 54.79 54.83 2jer n ASP 40 Cb 0.49 -4.59 -0.04 0.00 -0.02 0.00 0.00 41.12 36.95 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 -1.87 0.59 2.30 0.44 0.00 -1.22 -1.62 105.19 103.81 2jer n GLY 41 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jer n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 42 N -0.75 0.75 0.08 -0.02 0.00 -0.62 -4.79 105.19 99.84 2jer n GLY 42 Ca -0.23 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 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 2.21 -0.10 -0.50 1.61 1.79 -1.42 0.13 116.57 120.30 2jer h LYS 43 Ca 0.00 0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.49 2jer h LYS 43 Cb 0.00 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.65 2jer h LYS 43 CO 0.00 -0.06 0.32 -1.35 -1.08 0.00 0.00 179.45 177.28 2jer h PRO 44 N -0.12 0.63 0.00 3.15 0.11 -1.82 -2.63 132.00 131.32 2jer h PRO 44 Ca -0.01 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.97 2jer h PRO 44 Cb 0.10 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.05 2jer h PRO 44 CO 0.02 0.42 -0.44 -0.24 -0.21 0.00 0.00 178.00 177.54 2jer h VAL 45 N 0.65 1.26 -0.57 3.15 3.04 -1.81 -2.53 116.25 119.44 2jer h VAL 45 Ca 0.19 -1.55 -0.04 0.00 -1.01 0.00 0.00 66.70 64.29 2jer h VAL 45 Cb -0.05 1.85 -0.03 0.00 -2.01 0.00 0.00 31.29 31.05 2jer h VAL 45 CO -0.05 0.44 0.21 1.56 -1.01 0.00 0.00 177.57 178.71 2jer h GLN 46 N 0.00 0.84 -0.57 4.17 4.20 -0.38 0.82 115.11 124.20 2jer h GLN 46 Ca -0.00 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.49 2jer h GLN 46 Cb 0.82 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 2jer h GLN 46 CO 0.06 0.70 0.06 1.49 -0.67 0.00 0.00 178.83 180.47 2jer h GLU 47 N 0.82 0.96 -0.34 1.46 4.81 -1.18 -0.78 114.58 120.34 2jer h GLU 47 Ca 0.19 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 2jer h GLU 47 Cb 0.19 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2jer h GLU 47 CO -0.01 0.93 0.08 0.00 -0.73 0.00 0.00 179.01 179.28 2jer h ALA 48 N 0.99 0.44 -0.86 2.92 0.00 -0.99 -1.36 119.26 120.40 2jer h ALA 48 Ca 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2jer h ALA 48 Cb 0.46 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2jer h ALA 48 CO 0.02 0.11 0.47 0.74 0.00 0.00 0.00 179.25 180.59 2jer h PHE 49 N 0.39 1.19 -0.40 0.00 -1.00 -0.78 -0.87 116.94 115.47 2jer h PHE 49 Ca 0.11 -0.03 0.04 0.00 2.81 0.00 0.00 57.97 60.90 2jer h PHE 49 Cb 0.30 -0.38 -0.04 0.00 3.61 0.00 0.00 35.95 39.44 2jer h PHE 49 CO 0.02 0.82 0.16 1.15 -1.61 0.00 0.00 178.31 178.85 2jer h THR 50 N 1.21 0.91 -0.86 -1.55 2.02 -0.91 0.78 112.91 114.50 2jer h THR 50 Ca 0.30 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.34 2jer h THR 50 Cb 0.03 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 2jer h THR 50 CO -0.05 0.06 0.42 0.78 0.37 0.00 0.00 175.52 177.10 2jer h ASN 51 N 0.33 1.12 -0.07 4.18 2.35 -0.65 0.24 115.58 123.09 2jer h ASN 51 Ca 0.18 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2jer h ASN 51 Cb 0.14 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.22 2jer h ASN 51 CO -0.17 0.94 0.03 0.58 -1.65 0.00 0.00 177.43 177.16 2jer h VAL 52 N 1.22 1.12 -0.51 2.81 2.07 -0.89 -1.11 116.25 120.96 2jer h VAL 52 Ca 0.30 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2jer h VAL 52 Cb 0.11 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 2jer h VAL 52 CO -0.04 0.10 0.29 0.00 0.02 0.00 0.00 177.57 177.95 2jer h ALA 53 N 0.89 0.65 -0.71 1.67 0.00 -0.58 -0.94 119.26 120.24 2jer h ALA 53 Ca 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2jer h ALA 53 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2jer h ALA 53 CO -0.00 -0.02 0.38 0.87 0.00 0.00 0.00 179.25 180.48 2jer h LYS 54 N 0.57 1.00 -0.54 0.00 1.57 -0.89 -1.04 116.57 117.25 2jer h LYS 54 Ca 0.21 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2jer h LYS 54 Cb 0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 2jer h LYS 54 CO -0.11 0.75 0.18 0.00 -0.57 0.00 0.00 179.45 179.70 2jer h ALA 55 N 1.19 0.70 -0.61 3.86 0.00 -0.59 -2.83 119.26 120.98 2jer h ALA 55 Ca 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2jer h ALA 55 Cb 0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2jer h ALA 55 CO -0.04 0.35 0.26 0.82 0.00 0.00 0.00 179.25 180.63 2jer h ILE 56 N 0.74 1.23 -0.02 0.00 2.04 -0.96 -3.03 117.51 117.51 2jer h ILE 56 Ca 0.18 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2jer h ILE 56 Cb 0.25 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2jer h ILE 56 CO -0.01 0.27 0.04 0.77 0.00 0.00 0.00 178.15 179.23 2jer h SER 57 N 0.85 0.00 0.29 1.72 4.64 -0.94 0.47 113.55 120.58 2jer h SER 57 Ca 0.21 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.51 2jer h SER 57 Cb 0.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2jer h SER 57 CO -0.02 0.00 -0.10 1.56 -0.87 0.00 0.00 176.83 177.40 2jer h GLN 58 N 0.00 0.00 0.00 4.77 4.20 -1.50 -3.31 115.11 119.27 2jer h GLN 58 Ca 0.01 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.56 2jer h GLN 58 Cb 0.10 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 2jer h GLN 58 CO -0.00 0.10 -1.60 1.19 -0.67 0.00 0.00 178.83 177.84 2jer n PHE 59 N -3.70 0.00 -3.68 2.96 3.72 0.04 -5.07 117.46 111.73 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 0.21 -0.43 -0.09 0.00 -0.94 0.00 0.00 39.48 38.23 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 0.19 4.37 2.01 -0.51 -4.75 115.64 114.73 2jer s THR 60 Ca -0.06 0.02 -0.33 0.00 0.31 0.00 0.00 61.69 61.63 2jer s THR 60 Cb 0.03 -0.77 -0.15 0.00 0.01 0.00 0.00 72.50 71.62 2jer s THR 60 CO 0.34 0.01 1.32 -2.65 -0.69 0.00 0.00 174.62 172.94 2jer n PRO 61 N 3.41 1.60 -4.70 4.92 -0.02 -1.26 -3.69 135.00 135.26 2jer n PRO 61 Ca -0.17 0.57 -0.31 0.00 -2.02 0.00 0.00 63.50 61.57 2jer n PRO 61 Cb 0.56 -2.17 -0.13 0.00 -0.02 0.00 0.00 33.50 31.74 2jer n PRO 61 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jer s MET 62 N -0.19 2.04 -0.01 -0.52 1.75 -1.26 -1.15 119.30 119.96 2jer s MET 62 Ca 0.73 -0.99 0.01 0.00 -1.25 0.00 0.00 55.69 54.18 2jer s MET 62 Cb -0.76 -2.16 0.01 0.00 2.84 0.00 0.00 34.83 34.75 2jer s MET 62 CO 0.49 0.54 -0.01 -0.80 -0.65 0.00 0.00 175.02 174.59 2jer s ASN 63 N -1.39 0.36 -0.05 1.11 0.01 -0.21 -2.01 114.94 112.76 2jer s ASN 63 Ca 0.14 -0.04 0.04 0.00 -0.71 0.00 0.00 52.86 52.29 2jer s ASN 63 Cb -0.10 -0.12 -0.00 0.00 0.41 0.00 0.00 41.25 41.44 2jer s ASN 63 CO 0.05 -0.03 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.75 2jer s VAL 64 N 0.42 1.44 0.07 1.60 1.01 -0.23 -1.42 120.40 123.29 2jer s VAL 64 Ca -0.04 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.29 2jer s VAL 64 Cb -0.07 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2jer s VAL 64 CO -0.01 0.42 -0.10 0.68 0.00 0.00 0.00 175.10 176.09 2jer s VAL 65 N 0.11 3.40 -0.05 2.92 -7.23 -0.06 -1.36 120.40 118.13 2jer s VAL 65 Ca -0.06 -1.12 -0.23 0.00 -1.81 0.00 0.00 61.98 58.77 2jer s VAL 65 Cb -0.12 -2.55 0.05 0.00 0.56 0.00 0.00 36.38 34.32 2jer s VAL 65 CO 0.03 0.21 0.50 0.54 -0.31 0.00 0.00 175.10 176.07 2jer s VAL 66 N -1.13 0.03 1.01 1.32 0.11 -0.11 -0.50 120.40 121.12 2jer s VAL 66 Ca 0.20 -0.21 -0.11 0.00 -2.93 0.00 0.00 61.98 58.93 2jer s VAL 66 Cb -0.11 -0.81 0.20 0.00 -1.53 0.00 0.00 36.38 34.13 2jer s VAL 66 CO 0.11 -0.11 1.10 -0.94 -3.33 0.00 0.00 175.10 171.93 2jer s SER 67 N -1.11 2.15 0.19 3.54 1.04 -1.22 -0.41 113.70 117.88 2jer s SER 67 Ca -0.11 1.97 -0.15 0.00 0.48 0.00 0.00 55.95 58.14 2jer s SER 67 Cb -0.03 -2.49 0.17 0.00 0.10 0.00 0.00 66.02 63.78 2jer s SER 67 CO 0.07 -3.55 1.65 -0.61 0.98 0.00 0.00 173.24 171.78 2jer h GLN 68 N -2.17 0.01 -0.50 4.02 4.15 -1.97 -0.98 115.11 117.65 2jer h GLN 68 Ca -0.50 -0.00 -0.11 0.00 0.77 0.00 0.00 58.65 58.81 2jer h GLN 68 Cb 1.29 -0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.97 2jer h GLN 68 CO 0.44 0.00 -0.14 0.37 -1.93 0.00 0.00 178.83 177.58 2jer h GLN 69 N 0.01 0.97 -0.01 1.69 -0.00 -2.01 -3.11 115.11 112.65 2jer h GLN 69 Ca 0.25 -0.38 0.00 0.00 -0.00 0.00 0.00 58.65 58.52 2jer h GLN 69 Cb 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 27.48 27.81 2jer h GLN 69 CO -0.53 1.05 -0.24 1.04 0.00 0.00 0.00 178.83 180.15 2jer n GLN 70 N -4.18 0.82 -0.08 1.69 1.13 -1.06 -4.46 117.38 111.24 2jer n GLN 70 Ca 0.00 -0.46 -0.09 0.00 -1.94 0.00 0.00 57.00 54.51 2jer n GLN 70 Cb 0.41 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.24 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 1.13 -1.00 -0.48 1.08 3.04 -1.11 0.97 116.94 120.58 2jer h PHE 71 Ca 0.00 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 61.96 2jer h PHE 71 Cb 0.49 0.48 -0.02 0.00 2.56 0.00 0.00 35.95 39.46 2jer h PHE 71 CO 0.00 -0.41 0.12 1.96 -2.02 0.00 0.00 178.31 177.97 2jer h GLN 72 N -0.32 0.76 -0.19 1.11 4.20 -1.81 -0.59 115.11 118.26 2jer h GLN 72 Ca 0.14 -0.18 0.01 0.00 0.06 0.00 0.00 58.65 58.68 2jer h GLN 72 Cb 0.56 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 2jer h GLN 72 CO -0.49 0.74 0.09 -0.97 -0.67 0.00 0.00 178.83 177.53 2jer h ASN 73 N 0.64 0.14 -0.42 1.46 -1.24 -1.77 -2.16 115.58 112.23 2jer h ASN 73 Ca 0.15 0.01 0.07 0.00 0.71 0.00 0.00 56.30 57.23 2jer h ASN 73 Cb 0.31 -0.02 -0.06 0.00 0.73 0.00 0.00 38.32 39.29 2jer h ASN 73 CO 0.00 0.11 0.08 0.00 -1.29 0.00 0.00 177.43 176.33 2jer h ARG 75 N 0.22 0.90 -0.43 0.00 9.65 -1.02 -1.82 114.38 121.88 2jer h ARG 75 Ca 0.20 -0.15 -0.13 0.00 -1.10 0.00 0.00 59.98 58.81 2jer h ARG 75 Cb 0.25 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 2jer h ARG 75 CO -0.27 0.75 -0.22 0.00 2.80 0.00 0.00 179.97 183.03 2jer h ARG 76 N 0.89 0.92 -0.18 0.20 2.47 -0.68 -3.25 114.38 114.74 2jer h ARG 76 Ca 0.21 -0.41 -0.12 0.00 -1.26 0.00 0.00 59.98 58.39 2jer h ARG 76 Cb 0.20 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.48 2jer h ARG 76 CO -0.02 1.06 -0.42 1.96 0.56 0.00 0.00 179.97 183.12 2jer h GLN 77 N 0.75 0.43 -6.15 0.04 1.08 -0.48 -3.44 115.11 107.34 2jer h GLN 77 Ca 0.10 -0.22 -0.59 0.00 -1.45 0.00 0.00 58.65 56.49 2jer h GLN 77 Cb 0.80 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.18 2jer h GLN 77 CO 0.07 0.78 -0.10 -0.51 -0.95 0.00 0.00 178.83 178.12 2jer s LEU 78 N -8.39 4.51 0.70 1.46 1.43 -0.73 -5.06 118.68 112.60 2jer s LEU 78 Ca -0.06 1.15 -0.16 0.00 -1.03 0.00 0.00 54.13 54.03 2jer s LEU 78 Cb 0.13 -2.78 0.02 0.00 0.03 0.00 0.00 46.19 43.59 2jer s LEU 78 CO 0.80 0.29 1.24 -2.16 0.23 0.00 0.00 176.35 176.75 2jer s PRO 79 N -1.09 2.27 0.58 1.29 0.04 -1.26 -4.89 135.00 131.93 2jer s PRO 79 Ca 0.27 1.87 0.27 0.00 0.04 0.00 0.00 61.00 63.44 2jer s PRO 79 Cb -0.18 -1.84 1.70 0.00 0.04 0.00 0.00 34.50 34.22 2jer s PRO 79 CO 0.17 -1.76 2.23 -1.00 0.04 0.00 0.00 177.00 176.67 2jer h PRO 80 N -0.01 0.00 0.00 0.56 0.13 -1.96 -1.34 132.00 129.37 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 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.43 2jer n GLU 81 N -3.99 0.18 -3.28 0.86 0.00 -1.26 -4.45 120.64 108.70 2jer n GLU 81 Ca -0.03 0.47 -0.39 0.00 0.00 0.00 0.00 57.16 57.21 2jer n GLU 81 Cb 0.10 -1.89 -0.07 0.00 0.00 0.00 0.00 31.44 29.58 2jer n GLU 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2jer s ILE 82 N -3.36 5.12 0.20 3.84 1.01 -0.51 -4.58 121.20 122.92 2jer s ILE 82 Ca 0.03 0.86 -0.30 0.00 0.00 0.00 0.00 60.65 61.24 2jer s ILE 82 Cb 0.09 -3.81 -0.08 0.00 0.01 0.00 0.00 42.46 38.67 2jer s ILE 82 CO 0.35 0.16 0.96 -0.89 0.00 0.00 0.00 174.94 175.52 2jer s THR 83 N 1.80 4.16 -0.12 2.92 2.01 -0.85 -4.86 115.64 120.70 2jer s THR 83 Ca 0.22 2.03 0.03 0.00 0.31 0.00 0.00 61.69 64.27 2jer s THR 83 Cb -0.15 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.07 2jer s THR 83 CO 0.09 0.42 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.53 2jer s VAL 84 N -0.76 2.00 -0.01 3.82 1.01 -1.26 -1.07 120.40 124.13 2jer s VAL 84 Ca 0.43 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.52 2jer s VAL 84 Cb -0.26 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 2jer s VAL 84 CO 0.32 0.54 -0.20 -0.31 0.00 0.00 0.00 175.10 175.45 2jer s TYR 85 N 0.62 2.51 0.20 5.22 1.51 -0.46 -5.01 117.35 121.95 2jer s TYR 85 Ca -0.12 -0.30 -0.30 0.00 -1.01 0.00 0.00 57.07 55.34 2jer s TYR 85 Cb -0.17 -1.53 -0.08 0.00 -0.11 0.00 0.00 41.96 40.07 2jer s TYR 85 CO 0.03 0.12 1.24 -2.00 -1.11 0.00 0.00 175.55 173.82 2jer s GLU 86 N -0.89 4.45 -0.30 -0.62 2.12 -1.26 -0.94 118.70 121.28 2jer s GLU 86 Ca 0.12 1.95 -0.11 0.00 0.36 0.00 0.00 54.97 57.29 2jer s GLU 86 Cb -0.10 -3.21 0.13 0.00 0.26 0.00 0.00 34.13 31.20 2jer s GLU 86 CO 0.01 -0.14 0.69 1.41 -0.54 0.00 0.00 175.26 176.70 2jer s MET 87 N -0.33 0.57 0.61 4.30 1.75 0.45 -4.74 119.30 121.91 2jer s MET 87 Ca 0.54 1.35 -0.19 0.00 -1.25 0.00 0.00 55.69 56.13 2jer s MET 87 Cb -0.34 0.73 -0.03 0.00 2.84 0.00 0.00 34.83 38.03 2jer s MET 87 CO 0.38 -0.18 1.32 -1.12 -0.65 0.00 0.00 175.02 174.77 2jer s SER 88 N 2.67 4.85 0.08 1.11 0.01 -1.26 -3.44 113.70 117.72 2jer s SER 88 Ca -0.06 2.68 -0.26 0.00 1.31 0.00 0.00 55.95 59.61 2jer s SER 88 Cb -0.10 -2.62 0.08 0.00 0.21 0.00 0.00 66.02 63.58 2jer s SER 88 CO -0.19 -1.85 0.78 0.54 0.41 0.00 0.00 173.24 172.94 2jer s ASN 89 N -1.23 -0.42 -0.23 2.44 2.20 -1.26 -4.61 114.94 111.82 2jer s ASN 89 Ca 0.79 -0.07 0.09 0.00 -0.94 0.00 0.00 52.86 52.72 2jer s ASN 89 Cb -0.39 0.49 -0.20 0.00 -2.00 0.00 0.00 41.25 39.15 2jer s ASN 89 CO 0.43 -0.81 -0.10 0.59 -2.94 0.00 0.00 177.10 174.26 2jer n ASN 90 N -0.32 1.19 -2.16 3.54 3.02 -1.26 -4.79 115.26 114.47 2jer n ASN 90 Ca -0.11 -0.08 -0.08 0.00 -0.03 0.00 0.00 54.58 54.28 2jer n ASN 90 Cb 0.63 0.19 -0.01 0.00 -0.61 0.00 0.00 39.78 39.98 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 -3.03 -0.99 -2.66 6.41 -0.08 -1.26 -4.82 116.55 110.13 2jer n ASP 91 Ca -0.40 -2.08 -0.31 0.00 -1.51 0.00 0.00 54.79 50.49 2jer n ASP 91 Cb 1.05 1.76 0.01 0.00 2.34 0.00 0.00 41.12 46.28 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 -1.60 5.53 -3.51 -1.67 0.00 -1.26 -4.87 120.51 113.14 2jer n ALA 92 Ca -0.09 -4.28 -0.27 0.00 0.00 0.00 0.00 53.44 48.80 2jer n ALA 92 Cb 0.35 -1.03 -0.09 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.48 3.56 0.39 0.00 7.02 -1.26 -4.59 117.44 122.08 2jer n TRP 93 Ca 0.44 -4.18 0.13 0.00 -1.02 0.00 0.00 57.50 52.86 2jer n TRP 93 Cb 0.51 -0.57 0.51 0.00 -2.42 0.00 0.00 31.31 29.34 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 3.39 0.00 -0.49 -0.99 3.04 -1.85 -0.54 116.25 118.80 2jer h VAL 94 Ca 0.19 -0.36 0.06 0.00 -1.01 0.00 0.00 66.70 65.59 2jer h VAL 94 Cb 0.68 1.19 -0.03 0.00 -2.01 0.00 0.00 31.29 31.12 2jer h VAL 94 CO 0.81 0.00 0.33 -0.09 -1.01 0.00 0.00 177.57 177.61 2jer h ARG 95 N 0.00 0.41 0.00 4.17 9.65 -1.74 0.31 114.38 127.18 2jer h ARG 95 Ca 0.00 -0.02 -0.32 0.00 -1.10 0.00 0.00 59.98 58.54 2jer h ARG 95 Cb 0.47 -0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.90 2jer h ARG 95 CO 0.00 0.27 -2.19 -0.25 2.80 0.00 0.00 179.97 180.60 2jer n ASP 96 N -4.47 1.23 -0.36 -3.80 8.00 -0.26 -2.54 116.55 114.35 2jer n ASP 96 Ca 0.07 -0.03 0.08 0.00 0.71 0.00 0.00 54.79 55.62 2jer n ASP 96 Cb 0.25 0.56 -0.01 0.00 -0.02 0.00 0.00 41.12 41.90 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 -2.00 1.59 0.41 0.00 0.00 0.10 -3.50 107.32 103.92 2jer s GLY 98 Ca 0.14 -0.71 -0.22 0.00 0.00 0.00 0.00 44.72 43.93 2jer s GLY 98 CO 0.44 0.02 0.96 2.56 0.00 0.00 0.00 173.10 177.08 2jer s PRO 99 N -5.28 4.26 -0.38 2.90 0.04 -1.26 -4.77 135.00 130.51 2jer s PRO 99 Ca 0.68 1.21 -0.15 0.00 0.04 0.00 0.00 61.00 62.78 2jer s PRO 99 Cb -0.13 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2jer s PRO 99 CO 0.56 -0.01 0.35 -1.12 0.04 0.00 0.00 177.00 176.82 2jer s SER 100 N -2.00 6.15 0.26 6.66 0.01 -0.39 -4.89 113.70 119.51 2jer s SER 100 Ca 0.60 -0.54 -0.29 0.00 1.31 0.00 0.00 55.95 57.03 2jer s SER 100 Cb -0.13 -2.19 -0.09 0.00 0.21 0.00 0.00 66.02 63.82 2jer s SER 100 CO 0.17 -0.42 0.96 -0.36 0.41 0.00 0.00 173.24 174.00 2jer s PHE 101 N 1.93 3.86 0.05 2.43 0.40 -1.26 -0.22 117.98 125.18 2jer s PHE 101 Ca 0.09 1.86 0.07 0.00 -0.60 0.00 0.00 56.93 58.36 2jer s PHE 101 Cb -0.17 -3.01 -0.03 0.00 0.51 0.00 0.00 43.02 40.32 2jer s PHE 101 CO 0.12 0.26 -0.20 0.14 0.70 0.00 0.00 175.22 176.24 2jer s VAL 102 N -1.27 1.64 0.19 -0.44 -7.23 0.20 -4.42 120.40 109.06 2jer s VAL 102 Ca 0.44 -1.24 0.07 0.00 -1.81 0.00 0.00 61.98 59.44 2jer s VAL 102 Cb -0.25 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.21 2jer s VAL 102 CO 0.31 0.15 -0.14 0.27 -0.31 0.00 0.00 175.10 175.38 2jer s ILE 103 N -0.86 1.63 -1.01 -0.62 -4.36 0.14 -0.63 121.20 115.49 2jer s ILE 103 Ca 0.07 -2.16 0.13 0.00 -0.26 0.00 0.00 60.65 58.42 2jer s ILE 103 Cb -0.09 -1.99 -0.04 0.00 1.25 0.00 0.00 42.46 41.60 2jer s ILE 103 CO 0.02 -0.61 0.68 -0.46 0.24 0.00 0.00 174.94 174.81 2jer n ASN 104 N -0.30 1.19 -1.18 4.36 6.94 -0.93 -0.31 115.26 125.03 2jer n ASN 104 Ca -0.09 -1.09 -0.15 0.00 -0.02 0.00 0.00 54.58 53.23 2jer n ASN 104 Cb 0.60 0.60 -0.07 0.00 -2.36 0.00 0.00 39.78 38.56 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 -0.47 -5.48 -1.08 0.53 5.75 -1.25 -4.79 116.55 109.75 2jer n ASP 105 Ca 0.05 0.38 -0.02 0.00 -0.01 0.00 0.00 54.79 55.19 2jer n ASP 105 Cb 0.25 -4.34 0.21 0.00 -1.03 0.00 0.00 41.12 36.21 2jer n ASP 105 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jer n HIS 106 N -2.35 1.01 -0.51 2.11 -0.00 -1.25 -4.96 115.22 109.28 2jer n HIS 106 Ca -0.15 -1.49 0.00 0.00 -0.00 0.00 0.00 57.72 56.07 2jer n HIS 106 Cb 0.61 -0.45 0.00 0.00 -0.00 0.00 0.00 29.99 30.15 2jer n HIS 106 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jer n GLY 107 N -1.06 0.73 3.43 -1.39 0.00 -1.13 -5.05 105.19 100.71 2jer n GLY 107 Ca 0.31 -0.20 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2jer n GLY 107 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jer s GLU 108 N -0.68 1.64 0.00 1.61 2.56 -1.25 -4.88 118.70 117.70 2jer s GLU 108 Ca 0.00 -1.23 0.01 0.00 0.00 0.00 0.00 54.97 53.75 2jer s GLU 108 Cb 0.00 -2.01 -0.01 0.00 2.00 0.00 0.00 34.13 34.11 2jer s GLU 108 CO 0.00 0.48 -0.04 -1.50 -0.56 0.00 0.00 175.26 173.63 2jer s ILE 109 N -1.05 0.34 0.21 -3.70 2.07 -1.26 -2.18 121.20 115.62 2jer s ILE 109 Ca 0.15 -0.33 0.02 0.00 -1.41 0.00 0.00 60.65 59.09 2jer s ILE 109 Cb -0.10 -0.31 -0.05 0.00 0.13 0.00 0.00 42.46 42.12 2jer s ILE 109 CO 0.07 -0.00 0.03 -0.13 -1.91 0.00 0.00 174.94 173.00 2jer s ARG 110 N -0.36 1.24 0.03 3.50 0.52 0.20 -4.48 118.95 119.61 2jer s ARG 110 Ca -0.01 -1.62 0.07 0.00 -0.52 0.00 0.00 55.73 53.65 2jer s ARG 110 Cb -0.03 -0.32 -0.03 0.00 0.52 0.00 0.00 34.95 35.09 2jer s ARG 110 CO -0.00 -0.17 -0.18 0.20 0.02 0.00 0.00 175.30 175.16 2jer s GLY 111 N -3.24 1.56 -0.23 -3.53 0.00 -0.42 -0.63 107.32 100.84 2jer s GLY 111 Ca 0.29 -1.18 -0.09 0.00 0.00 0.00 0.00 44.72 43.74 2jer s GLY 111 CO 0.08 -1.06 0.12 0.14 0.00 0.00 0.00 173.10 172.37 2jer s VAL 112 N -0.90 5.03 -0.55 1.40 1.01 0.69 -0.68 120.40 126.41 2jer s VAL 112 Ca 0.14 0.06 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 2jer s VAL 112 Cb -0.10 -3.33 0.14 0.00 0.00 0.00 0.00 36.38 33.09 2jer s VAL 112 CO 0.05 0.37 0.38 -0.62 0.00 0.00 0.00 175.10 175.28 2jer s ASP 113 N 0.98 5.47 0.62 3.32 -1.08 0.12 -1.26 116.67 124.85 2jer s ASP 113 Ca 0.06 -2.40 -0.12 0.00 -0.52 0.00 0.00 52.55 49.57 2jer s ASP 113 Cb -0.14 -1.91 -0.03 0.00 -1.46 0.00 0.00 42.92 39.38 2jer s ASP 113 CO 0.03 -0.51 1.03 0.26 0.52 0.00 0.00 175.17 176.51 2jer s TRP 114 N 0.61 3.47 0.01 -5.34 0.52 -1.26 -1.56 118.94 115.39 2jer s TRP 114 Ca 0.12 1.35 -0.30 0.00 0.02 0.00 0.00 56.10 57.29 2jer s TRP 114 Cb -0.21 -2.77 -0.06 0.00 -1.15 0.00 0.00 33.47 29.28 2jer s TRP 114 CO -0.03 -0.78 1.36 0.99 0.02 0.00 0.00 176.95 178.50 2jer s THR 115 N -3.06 3.74 -0.11 2.01 2.01 -0.74 -4.84 115.64 114.65 2jer s THR 115 Ca 0.56 1.15 -0.06 0.00 0.31 0.00 0.00 61.69 63.65 2jer s THR 115 Cb -0.12 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2jer s THR 115 CO 0.51 0.02 0.11 0.12 -0.69 0.00 0.00 174.62 174.69 2jer s PHE 116 N 2.11 3.51 -0.02 4.92 5.36 -1.26 -1.82 117.98 130.78 2jer s PHE 116 Ca 0.63 0.46 0.25 0.00 -0.96 0.00 0.00 56.93 57.30 2jer s PHE 116 Cb -0.31 -1.91 0.43 0.00 -0.34 0.00 0.00 43.02 40.89 2jer s PHE 116 CO 0.27 0.68 1.17 0.27 -1.46 0.00 0.00 175.22 176.15 2jer n ASN 117 N 2.04 1.08 -3.61 6.13 6.94 -1.26 -4.84 115.26 121.74 2jer n ASN 117 Ca -0.20 -2.13 -0.22 0.00 -0.02 0.00 0.00 54.58 52.01 2jer n ASN 117 Cb 0.55 -0.32 0.07 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 0.35 -1.69 -3.49 -2.53 0.00 -1.26 -0.08 120.51 111.81 2jer n ALA 118 Ca 0.07 0.10 -0.18 0.00 0.00 0.00 0.00 53.44 53.43 2jer n ALA 118 Cb 1.11 -3.59 0.07 0.00 0.00 0.00 0.00 19.45 17.04 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 -4.51 -2.13 0.00 0.00 8.01 -1.26 -0.92 117.44 116.62 2jer n TRP 119 Ca -0.15 0.91 0.00 0.00 -1.31 0.00 0.00 57.50 56.95 2jer n TRP 119 Cb 0.62 -4.85 0.00 0.00 -2.01 0.00 0.00 31.31 25.06 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 -1.25 0.29 7.00 6.99 0.00 -1.22 -3.68 105.19 113.32 2jer n GLY 120 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2jer n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 121 N 0.00 2.94 0.04 -0.02 0.00 0.89 -1.61 105.19 107.42 2jer n GLY 121 Ca 0.00 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 46.02 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 0.20 -0.06 0.99 4.77 -1.26 -0.83 117.00 120.81 2jer n LEU 122 Ca 0.00 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.14 2jer n LEU 122 Cb 0.00 -0.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.79 2jer n LEU 122 CO 0.00 0.04 0.04 0.58 -1.33 0.00 0.00 177.39 176.72 2jer h VAL 123 N 0.21 0.35 0.00 4.08 2.07 -1.64 -3.44 116.25 117.87 2jer h VAL 123 Ca 0.00 -1.27 -0.13 0.00 0.82 0.00 0.00 66.70 66.11 2jer h VAL 123 Cb 0.36 0.67 -0.24 0.00 -1.52 0.00 0.00 31.29 30.56 2jer h VAL 123 CO 0.00 0.12 -0.65 -0.90 0.02 0.00 0.00 177.57 176.15 2jer n ASP 124 N -4.73 0.12 -4.68 0.57 5.75 -0.72 -5.03 116.55 107.83 2jer n ASP 124 Ca -0.03 -1.94 -0.29 0.00 -0.01 0.00 0.00 54.79 52.52 2jer n ASP 124 Cb 0.12 -0.05 0.16 0.00 -1.03 0.00 0.00 41.12 40.32 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 -1.42 1.59 0.00 6.12 0.00 -0.01 -4.59 107.32 109.01 2jer s GLY 125 Ca 0.17 -0.15 0.23 0.00 0.00 0.00 0.00 44.72 44.96 2jer s GLY 125 CO -0.08 0.40 1.10 1.04 0.00 0.00 0.00 173.10 175.56 2jer n LEU 126 N -4.11 0.76 -3.69 0.66 4.77 -0.10 -4.78 117.00 110.53 2jer n LEU 126 Ca 0.06 -0.26 -0.03 0.00 -0.03 0.00 0.00 56.01 55.75 2jer n LEU 126 Cb 0.56 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 2jer n LEU 126 CO 0.56 0.18 0.81 -0.72 -1.33 0.00 0.00 177.39 176.90 2jer s TYR 127 N -3.02 -0.13 -0.09 -1.77 -0.85 -1.24 -1.06 117.35 109.19 2jer s TYR 127 Ca 0.09 -0.09 -0.05 0.00 -0.52 0.00 0.00 57.07 56.50 2jer s TYR 127 Cb 0.16 0.60 0.04 0.00 0.38 0.00 0.00 41.96 43.15 2jer s TYR 127 CO 0.80 -0.63 0.22 0.12 -1.52 0.00 0.00 175.55 174.53 2jer s PHE 128 N -3.01 -0.28 0.71 -3.49 5.36 -1.26 -4.72 117.98 111.28 2jer s PHE 128 Ca 0.12 0.69 0.02 0.00 -0.96 0.00 0.00 56.93 56.80 2jer s PHE 128 Cb 0.00 0.01 0.13 0.00 -0.34 0.00 0.00 43.02 42.82 2jer s PHE 128 CO -0.01 -0.21 0.97 -1.25 -1.46 0.00 0.00 175.22 173.26 2jer s PRO 129 N 1.20 1.72 -0.05 10.12 0.04 -1.26 -4.99 135.00 141.79 2jer s PRO 129 Ca -0.09 -1.33 0.08 0.00 0.04 0.00 0.00 61.00 59.70 2jer s PRO 129 Cb -0.10 -2.40 0.14 0.00 0.04 0.00 0.00 34.50 32.18 2jer s PRO 129 CO -0.08 -1.39 1.07 -2.67 0.04 0.00 0.00 177.00 173.97 2jer n TRP 130 N -2.74 0.00 -0.08 0.56 2.14 -1.26 -4.87 117.44 111.19 2jer n TRP 130 Ca 0.16 -0.40 -0.02 0.00 2.07 0.00 0.00 57.50 59.32 2jer n TRP 130 Cb 0.61 -0.10 0.23 0.00 -0.81 0.00 0.00 31.31 31.24 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 0.15 0.67 0.13 -0.67 2.03 -1.99 -0.84 116.42 115.91 2jer h ASP 131 Ca -0.02 -0.12 -0.30 0.00 -0.73 0.00 0.00 57.03 55.86 2jer h ASP 131 Cb 1.32 -0.18 0.03 0.00 -0.83 0.00 0.00 39.33 39.68 2jer h ASP 131 CO 0.01 0.69 -1.23 1.56 -1.03 0.00 0.00 179.24 179.23 2jer h GLN 132 N 0.69 0.63 -0.85 4.15 1.08 -1.91 -3.06 115.11 115.84 2jer h GLN 132 Ca 0.15 -0.82 0.14 0.00 -1.45 0.00 0.00 58.65 56.67 2jer h GLN 132 Cb 0.30 0.27 -0.09 0.00 -0.05 0.00 0.00 27.48 27.91 2jer h GLN 132 CO 0.00 1.37 0.44 -0.44 -0.95 0.00 0.00 178.83 179.26 2jer h ASP 133 N 0.28 0.54 0.63 1.46 3.32 -1.76 -1.80 116.42 119.09 2jer h ASP 133 Ca -0.18 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2jer h ASP 133 Cb 1.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.45 2jer h ASP 133 CO 0.24 0.23 0.00 -0.67 -1.72 0.00 0.00 179.24 177.32 2jer n ASP 134 N -4.86 0.46 -0.09 6.45 2.03 -0.34 -1.91 116.55 118.29 2jer n ASP 134 Ca 0.17 0.62 0.11 0.00 0.52 0.00 0.00 54.79 56.21 2jer n ASP 134 Cb 0.43 -0.72 0.12 0.00 -0.72 0.00 0.00 41.12 40.23 2jer n ASP 134 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jer n LEU 135 N -2.02 0.92 -0.27 -2.67 4.77 -0.69 -4.44 117.00 112.60 2jer n LEU 135 Ca 0.02 -0.29 -0.05 0.00 -0.03 0.00 0.00 56.01 55.67 2jer n LEU 135 Cb 0.20 -0.12 0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2jer n LEU 135 CO 0.17 0.21 1.19 0.58 -1.33 0.00 0.00 177.39 178.21 2jer h VAL 136 N 0.46 1.19 -0.33 4.08 2.07 -1.30 -1.77 116.25 120.66 2jer h VAL 136 Ca 0.00 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.18 2jer h VAL 136 Cb 0.53 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2jer h VAL 136 CO 0.00 0.19 0.20 0.00 0.02 0.00 0.00 177.57 177.97 2jer h ALA 137 N 1.28 0.42 -0.51 1.67 0.00 -1.76 0.38 119.26 120.74 2jer h ALA 137 Ca 0.28 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 2jer h ALA 137 Cb -0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2jer h ALA 137 CO -0.06 -0.16 0.02 0.37 0.00 0.00 0.00 179.25 179.42 2jer h GLN 138 N 0.40 0.88 -0.68 0.00 4.15 -1.79 -1.57 115.11 116.50 2jer h GLN 138 Ca 0.13 -0.27 -0.04 0.00 0.77 0.00 0.00 58.65 59.24 2jer h GLN 138 Cb -0.00 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 2jer h GLN 138 CO -0.06 0.90 0.26 0.87 -1.93 0.00 0.00 178.83 178.87 2jer h LYS 139 N 0.75 1.02 -0.44 1.69 1.57 -0.82 0.89 116.57 121.23 2jer h LYS 139 Ca 0.15 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2jer h LYS 139 Cb 0.50 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2jer h LYS 139 CO 0.02 0.86 0.20 0.82 -0.57 0.00 0.00 179.45 180.78 2jer h ILE 140 N 0.97 1.19 -0.66 1.86 2.04 -0.86 -1.45 117.51 120.60 2jer h ILE 140 Ca 0.23 -0.56 0.05 0.00 1.00 0.00 0.00 64.86 65.58 2jer h ILE 140 Cb 0.23 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.00 2jer h ILE 140 CO -0.02 0.21 0.38 0.00 0.00 0.00 0.00 178.15 178.73 2jer h GLU 142 N 0.73 0.09 -0.80 0.00 4.39 -0.54 0.14 114.58 118.59 2jer h GLU 142 Ca 0.28 -0.01 0.17 0.00 0.34 0.00 0.00 59.36 60.15 2jer h GLU 142 Cb 0.12 -0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 28.64 2jer h GLU 142 CO -0.15 0.06 0.29 0.82 -1.16 0.00 0.00 179.01 178.87 2jer h ILE 143 N 0.10 0.55 -0.02 3.13 2.04 -0.96 -1.09 117.51 121.27 2jer h ILE 143 Ca 0.09 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.83 2jer h ILE 143 Cb 0.10 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 2jer h ILE 143 CO -0.14 0.07 0.00 -0.62 0.00 0.00 0.00 178.15 177.46 2jer n GLU 144 N -5.07 1.30 -3.38 2.37 -0.58 -0.76 -4.91 120.64 109.61 2jer n GLU 144 Ca 0.17 -0.44 -0.24 0.00 -0.42 0.00 0.00 57.16 56.23 2jer n GLU 144 Cb 0.50 -1.47 0.04 0.00 -0.57 0.00 0.00 31.44 29.95 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 -0.45 -2.29 -4.12 -0.32 8.25 -0.41 -4.98 115.22 110.90 2jer n HIS 145 Ca 0.21 0.73 -0.35 0.00 -0.26 0.00 0.00 57.72 58.05 2jer n HIS 145 Cb 0.21 -4.39 -0.12 0.00 1.12 0.00 0.00 29.99 26.81 2jer n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2jer s VAL 146 N -3.21 4.22 0.56 1.59 1.01 0.34 -4.92 120.40 120.00 2jer s VAL 146 Ca 0.46 -0.23 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 2jer s VAL 146 Cb -0.21 -2.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2jer s VAL 146 CO 0.57 0.45 1.07 -1.81 0.00 0.00 0.00 175.10 175.38 2jer s ASP 147 N 0.69 5.86 0.03 3.32 1.01 -1.26 -4.41 116.67 121.90 2jer s ASP 147 Ca 0.01 1.95 0.00 0.00 0.71 0.00 0.00 52.55 55.22 2jer s ASP 147 Cb -0.14 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.21 2jer s ASP 147 CO 0.02 -1.11 -0.04 -0.94 0.21 0.00 0.00 175.17 173.31 2jer s SER 148 N -2.30 0.37 -0.23 0.27 1.04 -0.73 -1.30 113.70 110.83 2jer s SER 148 Ca 0.67 -0.57 -0.10 0.00 0.48 0.00 0.00 55.95 56.43 2jer s SER 148 Cb -0.18 0.10 -0.05 0.00 0.10 0.00 0.00 66.02 65.99 2jer s SER 148 CO 0.30 -0.32 0.15 -0.31 0.98 0.00 0.00 173.24 174.04 2jer s TYR 149 N -1.74 3.31 -0.21 5.02 1.51 0.15 0.19 117.35 125.58 2jer s TYR 149 Ca -0.12 0.21 -0.12 0.00 -1.01 0.00 0.00 57.07 56.03 2jer s TYR 149 Cb -0.08 -2.25 -0.05 0.00 -0.11 0.00 0.00 41.96 39.47 2jer s TYR 149 CO -0.02 0.08 0.22 0.50 -1.11 0.00 0.00 175.55 175.22 2jer s ARG 150 N 0.98 4.15 -1.06 -0.62 6.06 -1.26 0.13 118.95 127.33 2jer s ARG 150 Ca 0.07 -0.10 -0.15 0.00 -2.50 0.00 0.00 55.73 53.05 2jer s ARG 150 Cb -0.13 -3.49 0.18 0.00 0.06 0.00 0.00 34.95 31.56 2jer s ARG 150 CO 0.04 0.12 1.21 0.95 -2.50 0.00 0.00 175.30 175.12 2jer s THR 151 N 0.86 5.15 0.16 4.11 -4.23 -0.60 -4.98 115.64 116.11 2jer s THR 151 Ca 0.11 -2.40 -0.34 0.00 -1.18 0.00 0.00 61.69 57.89 2jer s THR 151 Cb -0.13 -4.77 -0.14 0.00 1.34 0.00 0.00 72.50 68.80 2jer s THR 151 CO 0.04 -1.45 1.57 0.47 -0.54 0.00 0.00 174.62 174.70 2jer n ASP 152 N 5.30 3.04 -1.68 3.99 8.00 -1.26 -2.07 116.55 131.86 2jer n ASP 152 Ca 0.28 1.09 -0.21 0.00 0.71 0.00 0.00 54.79 56.66 2jer n ASP 152 Cb 0.45 -1.42 -0.08 0.00 -0.02 0.00 0.00 41.12 40.05 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 3.35 -5.54 -3.91 -2.24 8.00 -1.26 -4.95 116.55 109.99 2jer n ASP 153 Ca 0.17 0.45 -0.28 0.00 0.71 0.00 0.00 54.79 55.83 2jer n ASP 153 Cb 0.29 -4.83 -0.16 0.00 -0.02 0.00 0.00 41.12 36.39 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 1.80 -0.13 1.24 2.19 -0.88 -5.04 117.98 114.37 2jer s PHE 154 Ca 0.00 -1.14 -0.18 0.00 0.33 0.00 0.00 56.93 55.95 2jer s PHE 154 Cb 0.00 -1.36 -0.04 0.00 -1.31 0.00 0.00 43.02 40.30 2jer s PHE 154 CO 0.00 -0.63 0.47 0.08 1.83 0.00 0.00 175.22 176.97 2jer s VAL 155 N 1.60 5.19 0.01 3.12 1.01 -1.26 -1.79 120.40 128.29 2jer s VAL 155 Ca 0.01 0.93 -0.21 0.00 0.00 0.00 0.00 61.98 62.70 2jer s VAL 155 Cb -0.15 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.47 2jer s VAL 155 CO -0.08 0.32 0.47 -0.22 0.00 0.00 0.00 175.10 175.60 2jer s LEU 156 N 0.67 0.16 -0.00 3.92 2.96 -0.76 -4.79 118.68 120.84 2jer s LEU 156 Ca 0.25 0.22 0.08 0.00 -0.22 0.00 0.00 54.13 54.46 2jer s LEU 156 Cb -0.15 1.90 -0.02 0.00 0.50 0.00 0.00 46.19 48.42 2jer s LEU 156 CO 0.10 -0.61 -0.25 -1.61 -1.32 0.00 0.00 176.35 172.65 2jer s GLU 157 N -1.91 2.05 0.39 1.98 8.01 -1.26 -4.59 118.70 123.36 2jer s GLU 157 Ca -0.09 -0.97 0.20 0.00 0.01 0.00 0.00 54.97 54.13 2jer s GLU 157 Cb -0.02 -2.04 1.16 0.00 -4.31 0.00 0.00 34.13 28.92 2jer s GLU 157 CO 0.02 0.55 1.71 0.78 0.01 0.00 0.00 175.26 178.33 2jer h GLY 158 N 5.29 1.47 1.92 -1.39 0.00 -1.61 -1.18 103.07 107.57 2jer h GLY 158 Ca -0.44 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2jer h GLY 158 CO 0.46 -0.29 0.00 0.61 0.00 0.00 0.00 176.54 177.33 2jer n GLY 159 N -1.43 -1.06 0.31 4.60 0.00 -1.23 -3.34 105.19 103.03 2jer n GLY 159 Ca 0.30 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.39 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 -1.46 1.11 -3.81 1.61 3.41 -0.45 -2.57 113.62 111.47 2jer n SER 160 Ca 0.05 -1.06 -0.10 0.00 -0.26 0.00 0.00 58.87 57.50 2jer n SER 160 Cb 0.19 0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.14 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 -2.33 0.05 0.01 7.33 -0.12 -1.21 -4.22 117.98 117.49 2jer s PHE 161 Ca 0.30 -0.40 0.01 0.00 -0.05 0.00 0.00 56.93 56.79 2jer s PHE 161 Cb 0.20 0.01 -0.01 0.00 -0.63 0.00 0.00 43.02 42.59 2jer s PHE 161 CO 0.45 -0.55 -0.05 -1.01 -0.05 0.00 0.00 175.22 174.02 2jer s HIS 162 N -3.51 0.45 0.06 3.49 3.76 -0.15 -4.88 115.29 114.50 2jer s HIS 162 Ca 0.02 -0.18 0.08 0.00 -0.15 0.00 0.00 55.06 54.83 2jer s HIS 162 Cb 0.03 -0.28 -0.03 0.00 1.11 0.00 0.00 32.58 33.40 2jer s HIS 162 CO -0.09 -0.03 -0.20 0.14 -0.85 0.00 0.00 174.74 173.71 2jer s VAL 163 N -0.42 2.69 -1.88 -0.90 -7.23 -1.26 -0.28 120.40 111.12 2jer s VAL 163 Ca -0.01 -1.29 0.26 0.00 -1.81 0.00 0.00 61.98 59.12 2jer s VAL 163 Cb -0.04 -2.15 0.25 0.00 0.56 0.00 0.00 36.38 35.00 2jer s VAL 163 CO -0.00 0.29 1.50 -0.90 -0.31 0.00 0.00 175.10 175.68 2jer n ASP 164 N 1.42 1.25 0.00 4.85 5.75 -0.95 -4.50 116.55 124.37 2jer n ASP 164 Ca -0.16 -1.05 0.00 0.00 -0.01 0.00 0.00 54.79 53.56 2jer n ASP 164 Cb 0.52 0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.79 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 1.34 0.81 2.15 6.12 0.00 -1.26 -4.42 105.19 109.92 2jer n GLY 165 Ca 0.12 0.00 -0.07 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 -2.09 2.14 -0.13 1.61 6.02 -1.26 -4.80 117.38 118.88 2jer n GLN 166 Ca 0.00 -3.52 0.00 0.00 -0.01 0.00 0.00 57.00 53.47 2jer n GLN 166 Cb 0.01 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 29.64 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 -0.55 0.79 3.28 1.08 0.00 -1.26 -4.56 105.19 103.97 2jer n GLY 167 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.10 2.02 0.00 2.61 2.01 -1.26 -0.73 115.64 118.19 2jer s THR 168 Ca 0.00 -1.07 0.07 0.00 0.31 0.00 0.00 61.69 61.00 2jer s THR 168 Cb 0.00 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 2jer s THR 168 CO 0.00 0.57 -0.22 0.54 -0.69 0.00 0.00 174.62 174.81 2jer s VAL 169 N -0.36 1.78 -0.13 3.82 0.11 -0.46 -2.24 120.40 122.92 2jer s VAL 169 Ca 0.03 -1.05 0.01 0.00 -2.93 0.00 0.00 61.98 58.04 2jer s VAL 169 Cb -0.12 -1.49 -0.01 0.00 -1.53 0.00 0.00 36.38 33.23 2jer s VAL 169 CO 0.01 0.43 -0.16 -0.22 -3.33 0.00 0.00 175.10 171.83 2jer s LEU 170 N -0.73 2.52 0.00 2.54 2.96 0.61 -0.39 118.68 126.19 2jer s LEU 170 Ca 0.09 -0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 2jer s LEU 170 Cb -0.09 -1.55 0.00 0.00 0.50 0.00 0.00 46.19 45.05 2jer s LEU 170 CO -0.00 0.15 0.27 1.07 -1.32 0.00 0.00 176.35 176.52 2jer n THR 171 N 3.61 0.00 -5.09 3.68 5.66 -0.53 -0.98 114.28 120.62 2jer n THR 171 Ca -0.18 -1.08 -0.28 0.00 -3.05 0.00 0.00 64.05 59.45 2jer n THR 171 Cb 0.53 0.65 -0.16 0.00 -1.55 0.00 0.00 70.33 69.80 2jer n THR 171 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2jer s THR 172 N -2.67 1.75 0.23 1.09 -4.23 -1.26 -0.72 115.64 109.83 2jer s THR 172 Ca 0.18 -0.94 -0.07 0.00 -1.18 0.00 0.00 61.69 59.68 2jer s THR 172 Cb -0.00 -1.45 0.20 0.00 1.34 0.00 0.00 72.50 72.58 2jer s THR 172 CO 0.13 0.49 1.84 -0.33 -0.54 0.00 0.00 174.62 176.21 2jer h GLU 173 N 5.60 1.22 -0.99 3.99 5.08 -0.71 -2.48 114.58 126.30 2jer h GLU 173 Ca -0.40 -0.17 0.13 0.00 -1.00 0.00 0.00 59.36 57.92 2jer h GLU 173 Cb 1.13 -0.23 -0.08 0.00 0.50 0.00 0.00 28.75 30.07 2jer h GLU 173 CO 0.48 0.92 0.62 1.98 -1.00 0.00 0.00 179.01 182.01 2jer h MET 174 N 1.22 0.91 0.00 2.33 4.05 -1.54 -1.92 114.93 119.98 2jer h MET 174 Ca 0.30 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.66 2jer h MET 174 Cb 0.08 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 30.68 2jer h MET 174 CO -0.04 0.60 -0.09 0.00 0.23 0.00 0.00 176.91 177.62 2jer h LEU 176 N -0.86 0.00 -2.03 0.00 4.07 -1.42 -2.47 115.31 112.61 2jer h LEU 176 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2jer h LEU 176 Cb 0.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.83 2jer h LEU 176 CO 0.00 0.28 0.00 0.18 -1.08 0.00 0.00 178.44 177.82 2jer n LEU 177 N -3.80 3.00 -4.82 1.67 4.77 -0.72 -4.53 117.00 112.56 2jer n LEU 177 Ca -0.01 -1.38 -0.32 0.00 -0.03 0.00 0.00 56.01 54.26 2jer n LEU 177 Cb 0.37 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 2jer n LEU 177 CO 0.35 0.69 0.71 -0.94 -1.33 0.00 0.00 177.39 176.87 2jer s SER 178 N -1.28 5.89 0.45 -1.43 1.04 -0.93 -4.96 113.70 112.48 2jer s SER 178 Ca 0.38 1.65 0.12 0.00 0.48 0.00 0.00 55.95 58.58 2jer s SER 178 Cb 0.21 -2.51 1.03 0.00 0.10 0.00 0.00 66.02 64.85 2jer s SER 178 CO 0.29 -1.09 2.06 -0.08 0.98 0.00 0.00 173.24 175.39 2jer h GLU 179 N 0.08 0.19 -0.04 4.02 4.81 -1.92 -2.71 114.58 119.01 2jer h GLU 179 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jer h GLU 179 Cb 1.21 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2jer h GLU 179 CO 0.59 0.20 0.00 0.41 -0.73 0.00 0.00 179.01 179.47 2jer n GLY 180 N -1.32 -0.19 0.00 1.92 0.00 -1.26 -4.17 105.19 100.17 2jer n GLY 180 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.07 0.00 -3.17 1.61 5.12 -1.02 -4.11 116.66 115.02 2jer n ARG 181 Ca 0.19 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.87 2jer n ARG 181 Cb 0.29 -0.01 -0.05 0.00 -1.16 0.00 0.00 32.46 31.53 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 -0.47 2.31 0.29 0.55 4.13 -1.26 -4.64 115.26 116.16 2jer n ASN 182 Ca 0.00 -3.21 0.19 0.00 1.68 0.00 0.00 54.58 53.24 2jer n ASN 182 Cb 0.00 -0.62 0.87 0.00 -1.54 0.00 0.00 39.78 38.49 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 3.49 0.00 0.00 3.52 0.13 -1.76 -1.21 132.00 136.17 2jer h PRO 183 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2jer h PRO 183 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2jer h PRO 183 CO 0.65 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.46 2jer n GLN 184 N -3.01 0.26 -3.49 0.86 1.13 -1.26 -4.85 117.38 107.01 2jer n GLN 184 Ca -0.01 0.26 -0.38 0.00 -1.94 0.00 0.00 57.00 54.94 2jer n GLN 184 Cb 0.21 -1.83 -0.06 0.00 0.11 0.00 0.00 30.24 28.67 2jer n GLN 184 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2jer s LEU 185 N -4.56 4.44 0.85 1.08 1.43 -0.46 -5.09 118.68 116.36 2jer s LEU 185 Ca 0.09 0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 53.98 2jer s LEU 185 Cb 0.12 -2.57 0.10 0.00 0.03 0.00 0.00 46.19 43.87 2jer s LEU 185 CO 0.56 0.28 1.09 -0.94 0.23 0.00 0.00 176.35 177.56 2jer s SER 186 N -0.78 3.89 0.24 2.29 1.04 -1.26 -4.88 113.70 114.24 2jer s SER 186 Ca 0.23 1.54 -0.05 0.00 0.48 0.00 0.00 55.95 58.16 2jer s SER 186 Cb -0.16 -2.24 0.38 0.00 0.10 0.00 0.00 66.02 64.10 2jer s SER 186 CO 0.12 -2.38 1.81 0.50 0.98 0.00 0.00 173.24 174.27 2jer h LYS 187 N -1.37 0.75 -0.62 4.02 3.64 -1.98 -1.55 116.57 119.46 2jer h LYS 187 Ca -0.48 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 58.77 2jer h LYS 187 Cb 1.27 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 2jer h LYS 187 CO 0.55 0.50 0.05 0.93 -2.27 0.00 0.00 179.45 179.21 2jer h GLU 188 N 0.78 1.06 -0.84 1.90 3.07 -1.99 -0.25 114.58 118.31 2jer h GLU 188 Ca 0.39 -0.31 -0.01 0.00 -0.50 0.00 0.00 59.36 58.93 2jer h GLU 188 Cb 0.35 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.11 2jer h GLU 188 CO -0.24 1.01 0.48 0.00 -1.40 0.00 0.00 179.01 178.86 2jer h ALA 189 N 1.01 1.07 -0.33 3.43 0.00 -1.77 -1.50 119.26 121.17 2jer h ALA 189 Ca 0.18 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2jer h ALA 189 Cb 0.50 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2jer h ALA 189 CO 0.02 0.55 0.02 0.82 0.00 0.00 0.00 179.25 180.66 2jer h ILE 190 N 1.16 1.25 -0.77 0.00 2.04 -0.98 -2.47 117.51 117.74 2jer h ILE 190 Ca 0.30 -0.91 0.10 0.00 1.00 0.00 0.00 64.86 65.35 2jer h ILE 190 Cb -0.01 1.20 -0.08 0.00 -0.74 0.00 0.00 36.82 37.19 2jer h ILE 190 CO -0.05 0.30 0.40 -0.33 0.00 0.00 0.00 178.15 178.47 2jer h GLU 191 N 0.38 0.64 -0.50 2.37 5.08 -0.83 -1.82 114.58 119.89 2jer h GLU 191 Ca 0.10 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2jer h GLU 191 Cb 0.41 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2jer h GLU 191 CO 0.01 0.42 0.28 0.37 -1.00 0.00 0.00 179.01 179.10 2jer h GLN 192 N 0.65 0.69 -0.71 2.33 5.75 -1.05 -0.01 115.11 122.77 2jer h GLN 192 Ca 0.38 -0.07 0.03 0.00 -0.15 0.00 0.00 58.65 58.84 2jer h GLN 192 Cb 0.42 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 2jer h GLN 192 CO -0.28 0.53 0.45 0.87 -2.65 0.00 0.00 178.83 177.74 2jer h LYS 193 N 0.66 0.86 -0.38 1.69 1.79 -0.98 0.23 116.57 120.44 2jer h LYS 193 Ca 0.18 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 2jer h LYS 193 Cb 0.03 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.47 2jer h LYS 193 CO -0.03 0.57 0.11 -0.07 -1.08 0.00 0.00 179.45 178.95 2jer h LEU 194 N 0.88 0.55 -0.30 2.94 3.38 -0.90 -1.00 115.31 120.86 2jer h LEU 194 Ca 0.28 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.05 2jer h LEU 194 Cb 0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2jer h LEU 194 CO -0.10 0.62 0.19 0.00 0.09 0.00 0.00 178.44 179.23 2jer h ASP 196 N 0.39 0.91 0.37 0.00 3.32 -0.78 -1.17 116.42 119.45 2jer h ASP 196 Ca 0.12 -0.29 -0.24 0.00 0.02 0.00 0.00 57.03 56.64 2jer h ASP 196 Cb -0.02 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.24 2jer h ASP 196 CO -0.04 1.03 -1.84 -1.22 -1.72 0.00 0.00 179.24 175.45 2jer n TYR 197 N -4.15 0.59 0.45 4.55 4.02 -0.39 -1.31 117.16 120.92 2jer n TYR 197 Ca 0.01 0.20 0.11 0.00 -0.01 0.00 0.00 57.90 58.22 2jer n TYR 197 Cb 0.39 -1.02 -0.02 0.00 -0.02 0.00 0.00 39.34 38.66 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 -2.82 0.56 -2.92 7.72 4.32 -0.35 -4.69 117.00 118.84 2jer n LEU 198 Ca -0.18 -0.01 -0.09 0.00 -0.02 0.00 0.00 56.01 55.71 2jer n LEU 198 Cb 0.96 -0.07 0.04 0.00 -1.62 0.00 0.00 43.42 42.73 2jer n LEU 198 CO 0.44 0.03 0.10 -3.20 -1.22 0.00 0.00 177.39 173.53 2jer n ASN 199 N -2.05 -6.15 -4.43 -1.43 4.05 -0.50 -1.90 115.26 102.84 2jer n ASN 199 Ca 0.01 -0.44 -0.22 0.00 0.45 0.00 0.00 54.58 54.38 2jer n ASN 199 Cb 0.46 -4.48 -0.10 0.00 1.23 0.00 0.00 39.78 36.89 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 -3.24 1.93 -0.02 3.44 -7.23 -0.83 -4.51 120.40 109.94 2jer s VAL 200 Ca 0.28 -2.22 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 2jer s VAL 200 Cb -0.04 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 2jer s VAL 200 CO 0.62 -0.38 0.04 -0.62 -0.31 0.00 0.00 175.10 174.45 2jer n GLU 201 N -0.57 2.97 -4.07 4.82 1.02 0.09 -4.47 120.64 120.42 2jer n GLU 201 Ca -0.06 -0.01 -0.24 0.00 -0.02 0.00 0.00 57.16 56.84 2jer n GLU 201 Cb 0.62 -0.82 -0.17 0.00 -0.02 0.00 0.00 31.44 31.05 2jer n GLU 201 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2jer s LYS 202 N -1.65 1.14 -0.30 3.49 2.20 -0.69 -5.06 119.74 118.87 2jer s LYS 202 Ca -0.00 -0.15 -0.09 0.00 -0.36 0.00 0.00 55.97 55.37 2jer s LYS 202 Cb 0.01 -1.20 -0.00 0.00 -1.51 0.00 0.00 37.83 35.13 2jer s LYS 202 CO 0.05 -0.17 0.13 0.08 -0.36 0.00 0.00 175.35 175.07 2jer s VAL 203 N 1.36 4.41 -0.34 4.02 1.01 -1.26 -1.35 120.40 128.24 2jer s VAL 203 Ca -0.03 -0.48 -0.17 0.00 0.00 0.00 0.00 61.98 61.30 2jer s VAL 203 Cb -0.14 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 2jer s VAL 203 CO -0.03 0.08 0.44 -0.76 0.00 0.00 0.00 175.10 174.83 2jer s LEU 204 N 1.58 4.38 -0.41 3.92 1.43 0.48 -5.00 118.68 125.06 2jer s LEU 204 Ca 0.04 -0.11 -0.15 0.00 -1.03 0.00 0.00 54.13 52.88 2jer s LEU 204 Cb -0.17 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.61 2jer s LEU 204 CO 0.05 -0.40 0.30 0.26 0.23 0.00 0.00 176.35 176.79 2jer s TRP 205 N 2.20 3.24 0.75 0.29 0.52 -1.26 -1.46 118.94 123.21 2jer s TRP 205 Ca 0.15 -0.56 -0.11 0.00 0.02 0.00 0.00 56.10 55.60 2jer s TRP 205 Cb -0.16 -2.60 0.04 0.00 -1.15 0.00 0.00 33.47 29.60 2jer s TRP 205 CO 0.12 -0.58 1.09 -0.51 0.02 0.00 0.00 176.95 177.10 2jer s LEU 206 N 1.70 2.78 0.00 2.99 1.43 0.11 -4.91 118.68 122.78 2jer s LEU 206 Ca 0.05 1.24 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 2jer s LEU 206 Cb -0.19 -3.97 0.00 0.00 0.03 0.00 0.00 46.19 42.07 2jer s LEU 206 CO 0.10 -1.63 0.00 0.61 0.23 0.00 0.00 176.35 175.66 2jer n GLY 207 N -2.53 0.80 3.77 -3.19 0.00 -1.26 -0.82 105.19 101.96 2jer n GLY 207 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2jer n GLY 207 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jer s ASP 208 N -1.00 7.44 0.45 1.61 -0.00 -1.26 -1.57 116.67 122.34 2jer s ASP 208 Ca 0.00 1.84 0.00 0.00 -0.00 0.00 0.00 52.55 54.39 2jer s ASP 208 Cb 0.00 -2.58 0.00 0.00 -0.00 0.00 0.00 42.92 40.34 2jer s ASP 208 CO 0.00 0.04 0.00 0.61 -0.00 0.00 0.00 175.17 175.82 2jer n GLY 209 N 0.96 0.54 0.33 0.21 0.00 -1.26 -4.88 105.19 101.09 2jer n GLY 209 Ca -0.00 -1.92 0.06 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.45 0.00 -3.25 -0.61 -5.35 -1.26 -4.71 119.36 102.73 2jer n ILE 210 Ca 0.00 -0.42 -0.25 0.00 -0.27 0.00 0.00 62.75 61.81 2jer n ILE 210 Cb 0.00 1.17 -0.07 0.00 -1.74 0.00 0.00 39.64 39.01 2jer n ILE 210 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jer n ASP 211 N 0.06 2.39 0.04 7.28 3.85 -1.26 -4.93 116.55 123.98 2jer n ASP 211 Ca 0.05 -3.19 0.07 0.00 -0.71 0.00 0.00 54.79 51.01 2jer n ASP 211 Cb 0.26 -0.64 0.50 0.00 -1.35 0.00 0.00 41.12 39.89 2jer n ASP 211 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.20 177.74 2jer h PRO 212 N 3.81 0.38 0.00 0.11 0.13 -1.88 -2.15 132.00 132.39 2jer h PRO 212 Ca 0.14 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 2jer h PRO 212 Cb 0.74 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 2jer h PRO 212 CO 0.68 0.25 -0.63 0.93 -0.23 0.00 0.00 178.00 178.99 2jer h GLU 213 N 0.39 0.00 0.00 0.86 4.39 -1.95 -3.20 114.58 115.06 2jer h GLU 213 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2jer h GLU 213 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2jer h GLU 213 CO -0.03 0.15 0.00 -1.91 -1.16 0.00 0.00 179.01 176.06 2jer n GLU 214 N -2.97 0.00 -0.08 2.33 4.07 -0.92 -4.71 120.64 118.36 2jer n GLU 214 Ca 0.00 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.22 2jer n GLU 214 Cb 0.63 -0.12 0.33 0.00 -0.06 0.00 0.00 31.44 32.21 2jer n GLU 214 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2jer n THR 215 N -0.58 0.21 -3.30 6.31 -2.24 -1.17 -4.89 114.28 108.63 2jer n THR 215 Ca 0.00 -0.44 -0.18 0.00 -2.27 0.00 0.00 64.05 61.16 2jer n THR 215 Cb 0.00 0.68 0.06 0.00 -2.10 0.00 0.00 70.33 68.97 2jer n THR 215 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2jer n ASN 216 N 0.70 -5.26 -0.50 3.42 3.02 -0.87 -4.25 115.26 111.52 2jer n ASN 216 Ca 0.17 -0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.33 2jer n ASN 216 Cb 0.43 -3.86 0.00 0.00 -0.61 0.00 0.00 39.78 35.74 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 -1.62 0.86 3.58 7.41 0.00 -0.87 -1.63 105.19 112.93 2jer n GLY 217 Ca 0.01 -0.54 -0.49 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.84 1.35 0.28 1.61 8.25 -1.26 -3.98 115.22 119.63 2jer n HIS 218 Ca 0.00 0.67 0.15 0.00 -0.26 0.00 0.00 57.72 58.28 2jer n HIS 218 Cb 0.42 -2.29 0.89 0.00 1.12 0.00 0.00 29.99 30.13 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 2.79 0.55 0.00 1.59 3.04 -1.73 -2.91 116.25 119.57 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 1.34 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2jer h VAL 219 CO 0.72 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.38 2jer n ASP 220 N -3.88 0.00 -0.23 3.17 5.75 -1.06 -0.44 116.55 119.86 2jer n ASP 220 Ca -0.02 -0.23 0.11 0.00 -0.01 0.00 0.00 54.79 54.64 2jer n ASP 220 Cb 0.11 -0.20 0.08 0.00 -1.03 0.00 0.00 41.12 40.08 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 -1.20 1.30 -0.05 -1.12 8.00 -1.10 -3.46 116.55 118.92 2jer n ASP 221 Ca 0.12 -1.05 -0.10 0.00 0.71 0.00 0.00 54.79 54.48 2jer n ASP 221 Cb 0.15 0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 41.74 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 -0.80 0.54 -3.57 2.53 0.31 0.42 -4.63 118.33 113.14 2jer n VAL 222 Ca 0.08 -0.12 -0.17 0.00 -0.01 0.00 0.00 64.34 64.12 2jer n VAL 222 Cb 0.38 -1.64 -0.06 0.00 -0.91 0.00 0.00 33.84 31.61 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 -2.18 -1.58 0.27 3.52 0.00 -0.51 -1.60 121.76 119.68 2jer s ALA 223 Ca -0.13 1.12 -0.08 0.00 0.00 0.00 0.00 51.96 52.87 2jer s ALA 223 Cb 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 2jer s ALA 223 CO 0.17 -0.35 0.44 0.00 0.00 0.00 0.00 175.76 176.01 2jer s PHE 225 N -3.70 3.52 -0.13 0.00 0.08 -1.26 -1.60 117.98 114.89 2jer s PHE 225 Ca 0.27 0.97 0.19 0.00 0.12 0.00 0.00 56.93 58.48 2jer s PHE 225 Cb 0.00 -2.62 -0.20 0.00 -0.57 0.00 0.00 43.02 39.63 2jer s PHE 225 CO 0.13 0.13 0.60 0.44 -0.10 0.00 0.00 175.22 176.41 2jer n ILE 226 N 3.77 0.92 -3.68 0.64 -5.35 -0.50 -4.85 119.36 110.31 2jer n ILE 226 Ca -0.05 -0.67 -0.03 0.00 -0.27 0.00 0.00 62.75 61.72 2jer n ILE 226 Cb 0.51 -0.48 -0.01 0.00 -1.74 0.00 0.00 39.64 37.92 2jer n ILE 226 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jer s ALA 227 N -3.00 -1.80 0.17 -1.28 0.00 -1.22 -4.89 121.76 109.74 2jer s ALA 227 Ca -0.05 0.42 -0.33 0.00 0.00 0.00 0.00 51.96 51.99 2jer s ALA 227 Cb 0.09 0.53 -0.13 0.00 0.00 0.00 0.00 23.12 23.61 2jer s ALA 227 CO 0.84 -0.97 1.62 -2.30 0.00 0.00 0.00 175.76 174.95 2jer n PRO 228 N -0.42 2.32 -0.93 0.00 -0.02 -1.26 -1.72 135.00 132.97 2jer n PRO 228 Ca -0.07 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2jer n PRO 228 Cb 0.61 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 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 3.58 0.89 3.04 -1.23 0.00 -1.26 -5.03 105.19 105.19 2jer n GLY 229 Ca 0.17 0.00 -0.22 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 -0.07 1.21 0.10 1.61 2.02 -0.70 -1.95 118.70 120.92 2jer s GLU 230 Ca 0.00 -0.39 0.06 0.00 0.02 0.00 0.00 54.97 54.66 2jer s GLU 230 Cb 0.00 -1.09 -0.03 0.00 0.10 0.00 0.00 34.13 33.10 2jer s GLU 230 CO 0.00 0.15 -0.15 0.14 0.02 0.00 0.00 175.26 175.41 2jer s VAL 231 N 0.17 1.32 0.01 2.63 -7.23 -0.03 -1.40 120.40 115.86 2jer s VAL 231 Ca -0.04 -1.54 -0.00 0.00 -1.81 0.00 0.00 61.98 58.59 2jer s VAL 231 Cb -0.10 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 2jer s VAL 231 CO 0.01 -0.29 0.09 0.00 -0.31 0.00 0.00 175.10 174.60 2jer s ALA 232 N -1.67 3.62 -0.01 1.32 0.00 -0.63 -0.15 121.76 124.25 2jer s ALA 232 Ca 0.05 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.13 2jer s ALA 232 Cb -0.08 -1.59 0.01 0.00 0.00 0.00 0.00 23.12 21.46 2jer s ALA 232 CO 0.03 0.71 0.00 0.00 0.00 0.00 0.00 175.76 176.50 2jer s ILE 234 N 0.36 2.14 -0.12 0.00 -4.36 -0.63 -0.90 121.20 117.70 2jer s ILE 234 Ca -0.03 0.10 -0.09 0.00 -0.26 0.00 0.00 60.65 60.37 2jer s ILE 234 Cb -0.05 -3.04 0.04 0.00 1.25 0.00 0.00 42.46 40.65 2jer s ILE 234 CO -0.01 -0.01 0.30 -0.47 0.24 0.00 0.00 174.94 174.99 2jer s TYR 235 N -1.37 -0.35 -0.06 1.37 5.04 0.10 -4.77 117.35 117.31 2jer s TYR 235 Ca 0.76 0.84 -0.19 0.00 -2.44 0.00 0.00 57.07 56.05 2jer s TYR 235 Cb -0.38 0.11 0.04 0.00 0.35 0.00 0.00 41.96 42.08 2jer s TYR 235 CO 0.43 -0.19 0.42 -0.08 -1.34 0.00 0.00 175.55 174.79 2jer s THR 236 N 0.53 0.03 -1.71 4.34 -1.32 -1.26 -3.58 115.64 112.67 2jer s THR 236 Ca -0.03 -0.27 0.19 0.00 -1.21 0.00 0.00 61.69 60.37 2jer s THR 236 Cb -0.05 -0.70 -0.00 0.00 -1.51 0.00 0.00 72.50 70.24 2jer s THR 236 CO -0.03 -0.15 0.95 -0.62 -2.21 0.00 0.00 174.62 172.56 2jer n GLU 237 N 1.54 1.52 -2.32 7.08 1.02 -1.26 -4.90 120.64 123.32 2jer n GLU 237 Ca -0.19 -0.91 -0.40 0.00 -0.02 0.00 0.00 57.16 55.63 2jer n GLU 237 Cb 0.56 -1.35 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 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 -2.09 5.86 0.00 1.62 2.15 -1.26 -4.84 116.67 118.11 2jer s ASP 238 Ca 0.15 0.09 0.09 0.00 0.43 0.00 0.00 52.55 53.32 2jer s ASP 238 Cb 0.15 -2.54 0.47 0.00 -0.30 0.00 0.00 42.92 40.69 2jer s ASP 238 CO 0.46 -1.97 1.20 0.00 -0.17 0.00 0.00 175.17 174.69 2jer n GLN 239 N 9.06 0.11 0.01 4.34 6.02 -1.26 -1.80 117.38 133.87 2jer n GLN 239 Ca 0.12 0.22 0.11 0.00 -0.01 0.00 0.00 57.00 57.44 2jer n GLN 239 Cb 0.50 -1.50 0.07 0.00 1.02 0.00 0.00 30.24 30.33 2jer n GLN 239 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2jer n ASN 240 N -1.32 0.68 -4.77 1.08 2.85 -1.26 -4.92 115.26 107.59 2jer n ASN 240 Ca 0.04 -0.44 -0.40 0.00 -0.11 0.00 0.00 54.58 53.67 2jer n ASN 240 Cb 0.08 0.65 0.00 0.00 1.24 0.00 0.00 39.78 41.75 2jer n ASN 240 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2jer s SER 241 N -3.32 6.15 0.58 1.20 0.15 -0.74 -4.91 113.70 112.80 2jer s SER 241 Ca 0.08 2.83 0.32 0.00 0.70 0.00 0.00 55.95 59.88 2jer s SER 241 Cb 0.16 -2.65 1.78 0.00 -1.71 0.00 0.00 66.02 63.60 2jer s SER 241 CO 0.78 -0.98 2.20 1.55 1.20 0.00 0.00 173.24 177.99 2jer h PRO 242 N 2.61 0.00 0.00 5.44 0.13 -1.91 -3.04 132.00 135.22 2jer h PRO 242 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2jer h PRO 242 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2jer h PRO 242 CO 0.62 0.04 -0.39 1.19 -0.23 0.00 0.00 178.00 179.23 2jer n PHE 243 N -3.61 0.12 0.22 1.56 3.72 -1.26 -4.63 117.46 113.57 2jer n PHE 243 Ca -0.02 0.03 -0.16 0.00 -0.05 0.00 0.00 57.45 57.25 2jer n PHE 243 Cb 0.14 -0.39 -0.09 0.00 -0.94 0.00 0.00 39.48 38.20 2jer n PHE 243 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2jer h TYR 244 N 0.00 -1.35 -0.40 1.38 3.20 -1.79 0.03 116.97 118.04 2jer h TYR 244 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2jer h TYR 244 Cb 0.55 0.54 -0.02 0.00 1.54 0.00 0.00 36.73 39.34 2jer h TYR 244 CO 0.00 -0.60 0.24 0.93 -1.64 0.00 0.00 178.16 177.09 2jer h GLU 245 N -0.86 0.54 -0.50 1.82 5.08 -1.84 -1.28 114.58 117.53 2jer h GLU 245 Ca -0.04 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2jer h GLU 245 Cb 0.78 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 2jer h GLU 245 CO -0.13 0.40 0.18 0.00 -1.00 0.00 0.00 179.01 178.45 2jer h ALA 246 N 1.11 0.65 -0.26 3.43 0.00 -1.83 -1.06 119.26 121.31 2jer h ALA 246 Ca 0.14 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2jer h ALA 246 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2jer h ALA 246 CO -0.03 0.29 0.14 0.00 0.00 0.00 0.00 179.25 179.65 2jer h ALA 247 N 1.03 0.31 -0.48 0.00 0.00 -0.84 -1.18 119.26 118.11 2jer h ALA 247 Ca 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2jer h ALA 247 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2jer h ALA 247 CO -0.01 -0.25 0.24 1.96 0.00 0.00 0.00 179.25 181.19 2jer h GLN 248 N 0.29 0.68 -0.55 0.00 1.08 -1.03 -1.00 115.11 114.59 2jer h GLN 248 Ca 0.10 -0.10 -0.11 0.00 -1.45 0.00 0.00 58.65 57.10 2jer h GLN 248 Cb 0.01 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.30 2jer h GLN 248 CO -0.06 0.57 -0.10 0.22 -0.95 0.00 0.00 178.83 178.51 2jer h ASP 249 N 0.63 1.02 -0.63 1.46 3.58 -1.12 -2.23 116.42 119.14 2jer h ASP 249 Ca 0.17 -0.33 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 2jer h ASP 249 Cb 0.10 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.85 2jer h ASP 249 CO -0.02 1.12 0.30 0.00 -2.88 0.00 0.00 179.24 177.76 2jer h ALA 250 N 0.97 0.81 -0.13 -0.78 0.00 -0.93 -0.53 119.26 118.67 2jer h ALA 250 Ca 0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jer h ALA 250 Cb 0.66 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2jer h ALA 250 CO 0.05 0.37 0.06 -0.92 0.00 0.00 0.00 179.25 178.82 2jer h TYR 251 N 0.86 0.18 -0.60 0.00 3.20 -1.12 -1.05 116.97 118.45 2jer h TYR 251 Ca 0.22 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 2jer h TYR 251 Cb 0.12 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 2jer h TYR 251 CO 0.00 0.22 0.21 1.96 -1.64 0.00 0.00 178.16 178.90 2jer h GLN 252 N 0.09 0.89 -0.38 1.82 4.20 -1.27 -2.24 115.11 118.22 2jer h GLN 252 Ca 0.04 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.57 2jer h GLN 252 Cb 0.10 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2jer h GLN 252 CO -0.01 0.75 0.11 0.00 -0.67 0.00 0.00 178.83 179.01 2jer h ARG 253 N 0.87 0.60 -0.23 1.46 3.08 -0.87 -3.10 114.38 116.18 2jer h ARG 253 Ca 0.20 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 2jer h ARG 253 Cb 0.22 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2jer h ARG 253 CO -0.01 0.62 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.26 2jer h LEU 254 N 0.46 0.39 -1.11 3.04 3.38 -0.90 -1.87 115.31 118.70 2jer h LEU 254 Ca 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jer h LEU 254 Cb 0.28 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2jer h LEU 254 CO -0.00 0.58 0.00 -0.07 0.09 0.00 0.00 178.44 179.04 2jer h LEU 255 N 0.36 0.00 -2.61 1.67 3.38 -1.34 -2.31 115.31 114.47 2jer h LEU 255 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jer h LEU 255 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2jer h LEU 255 CO 0.03 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.85 2jer n LYS 256 N -2.60 2.58 -4.36 1.13 5.02 -0.71 -4.93 118.16 114.30 2jer n LYS 256 Ca 0.01 -2.31 -0.35 0.00 -2.02 0.00 0.00 58.31 53.64 2jer n LYS 256 Cb 0.24 -1.45 -0.10 0.00 -0.02 0.00 0.00 35.03 33.71 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 -1.11 3.10 0.05 1.97 -1.94 -0.87 -5.07 119.30 115.43 2jer s MET 257 Ca 0.37 -0.41 0.07 0.00 -1.71 0.00 0.00 55.69 54.00 2jer s MET 257 Cb 0.20 -2.83 -0.03 0.00 2.01 0.00 0.00 34.83 34.18 2jer s MET 257 CO 0.27 0.64 -0.14 0.95 -0.01 0.00 0.00 175.02 176.73 2jer s THR 258 N -0.71 3.08 0.33 2.05 -4.23 -1.26 -2.21 115.64 112.69 2jer s THR 258 Ca 0.11 -1.16 -0.06 0.00 -1.18 0.00 0.00 61.69 59.41 2jer s THR 258 Cb -0.12 -2.35 0.08 0.00 1.34 0.00 0.00 72.50 71.45 2jer s THR 258 CO 0.02 0.28 0.45 -0.90 -0.54 0.00 0.00 174.62 173.93 2jer n ASP 259 N 1.30 -0.01 0.13 3.99 5.68 -0.78 -4.83 116.55 122.03 2jer n ASP 259 Ca -0.15 -1.15 0.11 0.00 -0.50 0.00 0.00 54.79 53.10 2jer n ASP 259 Cb 0.52 -0.35 0.49 0.00 -1.14 0.00 0.00 41.12 40.65 2jer n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jer n ALA 260 N -3.30 1.51 -0.44 2.12 0.00 -1.26 -1.09 120.51 118.04 2jer n ALA 260 Ca -0.07 0.10 0.10 0.00 0.00 0.00 0.00 53.44 53.57 2jer n ALA 260 Cb 0.20 -1.36 0.31 0.00 0.00 0.00 0.00 19.45 18.60 2jer n ALA 260 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jer n LYS 261 N -2.19 3.06 -0.95 0.00 5.02 -1.26 -4.96 118.16 116.87 2jer n LYS 261 Ca 0.01 -2.65 0.00 0.00 -2.02 0.00 0.00 58.31 53.66 2jer n LYS 261 Cb 0.18 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 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 1.26 0.64 3.70 0.72 0.00 -0.25 -4.99 105.19 106.27 2jer n GLY 262 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.25 4.22 0.12 1.61 0.52 -1.26 -4.72 118.95 119.20 2jer s ARG 263 Ca 0.00 2.28 -0.31 0.00 -0.52 0.00 0.00 55.73 57.18 2jer s ARG 263 Cb 0.00 -3.42 -0.09 0.00 0.52 0.00 0.00 34.95 31.96 2jer s ARG 263 CO 0.00 -0.65 1.58 -1.14 0.02 0.00 0.00 175.30 175.11 2jer s GLN 264 N 1.97 4.22 0.07 3.54 2.00 -1.26 -1.88 119.66 128.32 2jer s GLN 264 Ca 0.71 2.32 -0.31 0.00 -2.00 0.00 0.00 55.36 56.08 2jer s GLN 264 Cb -0.40 -3.33 -0.08 0.00 0.80 0.00 0.00 33.01 30.01 2jer s GLN 264 CO 0.31 -0.64 1.52 -0.51 -0.50 0.00 0.00 175.29 175.47 2jer s LEU 265 N 1.70 4.35 -0.10 3.68 1.43 -0.94 -4.93 118.68 123.87 2jer s LEU 265 Ca 0.71 2.36 -0.28 0.00 -1.03 0.00 0.00 54.13 55.88 2jer s LEU 265 Cb -0.42 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.22 2jer s LEU 265 CO 0.31 -0.78 0.93 -0.75 0.23 0.00 0.00 176.35 176.29 2jer s LYS 266 N 2.10 4.41 -0.24 1.70 2.20 -0.82 -4.86 119.74 124.23 2jer s LYS 266 Ca 0.69 1.26 -0.05 0.00 -0.36 0.00 0.00 55.97 57.50 2jer s LYS 266 Cb -0.37 -3.53 -0.01 0.00 -1.51 0.00 0.00 37.83 32.41 2jer s LYS 266 CO 0.30 -0.24 0.00 0.08 -0.36 0.00 0.00 175.35 175.13 2jer s VAL 267 N 1.78 3.71 -0.24 4.02 1.01 -1.26 -0.85 120.40 128.57 2jer s VAL 267 Ca 0.45 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.90 2jer s VAL 267 Cb -0.18 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 2jer s VAL 267 CO 0.18 0.36 0.20 -1.00 0.00 0.00 0.00 175.10 174.84 2jer s HIS 268 N 1.52 3.30 0.41 5.22 0.09 0.79 -4.98 115.29 121.64 2jer s HIS 268 Ca 0.06 0.25 -0.25 0.00 -0.00 0.00 0.00 55.06 55.12 2jer s HIS 268 Cb -0.15 -2.33 -0.08 0.00 -0.00 0.00 0.00 32.58 30.02 2jer s HIS 268 CO -0.01 0.01 1.13 0.15 -0.00 0.00 0.00 174.74 176.02 2jer s LYS 269 N 1.24 4.05 -0.03 1.40 1.02 -1.26 -0.15 119.74 126.01 2jer s LYS 269 Ca 0.09 1.73 0.02 0.00 0.02 0.00 0.00 55.97 57.83 2jer s LYS 269 Cb -0.14 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.57 2jer s LYS 269 CO 0.06 -0.30 -0.09 -1.17 -0.92 0.00 0.00 175.35 172.94 2jer s LEU 270 N -2.60 1.69 1.02 3.17 2.96 -0.08 -4.81 118.68 120.03 2jer s LEU 270 Ca 0.58 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 54.17 2jer s LEU 270 Cb -0.28 -0.58 0.20 0.00 0.50 0.00 0.00 46.19 46.03 2jer s LEU 270 CO 0.35 0.04 1.09 0.00 -1.32 0.00 0.00 176.35 176.51 2jer n PRO 273 N -0.40 2.04 -0.04 0.00 -0.02 -1.26 -4.85 135.00 130.47 2jer n PRO 273 Ca -0.07 0.73 -0.10 0.00 -2.02 0.00 0.00 63.50 62.04 2jer n PRO 273 Cb 0.59 -2.55 0.05 0.00 -0.02 0.00 0.00 33.50 31.57 2jer n PRO 273 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2jer h VAL 274 N 2.04 1.30 -3.39 -1.45 2.07 -1.97 -3.43 116.25 111.41 2jer h VAL 274 Ca -0.50 -1.64 -0.67 0.00 0.82 0.00 0.00 66.70 64.71 2jer h VAL 274 Cb 1.28 1.57 -0.17 0.00 -1.52 0.00 0.00 31.29 32.45 2jer h VAL 274 CO 0.60 0.52 -0.64 -0.54 0.02 0.00 0.00 177.57 177.53 2jer s LYS 275 N -4.21 3.07 0.25 1.57 1.02 -1.26 -5.07 119.74 115.11 2jer s LYS 275 Ca -0.09 -0.45 -0.31 0.00 0.02 0.00 0.00 55.97 55.15 2jer s LYS 275 Cb 0.12 -2.79 -0.13 0.00 -0.52 0.00 0.00 37.83 34.51 2jer s LYS 275 CO 0.85 0.62 1.40 0.09 -0.92 0.00 0.00 175.35 177.39 2jer n ASN 276 N 2.40 2.81 -4.73 2.83 3.02 -1.26 -5.00 115.26 115.33 2jer n ASN 276 Ca -0.18 1.15 -0.39 0.00 -0.03 0.00 0.00 54.58 55.13 2jer n ASN 276 Cb 0.53 -1.44 -0.05 0.00 -0.61 0.00 0.00 39.78 38.21 2jer n ASN 276 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2jer s VAL 277 N -0.17 5.03 0.09 2.41 1.01 -1.26 -5.02 120.40 122.48 2jer s VAL 277 Ca 0.66 1.27 0.06 0.00 0.00 0.00 0.00 61.98 63.97 2jer s VAL 277 Cb -0.63 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 31.76 2jer s VAL 277 CO 0.51 0.32 -0.15 0.42 0.00 0.00 0.00 175.10 176.20 2jer s THR 278 N 0.42 1.24 0.19 3.92 -4.23 -1.26 -0.25 115.64 115.66 2jer s THR 278 Ca 0.33 -1.43 -0.31 0.00 -1.18 0.00 0.00 61.69 59.09 2jer s THR 278 Cb -0.17 -1.24 -0.10 0.00 1.34 0.00 0.00 72.50 72.33 2jer s THR 278 CO 0.16 -0.25 1.51 -0.63 -0.54 0.00 0.00 174.62 174.87 2jer s ILE 279 N -1.47 2.69 0.25 2.99 -1.09 -0.35 -4.93 121.20 119.30 2jer s ILE 279 Ca 0.02 0.52 0.04 0.00 -2.23 0.00 0.00 60.65 59.00 2jer s ILE 279 Cb -0.09 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.43 2jer s ILE 279 CO 0.03 0.05 0.38 -0.54 -1.23 0.00 0.00 174.94 173.63 2jer s LYS 280 N 0.69 3.45 0.00 2.79 1.02 -1.26 -0.79 119.74 125.64 2jer s LYS 280 Ca 0.66 -0.71 0.00 0.00 0.02 0.00 0.00 55.97 55.94 2jer s LYS 280 Cb -0.43 -2.86 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 2jer s LYS 280 CO 0.35 0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.59 2jer n GLY 281 N -1.44 0.00 0.25 -3.33 0.00 -1.26 -2.06 105.19 97.34 2jer n GLY 281 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 2jer n GLY 281 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jer n SER 282 N 0.00 0.00 -4.75 1.61 2.88 -1.26 -4.73 113.62 107.37 2jer n SER 282 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 2jer n SER 282 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 2jer n SER 282 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2jer s PHE 283 N 0.00 3.03 -0.92 0.66 2.99 -0.88 -4.94 117.98 117.93 2jer s PHE 283 Ca 0.00 1.10 -0.15 0.00 0.00 0.00 0.00 56.93 57.89 2jer s PHE 283 Cb 0.00 -3.79 0.20 0.00 0.00 0.00 0.00 43.02 39.43 2jer s PHE 283 CO 0.00 -2.49 0.96 0.15 -0.00 0.00 0.00 175.22 173.84 2jer s LYS 284 N -0.60 3.72 -0.06 0.44 -0.14 -1.26 -4.99 119.74 116.84 2jer s LYS 284 Ca 0.57 -2.38 0.03 0.00 -1.36 0.00 0.00 55.97 52.83 2jer s LYS 284 Cb -0.41 -4.63 0.01 0.00 -1.68 0.00 0.00 37.83 31.12 2jer s LYS 284 CO 0.45 -1.45 -0.14 0.42 -0.76 0.00 0.00 175.35 173.87 2jer s ILE 285 N 0.76 1.22 0.38 2.17 1.01 -1.26 -1.62 121.20 123.86 2jer s ILE 285 Ca 0.25 -0.55 -0.27 0.00 0.00 0.00 0.00 60.65 60.09 2jer s ILE 285 Cb -0.08 -1.09 -0.09 0.00 0.01 0.00 0.00 42.46 41.21 2jer s ILE 285 CO -0.08 0.37 1.26 -1.81 0.00 0.00 0.00 174.94 174.68 2jer s ASP 286 N 0.47 6.49 -0.19 3.58 1.11 0.22 -4.97 116.67 123.39 2jer s ASP 286 Ca -0.12 2.58 -0.12 0.00 0.18 0.00 0.00 52.55 55.07 2jer s ASP 286 Cb -0.14 -2.63 -0.05 0.00 1.07 0.00 0.00 42.92 41.16 2jer s ASP 286 CO 0.03 -0.72 0.24 0.12 1.18 0.00 0.00 175.17 176.02 2jer s PHE 287 N -1.27 3.41 -0.06 4.23 5.36 -1.26 -4.35 117.98 124.05 2jer s PHE 287 Ca 0.55 0.46 -0.00 0.00 -0.96 0.00 0.00 56.93 56.98 2jer s PHE 287 Cb -0.36 -2.30 0.03 0.00 -0.34 0.00 0.00 43.02 40.04 2jer s PHE 287 CO 0.47 0.20 -0.02 0.08 -1.46 0.00 0.00 175.22 174.49 2jer s VAL 288 N 0.63 0.44 0.15 3.12 1.01 -1.26 -5.09 120.40 119.40 2jer s VAL 288 Ca 0.13 0.01 -0.32 0.00 0.00 0.00 0.00 61.98 61.80 2jer s VAL 288 Cb -0.13 -0.54 -0.12 0.00 0.00 0.00 0.00 36.38 35.60 2jer s VAL 288 CO 0.03 0.24 1.76 1.21 0.00 0.00 0.00 175.10 178.34 2jer n GLU 289 N 4.63 2.68 0.00 2.72 4.07 -1.26 -0.78 120.64 132.70 2jer n GLU 289 Ca -0.16 0.97 0.00 0.00 -0.06 0.00 0.00 57.16 57.91 2jer n GLU 289 Cb 0.50 -2.83 0.00 0.00 -0.06 0.00 0.00 31.44 29.06 2jer n GLU 289 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jer n GLY 290 N 4.03 3.26 3.81 8.31 0.00 -1.26 -4.99 105.19 118.35 2jer n GLY 290 Ca 0.17 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 -2.89 5.37 -0.24 2.61 2.01 0.04 -3.61 115.64 118.94 2jer s THR 291 Ca 0.00 0.38 -0.36 0.00 0.31 0.00 0.00 61.69 62.02 2jer s THR 291 Cb 0.00 -3.51 -0.13 0.00 0.01 0.00 0.00 72.50 68.87 2jer s THR 291 CO 0.00 0.53 1.96 0.80 -0.69 0.00 0.00 174.62 177.22 2jer n MET 292 N 2.60 1.49 -1.91 4.92 1.56 -0.22 -4.66 117.12 120.90 2jer n MET 292 Ca -0.16 0.50 -0.38 0.00 -0.27 0.00 0.00 57.70 57.39 2jer n MET 292 Cb 0.53 -2.44 0.03 0.00 2.15 0.00 0.00 33.22 33.49 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 4.75 3.24 -0.46 2.12 0.02 -1.26 -4.91 135.00 138.49 2jer s PRO 293 Ca 1.01 2.09 -0.02 0.00 0.02 0.00 0.00 61.00 64.10 2jer s PRO 293 Cb -0.85 -2.24 0.12 0.00 0.02 0.00 0.00 34.50 31.55 2jer s PRO 293 CO 0.55 -1.07 0.25 1.03 -0.33 0.00 0.00 177.00 177.43 2jer s ARG 294 N -2.92 2.09 0.15 5.54 1.81 -1.26 -5.10 118.95 119.27 2jer s ARG 294 Ca 0.71 -2.04 0.07 0.00 -1.72 0.00 0.00 55.73 52.75 2jer s ARG 294 Cb -0.37 -3.58 -0.04 0.00 -0.45 0.00 0.00 34.95 30.52 2jer s ARG 294 CO 0.43 -1.09 -0.01 -1.21 -0.68 0.00 0.00 175.30 172.75 2jer s GLU 295 N 0.76 2.42 0.12 3.54 2.02 -1.26 -4.98 118.70 121.31 2jer s GLU 295 Ca 0.11 -1.05 -0.36 0.00 0.02 0.00 0.00 54.97 53.70 2jer s GLU 295 Cb -0.22 -2.39 -0.16 0.00 0.10 0.00 0.00 34.13 31.46 2jer s GLU 295 CO -0.04 0.47 1.37 -3.47 0.02 0.00 0.00 175.26 173.62 2jer n ASP 296 N 0.05 1.96 0.00 -0.19 2.03 -1.26 -1.50 116.55 117.64 2jer n ASP 296 Ca -0.10 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.32 2jer n ASP 296 Cb 0.54 -1.25 0.00 0.00 -0.72 0.00 0.00 41.12 39.69 2jer n ASP 296 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jer n GLY 297 N 2.64 1.69 3.67 0.27 0.00 0.03 -5.00 105.19 108.50 2jer n GLY 297 Ca 0.17 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.71 2jer n GLY 297 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jer n ASP 298 N 0.00 2.99 -4.66 1.61 8.00 -0.57 -4.75 116.55 119.17 2jer n ASP 298 Ca 0.00 1.05 -0.43 0.00 0.71 0.00 0.00 54.79 56.12 2jer n ASP 298 Cb 0.00 -1.36 -0.02 0.00 -0.02 0.00 0.00 41.12 39.72 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 2.07 4.62 0.19 0.53 1.01 -1.26 -1.21 121.20 127.15 2jer s ILE 299 Ca 0.85 1.95 -0.16 0.00 0.00 0.00 0.00 60.65 63.29 2jer s ILE 299 Cb -0.74 -4.26 -0.08 0.00 0.01 0.00 0.00 42.46 37.39 2jer s ILE 299 CO 0.45 -0.16 0.63 0.00 0.00 0.00 0.00 174.94 175.86 2jer s ILE 301 N -1.54 4.45 -0.66 0.00 -1.09 -1.26 -4.46 121.20 116.63 2jer s ILE 301 Ca 0.41 -1.85 -0.18 0.00 -2.23 0.00 0.00 60.65 56.81 2jer s ILE 301 Cb -0.15 -5.02 0.13 0.00 -1.58 0.00 0.00 42.46 35.84 2jer s ILE 301 CO 0.20 -1.81 0.75 0.00 -1.23 0.00 0.00 174.94 172.85 2jer s ALA 302 N 3.34 3.53 -0.11 9.38 0.00 -1.26 -4.77 121.76 131.88 2jer s ALA 302 Ca 0.46 -2.49 0.01 0.00 0.00 0.00 0.00 51.96 49.93 2jer s ALA 302 Cb -0.00 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.53 2jer s ALA 302 CO -0.01 -2.39 -0.14 0.45 0.00 0.00 0.00 175.76 173.68 2jer s SER 303 N 3.41 4.00 0.15 0.00 0.15 -1.26 -4.45 113.70 115.71 2jer s SER 303 Ca 0.14 -0.29 0.20 0.00 0.70 0.00 0.00 55.95 56.70 2jer s SER 303 Cb -0.20 -1.38 0.83 0.00 -1.71 0.00 0.00 66.02 63.56 2jer s SER 303 CO 0.02 0.22 1.61 -1.22 1.20 0.00 0.00 173.24 175.06 2jer n TYR 304 N 3.16 0.48 0.28 3.44 4.02 -1.26 -3.01 117.16 124.27 2jer n TYR 304 Ca -0.18 0.19 0.17 0.00 -0.01 0.00 0.00 57.90 58.07 2jer n TYR 304 Cb 0.53 -0.81 0.68 0.00 -0.02 0.00 0.00 39.34 39.72 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 -2.44 -0.72 4.05 -1.85 -3.34 114.93 110.63 2jer h MET 305 Ca 0.00 0.00 -0.44 0.00 -0.28 0.00 0.00 59.70 58.98 2jer h MET 305 Cb 0.31 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.07 2jer h MET 305 CO 0.00 0.01 1.55 -1.71 0.23 0.00 0.00 176.91 176.99 2jer n ASN 306 N -3.11 6.93 -4.93 1.39 2.85 -1.16 -4.80 115.26 112.41 2jer n ASN 306 Ca 0.01 -2.61 -0.21 0.00 -0.11 0.00 0.00 54.58 51.66 2jer n ASN 306 Cb 0.31 -1.46 -0.03 0.00 1.24 0.00 0.00 39.78 39.85 2jer n ASN 306 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 2jer s PHE 307 N 1.14 3.30 -0.20 1.20 -0.12 -1.25 -1.54 117.98 120.51 2jer s PHE 307 Ca 0.67 -0.08 -0.05 0.00 -0.05 0.00 0.00 56.93 57.42 2jer s PHE 307 Cb 0.26 -1.58 -0.02 0.00 -0.63 0.00 0.00 43.02 41.04 2jer s PHE 307 CO -0.05 0.40 -0.00 -1.17 -0.05 0.00 0.00 175.22 174.35 2jer s LEU 308 N -3.97 3.27 -0.17 -1.99 0.20 -0.55 -4.40 118.68 111.07 2jer s LEU 308 Ca 0.35 -0.19 -0.23 0.00 0.69 0.00 0.00 54.13 54.75 2jer s LEU 308 Cb -0.09 -1.82 -0.02 0.00 -0.43 0.00 0.00 46.19 43.83 2jer s LEU 308 CO 0.28 0.08 0.74 -0.63 -0.29 0.00 0.00 176.35 176.53 2jer s ILE 309 N 0.93 4.95 -0.29 6.68 1.01 -1.26 -0.84 121.20 132.38 2jer s ILE 309 Ca 0.01 1.44 -0.02 0.00 0.00 0.00 0.00 60.65 62.08 2jer s ILE 309 Cb -0.14 -4.05 0.12 0.00 0.01 0.00 0.00 42.46 38.39 2jer s ILE 309 CO 0.02 0.08 0.22 0.28 0.00 0.00 0.00 174.94 175.54 2jer s THR 310 N 1.92 -0.24 0.00 2.92 -1.32 -0.03 -4.72 115.64 114.17 2jer s THR 310 Ca 0.34 -0.67 0.00 0.00 -1.21 0.00 0.00 61.69 60.16 2jer s THR 310 Cb -0.16 -0.98 0.00 0.00 -1.51 0.00 0.00 72.50 69.85 2jer s THR 310 CO 0.12 -0.61 0.00 0.59 -2.21 0.00 0.00 174.62 172.52 2jer n ASN 311 N 5.20 0.00 -0.13 8.08 5.03 -1.26 -1.38 115.26 130.80 2jer n ASN 311 Ca -0.03 0.00 0.09 0.00 0.87 0.00 0.00 54.58 55.51 2jer n ASN 311 Cb 0.44 0.00 0.49 0.00 -1.02 0.00 0.00 39.78 39.69 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 5.92 0.38 -4.38 6.41 8.00 -1.26 -4.86 116.55 126.76 2jer n ASP 312 Ca 0.00 -1.50 -0.21 0.00 0.71 0.00 0.00 54.79 53.79 2jer n ASP 312 Cb 0.00 -0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 40.97 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 -1.56 1.55 -0.07 0.44 0.00 -0.48 -0.53 107.32 106.67 2jer s GLY 313 Ca 0.28 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.33 2jer s GLY 313 CO 0.22 -1.76 -0.06 0.14 0.00 0.00 0.00 173.10 171.64 2jer s VAL 314 N -2.61 0.71 -0.35 1.40 1.01 -0.32 -0.85 120.40 119.39 2jer s VAL 314 Ca 0.23 -0.17 -0.11 0.00 0.00 0.00 0.00 61.98 61.93 2jer s VAL 314 Cb -0.03 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.62 2jer s VAL 314 CO 0.09 0.28 0.20 -0.63 0.00 0.00 0.00 175.10 175.04 2jer s ILE 315 N 1.23 4.70 -0.08 2.22 -1.09 -0.02 -0.63 121.20 127.53 2jer s ILE 315 Ca -0.06 -0.62 0.03 0.00 -2.23 0.00 0.00 60.65 57.77 2jer s ILE 315 Cb -0.14 -3.52 -0.02 0.00 -1.58 0.00 0.00 42.46 37.20 2jer s ILE 315 CO -0.02 -0.11 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.73 2jer s VAL 316 N 1.60 2.85 0.43 2.92 1.01 0.07 -1.49 120.40 127.80 2jer s VAL 316 Ca 0.04 -0.77 -0.25 0.00 0.00 0.00 0.00 61.98 60.99 2jer s VAL 316 Cb -0.18 -2.13 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 2jer s VAL 316 CO 0.07 0.56 1.31 -2.65 0.00 0.00 0.00 175.10 174.40 2jer n PRO 317 N 2.86 2.00 -4.30 2.72 -0.02 -1.26 -1.86 135.00 135.14 2jer n PRO 317 Ca -0.18 0.71 -0.24 0.00 -2.02 0.00 0.00 63.50 61.78 2jer n PRO 317 Cb 0.52 -2.45 -0.17 0.00 -0.02 0.00 0.00 33.50 31.38 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 -2.30 1.41 0.00 -0.52 -1.52 -0.33 -4.76 119.66 111.64 2jer s GLN 318 Ca 0.61 -0.28 0.11 0.00 -1.95 0.00 0.00 55.36 53.85 2jer s GLN 318 Cb -0.49 -1.30 0.09 0.00 -0.22 0.00 0.00 33.01 31.10 2jer s GLN 318 CO 0.57 -0.08 0.85 0.66 -0.25 0.00 0.00 175.29 177.05 2jer n TYR 319 N 4.18 0.02 -1.39 0.91 4.02 -1.26 -1.34 117.16 122.30 2jer n TYR 319 Ca -0.20 -0.02 -0.02 0.00 -0.01 0.00 0.00 57.90 57.65 2jer n TYR 319 Cb 0.51 -0.00 -0.01 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 0.59 0.46 3.94 2.72 0.00 -1.26 -4.78 105.19 106.87 2jer n GLY 320 Ca 0.06 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.95 6.34 0.56 1.61 2.15 -1.26 -4.99 116.67 118.13 2jer s ASP 321 Ca 0.00 0.30 0.25 0.00 0.43 0.00 0.00 52.55 53.54 2jer s ASP 321 Cb 0.00 -1.97 1.55 0.00 -0.30 0.00 0.00 42.92 42.21 2jer s ASP 321 CO 0.00 -0.11 2.12 1.05 -0.17 0.00 0.00 175.17 178.06 2jer h GLU 322 N 1.42 0.00 -0.18 4.34 4.11 -1.97 -1.82 114.58 120.48 2jer h GLU 322 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 2jer h GLU 322 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2jer h GLU 322 CO 0.64 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.81 2jer n ASN 323 N -4.08 1.31 -0.04 3.06 5.03 -1.26 -4.38 115.26 114.90 2jer n ASN 323 Ca 0.01 -1.79 -0.08 0.00 0.87 0.00 0.00 54.58 53.59 2jer n ASN 323 Cb 0.27 -0.12 -0.03 0.00 -1.02 0.00 0.00 39.78 38.89 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 1.60 -0.22 -0.45 6.41 3.32 -1.72 -0.81 116.42 124.54 2jer h ASP 324 Ca 0.00 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.01 2jer h ASP 324 Cb 0.36 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2jer h ASP 324 CO 0.00 -0.08 -0.12 -0.09 -1.72 0.00 0.00 179.24 177.23 2jer h ARG 325 N -0.02 0.88 -0.67 3.56 2.43 -1.83 -2.75 114.38 115.97 2jer h ARG 325 Ca 0.10 -0.34 0.09 0.00 -0.81 0.00 0.00 59.98 59.02 2jer h ARG 325 Cb 0.17 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.60 2jer h ARG 325 CO -0.21 0.98 0.32 1.25 -1.51 0.00 0.00 179.97 180.79 2jer h LEU 326 N 0.71 0.40 -0.39 3.80 5.85 -1.76 -1.25 115.31 122.67 2jer h LEU 326 Ca 0.11 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2jer h LEU 326 Cb 0.66 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 2jer h LEU 326 CO 0.05 0.23 0.17 0.00 -0.34 0.00 0.00 178.44 178.54 2jer h ALA 327 N 1.42 0.47 -0.75 1.25 0.00 -0.97 -0.17 119.26 120.51 2jer h ALA 327 Ca 0.33 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.31 2jer h ALA 327 Cb 0.36 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2jer h ALA 327 CO -0.27 -0.21 0.47 -0.07 0.00 0.00 0.00 179.25 179.17 2jer h LEU 328 N 0.34 0.78 -0.50 0.00 3.38 -1.13 -1.29 115.31 116.89 2jer h LEU 328 Ca 0.17 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2jer h LEU 328 Cb 0.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2jer h LEU 328 CO -0.15 0.53 0.32 -0.33 0.09 0.00 0.00 178.44 178.91 2jer h GLU 329 N 0.92 0.67 -0.42 1.13 5.08 -0.65 -0.52 114.58 120.79 2jer h GLU 329 Ca 0.30 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.52 2jer h GLU 329 Cb 0.03 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2jer h GLU 329 CO -0.12 0.46 -0.13 1.96 -1.00 0.00 0.00 179.01 180.18 2jer h GLN 330 N 0.68 0.83 -0.58 2.33 4.20 -0.77 -2.36 115.11 119.44 2jer h GLN 330 Ca 0.18 -0.33 -0.09 0.00 0.06 0.00 0.00 58.65 58.47 2jer h GLN 330 Cb -0.06 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2jer h GLN 330 CO -0.04 0.96 0.02 0.28 -0.67 0.00 0.00 178.83 179.38 2jer h VAL 331 N 0.65 1.26 -0.94 -0.54 2.07 -1.16 -2.66 116.25 114.93 2jer h VAL 331 Ca 0.10 -1.10 0.08 0.00 0.82 0.00 0.00 66.70 66.61 2jer h VAL 331 Cb 0.67 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 2jer h VAL 331 CO 0.05 0.40 0.59 -0.61 0.02 0.00 0.00 177.57 178.01 2jer h GLN 332 N 0.92 0.98 0.00 1.57 5.75 -0.89 -1.43 115.11 122.02 2jer h GLN 332 Ca 0.17 -0.06 -0.11 0.00 -0.15 0.00 0.00 58.65 58.50 2jer h GLN 332 Cb 0.51 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 2jer h GLN 332 CO 0.02 0.65 -0.51 1.79 -2.65 0.00 0.00 178.83 178.13 2jer h THR 333 N 1.01 1.31 -0.12 2.39 1.35 -1.15 -2.24 112.91 115.46 2jer h THR 333 Ca 0.43 -1.79 -0.11 0.00 -0.55 0.00 0.00 66.41 64.39 2jer h THR 333 Cb 0.29 1.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.68 2jer h THR 333 CO -0.21 0.50 -0.39 0.24 -0.25 0.00 0.00 175.52 175.41 2jer h MET 334 N 0.00 0.27 -2.24 4.72 2.86 -1.00 -3.35 114.93 116.20 2jer h MET 334 Ca -0.01 -0.12 -0.59 0.00 -2.06 0.00 0.00 59.70 56.92 2jer h MET 334 Cb 0.94 -0.00 -0.41 0.00 0.06 0.00 0.00 31.60 32.19 2jer h MET 334 CO 0.07 0.62 -0.81 1.19 1.06 0.00 0.00 176.91 179.04 2jer n PHE 335 N -4.04 1.74 0.29 -0.22 3.01 -0.63 -4.98 117.46 112.64 2jer n PHE 335 Ca -0.01 -3.88 0.14 0.00 1.01 0.00 0.00 57.45 54.71 2jer n PHE 335 Cb 0.47 -0.42 0.87 0.00 -0.01 0.00 0.00 39.48 40.40 2jer n PHE 335 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2jer h PRO 336 N 4.38 0.00 -0.46 -1.08 0.13 -1.56 -1.91 132.00 131.50 2jer h PRO 336 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2jer h PRO 336 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 2jer h PRO 336 CO 0.65 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.19 2jer n ASP 337 N -3.85 3.56 -4.87 1.44 10.43 -1.26 -4.95 116.55 117.05 2jer n ASP 337 Ca -0.03 -1.99 -0.21 0.00 2.57 0.00 0.00 54.79 55.13 2jer n ASP 337 Cb 0.11 -0.30 -0.04 0.00 1.84 0.00 0.00 41.12 42.73 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 -1.37 3.04 -0.23 -1.24 1.02 -0.72 -5.00 119.74 115.24 2jer s LYS 338 Ca 0.40 -1.01 -0.20 0.00 0.02 0.00 0.00 55.97 55.19 2jer s LYS 338 Cb 0.23 -2.64 -0.02 0.00 -0.52 0.00 0.00 37.83 34.87 2jer s LYS 338 CO 0.32 0.36 0.59 0.21 -0.92 0.00 0.00 175.35 175.91 2jer s LYS 339 N -3.90 4.15 -0.25 1.68 2.20 0.31 -4.95 119.74 118.98 2jer s LYS 339 Ca 0.34 0.51 -0.14 0.00 -0.36 0.00 0.00 55.97 56.32 2jer s LYS 339 Cb -0.08 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 2jer s LYS 339 CO 0.26 -0.30 0.31 0.42 -0.36 0.00 0.00 175.35 175.68 2jer s ILE 340 N 2.11 5.24 -0.21 5.43 -1.09 -1.26 -1.17 121.20 130.26 2jer s ILE 340 Ca 0.26 0.46 0.02 0.00 -2.23 0.00 0.00 60.65 59.15 2jer s ILE 340 Cb -0.16 -3.64 0.04 0.00 -1.58 0.00 0.00 42.46 37.12 2jer s ILE 340 CO 0.09 0.24 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.20 2jer s VAL 341 N 1.60 1.97 0.18 2.92 1.01 0.19 -4.97 120.40 123.31 2jer s VAL 341 Ca 0.13 -1.15 -0.25 0.00 0.00 0.00 0.00 61.98 60.71 2jer s VAL 341 Cb -0.15 -1.93 -0.08 0.00 0.00 0.00 0.00 36.38 34.22 2jer s VAL 341 CO 0.08 0.28 0.78 -0.83 0.00 0.00 0.00 175.10 175.41 2jer s GLY 342 N 1.27 2.90 -0.03 4.51 0.00 -1.26 -0.75 107.32 113.95 2jer s GLY 342 Ca -0.01 0.35 0.03 0.00 0.00 0.00 0.00 44.72 45.10 2jer s GLY 342 CO -0.09 0.85 -0.11 0.14 0.00 0.00 0.00 173.10 173.88 2jer s VAL 343 N -1.19 0.97 -0.37 1.40 1.01 -0.78 -4.91 120.40 116.53 2jer s VAL 343 Ca 0.37 -0.46 -0.28 0.00 0.00 0.00 0.00 61.98 61.60 2jer s VAL 343 Cb -0.23 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.29 2jer s VAL 343 CO 0.26 0.30 1.67 0.20 0.00 0.00 0.00 175.10 177.53 2jer s ASN 344 N 0.17 6.01 -0.08 3.32 0.01 -1.26 -1.19 114.94 121.92 2jer s ASN 344 Ca -0.04 1.10 0.12 0.00 -0.71 0.00 0.00 52.86 53.33 2jer s ASN 344 Cb -0.10 -2.53 0.21 0.00 0.41 0.00 0.00 41.25 39.24 2jer s ASN 344 CO 0.01 -1.65 1.10 0.35 -1.51 0.00 0.00 177.10 175.41 2jer n THR 345 N 7.29 1.08 -0.22 1.60 -2.24 -0.45 -4.75 114.28 116.59 2jer n THR 345 Ca 0.21 -1.43 0.11 0.00 -2.27 0.00 0.00 64.05 60.66 2jer n THR 345 Cb 0.47 0.13 0.39 0.00 -2.10 0.00 0.00 70.33 69.23 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 3.23 0.89 0.00 2.28 3.04 -1.86 -0.78 116.25 123.06 2jer h VAL 346 Ca -0.02 -0.23 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 2jer h VAL 346 Cb 1.22 0.17 -0.00 0.00 -2.01 0.00 0.00 31.29 30.67 2jer h VAL 346 CO 0.01 0.12 -0.12 -0.33 -1.01 0.00 0.00 177.57 176.24 2jer h GLU 347 N 0.66 0.00 0.09 4.17 4.39 -1.93 -2.01 114.58 119.96 2jer h GLU 347 Ca 0.39 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.81 2jer h GLU 347 Cb 0.58 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.26 2jer h GLU 347 CO -0.15 0.12 -1.13 0.28 -1.16 0.00 0.00 179.01 176.97 2jer h VAL 348 N 0.00 1.31 0.00 3.13 2.07 -1.45 -3.30 116.25 118.00 2jer h VAL 348 Ca -0.00 -2.39 -0.04 0.00 0.82 0.00 0.00 66.70 65.09 2jer h VAL 348 Cb 0.26 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 2jer h VAL 348 CO 0.02 0.72 -0.19 1.62 0.02 0.00 0.00 177.57 179.76 2jer h VAL 349 N 0.22 0.91 -0.38 2.57 3.04 -0.85 -0.94 116.25 120.83 2jer h VAL 349 Ca -0.17 -0.70 0.11 0.00 -1.01 0.00 0.00 66.70 64.94 2jer h VAL 349 Cb 1.81 1.40 -0.02 0.00 -2.01 0.00 0.00 31.29 32.48 2jer h VAL 349 CO 0.22 0.18 0.28 1.88 -1.01 0.00 0.00 177.57 179.12 2jer h TYR 350 N 0.00 0.00 -0.25 3.17 0.99 -1.54 -2.31 116.97 117.03 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 0.39 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.12 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 -1.60 0.94 0.00 3.88 0.00 -0.36 -4.95 105.19 103.10 2jer n GLY 351 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2jer n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 352 N 1.31 1.01 0.00 -0.02 0.00 -0.87 -5.05 105.19 101.57 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 -0.68 1.91 0.00 -0.02 0.00 -1.25 -4.86 105.19 100.29 2jer n GLY 353 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 0.00 0.00 -0.19 1.61 5.15 -1.26 -2.64 115.26 117.93 2jer n ASN 354 Ca 0.00 0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.97 2jer n ASN 354 Cb 0.00 0.00 0.09 0.00 -0.53 0.00 0.00 39.78 39.34 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 0.82 0.00 -1.44 2.04 -1.90 -1.90 117.51 115.13 2jer h ILE 355 Ca 0.00 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.72 2jer h ILE 355 Cb 0.00 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2jer h ILE 355 CO 0.00 0.08 0.00 1.57 0.00 0.00 0.00 178.15 179.80 2jer n HIS 356 N -4.98 0.00 0.00 1.37 -0.00 -0.59 -3.10 115.22 107.93 2jer n HIS 356 Ca 0.07 -0.02 0.00 0.00 0.46 0.00 0.00 57.72 58.23 2jer n HIS 356 Cb 0.23 -0.09 0.00 0.00 -0.12 0.00 0.00 29.99 30.01 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 0.89 0.00 -4.25 3.57 -5.35 -0.72 -4.54 119.36 108.98 2jer n ILE 358 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.29 2jer n ILE 358 Cb 0.02 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.81 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 1.40 -0.10 7.28 -4.23 -1.18 -4.25 115.64 114.56 2jer s THR 359 Ca 0.00 -1.67 -0.03 0.00 -1.18 0.00 0.00 61.69 58.81 2jer s THR 359 Cb 0.00 -1.51 0.04 0.00 1.34 0.00 0.00 72.50 72.37 2jer s THR 359 CO 0.00 -0.34 0.06 -1.58 -0.54 0.00 0.00 174.62 172.22 2jer s GLN 360 N -2.48 0.16 0.58 3.99 2.00 -0.64 -2.61 119.66 120.65 2jer s GLN 360 Ca 0.08 0.10 -0.17 0.00 -2.00 0.00 0.00 55.36 53.37 2jer s GLN 360 Cb -0.06 -1.18 -0.04 0.00 0.80 0.00 0.00 33.01 32.53 2jer s GLN 360 CO 0.03 -0.47 1.07 1.14 -0.50 0.00 0.00 175.29 176.57 2jer s GLN 361 N 2.09 3.32 -0.24 1.67 0.00 -1.26 -0.99 119.66 124.24 2jer s GLN 361 Ca 0.03 1.32 0.02 0.00 -0.00 0.00 0.00 55.36 56.73 2jer s GLN 361 Cb -0.14 -2.03 0.06 0.00 0.00 0.00 0.00 33.01 30.90 2jer s GLN 361 CO -0.06 -0.83 -0.09 -2.00 0.00 0.00 0.00 175.29 172.31 2jer s GLU 362 N -3.83 2.03 0.61 9.60 2.12 0.88 -4.71 118.70 125.41 2jer s GLU 362 Ca 0.66 -1.18 -0.18 0.00 0.36 0.00 0.00 54.97 54.64 2jer s GLU 362 Cb -0.18 -2.74 -0.03 0.00 0.26 0.00 0.00 34.13 31.44 2jer s GLU 362 CO 0.33 -0.56 1.18 -1.25 -0.54 0.00 0.00 175.26 174.42 2jer s PRO 363 N 1.23 2.93 0.40 4.30 0.04 -1.26 0.31 135.00 142.96 2jer s PRO 363 Ca -0.07 1.71 -0.26 0.00 0.04 0.00 0.00 61.00 62.42 2jer s PRO 363 Cb -0.19 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.32 2jer s PRO 363 CO -0.06 -1.21 1.29 0.15 0.04 0.00 0.00 177.00 177.21 2jer s LYS 364 N -3.50 3.98 0.00 4.56 1.02 -0.20 -4.21 119.74 121.39 2jer s LYS 364 Ca 0.75 2.13 0.00 0.00 0.02 0.00 0.00 55.97 58.86 2jer s LYS 364 Cb -0.27 -2.75 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 2jer s LYS 364 CO 0.34 -0.47 0.15 0.54 -0.92 0.00 0.00 175.35 174.99 2jer n ARG 365 N 0.13 0.28 0.00 1.68 1.74 -1.26 -4.93 116.66 114.30 2jer n ARG 365 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 2jer n ARG 365 Cb 0.44 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 2jer n ARG 365 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66