#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 2.54 -0.02 0.00 2.20 -1.26 -4.99 119.74 118.21 2jer s LYS 3 Ca 0.00 -0.81 -0.28 0.00 -0.36 0.00 0.00 55.97 54.52 2jer s LYS 3 Cb 0.00 -2.53 -0.03 0.00 -1.51 0.00 0.00 37.83 33.76 2jer s LYS 3 CO 0.00 0.56 0.89 0.50 -0.36 0.00 0.00 175.35 176.94 2jer s ARG 4 N -2.09 4.52 -0.23 4.03 6.06 -1.26 -1.46 118.95 128.52 2jer s ARG 4 Ca 0.23 1.24 -0.21 0.00 -2.50 0.00 0.00 55.73 54.50 2jer s ARG 4 Cb -0.12 -3.46 -0.02 0.00 0.06 0.00 0.00 34.95 31.42 2jer s ARG 4 CO 0.16 -0.02 0.66 0.42 -2.50 0.00 0.00 175.30 174.01 2jer s ILE 5 N 0.97 4.98 0.00 4.11 -1.09 0.11 -4.90 121.20 125.38 2jer s ILE 5 Ca 0.47 1.22 0.08 0.00 -2.23 0.00 0.00 60.65 60.19 2jer s ILE 5 Cb -0.20 -3.97 -0.02 0.00 -1.58 0.00 0.00 42.46 36.70 2jer s ILE 5 CO 0.25 0.05 -0.24 0.68 -1.23 0.00 0.00 174.94 174.45 2jer s VAL 6 N 2.28 1.87 0.00 2.92 -7.23 -1.26 -4.57 120.40 114.41 2jer s VAL 6 Ca 0.29 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 2jer s VAL 6 Cb -0.16 -1.57 0.00 0.00 0.56 0.00 0.00 36.38 35.21 2jer s VAL 6 CO 0.09 0.45 0.00 0.61 -0.31 0.00 0.00 175.10 175.95 2jer n GLY 7 N 2.29 0.59 3.53 2.32 0.00 -1.26 -5.03 105.19 107.63 2jer n GLY 7 Ca -0.16 -0.23 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.21 -0.06 0.29 1.61 1.04 -1.26 -5.17 113.70 107.94 2jer s SER 8 Ca 0.00 -0.95 0.11 0.00 0.48 0.00 0.00 55.95 55.58 2jer s SER 8 Cb 0.00 0.55 -0.05 0.00 0.10 0.00 0.00 66.02 66.62 2jer s SER 8 CO 0.00 -1.09 -0.10 0.42 0.98 0.00 0.00 173.24 173.45 2jer s THR 9 N -4.02 2.74 0.24 2.02 -4.23 -1.26 -5.02 115.64 106.10 2jer s THR 9 Ca 0.23 -2.18 -0.08 0.00 -1.18 0.00 0.00 61.69 58.48 2jer s THR 9 Cb 0.00 -2.57 0.25 0.00 1.34 0.00 0.00 72.50 71.53 2jer s THR 9 CO 0.08 -0.34 1.65 -0.65 -0.54 0.00 0.00 174.62 174.82 2jer h PRO 10 N 2.06 0.12 -0.14 3.99 0.11 -1.84 -1.14 132.00 135.16 2jer h PRO 10 Ca -0.42 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.70 2jer h PRO 10 Cb 1.25 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2jer h PRO 10 CO 0.62 0.08 0.04 -0.22 -0.21 0.00 0.00 178.00 178.31 2jer h LYS 11 N 0.12 0.10 0.00 1.05 3.64 -1.42 0.26 116.57 120.33 2jer h LYS 11 Ca 0.39 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.75 2jer h LYS 11 Cb 0.66 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2jer h LYS 11 CO -0.61 0.07 -0.04 1.96 -2.27 0.00 0.00 179.45 178.56 2jer h GLN 12 N 0.10 0.00 -0.16 1.90 4.20 -1.62 -1.09 115.11 118.44 2jer h GLN 12 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2jer h GLN 12 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 2jer h GLN 12 CO -0.07 0.04 0.00 -0.25 -0.67 0.00 0.00 178.83 177.87 2jer n ASP 13 N -3.32 2.83 0.00 1.46 8.00 -0.51 -4.94 116.55 120.06 2jer n ASP 13 Ca -0.02 -1.90 0.00 0.00 0.71 0.00 0.00 54.79 53.58 2jer n ASP 13 Cb 0.18 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 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 1.36 0.39 3.86 0.44 0.00 -0.41 -5.03 105.19 105.80 2jer n GLY 14 Ca 0.17 -1.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 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 3.50 0.06 1.61 0.40 -0.04 -4.33 117.98 117.17 2jer s PHE 15 Ca 0.00 0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.75 2jer s PHE 15 Cb 0.00 -1.86 -0.03 0.00 0.51 0.00 0.00 43.02 41.64 2jer s PHE 15 CO 0.00 0.66 -0.08 -0.98 0.70 0.00 0.00 175.22 175.51 2jer s ARG 16 N -1.43 0.62 -0.22 0.44 1.70 -0.07 -3.73 118.95 116.26 2jer s ARG 16 Ca 0.20 -0.87 -0.27 0.00 -0.47 0.00 0.00 55.73 54.32 2jer s ARG 16 Cb -0.12 -0.35 0.00 0.00 -0.57 0.00 0.00 34.95 33.91 2jer s ARG 16 CO 0.10 0.06 0.95 1.41 -1.08 0.00 0.00 175.30 176.74 2jer s MET 17 N -1.95 4.25 0.67 3.89 -2.45 -0.70 -0.56 119.30 122.44 2jer s MET 17 Ca -0.06 1.19 -0.11 0.00 -1.25 0.00 0.00 55.69 55.47 2jer s MET 17 Cb -0.08 -3.63 -0.01 0.00 1.25 0.00 0.00 34.83 32.36 2jer s MET 17 CO -0.00 -0.54 1.05 -1.25 1.05 0.00 0.00 175.02 175.33 2jer s PRO 18 N 2.91 3.20 0.81 4.11 0.04 -1.26 -4.13 135.00 140.68 2jer s PRO 18 Ca 0.41 0.78 -0.13 0.00 0.04 0.00 0.00 61.00 62.10 2jer s PRO 18 Cb -0.15 -2.03 0.08 0.00 0.04 0.00 0.00 34.50 32.44 2jer s PRO 18 CO 0.08 -0.87 1.20 0.20 0.04 0.00 0.00 177.00 177.65 2jer s GLY 19 N -4.05 2.12 0.58 0.56 0.00 -1.26 -4.70 107.32 100.56 2jer s GLY 19 Ca 0.57 0.81 0.37 0.00 0.00 0.00 0.00 44.72 46.46 2jer s GLY 19 CO 0.54 1.23 2.09 -2.09 0.00 0.00 0.00 173.10 174.87 2jer h GLU 20 N -0.95 0.00 -0.03 2.90 4.81 -1.90 -1.46 114.58 117.94 2jer h GLU 20 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2jer h GLU 20 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 2jer h GLU 20 CO 0.46 0.00 0.00 1.97 -0.73 0.00 0.00 179.01 180.71 2jer n PHE 21 N -3.07 0.03 -2.35 0.92 1.16 -1.26 -4.57 117.46 108.32 2jer n PHE 21 Ca -0.00 -0.02 -0.30 0.00 -1.87 0.00 0.00 57.45 55.26 2jer n PHE 21 Cb 0.24 0.00 -0.01 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 -1.97 3.65 0.42 3.97 2.02 -0.55 -4.89 118.70 121.35 2jer s GLU 22 Ca 0.39 0.54 -0.26 0.00 0.02 0.00 0.00 54.97 55.67 2jer s GLU 22 Cb 0.20 -2.24 -0.10 0.00 0.10 0.00 0.00 34.13 32.10 2jer s GLU 22 CO 0.33 -0.33 1.30 -2.30 0.02 0.00 0.00 175.26 174.28 2jer n PRO 23 N -2.21 2.00 -5.15 0.39 -0.02 -1.26 -4.69 135.00 124.06 2jer n PRO 23 Ca 0.04 0.71 -0.32 0.00 -2.02 0.00 0.00 63.50 61.91 2jer n PRO 23 Cb 0.54 -2.43 -0.15 0.00 -0.02 0.00 0.00 33.50 31.44 2jer n PRO 23 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2jer s GLN 24 N -2.23 2.49 0.02 -0.52 -0.21 -1.26 -1.14 119.66 116.80 2jer s GLN 24 Ca 0.61 -0.84 -0.15 0.00 0.02 0.00 0.00 55.36 54.99 2jer s GLN 24 Cb -0.50 -2.22 -0.35 0.00 1.00 0.00 0.00 33.01 30.94 2jer s GLN 24 CO 0.58 0.48 0.95 1.49 -2.12 0.00 0.00 175.29 176.67 2jer h GLU 25 N 5.78 0.52 -2.65 2.91 4.57 -0.44 -3.42 114.58 121.85 2jer h GLU 25 Ca -0.38 -0.90 0.11 0.00 -1.18 0.00 0.00 59.36 57.01 2jer h GLU 25 Cb 1.16 0.33 -0.08 0.00 -0.16 0.00 0.00 28.75 30.00 2jer h GLU 25 CO 0.49 1.43 0.36 -1.59 -1.18 0.00 0.00 179.01 178.51 2jer s LYS 26 N -2.59 1.38 0.08 1.92 -2.85 -1.09 -4.17 119.74 112.42 2jer s LYS 26 Ca -0.10 -0.72 0.06 0.00 -1.00 0.00 0.00 55.97 54.20 2jer s LYS 26 Cb 0.04 0.50 -0.03 0.00 -2.06 0.00 0.00 37.83 36.28 2jer s LYS 26 CO 0.93 -0.63 -0.15 0.08 0.10 0.00 0.00 175.35 175.69 2jer s VAL 27 N -3.56 1.21 0.15 1.79 1.01 -0.24 -0.18 120.40 120.58 2jer s VAL 27 Ca 0.10 -1.39 0.11 0.00 0.00 0.00 0.00 61.98 60.80 2jer s VAL 27 Cb -0.03 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 2jer s VAL 27 CO 0.01 -0.23 -0.25 0.26 0.00 0.00 0.00 175.10 174.89 2jer s TRP 28 N -1.37 2.23 -0.08 5.22 0.52 -0.33 -0.77 118.94 124.35 2jer s TRP 28 Ca 0.00 -0.38 -0.23 0.00 0.02 0.00 0.00 56.10 55.51 2jer s TRP 28 Cb -0.09 -1.16 0.05 0.00 -1.15 0.00 0.00 33.47 31.12 2jer s TRP 28 CO 0.03 0.39 0.53 1.41 0.02 0.00 0.00 176.95 179.33 2jer s MET 29 N -2.32 0.83 -0.09 4.98 1.75 -0.51 -1.53 119.30 122.40 2jer s MET 29 Ca 0.16 0.26 -0.05 0.00 -1.25 0.00 0.00 55.69 54.81 2jer s MET 29 Cb -0.09 0.39 -0.04 0.00 2.84 0.00 0.00 34.83 37.93 2jer s MET 29 CO 0.07 -0.22 0.10 0.42 -0.65 0.00 0.00 175.02 174.75 2jer s ILE 30 N -0.83 5.13 0.00 10.11 1.01 -1.26 -1.05 121.20 134.31 2jer s ILE 30 Ca -0.09 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.27 2jer s ILE 30 Cb -0.03 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 2jer s ILE 30 CO 0.06 0.57 1.07 0.86 0.00 0.00 0.00 174.94 177.49 2jer s TRP 31 N -1.03 3.54 0.33 3.97 -0.11 0.10 -4.81 118.94 120.92 2jer s TRP 31 Ca 0.16 1.53 -0.14 0.00 1.22 0.00 0.00 56.10 58.87 2jer s TRP 31 Cb -0.12 -3.24 -0.09 0.00 -1.50 0.00 0.00 33.47 28.52 2jer s TRP 31 CO 0.06 -0.52 0.73 -1.25 -4.62 0.00 0.00 176.95 171.35 2jer s PRO 32 N 1.25 3.98 0.00 5.86 0.04 -1.26 -4.76 135.00 140.10 2jer s PRO 32 Ca 0.54 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.22 2jer s PRO 32 Cb -0.23 -2.43 0.00 0.00 0.04 0.00 0.00 34.50 31.87 2jer s PRO 32 CO 0.27 0.15 0.00 -0.85 0.04 0.00 0.00 177.00 176.60 2jer n GLU 33 N -0.44 0.00 -1.90 4.56 0.28 -1.26 -4.75 120.64 117.13 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 -0.43 4.19 0.00 3.44 1.70 -1.26 -4.15 118.95 122.44 2jer s ARG 34 Ca 0.00 2.38 0.26 0.00 -0.47 0.00 0.00 55.73 57.91 2jer s ARG 34 Cb 0.00 -3.38 1.20 0.00 -0.57 0.00 0.00 34.95 32.20 2jer s ARG 34 CO 0.00 -0.69 1.87 -0.35 -1.08 0.00 0.00 175.30 175.05 2jer n PRO 35 N 4.83 0.13 -0.10 3.89 -0.04 -1.26 -0.90 135.00 141.55 2jer n PRO 35 Ca 0.15 0.04 0.10 0.00 -0.04 0.00 0.00 63.50 63.76 2jer n PRO 35 Cb 0.39 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.69 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 -1.43 1.88 0.02 3.54 5.75 -1.26 -0.79 116.55 124.26 2jer n ASP 36 Ca 0.08 -1.76 0.00 0.00 -0.01 0.00 0.00 54.79 53.10 2jer n ASP 36 Cb 0.28 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 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 0.47 0.29 -4.67 -1.12 4.05 -0.94 -4.73 115.26 108.61 2jer n ASN 37 Ca 0.16 0.05 -0.38 0.00 0.45 0.00 0.00 54.58 54.86 2jer n ASN 37 Cb 0.36 -0.08 -0.08 0.00 1.23 0.00 0.00 39.78 41.21 2jer n ASN 37 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2jer s TRP 38 N -2.00 3.36 0.70 1.20 0.52 -0.08 -4.77 118.94 117.87 2jer s TRP 38 Ca 0.00 0.53 -0.15 0.00 0.02 0.00 0.00 56.10 56.49 2jer s TRP 38 Cb 0.00 -2.46 0.02 0.00 -1.15 0.00 0.00 33.47 29.88 2jer s TRP 38 CO 0.00 0.02 1.18 -0.98 0.02 0.00 0.00 176.95 177.18 2jer s ARG 39 N 1.22 2.40 -1.49 4.98 1.70 -1.26 -3.47 118.95 123.03 2jer s ARG 39 Ca 0.16 1.65 -0.07 0.00 -0.47 0.00 0.00 55.73 57.01 2jer s ARG 39 Cb -0.14 -1.88 0.02 0.00 -0.57 0.00 0.00 34.95 32.38 2jer s ARG 39 CO 0.07 -1.61 0.75 -0.25 -1.08 0.00 0.00 175.30 173.19 2jer n ASP 40 N -2.53 -5.91 -2.28 -2.89 8.00 -0.53 -1.57 116.55 108.84 2jer n ASP 40 Ca 0.12 -0.38 -0.21 0.00 0.71 0.00 0.00 54.79 55.04 2jer n ASP 40 Cb 0.51 -4.74 -0.02 0.00 -0.02 0.00 0.00 41.12 36.84 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 -1.62 -0.12 2.39 0.44 0.00 -1.23 -1.89 105.19 103.16 2jer n GLY 41 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.91 0.82 0.06 -0.02 0.00 -0.61 -4.81 105.19 99.72 2jer n GLY 42 Ca -0.24 0.00 -0.12 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 2.65 0.07 -0.52 1.61 1.79 -1.48 0.97 116.57 121.65 2jer h LYS 43 Ca 0.00 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 2jer h LYS 43 Cb 0.00 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 2jer h LYS 43 CO 0.00 0.18 0.30 -1.35 -1.08 0.00 0.00 179.45 177.50 2jer h PRO 44 N -0.05 0.72 -0.08 3.15 0.11 -1.82 -2.60 132.00 131.44 2jer h PRO 44 Ca 0.02 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 65.97 2jer h PRO 44 Cb 0.13 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 2jer h PRO 44 CO -0.00 0.55 -0.34 -0.24 -0.21 0.00 0.00 178.00 177.75 2jer h VAL 45 N 0.70 1.27 -0.97 3.15 3.04 -1.81 -2.49 116.25 119.14 2jer h VAL 45 Ca 0.19 -1.29 -0.00 0.00 -1.01 0.00 0.00 66.70 64.58 2jer h VAL 45 Cb 0.02 1.59 -0.05 0.00 -2.01 0.00 0.00 31.29 30.85 2jer h VAL 45 CO -0.03 0.38 0.60 1.56 -1.01 0.00 0.00 177.57 179.07 2jer h GLN 46 N 0.13 1.30 -0.69 4.17 4.20 -0.47 0.75 115.11 124.50 2jer h GLN 46 Ca 0.02 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 2jer h GLN 46 Cb 0.67 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 2jer h GLN 46 CO 0.05 0.90 0.33 1.49 -0.67 0.00 0.00 178.83 180.93 2jer h GLU 47 N 1.33 1.00 -0.10 1.46 4.81 -1.09 -0.38 114.58 121.60 2jer h GLU 47 Ca 0.35 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 2jer h GLU 47 Cb -0.08 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.11 2jer h GLU 47 CO -0.07 0.79 0.03 0.00 -0.73 0.00 0.00 179.01 179.03 2jer h ALA 48 N 1.16 0.13 -0.94 2.92 0.00 -0.91 -1.00 119.26 120.61 2jer h ALA 48 Ca 0.24 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2jer h ALA 48 Cb 0.12 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2jer h ALA 48 CO -0.03 -0.26 0.62 0.74 0.00 0.00 0.00 179.25 180.32 2jer h PHE 49 N -0.04 1.14 -0.32 0.00 -1.00 -0.78 -0.12 116.94 115.83 2jer h PHE 49 Ca 0.03 0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.86 2jer h PHE 49 Cb 0.22 -0.38 -0.02 0.00 3.61 0.00 0.00 35.95 39.38 2jer h PHE 49 CO -0.00 0.66 0.17 1.15 -1.61 0.00 0.00 178.31 178.67 2jer h THR 50 N 1.18 1.00 -0.81 -1.55 2.02 -0.73 0.55 112.91 114.57 2jer h THR 50 Ca 0.38 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.40 2jer h THR 50 Cb 0.02 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.02 2jer h THR 50 CO -0.12 0.06 0.35 0.78 0.37 0.00 0.00 175.52 176.97 2jer h ASN 51 N 0.35 1.09 -0.11 4.18 2.35 -0.47 0.48 115.58 123.45 2jer h ASN 51 Ca 0.13 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 2jer h ASN 51 Cb 0.03 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.12 2jer h ASN 51 CO -0.08 0.94 0.03 0.58 -1.65 0.00 0.00 177.43 177.25 2jer h VAL 52 N 1.16 1.19 -0.73 2.81 2.07 -0.69 -0.62 116.25 121.46 2jer h VAL 52 Ca 0.27 -0.59 0.04 0.00 0.82 0.00 0.00 66.70 67.24 2jer h VAL 52 Cb 0.17 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2jer h VAL 52 CO -0.03 0.17 0.45 0.00 0.02 0.00 0.00 177.57 178.18 2jer h ALA 53 N 0.82 0.96 -0.53 1.67 0.00 -0.63 -0.86 119.26 120.69 2jer h ALA 53 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2jer h ALA 53 Cb 0.25 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2jer h ALA 53 CO 0.00 0.22 0.32 0.87 0.00 0.00 0.00 179.25 180.66 2jer h LYS 54 N 0.87 0.72 -0.48 0.00 1.57 -0.77 -1.05 116.57 117.43 2jer h LYS 54 Ca 0.30 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 2jer h LYS 54 Cb 0.06 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2jer h LYS 54 CO -0.13 0.52 0.27 0.00 -0.57 0.00 0.00 179.45 179.54 2jer h ALA 55 N 1.16 0.61 -0.51 3.86 0.00 -0.41 -2.87 119.26 121.10 2jer h ALA 55 Ca 0.19 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2jer h ALA 55 Cb -0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2jer h ALA 55 CO -0.04 0.12 0.19 0.82 0.00 0.00 0.00 179.25 180.34 2jer h ILE 56 N 0.63 1.22 -0.08 0.00 2.04 -0.88 -2.94 117.51 117.50 2jer h ILE 56 Ca 0.17 -0.71 0.02 0.00 1.00 0.00 0.00 64.86 65.34 2jer h ILE 56 Cb 0.03 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2jer h ILE 56 CO -0.03 0.27 0.17 0.77 0.00 0.00 0.00 178.15 179.33 2jer h SER 57 N 0.69 0.00 1.00 1.72 4.64 -0.97 0.13 113.55 120.76 2jer h SER 57 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2jer h SER 57 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2jer h SER 57 CO -0.01 0.00 0.00 0.06 -0.87 0.00 0.00 176.83 176.01 2jer h GLN 58 N 0.00 0.00 0.00 4.77 3.07 -1.49 -3.32 115.11 118.14 2jer h GLN 58 Ca 0.04 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.59 2jer h GLN 58 Cb 0.37 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.90 2jer h GLN 58 CO -0.00 0.00 -1.71 1.19 0.09 0.00 0.00 178.83 178.40 2jer n PHE 59 N -2.90 0.00 -3.69 0.06 3.72 0.32 -5.07 117.46 109.90 2jer n PHE 59 Ca 0.01 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.29 2jer n PHE 59 Cb 0.30 -0.50 -0.09 0.00 -0.94 0.00 0.00 39.48 38.24 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 -2.25 -0.01 0.20 4.37 2.01 -0.52 -4.72 115.64 114.72 2jer s THR 60 Ca -0.07 0.02 -0.32 0.00 0.31 0.00 0.00 61.69 61.63 2jer s THR 60 Cb 0.03 -0.71 -0.14 0.00 0.01 0.00 0.00 72.50 71.69 2jer s THR 60 CO 0.40 0.01 1.35 -2.65 -0.69 0.00 0.00 174.62 173.04 2jer n PRO 61 N 3.31 1.72 -4.52 4.92 -0.02 -1.26 -3.71 135.00 135.44 2jer n PRO 61 Ca -0.16 0.61 -0.30 0.00 -2.02 0.00 0.00 63.50 61.63 2jer n PRO 61 Cb 0.56 -2.24 -0.12 0.00 -0.02 0.00 0.00 33.50 31.69 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 -0.16 1.88 -0.02 -0.52 1.75 -1.26 -1.08 119.30 119.89 2jer s MET 62 Ca 0.72 -1.10 -0.01 0.00 -1.25 0.00 0.00 55.69 54.05 2jer s MET 62 Cb -0.74 -2.12 0.02 0.00 2.84 0.00 0.00 34.83 34.83 2jer s MET 62 CO 0.49 0.51 0.05 -0.80 -0.65 0.00 0.00 175.02 174.61 2jer s ASN 63 N -1.75 -0.01 -0.04 1.11 0.01 0.05 -2.08 114.94 112.23 2jer s ASN 63 Ca 0.16 0.09 0.04 0.00 -0.71 0.00 0.00 52.86 52.44 2jer s ASN 63 Cb -0.10 0.04 -0.00 0.00 0.41 0.00 0.00 41.25 41.60 2jer s ASN 63 CO 0.07 -0.07 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.76 2jer s VAL 64 N 0.51 1.19 0.06 1.60 1.01 -0.23 -1.43 120.40 123.13 2jer s VAL 64 Ca -0.04 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.42 2jer s VAL 64 Cb -0.06 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 2jer s VAL 64 CO -0.02 0.35 -0.11 0.68 0.00 0.00 0.00 175.10 176.00 2jer s VAL 65 N 0.11 3.28 -0.03 2.92 -7.23 -0.21 -1.20 120.40 118.04 2jer s VAL 65 Ca -0.04 -1.14 -0.22 0.00 -1.81 0.00 0.00 61.98 58.78 2jer s VAL 65 Cb -0.11 -2.47 0.04 0.00 0.56 0.00 0.00 36.38 34.40 2jer s VAL 65 CO 0.02 0.23 0.47 0.54 -0.31 0.00 0.00 175.10 176.05 2jer s VAL 66 N -1.09 0.03 0.97 1.32 0.11 -0.06 -0.72 120.40 120.96 2jer s VAL 66 Ca 0.19 -0.26 -0.11 0.00 -2.93 0.00 0.00 61.98 58.87 2jer s VAL 66 Cb -0.11 -0.78 0.16 0.00 -1.53 0.00 0.00 36.38 34.12 2jer s VAL 66 CO 0.10 -0.14 1.02 -1.54 -3.33 0.00 0.00 175.10 171.21 2jer n SER 67 N 1.15 -0.35 -0.20 3.54 3.41 -1.22 -0.03 113.62 119.92 2jer n SER 67 Ca -0.20 0.29 -0.02 0.00 -0.26 0.00 0.00 58.87 58.68 2jer n SER 67 Cb 0.56 -1.40 0.05 0.00 -0.26 0.00 0.00 64.21 63.17 2jer n SER 67 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2jer h GLN 68 N -2.02 -0.02 -0.43 4.33 4.15 -1.97 -1.59 115.11 117.57 2jer h GLN 68 Ca -0.47 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 58.83 2jer h GLN 68 Cb 1.28 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 2jer h GLN 68 CO 0.42 -0.01 -0.23 0.37 -1.93 0.00 0.00 178.83 177.45 2jer h GLN 69 N -0.02 0.87 -0.00 1.69 -0.00 -2.01 -3.11 115.11 112.53 2jer h GLN 69 Ca 0.28 -0.36 0.00 0.00 -0.00 0.00 0.00 58.65 58.57 2jer h GLN 69 Cb 0.45 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 27.90 2jer h GLN 69 CO -0.62 1.00 -0.29 1.04 0.00 0.00 0.00 178.83 179.97 2jer n GLN 70 N -4.11 0.49 -0.09 1.69 1.13 -1.06 -4.45 117.38 110.98 2jer n GLN 70 Ca 0.00 -0.25 -0.07 0.00 -1.94 0.00 0.00 57.00 54.74 2jer n GLN 70 Cb 0.45 -1.49 -0.01 0.00 0.11 0.00 0.00 30.24 29.30 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 0.62 -0.66 -0.46 1.08 3.04 -1.22 0.18 116.94 119.52 2jer h PHE 71 Ca 0.00 0.05 -0.04 0.00 3.98 0.00 0.00 57.97 61.95 2jer h PHE 71 Cb 0.47 0.34 -0.02 0.00 2.56 0.00 0.00 35.95 39.31 2jer h PHE 71 CO 0.00 -0.32 0.12 1.96 -2.02 0.00 0.00 178.31 178.05 2jer h GLN 72 N -0.21 0.74 -0.30 1.11 4.20 -1.82 -0.62 115.11 118.21 2jer h GLN 72 Ca 0.17 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2jer h GLN 72 Cb 0.47 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2jer h GLN 72 CO -0.46 0.72 0.14 -0.97 -0.67 0.00 0.00 178.83 177.59 2jer h ASN 73 N 0.62 0.40 -0.32 1.46 -1.24 -1.73 -1.78 115.58 112.98 2jer h ASN 73 Ca 0.15 -0.13 0.06 0.00 0.71 0.00 0.00 56.30 57.08 2jer h ASN 73 Cb 0.31 -0.10 -0.05 0.00 0.73 0.00 0.00 38.32 39.20 2jer h ASN 73 CO -0.00 0.41 0.01 0.00 -1.29 0.00 0.00 177.43 176.57 2jer h ARG 75 N 0.11 0.86 -0.46 0.00 9.65 -0.97 -1.51 114.38 122.06 2jer h ARG 75 Ca 0.16 -0.12 -0.11 0.00 -1.10 0.00 0.00 59.98 58.80 2jer h ARG 75 Cb 0.20 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 2jer h ARG 75 CO -0.25 0.69 -0.15 0.00 2.80 0.00 0.00 179.97 183.07 2jer h ARG 76 N 0.85 0.91 -0.16 0.20 2.47 -0.50 -3.26 114.38 114.89 2jer h ARG 76 Ca 0.21 -0.37 -0.16 0.00 -1.26 0.00 0.00 59.98 58.40 2jer h ARG 76 Cb 0.14 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 2jer h ARG 76 CO -0.02 1.02 -0.57 1.96 0.56 0.00 0.00 179.97 182.92 2jer h GLN 77 N 0.75 0.50 -6.27 0.04 1.08 -0.38 -3.44 115.11 107.39 2jer h GLN 77 Ca 0.11 -0.33 -0.57 0.00 -1.45 0.00 0.00 58.65 56.42 2jer h GLN 77 Cb 0.70 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.13 2jer h GLN 77 CO 0.05 0.93 -0.03 -0.51 -0.95 0.00 0.00 178.83 178.32 2jer s LEU 78 N -8.27 4.49 0.69 1.46 1.43 -0.62 -5.06 118.68 112.79 2jer s LEU 78 Ca -0.07 1.24 -0.16 0.00 -1.03 0.00 0.00 54.13 54.12 2jer s LEU 78 Cb 0.11 -3.00 0.02 0.00 0.03 0.00 0.00 46.19 43.35 2jer s LEU 78 CO 0.83 0.23 1.19 -2.16 0.23 0.00 0.00 176.35 176.68 2jer s PRO 79 N -1.30 2.43 0.58 1.29 0.04 -1.26 -4.89 135.00 131.89 2jer s PRO 79 Ca 0.31 1.71 0.31 0.00 0.04 0.00 0.00 61.00 63.38 2jer s PRO 79 Cb -0.19 -1.87 1.77 0.00 0.04 0.00 0.00 34.50 34.25 2jer s PRO 79 CO 0.19 -1.60 2.20 -1.00 0.04 0.00 0.00 177.00 176.84 2jer h PRO 80 N 0.02 0.00 0.00 0.56 0.13 -1.96 -1.23 132.00 129.52 2jer h PRO 80 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2jer h PRO 80 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2jer h PRO 80 CO 0.52 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.48 2jer n GLU 81 N -3.64 0.17 -3.35 0.86 0.00 -1.26 -4.48 120.64 108.93 2jer n GLU 81 Ca -0.02 0.47 -0.39 0.00 0.00 0.00 0.00 57.16 57.22 2jer n GLU 81 Cb 0.14 -1.86 -0.08 0.00 0.00 0.00 0.00 31.44 29.64 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 -3.34 5.17 0.17 3.84 1.01 -0.47 -4.57 121.20 123.01 2jer s ILE 82 Ca 0.03 0.74 -0.28 0.00 0.00 0.00 0.00 60.65 61.14 2jer s ILE 82 Cb 0.08 -3.75 -0.08 0.00 0.01 0.00 0.00 42.46 38.73 2jer s ILE 82 CO 0.33 0.21 0.86 -0.89 0.00 0.00 0.00 174.94 175.45 2jer s THR 83 N 1.55 4.33 -0.09 2.92 2.01 -0.88 -4.86 115.64 120.61 2jer s THR 83 Ca 0.19 1.89 0.04 0.00 0.31 0.00 0.00 61.69 64.12 2jer s THR 83 Cb -0.15 -4.23 0.00 0.00 0.01 0.00 0.00 72.50 68.13 2jer s THR 83 CO 0.09 0.46 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.57 2jer s VAL 84 N -0.85 1.93 0.07 3.82 1.01 -1.26 -1.07 120.40 124.05 2jer s VAL 84 Ca 0.40 -0.95 0.10 0.00 0.00 0.00 0.00 61.98 61.53 2jer s VAL 84 Cb -0.24 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2jer s VAL 84 CO 0.28 0.53 -0.26 -0.31 0.00 0.00 0.00 175.10 175.34 2jer s TYR 85 N 0.34 2.32 0.18 5.22 1.51 -0.34 -4.99 117.35 121.59 2jer s TYR 85 Ca -0.17 -0.40 -0.30 0.00 -1.01 0.00 0.00 57.07 55.19 2jer s TYR 85 Cb -0.17 -1.35 -0.08 0.00 -0.11 0.00 0.00 41.96 40.25 2jer s TYR 85 CO 0.08 0.19 1.09 -2.00 -1.11 0.00 0.00 175.55 173.80 2jer s GLU 86 N -1.49 4.61 -0.30 -0.62 2.12 -1.26 -0.89 118.70 120.88 2jer s GLU 86 Ca 0.12 1.70 -0.12 0.00 0.36 0.00 0.00 54.97 57.04 2jer s GLU 86 Cb -0.10 -3.28 0.12 0.00 0.26 0.00 0.00 34.13 31.14 2jer s GLU 86 CO 0.03 0.10 0.69 1.41 -0.54 0.00 0.00 175.26 176.96 2jer s MET 87 N -0.42 0.57 0.60 4.30 1.75 0.96 -4.74 119.30 122.33 2jer s MET 87 Ca 0.49 1.34 -0.19 0.00 -1.25 0.00 0.00 55.69 56.07 2jer s MET 87 Cb -0.29 0.69 -0.03 0.00 2.84 0.00 0.00 34.83 38.04 2jer s MET 87 CO 0.35 -0.18 1.29 -1.12 -0.65 0.00 0.00 175.02 174.71 2jer s SER 88 N 2.60 4.93 0.09 1.11 0.01 -1.26 -3.40 113.70 117.78 2jer s SER 88 Ca -0.06 2.61 -0.26 0.00 1.31 0.00 0.00 55.95 59.55 2jer s SER 88 Cb -0.10 -2.62 0.08 0.00 0.21 0.00 0.00 66.02 63.59 2jer s SER 88 CO -0.19 -1.78 0.76 0.54 0.41 0.00 0.00 173.24 172.98 2jer s ASN 89 N -1.32 -0.44 -0.21 2.44 2.20 -1.26 -4.59 114.94 111.76 2jer s ASN 89 Ca 0.78 -0.05 0.09 0.00 -0.94 0.00 0.00 52.86 52.74 2jer s ASN 89 Cb -0.37 0.50 -0.19 0.00 -2.00 0.00 0.00 41.25 39.19 2jer s ASN 89 CO 0.40 -0.82 -0.08 0.59 -2.94 0.00 0.00 177.10 174.26 2jer n ASN 90 N -0.32 1.32 -1.88 3.54 3.02 -1.26 -4.78 115.26 114.89 2jer n ASN 90 Ca -0.12 -0.07 -0.06 0.00 -0.03 0.00 0.00 54.58 54.30 2jer n ASN 90 Cb 0.63 0.26 -0.01 0.00 -0.61 0.00 0.00 39.78 40.05 2jer n ASN 90 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2jer n ASP 91 N -2.95 -0.65 -2.61 6.41 2.03 -1.26 -4.83 116.55 112.68 2jer n ASP 91 Ca -0.37 -1.84 -0.32 0.00 0.52 0.00 0.00 54.79 52.79 2jer n ASP 91 Cb 1.02 1.19 0.02 0.00 -0.72 0.00 0.00 41.12 42.63 2jer n ASP 91 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jer n ALA 92 N -1.96 5.61 -3.49 -1.67 0.00 -1.26 -4.86 120.51 112.87 2jer n ALA 92 Ca -0.06 -4.21 -0.27 0.00 0.00 0.00 0.00 53.44 48.89 2jer n ALA 92 Cb 0.26 -1.07 -0.09 0.00 0.00 0.00 0.00 19.45 18.55 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 -0.52 3.13 0.36 0.00 7.02 -1.26 -4.57 117.44 121.59 2jer n TRP 93 Ca 0.45 -4.12 0.14 0.00 -1.02 0.00 0.00 57.50 52.96 2jer n TRP 93 Cb 0.52 -0.54 0.54 0.00 -2.42 0.00 0.00 31.31 29.41 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 3.34 0.00 -0.75 -0.99 3.04 -1.85 -1.04 116.25 118.00 2jer h VAL 94 Ca 0.18 -0.44 0.14 0.00 -1.01 0.00 0.00 66.70 65.57 2jer h VAL 94 Cb 0.70 1.33 -0.05 0.00 -2.01 0.00 0.00 31.29 31.27 2jer h VAL 94 CO 0.77 0.00 0.50 -0.09 -1.01 0.00 0.00 177.57 177.74 2jer h ARG 95 N 0.00 0.46 0.00 4.17 9.65 -1.70 0.97 114.38 127.93 2jer h ARG 95 Ca 0.00 -0.03 -0.36 0.00 -1.10 0.00 0.00 59.98 58.49 2jer h ARG 95 Cb 0.52 -0.10 -0.07 0.00 -1.39 0.00 0.00 29.97 28.93 2jer h ARG 95 CO 0.00 0.30 -2.35 -0.25 2.80 0.00 0.00 179.97 180.47 2jer n ASP 96 N -4.49 1.22 -0.21 -3.80 8.00 -0.44 -2.32 116.55 114.52 2jer n ASP 96 Ca 0.14 -0.07 0.09 0.00 0.71 0.00 0.00 54.79 55.66 2jer n ASP 96 Cb 0.48 0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 41.81 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 -2.47 1.55 0.51 0.00 0.00 0.34 -3.42 107.32 103.81 2jer s GLY 98 Ca 0.11 -0.46 -0.18 0.00 0.00 0.00 0.00 44.72 44.20 2jer s GLY 98 CO 0.63 0.27 1.01 2.56 0.00 0.00 0.00 173.10 177.56 2jer s PRO 99 N -4.91 3.84 -0.41 2.90 0.04 -1.26 -4.78 135.00 130.41 2jer s PRO 99 Ca 0.67 1.14 -0.15 0.00 0.04 0.00 0.00 61.00 62.70 2jer s PRO 99 Cb -0.18 -2.11 0.02 0.00 0.04 0.00 0.00 34.50 32.26 2jer s PRO 99 CO 0.59 -0.37 0.30 -1.12 0.04 0.00 0.00 177.00 176.44 2jer s SER 100 N -2.58 6.11 0.28 6.66 0.01 -0.18 -4.90 113.70 119.10 2jer s SER 100 Ca 0.62 -0.90 -0.28 0.00 1.31 0.00 0.00 55.95 56.71 2jer s SER 100 Cb -0.12 -2.16 -0.09 0.00 0.21 0.00 0.00 66.02 63.85 2jer s SER 100 CO 0.26 -0.45 0.99 -0.36 0.41 0.00 0.00 173.24 174.09 2jer s PHE 101 N 1.68 3.76 0.09 2.43 0.40 -1.26 -0.35 117.98 124.73 2jer s PHE 101 Ca 0.05 1.81 0.08 0.00 -0.60 0.00 0.00 56.93 58.28 2jer s PHE 101 Cb -0.19 -3.05 -0.03 0.00 0.51 0.00 0.00 43.02 40.26 2jer s PHE 101 CO 0.10 0.07 -0.22 0.14 0.70 0.00 0.00 175.22 176.01 2jer s VAL 102 N -1.32 1.79 0.12 -0.44 -7.23 0.06 -4.42 120.40 108.96 2jer s VAL 102 Ca 0.45 -1.48 0.06 0.00 -1.81 0.00 0.00 61.98 59.21 2jer s VAL 102 Cb -0.25 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 2jer s VAL 102 CO 0.32 0.05 -0.14 0.27 -0.31 0.00 0.00 175.10 175.29 2jer s ILE 103 N -1.04 1.29 -2.08 -0.62 -4.36 0.27 -0.95 121.20 113.72 2jer s ILE 103 Ca 0.08 -1.68 0.20 0.00 -0.26 0.00 0.00 60.65 58.99 2jer s ILE 103 Cb -0.10 -1.48 0.36 0.00 1.25 0.00 0.00 42.46 42.49 2jer s ILE 103 CO 0.04 -0.41 1.30 -0.46 0.24 0.00 0.00 174.94 175.65 2jer n ASN 104 N 0.60 3.17 -0.37 4.36 6.94 -0.90 -0.89 115.26 128.18 2jer n ASN 104 Ca -0.16 -1.92 -0.04 0.00 -0.02 0.00 0.00 54.58 52.44 2jer n ASN 104 Cb 0.57 -0.21 -0.02 0.00 -2.36 0.00 0.00 39.78 37.76 2jer n ASN 104 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2jer n ASP 105 N 1.22 -4.55 -1.23 0.53 5.68 -1.24 -4.72 116.55 112.25 2jer n ASP 105 Ca 0.16 0.10 -0.06 0.00 -0.50 0.00 0.00 54.79 54.49 2jer n ASP 105 Cb 0.53 -3.08 0.18 0.00 -1.14 0.00 0.00 41.12 37.61 2jer n ASP 105 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2jer n HIS 106 N -1.68 1.20 -0.85 2.11 -0.00 -1.06 -4.18 115.22 110.78 2jer n HIS 106 Ca -0.04 -1.73 0.00 0.00 -0.00 0.00 0.00 57.72 55.95 2jer n HIS 106 Cb 0.42 -0.49 0.00 0.00 -0.00 0.00 0.00 29.99 29.93 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 -1.07 0.68 3.58 -1.41 0.00 0.90 -4.62 105.19 103.24 2jer n GLY 107 Ca 0.34 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.10 2jer n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jer s GLU 108 N -0.15 2.09 -0.01 1.61 2.02 -1.26 -4.79 118.70 118.21 2jer s GLU 108 Ca 0.00 -1.34 -0.01 0.00 0.02 0.00 0.00 54.97 53.64 2jer s GLU 108 Cb 0.00 -2.13 0.00 0.00 0.10 0.00 0.00 34.13 32.10 2jer s GLU 108 CO 0.00 0.41 0.03 -1.50 0.02 0.00 0.00 175.26 174.22 2jer s ILE 109 N -1.91 -0.01 0.31 -1.63 2.07 -1.26 -2.12 121.20 116.65 2jer s ILE 109 Ca 0.27 0.02 0.03 0.00 -1.41 0.00 0.00 60.65 59.55 2jer s ILE 109 Cb -0.08 -0.05 -0.05 0.00 0.13 0.00 0.00 42.46 42.41 2jer s ILE 109 CO 0.16 0.01 0.09 -0.13 -1.91 0.00 0.00 174.94 173.16 2jer s ARG 110 N 0.11 1.60 0.04 3.50 0.52 -0.12 -4.47 118.95 120.12 2jer s ARG 110 Ca -0.01 -1.89 0.08 0.00 -0.52 0.00 0.00 55.73 53.39 2jer s ARG 110 Cb -0.01 -0.56 -0.03 0.00 0.52 0.00 0.00 34.95 34.88 2jer s ARG 110 CO -0.00 -0.28 -0.23 0.20 0.02 0.00 0.00 175.30 175.00 2jer s GLY 111 N -3.43 1.24 -0.23 -3.53 0.00 -0.45 -0.76 107.32 100.16 2jer s GLY 111 Ca 0.35 -1.14 -0.09 0.00 0.00 0.00 0.00 44.72 43.84 2jer s GLY 111 CO 0.15 -1.04 0.11 0.14 0.00 0.00 0.00 173.10 172.46 2jer s VAL 112 N -0.77 4.94 -0.52 1.40 1.01 0.53 -0.75 120.40 126.24 2jer s VAL 112 Ca 0.09 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.06 2jer s VAL 112 Cb -0.09 -3.29 0.14 0.00 0.00 0.00 0.00 36.38 33.14 2jer s VAL 112 CO 0.02 0.37 0.35 -0.62 0.00 0.00 0.00 175.10 175.22 2jer s ASP 113 N 1.02 5.41 0.58 3.32 -1.08 0.71 -1.02 116.67 125.61 2jer s ASP 113 Ca 0.06 -2.36 -0.10 0.00 -0.52 0.00 0.00 52.55 49.63 2jer s ASP 113 Cb -0.14 -1.89 -0.04 0.00 -1.46 0.00 0.00 42.92 39.39 2jer s ASP 113 CO 0.04 -0.51 0.97 0.26 0.52 0.00 0.00 175.17 176.45 2jer s TRP 114 N 0.67 3.60 0.02 -5.34 0.52 -1.26 -1.42 118.94 115.72 2jer s TRP 114 Ca 0.12 1.20 -0.30 0.00 0.02 0.00 0.00 56.10 57.13 2jer s TRP 114 Cb -0.22 -2.63 -0.06 0.00 -1.15 0.00 0.00 33.47 29.41 2jer s TRP 114 CO -0.03 -0.57 1.38 0.99 0.02 0.00 0.00 176.95 178.73 2jer s THR 115 N -3.04 3.69 -0.13 2.01 2.01 -0.62 -4.85 115.64 114.71 2jer s THR 115 Ca 0.54 1.11 -0.06 0.00 0.31 0.00 0.00 61.69 63.59 2jer s THR 115 Cb -0.11 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 2jer s THR 115 CO 0.50 0.02 0.09 0.12 -0.69 0.00 0.00 174.62 174.65 2jer s PHE 116 N 2.13 3.39 -0.03 4.92 5.36 -1.26 -1.63 117.98 130.86 2jer s PHE 116 Ca 0.63 0.32 0.20 0.00 -0.96 0.00 0.00 56.93 57.12 2jer s PHE 116 Cb -0.32 -1.96 0.35 0.00 -0.34 0.00 0.00 43.02 40.75 2jer s PHE 116 CO 0.27 0.49 1.14 0.27 -1.46 0.00 0.00 175.22 175.94 2jer n ASN 117 N 2.53 0.93 -3.57 6.13 6.94 -1.26 -4.82 115.26 122.14 2jer n ASN 117 Ca -0.18 -2.23 -0.22 0.00 -0.02 0.00 0.00 54.58 51.93 2jer n ASN 117 Cb 0.54 -0.31 0.08 0.00 -2.36 0.00 0.00 39.78 37.72 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 0.19 -1.63 -3.46 -2.53 0.00 -1.26 -0.16 120.51 111.65 2jer n ALA 118 Ca 0.07 0.17 -0.18 0.00 0.00 0.00 0.00 53.44 53.50 2jer n ALA 118 Cb 1.01 -3.99 0.09 0.00 0.00 0.00 0.00 19.45 16.55 2jer n ALA 118 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2jer n TRP 119 N -4.60 -2.25 0.00 0.00 8.01 -1.26 -1.20 117.44 116.14 2jer n TRP 119 Ca -0.13 0.94 0.00 0.00 -1.31 0.00 0.00 57.50 57.01 2jer n TRP 119 Cb 0.61 -5.05 0.00 0.00 -2.01 0.00 0.00 31.31 24.86 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 -1.24 0.11 7.00 6.99 0.00 -1.22 -3.66 105.19 113.17 2jer n GLY 120 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2jer n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 121 N 0.00 3.13 0.15 -0.02 0.00 0.77 -1.62 105.19 107.61 2jer n GLY 121 Ca 0.00 -0.21 0.14 0.00 0.00 0.00 0.00 46.02 45.95 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 0.56 -0.05 0.99 4.77 -1.26 -0.72 117.00 121.29 2jer n LEU 122 Ca 0.00 -0.07 -0.01 0.00 -0.03 0.00 0.00 56.01 55.89 2jer n LEU 122 Cb 0.00 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 40.95 2jer n LEU 122 CO 0.00 0.10 0.03 0.58 -1.33 0.00 0.00 177.39 176.77 2jer h VAL 123 N 0.76 0.16 0.00 4.08 2.07 -1.65 -3.44 116.25 118.23 2jer h VAL 123 Ca 0.00 -1.12 -0.14 0.00 0.82 0.00 0.00 66.70 66.26 2jer h VAL 123 Cb 0.33 0.30 -0.25 0.00 -1.52 0.00 0.00 31.29 30.14 2jer h VAL 123 CO 0.00 0.05 -0.68 -0.90 0.02 0.00 0.00 177.57 176.06 2jer n ASP 124 N -4.76 0.14 -4.62 0.57 5.75 -0.82 -5.04 116.55 107.78 2jer n ASP 124 Ca -0.01 -1.96 -0.29 0.00 -0.01 0.00 0.00 54.79 52.52 2jer n ASP 124 Cb 0.05 -0.05 0.20 0.00 -1.03 0.00 0.00 41.12 40.28 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 -1.48 1.58 0.01 6.12 0.00 0.11 -4.58 107.32 109.08 2jer s GLY 125 Ca 0.18 -0.15 0.23 0.00 0.00 0.00 0.00 44.72 44.97 2jer s GLY 125 CO -0.09 0.47 1.02 1.04 0.00 0.00 0.00 173.10 175.54 2jer n LEU 126 N -4.40 0.71 -3.68 0.66 4.32 -0.34 -4.78 117.00 109.49 2jer n LEU 126 Ca 0.05 -0.21 -0.03 0.00 -0.02 0.00 0.00 56.01 55.80 2jer n LEU 126 Cb 0.55 -0.08 -0.01 0.00 -1.62 0.00 0.00 43.42 42.26 2jer n LEU 126 CO 0.56 0.14 0.80 -0.72 -1.22 0.00 0.00 177.39 176.96 2jer s TYR 127 N -3.09 -0.15 -0.07 -1.77 -0.85 -1.23 -0.96 117.35 109.22 2jer s TYR 127 Ca 0.06 -0.08 -0.04 0.00 -0.52 0.00 0.00 57.07 56.49 2jer s TYR 127 Cb 0.16 0.60 0.03 0.00 0.38 0.00 0.00 41.96 43.13 2jer s TYR 127 CO 0.81 -0.64 0.17 0.12 -1.52 0.00 0.00 175.55 174.50 2jer s PHE 128 N -3.04 -0.20 0.45 -3.49 5.36 -1.26 -4.70 117.98 111.10 2jer s PHE 128 Ca 0.11 0.54 0.04 0.00 -0.96 0.00 0.00 56.93 56.66 2jer s PHE 128 Cb 0.00 -0.02 0.08 0.00 -0.34 0.00 0.00 43.02 42.74 2jer s PHE 128 CO -0.01 -0.16 0.62 -0.35 -1.46 0.00 0.00 175.22 173.86 2jer n PRO 129 N 3.92 0.44 -0.34 10.12 -0.04 -1.26 -4.99 135.00 142.84 2jer n PRO 129 Ca -0.23 -2.04 0.02 0.00 -0.04 0.00 0.00 63.50 61.21 2jer n PRO 129 Cb 0.54 -0.31 0.03 0.00 -0.04 0.00 0.00 33.50 33.72 2jer n PRO 129 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2jer n TRP 130 N -2.13 0.00 -0.13 0.54 2.14 -1.26 -4.87 117.44 111.73 2jer n TRP 130 Ca 0.11 -0.25 0.02 0.00 2.07 0.00 0.00 57.50 59.45 2jer n TRP 130 Cb 0.41 -0.07 0.31 0.00 -0.81 0.00 0.00 31.31 31.15 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 0.00 0.71 0.04 -0.67 2.03 -1.99 -1.13 116.42 115.41 2jer h ASP 131 Ca 0.00 -0.03 -0.20 0.00 -0.73 0.00 0.00 57.03 56.08 2jer h ASP 131 Cb 1.24 -0.18 0.02 0.00 -0.83 0.00 0.00 39.33 39.58 2jer h ASP 131 CO 0.00 0.53 -0.79 1.56 -1.03 0.00 0.00 179.24 179.51 2jer h GLN 132 N 0.83 0.46 -0.88 4.15 1.08 -1.91 -3.13 115.11 115.72 2jer h GLN 132 Ca 0.22 -0.55 0.22 0.00 -1.45 0.00 0.00 58.65 57.09 2jer h GLN 132 Cb -0.07 0.17 -0.13 0.00 -0.05 0.00 0.00 27.48 27.40 2jer h GLN 132 CO -0.05 1.20 0.34 -0.44 -0.95 0.00 0.00 178.83 178.93 2jer h ASP 133 N -0.03 0.22 0.68 1.46 3.32 -1.74 -1.38 116.42 118.95 2jer h ASP 133 Ca -0.11 0.16 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2jer h ASP 133 Cb 1.51 0.17 0.00 0.00 0.22 0.00 0.00 39.33 41.23 2jer h ASP 133 CO 0.15 -0.04 0.00 -0.67 -1.72 0.00 0.00 179.24 176.96 2jer n ASP 134 N -5.10 0.49 0.00 6.45 2.03 -0.46 -2.07 116.55 117.90 2jer n ASP 134 Ca 0.21 0.62 0.11 0.00 0.52 0.00 0.00 54.79 56.25 2jer n ASP 134 Cb 0.65 -0.72 0.08 0.00 -0.72 0.00 0.00 41.12 40.41 2jer n ASP 134 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2jer n LEU 135 N -2.03 0.71 -0.32 -2.67 4.77 -0.53 -4.46 117.00 112.46 2jer n LEU 135 Ca 0.03 -0.20 -0.04 0.00 -0.03 0.00 0.00 56.01 55.77 2jer n LEU 135 Cb 0.22 -0.14 0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2jer n LEU 135 CO 0.18 0.17 1.20 0.58 -1.33 0.00 0.00 177.39 178.19 2jer h VAL 136 N 0.00 1.23 -0.14 4.08 2.07 -1.34 -1.47 116.25 120.69 2jer h VAL 136 Ca 0.00 -0.49 0.01 0.00 0.82 0.00 0.00 66.70 67.04 2jer h VAL 136 Cb 0.52 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2jer h VAL 136 CO 0.00 0.24 0.08 0.00 0.02 0.00 0.00 177.57 177.91 2jer h ALA 137 N 1.29 0.17 -0.73 1.67 0.00 -1.76 -0.30 119.26 119.59 2jer h ALA 137 Ca 0.31 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2jer h ALA 137 Cb -0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2jer h ALA 137 CO -0.06 -0.36 0.32 0.37 0.00 0.00 0.00 179.25 179.52 2jer h GLN 138 N 0.17 1.08 -0.66 0.00 4.15 -1.79 -1.27 115.11 116.78 2jer h GLN 138 Ca 0.05 -0.18 -0.07 0.00 0.77 0.00 0.00 58.65 59.22 2jer h GLN 138 Cb -0.00 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.48 2jer h GLN 138 CO -0.03 0.87 0.13 0.87 -1.93 0.00 0.00 178.83 178.74 2jer h LYS 139 N 1.04 1.07 -0.60 1.69 1.57 -0.86 0.78 116.57 121.26 2jer h LYS 139 Ca 0.25 -0.28 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2jer h LYS 139 Cb 0.17 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 2jer h LYS 139 CO -0.02 0.98 0.06 0.82 -0.57 0.00 0.00 179.45 180.71 2jer h ILE 140 N 1.00 1.26 -0.63 1.86 2.04 -0.96 -1.48 117.51 120.61 2jer h ILE 140 Ca 0.20 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.99 2jer h ILE 140 Cb 0.41 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2jer h ILE 140 CO 0.01 0.39 0.37 0.00 0.00 0.00 0.00 178.15 178.92 2jer h GLU 142 N 0.85 -0.03 -0.79 0.00 4.39 -0.57 0.14 114.58 118.56 2jer h GLU 142 Ca 0.22 0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.06 2jer h GLU 142 Cb -0.01 0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 2jer h GLU 142 CO -0.04 -0.02 0.39 0.82 -1.16 0.00 0.00 179.01 178.99 2jer h ILE 143 N -0.03 0.75 -0.03 3.13 2.04 -0.93 -0.54 117.51 121.90 2jer h ILE 143 Ca 0.15 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2jer h ILE 143 Cb 0.26 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 2jer h ILE 143 CO -0.33 0.11 0.00 -0.62 0.00 0.00 0.00 178.15 177.31 2jer n GLU 144 N -4.89 1.21 -3.39 2.37 -0.58 -0.78 -4.89 120.64 109.68 2jer n GLU 144 Ca 0.15 -0.30 -0.25 0.00 -0.42 0.00 0.00 57.16 56.34 2jer n GLU 144 Cb 0.38 -1.41 0.03 0.00 -0.57 0.00 0.00 31.44 29.88 2jer n GLU 144 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jer n HIS 145 N -0.56 -2.18 -4.18 -0.32 8.25 -0.21 -4.97 115.22 111.05 2jer n HIS 145 Ca 0.19 0.68 -0.34 0.00 -0.26 0.00 0.00 57.72 57.99 2jer n HIS 145 Cb 0.16 -4.16 -0.11 0.00 1.12 0.00 0.00 29.99 27.00 2jer n HIS 145 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2jer s VAL 146 N -3.18 4.21 0.45 1.59 -7.23 0.38 -4.91 120.40 111.71 2jer s VAL 146 Ca 0.45 -0.24 -0.23 0.00 -1.81 0.00 0.00 61.98 60.16 2jer s VAL 146 Cb -0.22 -2.88 -0.08 0.00 0.56 0.00 0.00 36.38 33.76 2jer s VAL 146 CO 0.56 0.46 1.10 -1.81 -0.31 0.00 0.00 175.10 175.10 2jer s ASP 147 N 0.54 6.39 0.07 4.85 1.01 -1.26 -4.38 116.67 123.89 2jer s ASP 147 Ca -0.00 2.13 0.03 0.00 0.71 0.00 0.00 52.55 55.41 2jer s ASP 147 Cb -0.14 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.18 2jer s ASP 147 CO 0.02 -0.75 -0.09 -0.94 0.21 0.00 0.00 175.17 173.62 2jer s SER 148 N -1.57 1.09 -0.24 0.27 1.04 -0.54 -1.35 113.70 112.41 2jer s SER 148 Ca 0.63 -0.70 -0.09 0.00 0.48 0.00 0.00 55.95 56.27 2jer s SER 148 Cb -0.24 0.04 -0.04 0.00 0.10 0.00 0.00 66.02 65.88 2jer s SER 148 CO 0.29 -0.26 0.11 -0.31 0.98 0.00 0.00 173.24 174.06 2jer s TYR 149 N -2.02 3.20 -0.17 5.02 1.51 0.07 0.09 117.35 125.05 2jer s TYR 149 Ca -0.02 -0.04 -0.12 0.00 -1.01 0.00 0.00 57.07 55.88 2jer s TYR 149 Cb -0.06 -2.24 -0.05 0.00 -0.11 0.00 0.00 41.96 39.51 2jer s TYR 149 CO -0.01 -0.09 0.23 0.50 -1.11 0.00 0.00 175.55 175.07 2jer s ARG 150 N 1.22 4.22 -1.01 -0.62 6.06 -1.26 -0.21 118.95 127.35 2jer s ARG 150 Ca 0.06 -0.02 -0.14 0.00 -2.50 0.00 0.00 55.73 53.13 2jer s ARG 150 Cb -0.14 -3.42 0.20 0.00 0.06 0.00 0.00 34.95 31.65 2jer s ARG 150 CO 0.05 0.27 1.09 0.95 -2.50 0.00 0.00 175.30 175.16 2jer s THR 151 N 0.41 5.38 0.17 4.11 -4.23 -0.51 -4.99 115.64 115.98 2jer s THR 151 Ca 0.13 -2.55 -0.33 0.00 -1.18 0.00 0.00 61.69 57.76 2jer s THR 151 Cb -0.12 -4.68 -0.13 0.00 1.34 0.00 0.00 72.50 68.90 2jer s THR 151 CO 0.02 -1.32 1.61 0.47 -0.54 0.00 0.00 174.62 174.86 2jer n ASP 152 N 4.63 3.32 -1.06 3.99 8.00 -1.26 -1.83 116.55 132.33 2jer n ASP 152 Ca 0.24 1.08 -0.14 0.00 0.71 0.00 0.00 54.79 56.68 2jer n ASP 152 Cb 0.44 -1.46 -0.06 0.00 -0.02 0.00 0.00 41.12 40.02 2jer n ASP 152 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2jer n ASP 153 N 3.53 -5.08 -3.93 -2.24 8.00 -1.26 -4.95 116.55 110.63 2jer n ASP 153 Ca 0.17 0.34 -0.30 0.00 0.71 0.00 0.00 54.79 55.71 2jer n ASP 153 Cb 0.30 -3.80 -0.16 0.00 -0.02 0.00 0.00 41.12 37.44 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 -2.38 2.12 -0.09 1.24 2.19 -0.76 -5.03 117.98 115.27 2jer s PHE 154 Ca 0.00 -1.48 -0.20 0.00 0.33 0.00 0.00 56.93 55.59 2jer s PHE 154 Cb 0.00 -1.49 -0.04 0.00 -1.31 0.00 0.00 43.02 40.18 2jer s PHE 154 CO 0.00 -0.71 0.54 0.08 1.83 0.00 0.00 175.22 176.96 2jer s VAL 155 N 1.49 5.12 0.05 3.12 1.01 -1.26 -1.59 120.40 128.34 2jer s VAL 155 Ca -0.03 1.10 -0.24 0.00 0.00 0.00 0.00 61.98 62.81 2jer s VAL 155 Cb -0.17 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.39 2jer s VAL 155 CO -0.07 0.32 0.57 -0.22 0.00 0.00 0.00 175.10 175.70 2jer s LEU 156 N 0.54 -0.29 0.01 3.92 2.96 -0.64 -4.79 118.68 120.38 2jer s LEU 156 Ca 0.29 0.25 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 2jer s LEU 156 Cb -0.16 2.31 -0.02 0.00 0.50 0.00 0.00 46.19 48.82 2jer s LEU 156 CO 0.13 -0.75 -0.20 -1.61 -1.32 0.00 0.00 176.35 172.60 2jer s GLU 157 N -2.47 1.47 0.58 1.98 8.01 -1.26 -4.58 118.70 122.43 2jer s GLU 157 Ca -0.05 -0.80 0.27 0.00 0.01 0.00 0.00 54.97 54.40 2jer s GLU 157 Cb -0.01 -1.49 1.64 0.00 -4.31 0.00 0.00 34.13 29.96 2jer s GLU 157 CO -0.02 0.40 2.14 0.78 0.01 0.00 0.00 175.26 178.57 2jer h GLY 158 N 5.29 0.00 1.83 -1.39 0.00 -1.57 -1.50 103.07 105.72 2jer h GLY 158 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 2jer h GLY 158 CO 0.46 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.61 2jer n GLY 159 N -1.42 -1.18 0.22 4.60 0.00 -1.22 -3.51 105.19 102.69 2jer n GLY 159 Ca 0.01 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.41 0.95 -3.87 1.61 3.41 -0.56 -2.76 113.62 110.99 2jer n SER 160 Ca 0.08 -0.83 -0.09 0.00 -0.26 0.00 0.00 58.87 57.77 2jer n SER 160 Cb 0.23 0.12 -0.07 0.00 -0.26 0.00 0.00 64.21 64.23 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 -2.52 0.16 -0.00 7.33 -0.12 -1.23 -4.16 117.98 117.43 2jer s PHE 161 Ca 0.24 -0.58 0.02 0.00 -0.05 0.00 0.00 56.93 56.56 2jer s PHE 161 Cb 0.19 -0.07 -0.00 0.00 -0.63 0.00 0.00 43.02 42.50 2jer s PHE 161 CO 0.52 -0.52 -0.06 -1.01 -0.05 0.00 0.00 175.22 174.10 2jer s HIS 162 N -3.73 0.52 0.15 3.49 3.76 0.01 -4.89 115.29 114.59 2jer s HIS 162 Ca 0.04 -0.10 0.09 0.00 -0.15 0.00 0.00 55.06 54.94 2jer s HIS 162 Cb 0.04 -0.33 -0.04 0.00 1.11 0.00 0.00 32.58 33.36 2jer s HIS 162 CO -0.10 -0.01 -0.13 0.14 -0.85 0.00 0.00 174.74 173.79 2jer s VAL 163 N -0.14 3.06 -2.31 -0.90 -7.23 -1.26 -0.26 120.40 111.36 2jer s VAL 163 Ca 0.02 -1.59 0.24 0.00 -1.81 0.00 0.00 61.98 58.84 2jer s VAL 163 Cb -0.02 -2.47 0.13 0.00 0.56 0.00 0.00 36.38 34.58 2jer s VAL 163 CO -0.00 -0.03 1.26 -0.90 -0.31 0.00 0.00 175.10 175.12 2jer n ASP 164 N 0.35 2.12 0.00 4.85 5.75 -1.06 -4.48 116.55 124.07 2jer n ASP 164 Ca -0.12 -1.57 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 2jer n ASP 164 Cb 0.54 0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 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 1.37 0.51 1.89 6.12 0.00 -1.26 -4.31 105.19 109.51 2jer n GLY 165 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.85 1.31 0.00 1.61 6.02 -1.26 -4.80 117.38 118.40 2jer n GLN 166 Ca 0.00 -3.00 0.00 0.00 -0.01 0.00 0.00 57.00 53.99 2jer n GLN 166 Cb 0.08 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.25 2jer n GLN 166 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jer n GLY 167 N -0.28 0.72 3.38 1.08 0.00 -1.26 -4.58 105.19 104.26 2jer n GLY 167 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.00 2.35 0.01 2.61 2.01 -1.26 -0.26 115.64 119.10 2jer s THR 168 Ca 0.00 -1.39 0.05 0.00 0.31 0.00 0.00 61.69 60.66 2jer s THR 168 Cb 0.00 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 2jer s THR 168 CO 0.00 0.32 -0.15 0.54 -0.69 0.00 0.00 174.62 174.63 2jer s VAL 169 N -0.88 1.21 -0.09 3.82 0.11 -0.64 -2.57 120.40 121.36 2jer s VAL 169 Ca 0.13 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.38 2jer s VAL 169 Cb -0.10 -1.05 -0.02 0.00 -1.53 0.00 0.00 36.38 33.69 2jer s VAL 169 CO 0.04 0.21 -0.17 -0.22 -3.33 0.00 0.00 175.10 171.62 2jer s LEU 170 N -0.72 2.52 0.00 2.54 0.20 0.64 -0.26 118.68 123.61 2jer s LEU 170 Ca 0.05 -0.36 -0.01 0.00 0.69 0.00 0.00 54.13 54.49 2jer s LEU 170 Cb -0.07 -1.53 0.01 0.00 -0.43 0.00 0.00 46.19 44.17 2jer s LEU 170 CO 0.00 0.23 0.16 1.07 -0.29 0.00 0.00 176.35 177.52 2jer n THR 171 N 3.10 0.00 -4.83 3.68 5.66 -0.41 -0.81 114.28 120.66 2jer n THR 171 Ca -0.18 -0.44 -0.25 0.00 -3.05 0.00 0.00 64.05 60.13 2jer n THR 171 Cb 0.52 0.30 -0.16 0.00 -1.55 0.00 0.00 70.33 69.45 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 -2.60 1.39 0.27 1.09 -4.23 -1.26 -0.55 115.64 109.75 2jer s THR 172 Ca 0.07 -0.73 -0.03 0.00 -1.18 0.00 0.00 61.69 59.82 2jer s THR 172 Cb -0.01 -1.17 0.18 0.00 1.34 0.00 0.00 72.50 72.85 2jer s THR 172 CO 0.05 0.40 1.85 -0.33 -0.54 0.00 0.00 174.62 176.05 2jer h GLU 173 N 5.91 1.00 -0.98 3.99 5.08 -0.56 -2.52 114.58 126.50 2jer h GLU 173 Ca -0.35 -0.16 0.14 0.00 -1.00 0.00 0.00 59.36 57.99 2jer h GLU 173 Cb 1.16 -0.18 -0.09 0.00 0.50 0.00 0.00 28.75 30.14 2jer h GLU 173 CO 0.48 0.80 0.60 1.98 -1.00 0.00 0.00 179.01 181.87 2jer h MET 174 N 0.99 0.85 0.00 2.33 4.05 -1.54 -2.01 114.93 119.60 2jer h MET 174 Ca 0.23 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.60 2jer h MET 174 Cb 0.16 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 30.77 2jer h MET 174 CO -0.02 0.56 -0.08 0.00 0.23 0.00 0.00 176.91 177.60 2jer h LEU 176 N -0.78 0.00 -2.09 0.00 3.38 -1.44 -2.33 115.31 112.04 2jer h LEU 176 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jer h LEU 176 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2jer h LEU 176 CO 0.00 0.26 0.00 0.18 0.09 0.00 0.00 178.44 178.97 2jer n LEU 177 N -3.71 3.08 -4.81 1.67 4.77 -0.76 -4.52 117.00 112.73 2jer n LEU 177 Ca -0.01 -1.44 -0.33 0.00 -0.03 0.00 0.00 56.01 54.19 2jer n LEU 177 Cb 0.37 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2jer n LEU 177 CO 0.34 0.72 0.71 -0.94 -1.33 0.00 0.00 177.39 176.90 2jer s SER 178 N -1.24 6.04 0.50 -1.43 1.04 -0.88 -4.95 113.70 112.77 2jer s SER 178 Ca 0.39 1.81 0.16 0.00 0.48 0.00 0.00 55.95 58.79 2jer s SER 178 Cb 0.21 -2.54 1.20 0.00 0.10 0.00 0.00 66.02 65.00 2jer s SER 178 CO 0.29 -0.99 2.09 -0.08 0.98 0.00 0.00 173.24 175.52 2jer h GLU 179 N 0.79 0.13 -0.05 4.02 4.81 -1.93 -2.59 114.58 119.76 2jer h GLU 179 Ca -0.48 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2jer h GLU 179 Cb 1.22 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.57 2jer h GLU 179 CO 0.58 0.08 0.00 0.41 -0.73 0.00 0.00 179.01 179.36 2jer n GLY 180 N -1.55 -0.24 0.00 1.92 0.00 -1.26 -4.17 105.19 99.89 2jer n GLY 180 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.13 0.00 -3.19 1.61 5.12 -0.98 -4.12 116.66 114.97 2jer n ARG 181 Ca 0.18 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.86 2jer n ARG 181 Cb 0.26 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.51 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 -0.32 2.54 0.28 0.55 4.13 -1.26 -4.66 115.26 116.52 2jer n ASN 182 Ca 0.00 -3.25 0.18 0.00 1.68 0.00 0.00 54.58 53.20 2jer n ASN 182 Cb 0.00 -0.62 0.88 0.00 -1.54 0.00 0.00 39.78 38.50 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 3.57 0.00 0.00 3.52 0.13 -1.77 -1.22 132.00 136.23 2jer h PRO 183 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2jer h PRO 183 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2jer h PRO 183 CO 0.68 0.00 -0.19 0.00 -0.23 0.00 0.00 178.00 178.26 2jer n GLN 184 N -2.91 0.15 -3.70 0.86 0.00 -1.26 -4.84 117.38 105.68 2jer n GLN 184 Ca -0.01 0.09 -0.37 0.00 0.00 0.00 0.00 57.00 56.71 2jer n GLN 184 Cb 0.17 -1.64 -0.06 0.00 0.00 0.00 0.00 30.24 28.71 2jer n GLN 184 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2jer s LEU 185 N -3.77 4.43 0.80 2.61 1.43 -0.46 -5.10 118.68 118.62 2jer s LEU 185 Ca 0.11 0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 53.80 2jer s LEU 185 Cb 0.15 -2.32 0.07 0.00 0.03 0.00 0.00 46.19 44.13 2jer s LEU 185 CO 0.61 0.37 1.10 -0.94 0.23 0.00 0.00 176.35 177.73 2jer s SER 186 N -1.06 4.45 0.25 2.29 1.04 -1.26 -4.87 113.70 114.55 2jer s SER 186 Ca 0.19 1.24 -0.04 0.00 0.48 0.00 0.00 55.95 57.82 2jer s SER 186 Cb -0.14 -1.96 0.35 0.00 0.10 0.00 0.00 66.02 64.37 2jer s SER 186 CO 0.09 -1.99 1.89 0.50 0.98 0.00 0.00 173.24 174.70 2jer h LYS 187 N -1.10 1.13 -0.63 4.02 3.64 -1.98 -1.36 116.57 120.29 2jer h LYS 187 Ca -0.47 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 58.75 2jer h LYS 187 Cb 1.28 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 2jer h LYS 187 CO 0.60 0.75 0.06 0.93 -2.27 0.00 0.00 179.45 179.52 2jer h GLU 188 N 1.17 1.07 -0.63 1.90 3.07 -1.99 -0.48 114.58 118.68 2jer h GLU 188 Ca 0.40 -0.31 -0.05 0.00 -0.50 0.00 0.00 59.36 58.90 2jer h GLU 188 Cb 0.09 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 2jer h GLU 188 CO -0.15 1.01 0.18 0.00 -1.40 0.00 0.00 179.01 178.65 2jer h ALA 189 N 1.06 1.12 -0.36 3.43 0.00 -1.76 -0.82 119.26 121.93 2jer h ALA 189 Ca 0.19 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2jer h ALA 189 Cb 0.49 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2jer h ALA 189 CO 0.02 0.60 -0.01 0.82 0.00 0.00 0.00 179.25 180.67 2jer h ILE 190 N 0.93 1.26 -0.68 0.00 2.04 -0.93 -2.39 117.51 117.74 2jer h ILE 190 Ca 0.20 -1.01 0.09 0.00 1.00 0.00 0.00 64.86 65.14 2jer h ILE 190 Cb 0.30 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 2jer h ILE 190 CO -0.00 0.34 0.33 -0.33 0.00 0.00 0.00 178.15 178.49 2jer h GLU 191 N 0.45 0.57 -0.61 2.37 5.08 -0.75 -1.73 114.58 119.96 2jer h GLU 191 Ca 0.10 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2jer h GLU 191 Cb 0.48 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 2jer h GLU 191 CO 0.02 0.37 0.39 0.37 -1.00 0.00 0.00 179.01 179.16 2jer h GLN 192 N 0.58 0.76 -0.57 2.33 5.75 -0.94 0.81 115.11 123.83 2jer h GLN 192 Ca 0.33 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.78 2jer h GLN 192 Cb 0.33 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 2jer h GLN 192 CO -0.25 0.50 0.35 0.87 -2.65 0.00 0.00 178.83 177.64 2jer h LYS 193 N 0.78 0.77 -0.40 1.69 1.79 -0.90 -0.18 116.57 120.13 2jer h LYS 193 Ca 0.23 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.63 2jer h LYS 193 Cb -0.05 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.42 2jer h LYS 193 CO -0.07 0.55 0.23 -0.07 -1.08 0.00 0.00 179.45 179.01 2jer h LEU 194 N 0.77 0.49 -0.18 2.94 3.38 -0.77 -0.63 115.31 121.30 2jer h LEU 194 Ca 0.20 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2jer h LEU 194 Cb -0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2jer h LEU 194 CO -0.04 0.42 0.12 0.00 0.09 0.00 0.00 178.44 179.03 2jer h ASP 196 N 0.24 1.00 0.34 0.00 3.32 -0.81 -1.51 116.42 119.01 2jer h ASP 196 Ca 0.07 -0.24 -0.21 0.00 0.02 0.00 0.00 57.03 56.66 2jer h ASP 196 Cb -0.02 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.22 2jer h ASP 196 CO -0.02 1.01 -1.85 -1.22 -1.72 0.00 0.00 179.24 175.44 2jer n TYR 197 N -4.21 0.51 0.42 4.55 4.02 -0.26 -1.72 117.16 120.46 2jer n TYR 197 Ca 0.04 0.17 0.11 0.00 -0.01 0.00 0.00 57.90 58.22 2jer n TYR 197 Cb 0.29 -0.97 0.01 0.00 -0.02 0.00 0.00 39.34 38.65 2jer n TYR 197 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2jer n LEU 198 N -2.75 0.60 -2.81 7.72 4.77 -0.17 -4.70 117.00 119.66 2jer n LEU 198 Ca -0.17 0.07 -0.08 0.00 -0.03 0.00 0.00 56.01 55.80 2jer n LEU 198 Cb 0.91 -0.09 0.04 0.00 -2.33 0.00 0.00 43.42 41.95 2jer n LEU 198 CO 0.44 -0.01 0.11 -3.20 -1.33 0.00 0.00 177.39 173.39 2jer n ASN 199 N -2.14 -5.90 -4.40 -1.43 4.05 -0.63 -1.72 115.26 103.08 2jer n ASN 199 Ca 0.01 -0.38 -0.20 0.00 0.45 0.00 0.00 54.58 54.46 2jer n ASN 199 Cb 0.47 -4.22 -0.10 0.00 1.23 0.00 0.00 39.78 37.16 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 -3.20 1.34 0.00 3.44 -7.23 -0.80 -4.41 120.40 109.54 2jer s VAL 200 Ca 0.24 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 2jer s VAL 200 Cb -0.03 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.43 2jer s VAL 200 CO 0.58 -0.26 0.00 -0.62 -0.31 0.00 0.00 175.10 174.49 2jer n GLU 201 N -0.54 0.71 -4.39 4.82 -0.58 0.64 -4.45 120.64 116.86 2jer n GLU 201 Ca -0.05 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.46 2jer n GLU 201 Cb 0.64 -0.94 -0.17 0.00 -0.57 0.00 0.00 31.44 30.41 2jer n GLU 201 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 2jer s LYS 202 N -1.77 1.38 -0.26 3.49 2.20 -0.84 -5.06 119.74 118.88 2jer s LYS 202 Ca 0.00 -0.29 -0.06 0.00 -0.36 0.00 0.00 55.97 55.26 2jer s LYS 202 Cb 0.00 -1.22 -0.01 0.00 -1.51 0.00 0.00 37.83 35.09 2jer s LYS 202 CO 0.00 -0.03 0.04 0.08 -0.36 0.00 0.00 175.35 175.07 2jer s VAL 203 N 0.84 3.87 -0.33 4.02 1.01 -1.26 -1.62 120.40 126.92 2jer s VAL 203 Ca -0.12 -0.47 -0.17 0.00 0.00 0.00 0.00 61.98 61.23 2jer s VAL 203 Cb -0.15 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 2jer s VAL 203 CO 0.02 0.27 0.44 -0.76 0.00 0.00 0.00 175.10 175.07 2jer s LEU 204 N 1.53 4.32 -0.41 3.92 1.43 0.64 -5.00 118.68 125.12 2jer s LEU 204 Ca 0.05 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 52.96 2jer s LEU 204 Cb -0.16 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.60 2jer s LEU 204 CO 0.01 -0.38 0.36 0.26 0.23 0.00 0.00 176.35 176.83 2jer s TRP 205 N 2.21 3.21 0.71 0.29 0.52 -1.26 -1.29 118.94 123.32 2jer s TRP 205 Ca 0.16 -0.44 -0.11 0.00 0.02 0.00 0.00 56.10 55.72 2jer s TRP 205 Cb -0.16 -2.72 0.02 0.00 -1.15 0.00 0.00 33.47 29.46 2jer s TRP 205 CO 0.12 -0.62 1.09 -0.51 0.02 0.00 0.00 176.95 177.05 2jer s LEU 206 N 1.90 2.89 0.00 2.99 1.43 0.29 -4.91 118.68 123.27 2jer s LEU 206 Ca 0.09 1.19 0.00 0.00 -1.03 0.00 0.00 54.13 54.38 2jer s LEU 206 Cb -0.18 -3.99 0.00 0.00 0.03 0.00 0.00 46.19 42.05 2jer s LEU 206 CO 0.12 -1.39 0.00 0.61 0.23 0.00 0.00 176.35 175.92 2jer n GLY 207 N -2.83 0.81 3.77 -3.19 0.00 -1.26 -0.57 105.19 101.92 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 7.16 0.30 1.61 -0.00 -1.26 -1.57 116.67 121.90 2jer s ASP 208 Ca 0.00 1.99 0.00 0.00 -0.00 0.00 0.00 52.55 54.54 2jer s ASP 208 Cb 0.00 -2.59 0.01 0.00 -0.00 0.00 0.00 42.92 40.33 2jer s ASP 208 CO 0.00 -0.20 0.05 0.61 -0.00 0.00 0.00 175.17 175.63 2jer n GLY 209 N 0.68 1.07 0.43 0.21 0.00 -1.26 -4.89 105.19 101.44 2jer n GLY 209 Ca 0.02 -2.01 0.08 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.35 0.00 -3.22 -0.61 -5.35 -1.26 -4.68 119.36 102.88 2jer n ILE 210 Ca 0.01 -0.37 -0.25 0.00 -0.27 0.00 0.00 62.75 61.87 2jer n ILE 210 Cb 0.03 1.22 -0.06 0.00 -1.74 0.00 0.00 39.64 39.09 2jer n ILE 210 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jer n ASP 211 N 0.12 2.37 0.17 7.28 3.85 -1.26 -4.93 116.55 124.14 2jer n ASP 211 Ca 0.07 -3.20 0.07 0.00 -0.71 0.00 0.00 54.79 51.03 2jer n ASP 211 Cb 0.35 -0.63 0.58 0.00 -1.35 0.00 0.00 41.12 40.06 2jer n ASP 211 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.20 177.74 2jer h PRO 212 N 3.70 0.17 0.00 0.11 0.13 -1.88 -2.26 132.00 131.97 2jer h PRO 212 Ca 0.13 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 2jer h PRO 212 Cb 0.74 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 2jer h PRO 212 CO 0.67 0.11 -0.53 0.93 -0.23 0.00 0.00 178.00 178.95 2jer h GLU 213 N 0.17 0.00 0.00 0.86 4.39 -1.95 -3.20 114.58 114.85 2jer h GLU 213 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2jer h GLU 213 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2jer h GLU 213 CO -0.01 0.19 0.00 -1.91 -1.16 0.00 0.00 179.01 176.12 2jer n GLU 214 N -3.03 0.00 -0.04 2.33 4.07 -0.90 -4.72 120.64 118.35 2jer n GLU 214 Ca 0.01 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.23 2jer n GLU 214 Cb 0.64 -0.09 0.37 0.00 -0.06 0.00 0.00 31.44 32.29 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 -0.74 0.11 -2.94 6.31 -2.24 -1.17 -4.89 114.28 108.73 2jer n THR 215 Ca 0.00 -0.38 -0.16 0.00 -2.27 0.00 0.00 64.05 61.24 2jer n THR 215 Cb 0.00 0.71 0.03 0.00 -2.10 0.00 0.00 70.33 68.98 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 0.59 -4.81 -0.39 3.42 3.02 -0.91 -4.27 115.26 111.91 2jer n ASN 216 Ca 0.17 -0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 2jer n ASN 216 Cb 0.42 -3.59 0.00 0.00 -0.61 0.00 0.00 39.78 36.01 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 -1.37 0.84 3.61 7.41 0.00 -0.96 -1.69 105.19 113.02 2jer n GLY 217 Ca -0.05 -0.38 -0.47 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.28 1.58 0.27 1.61 8.25 -1.26 -4.00 115.22 120.39 2jer n HIS 218 Ca 0.00 0.61 0.11 0.00 -0.26 0.00 0.00 57.72 58.17 2jer n HIS 218 Cb 0.31 -2.33 0.74 0.00 1.12 0.00 0.00 29.99 29.82 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 2.64 0.83 0.00 1.59 3.04 -1.72 -2.97 116.25 119.66 2jer h VAL 219 Ca -0.43 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 2jer h VAL 219 Cb 1.32 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 2jer h VAL 219 CO 0.70 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.36 2jer n ASP 220 N -4.29 0.00 -0.21 3.17 5.75 -1.11 -0.19 116.55 119.66 2jer n ASP 220 Ca -0.03 -0.04 0.12 0.00 -0.01 0.00 0.00 54.79 54.83 2jer n ASP 220 Cb 0.09 -0.28 0.21 0.00 -1.03 0.00 0.00 41.12 40.11 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 -1.28 1.10 -0.04 -1.12 8.00 -1.12 -3.52 116.55 118.58 2jer n ASP 221 Ca 0.10 -0.88 -0.08 0.00 0.71 0.00 0.00 54.79 54.64 2jer n ASP 221 Cb 0.17 0.34 -0.03 0.00 -0.02 0.00 0.00 41.12 41.58 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 -0.82 0.47 -3.53 2.53 0.31 0.73 -4.62 118.33 113.40 2jer n VAL 222 Ca 0.09 -0.08 -0.15 0.00 -0.01 0.00 0.00 64.34 64.19 2jer n VAL 222 Cb 0.37 -1.62 -0.05 0.00 -0.91 0.00 0.00 33.84 31.63 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 -2.15 -1.52 0.28 3.52 0.00 -0.33 -1.33 121.76 120.23 2jer s ALA 223 Ca -0.11 0.83 -0.10 0.00 0.00 0.00 0.00 51.96 52.58 2jer s ALA 223 Cb 0.04 0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.49 2jer s ALA 223 CO 0.13 -0.50 0.50 0.00 0.00 0.00 0.00 175.76 175.89 2jer s PHE 225 N -3.64 3.51 -0.13 0.00 0.08 -1.26 -1.29 117.98 115.24 2jer s PHE 225 Ca 0.24 0.91 0.21 0.00 0.12 0.00 0.00 56.93 58.41 2jer s PHE 225 Cb -0.01 -2.58 -0.18 0.00 -0.57 0.00 0.00 43.02 39.69 2jer s PHE 225 CO 0.12 0.15 0.70 0.44 -0.10 0.00 0.00 175.22 176.53 2jer n ILE 226 N 3.72 0.59 -3.64 0.64 -5.35 -0.08 -4.85 119.36 110.38 2jer n ILE 226 Ca -0.06 -0.59 -0.04 0.00 -0.27 0.00 0.00 62.75 61.79 2jer n ILE 226 Cb 0.52 -0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 38.09 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 -3.24 -1.87 0.20 -1.28 0.00 -1.20 -4.89 121.76 109.48 2jer s ALA 227 Ca -0.05 0.64 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 2jer s ALA 227 Cb 0.11 0.44 -0.13 0.00 0.00 0.00 0.00 23.12 23.54 2jer s ALA 227 CO 0.84 -0.91 1.63 -2.30 0.00 0.00 0.00 175.76 175.02 2jer n PRO 228 N -0.38 2.47 -0.91 0.00 -0.02 -1.26 -1.56 135.00 133.35 2jer n PRO 228 Ca -0.07 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 2jer n PRO 228 Cb 0.61 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 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 3.40 0.84 2.96 -1.23 0.00 -1.26 -5.02 105.19 104.88 2jer n GLY 229 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 2jer n GLY 229 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jer s GLU 230 N -0.09 1.01 0.10 1.61 2.02 -0.60 -1.32 118.70 121.43 2jer s GLU 230 Ca 0.00 -0.23 0.07 0.00 0.02 0.00 0.00 54.97 54.83 2jer s GLU 230 Cb 0.00 -0.94 -0.03 0.00 0.10 0.00 0.00 34.13 33.26 2jer s GLU 230 CO 0.00 0.01 -0.17 0.14 0.02 0.00 0.00 175.26 175.26 2jer s VAL 231 N 0.57 1.46 -0.05 2.63 -7.23 0.28 -0.90 120.40 117.15 2jer s VAL 231 Ca -0.09 -1.53 -0.03 0.00 -1.81 0.00 0.00 61.98 58.53 2jer s VAL 231 Cb -0.12 -1.42 -0.04 0.00 0.56 0.00 0.00 36.38 35.36 2jer s VAL 231 CO 0.01 -0.20 0.09 0.00 -0.31 0.00 0.00 175.10 174.69 2jer s ALA 232 N -1.45 3.65 -0.02 1.32 0.00 -0.42 -0.45 121.76 124.40 2jer s ALA 232 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2jer s ALA 232 Cb -0.09 -1.70 0.02 0.00 0.00 0.00 0.00 23.12 21.35 2jer s ALA 232 CO 0.04 0.66 -0.00 0.00 0.00 0.00 0.00 175.76 176.45 2jer n ILE 234 N 3.79 3.76 -3.74 0.00 -5.35 -0.45 -0.75 119.36 116.62 2jer n ILE 234 Ca -0.23 -0.50 -0.13 0.00 -0.27 0.00 0.00 62.75 61.62 2jer n ILE 234 Cb 0.53 -1.49 -0.09 0.00 -1.74 0.00 0.00 39.64 36.85 2jer n ILE 234 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2jer s TYR 235 N -1.34 -0.34 -0.10 4.28 5.04 -0.12 -4.76 117.35 120.02 2jer s TYR 235 Ca 0.73 0.73 -0.27 0.00 -2.44 0.00 0.00 57.07 55.82 2jer s TYR 235 Cb -0.43 0.14 0.06 0.00 0.35 0.00 0.00 41.96 42.09 2jer s TYR 235 CO 0.49 -0.30 0.63 -0.08 -1.34 0.00 0.00 175.55 174.95 2jer s THR 236 N -0.50 0.01 -1.89 4.34 -1.32 -1.26 -3.65 115.64 111.37 2jer s THR 236 Ca -0.06 -0.05 0.17 0.00 -1.21 0.00 0.00 61.69 60.53 2jer s THR 236 Cb -0.04 -0.94 0.23 0.00 -1.51 0.00 0.00 72.50 70.24 2jer s THR 236 CO 0.03 -0.03 1.13 -0.62 -2.21 0.00 0.00 174.62 172.92 2jer n GLU 237 N 1.40 1.75 -2.74 7.08 1.02 -1.26 -4.84 120.64 123.06 2jer n GLU 237 Ca -0.18 -1.74 -0.43 0.00 -0.02 0.00 0.00 57.16 54.80 2jer n GLU 237 Cb 0.56 -1.34 -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 -1.28 6.43 0.00 1.62 -1.08 -1.26 -4.88 116.67 116.21 2jer s ASP 238 Ca 0.24 -0.05 0.14 0.00 -0.52 0.00 0.00 52.55 52.36 2jer s ASP 238 Cb 0.15 -2.48 0.64 0.00 -1.46 0.00 0.00 42.92 39.77 2jer s ASP 238 CO 0.22 -1.27 1.43 0.00 0.52 0.00 0.00 175.17 176.07 2jer n GLN 239 N 7.72 0.07 0.02 4.34 6.02 -1.26 -1.54 117.38 132.74 2jer n GLN 239 Ca 0.05 0.22 0.12 0.00 -0.01 0.00 0.00 57.00 57.39 2jer n GLN 239 Cb 0.48 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 30.44 2jer n GLN 239 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2jer n ASN 240 N -1.43 0.57 -4.74 1.08 3.02 -1.26 -4.91 115.26 107.58 2jer n ASN 240 Ca 0.05 -0.18 -0.42 0.00 -0.03 0.00 0.00 54.58 53.99 2jer n ASN 240 Cb 0.15 0.31 -0.01 0.00 -0.61 0.00 0.00 39.78 39.62 2jer n ASN 240 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2jer n SER 241 N -1.68 3.67 0.29 6.41 2.88 -0.59 -4.87 113.62 119.73 2jer n SER 241 Ca 0.05 1.16 0.19 0.00 -1.33 0.00 0.00 58.87 58.94 2jer n SER 241 Cb 0.37 -1.58 0.96 0.00 -0.75 0.00 0.00 64.21 63.21 2jer n SER 241 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2jer h PRO 242 N 4.28 0.00 -0.00 -1.46 0.13 -1.91 -2.74 132.00 130.30 2jer h PRO 242 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2jer h PRO 242 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2jer h PRO 242 CO 0.75 0.00 -0.54 1.19 -0.23 0.00 0.00 178.00 179.17 2jer n PHE 243 N -2.92 0.00 0.10 1.56 3.72 -1.26 -4.67 117.46 113.98 2jer n PHE 243 Ca -0.02 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.22 2jer n PHE 243 Cb 0.14 -0.21 -0.10 0.00 -0.94 0.00 0.00 39.48 38.37 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 0.13 -1.53 -0.15 1.38 3.20 -1.75 -0.44 116.97 117.82 2jer h TYR 244 Ca 0.00 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.95 2jer h TYR 244 Cb 0.50 0.65 -0.04 0.00 1.54 0.00 0.00 36.73 39.39 2jer h TYR 244 CO 0.00 -0.59 -0.07 0.93 -1.64 0.00 0.00 178.16 176.79 2jer h GLU 245 N -0.73 -0.05 -0.62 1.82 3.07 -1.83 -0.96 114.58 115.28 2jer h GLU 245 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.78 2jer h GLU 245 Cb 0.75 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.65 2jer h GLU 245 CO -0.31 -0.04 0.05 0.00 -1.40 0.00 0.00 179.01 177.31 2jer h ALA 246 N 1.08 0.91 -0.19 3.43 0.00 -1.85 -0.61 119.26 122.04 2jer h ALA 246 Ca 0.08 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2jer h ALA 246 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2jer h ALA 246 CO -0.19 0.66 0.05 0.00 0.00 0.00 0.00 179.25 179.77 2jer h ALA 247 N 1.07 0.25 -0.75 0.00 0.00 -0.91 0.02 119.26 118.93 2jer h ALA 247 Ca 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2jer h ALA 247 Cb 0.49 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2jer h ALA 247 CO 0.02 -0.11 0.38 1.96 0.00 0.00 0.00 179.25 181.50 2jer h GLN 248 N 0.12 1.07 -0.28 0.00 1.08 -1.04 -1.49 115.11 114.57 2jer h GLN 248 Ca 0.06 -0.15 -0.19 0.00 -1.45 0.00 0.00 58.65 56.93 2jer h GLN 248 Cb 0.26 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 2jer h GLN 248 CO 0.00 0.82 -0.55 0.22 -0.95 0.00 0.00 178.83 178.37 2jer h ASP 249 N 1.05 0.97 -0.56 1.46 3.58 -0.96 -2.11 116.42 119.86 2jer h ASP 249 Ca 0.26 -0.54 -0.03 0.00 0.42 0.00 0.00 57.03 57.15 2jer h ASP 249 Cb 0.09 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.83 2jer h ASP 249 CO -0.04 1.33 0.24 0.00 -2.88 0.00 0.00 179.24 177.89 2jer h ALA 250 N 0.67 0.72 -0.18 -0.78 0.00 -0.79 -1.43 119.26 117.47 2jer h ALA 250 Ca 0.01 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2jer h ALA 250 Cb 1.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2jer h ALA 250 CO 0.12 0.32 0.03 -0.92 0.00 0.00 0.00 179.25 178.80 2jer h TYR 251 N 0.76 0.05 -0.75 0.00 3.20 -1.24 -1.20 116.97 117.80 2jer h TYR 251 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 2jer h TYR 251 Cb 0.17 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 2jer h TYR 251 CO 0.00 0.01 0.46 1.96 -1.64 0.00 0.00 178.16 178.96 2jer h GLN 252 N 0.10 1.01 -0.23 1.82 1.08 -1.18 -2.17 115.11 115.54 2jer h GLN 252 Ca 0.08 -0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2jer h GLN 252 Cb 0.08 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.28 2jer h GLN 252 CO -0.11 0.70 0.13 0.00 -0.95 0.00 0.00 178.83 178.60 2jer h ARG 253 N 1.02 0.32 -0.61 1.46 3.08 -1.05 -3.11 114.38 115.49 2jer h ARG 253 Ca 0.27 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 2jer h ARG 253 Cb -0.06 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 2jer h ARG 253 CO -0.05 0.28 0.35 -0.07 -1.07 0.00 0.00 179.97 179.40 2jer h LEU 254 N 0.27 0.74 -1.77 3.04 -0.00 -0.91 -1.16 115.31 115.51 2jer h LEU 254 Ca 0.08 -0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 2jer h LEU 254 Cb 0.05 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 40.52 2jer h LEU 254 CO -0.01 0.58 0.00 -0.07 -0.00 0.00 0.00 178.44 178.94 2jer h LEU 255 N 0.84 0.00 -2.03 1.67 3.38 -1.32 -2.20 115.31 115.65 2jer h LEU 255 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2jer h LEU 255 Cb -0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jer h LEU 255 CO -0.04 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.78 2jer n LYS 256 N -2.77 2.01 -3.76 1.13 5.02 -0.45 -4.92 118.16 114.41 2jer n LYS 256 Ca -0.01 -1.88 -0.36 0.00 -2.02 0.00 0.00 58.31 54.04 2jer n LYS 256 Cb 0.17 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 33.72 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 -1.48 3.59 0.06 1.97 -1.94 -0.83 -5.04 119.30 115.62 2jer s MET 257 Ca 0.28 -0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.30 2jer s MET 257 Cb 0.18 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.84 2jer s MET 257 CO 0.26 0.70 -0.08 0.95 -0.01 0.00 0.00 175.02 176.84 2jer s THR 258 N -1.16 3.52 0.88 2.05 -4.23 -1.26 -1.91 115.64 113.53 2jer s THR 258 Ca 0.22 -1.04 -0.14 0.00 -1.18 0.00 0.00 61.69 59.55 2jer s THR 258 Cb -0.13 -2.60 0.20 0.00 1.34 0.00 0.00 72.50 71.31 2jer s THR 258 CO 0.11 0.23 1.20 -0.90 -0.54 0.00 0.00 174.62 174.72 2jer n ASP 259 N 1.06 0.18 0.31 3.99 5.68 -0.45 -4.87 116.55 122.45 2jer n ASP 259 Ca -0.14 -1.49 0.18 0.00 -0.50 0.00 0.00 54.79 52.85 2jer n ASP 259 Cb 0.52 -0.91 1.03 0.00 -1.14 0.00 0.00 41.12 40.62 2jer n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2jer h ALA 260 N -1.72 1.27 -0.16 2.12 0.00 -1.83 0.25 119.26 119.19 2jer h ALA 260 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2jer h ALA 260 Cb 1.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2jer h ALA 260 CO 0.28 0.01 0.00 1.63 0.00 0.00 0.00 179.25 181.18 2jer n LYS 261 N -3.48 1.99 -0.72 0.00 5.02 -1.26 -4.92 118.16 114.78 2jer n LYS 261 Ca -0.03 -1.47 0.00 0.00 -2.02 0.00 0.00 58.31 54.79 2jer n LYS 261 Cb 0.10 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 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 0.69 3.70 0.72 0.00 0.08 -5.03 105.19 106.62 2jer n GLY 262 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2jer n GLY 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jer s ARG 263 N -0.28 4.41 0.08 1.61 0.52 -1.26 -4.74 118.95 119.29 2jer s ARG 263 Ca 0.00 1.72 -0.31 0.00 -0.52 0.00 0.00 55.73 56.62 2jer s ARG 263 Cb 0.00 -3.44 -0.08 0.00 0.52 0.00 0.00 34.95 31.95 2jer s ARG 263 CO 0.00 -0.32 1.62 -1.14 0.02 0.00 0.00 175.30 175.48 2jer s GLN 264 N 1.52 4.21 0.26 3.54 2.00 -1.26 -1.34 119.66 128.59 2jer s GLN 264 Ca 0.57 2.30 -0.30 0.00 -2.00 0.00 0.00 55.36 55.94 2jer s GLN 264 Cb -0.27 -3.53 -0.10 0.00 0.80 0.00 0.00 33.01 29.91 2jer s GLN 264 CO 0.26 -0.70 1.41 -0.51 -0.50 0.00 0.00 175.29 175.26 2jer s LEU 265 N 2.39 4.39 -0.22 3.68 1.43 -0.80 -4.94 118.68 124.62 2jer s LEU 265 Ca 0.72 2.66 -0.19 0.00 -1.03 0.00 0.00 54.13 56.30 2jer s LEU 265 Cb -0.40 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.17 2jer s LEU 265 CO 0.32 -0.67 0.55 -0.54 0.23 0.00 0.00 176.35 176.24 2jer s LYS 266 N -0.60 4.15 -0.20 1.70 1.02 -0.44 -4.87 119.74 120.50 2jer s LYS 266 Ca 0.57 0.45 -0.04 0.00 0.02 0.00 0.00 55.97 56.97 2jer s LYS 266 Cb -0.41 -3.60 -0.02 0.00 -0.52 0.00 0.00 37.83 33.28 2jer s LYS 266 CO 0.45 -0.25 -0.02 0.08 -0.92 0.00 0.00 175.35 174.68 2jer s VAL 267 N 1.97 3.72 -0.22 3.17 1.01 -1.26 -0.56 120.40 128.24 2jer s VAL 267 Ca 0.24 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 2jer s VAL 267 Cb -0.16 -2.67 -0.01 0.00 0.00 0.00 0.00 36.38 33.54 2jer s VAL 267 CO 0.09 0.44 -0.01 -1.00 0.00 0.00 0.00 175.10 174.62 2jer s HIS 268 N 1.02 2.99 0.36 5.22 3.76 0.41 -4.99 115.29 124.06 2jer s HIS 268 Ca 0.01 -0.76 -0.27 0.00 -0.15 0.00 0.00 55.06 53.89 2jer s HIS 268 Cb -0.14 -2.13 -0.09 0.00 1.11 0.00 0.00 32.58 31.33 2jer s HIS 268 CO 0.01 -0.46 1.26 0.15 -0.85 0.00 0.00 174.74 174.85 2jer s LYS 269 N 1.43 4.20 -0.06 1.40 1.02 -1.26 -0.89 119.74 125.58 2jer s LYS 269 Ca 0.05 2.08 0.05 0.00 0.02 0.00 0.00 55.97 58.17 2jer s LYS 269 Cb -0.14 -2.90 -0.00 0.00 -0.52 0.00 0.00 37.83 34.26 2jer s LYS 269 CO -0.01 -0.27 -0.20 -1.17 -0.92 0.00 0.00 175.35 172.78 2jer s LEU 270 N -2.10 1.96 0.98 3.17 2.96 0.07 -4.83 118.68 120.89 2jer s LEU 270 Ca 0.53 -0.43 -0.12 0.00 -0.22 0.00 0.00 54.13 53.89 2jer s LEU 270 Cb -0.37 -1.15 0.18 0.00 0.50 0.00 0.00 46.19 45.35 2jer s LEU 270 CO 0.48 0.17 1.09 0.00 -1.32 0.00 0.00 176.35 176.76 2jer n PRO 273 N -0.01 2.22 -0.08 0.00 -0.02 -1.26 -4.87 135.00 130.99 2jer n PRO 273 Ca -0.10 0.79 -0.13 0.00 -2.02 0.00 0.00 63.50 62.04 2jer n PRO 273 Cb 0.57 -2.62 -0.05 0.00 -0.02 0.00 0.00 33.50 31.37 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 2.25 1.32 -2.82 -1.45 2.07 -1.97 -3.44 116.25 112.20 2jer h VAL 274 Ca -0.51 -1.30 -0.65 0.00 0.82 0.00 0.00 66.70 65.06 2jer h VAL 274 Cb 1.27 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.64 2jer h VAL 274 CO 0.61 0.40 -0.51 -0.54 0.02 0.00 0.00 177.57 177.55 2jer s LYS 275 N -4.44 3.36 0.30 1.57 1.02 -1.26 -5.04 119.74 115.25 2jer s LYS 275 Ca -0.13 -0.29 -0.29 0.00 0.02 0.00 0.00 55.97 55.28 2jer s LYS 275 Cb 0.07 -3.08 -0.10 0.00 -0.52 0.00 0.00 37.83 34.20 2jer s LYS 275 CO 0.78 0.71 1.33 -0.80 -0.92 0.00 0.00 175.35 176.45 2jer s ASN 276 N -1.56 6.77 -0.08 2.83 0.01 -1.26 -5.02 114.94 116.62 2jer s ASN 276 Ca 0.22 2.65 -0.19 0.00 -0.71 0.00 0.00 52.86 54.83 2jer s ASN 276 Cb -0.12 -2.64 -0.04 0.00 0.41 0.00 0.00 41.25 38.85 2jer s ASN 276 CO 0.12 -0.56 0.52 -0.69 -1.51 0.00 0.00 177.10 174.98 2jer s VAL 277 N -0.80 5.11 0.07 1.60 1.01 -1.26 -5.02 120.40 121.11 2jer s VAL 277 Ca 0.52 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.60 2jer s VAL 277 Cb -0.40 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2jer s VAL 277 CO 0.50 0.35 -0.15 0.42 0.00 0.00 0.00 175.10 176.22 2jer s THR 278 N 0.38 1.17 0.34 3.92 -4.23 -1.26 0.08 115.64 116.05 2jer s THR 278 Ca 0.28 -1.28 -0.28 0.00 -1.18 0.00 0.00 61.69 59.23 2jer s THR 278 Cb -0.16 -1.11 -0.10 0.00 1.34 0.00 0.00 72.50 72.47 2jer s THR 278 CO 0.13 -0.17 1.27 -0.63 -0.54 0.00 0.00 174.62 174.67 2jer s ILE 279 N -1.19 2.84 -0.14 2.99 -1.09 -0.20 -4.90 121.20 119.51 2jer s ILE 279 Ca -0.01 0.83 -0.06 0.00 -2.23 0.00 0.00 60.65 59.19 2jer s ILE 279 Cb -0.10 -3.52 -0.04 0.00 -1.58 0.00 0.00 42.46 37.22 2jer s ILE 279 CO 0.02 0.18 0.06 -0.54 -1.23 0.00 0.00 174.94 173.44 2jer s LYS 280 N -1.83 3.54 0.49 2.79 1.02 -1.26 -0.65 119.74 123.84 2jer s LYS 280 Ca 0.50 -0.31 0.26 0.00 0.02 0.00 0.00 55.97 56.44 2jer s LYS 280 Cb -0.38 -3.08 1.33 0.00 -0.52 0.00 0.00 37.83 35.18 2jer s LYS 280 CO 0.50 0.53 1.87 0.78 -0.92 0.00 0.00 175.35 178.12 2jer h GLY 281 N 5.79 0.36 2.00 -3.33 0.00 -1.89 -0.16 103.07 105.83 2jer h GLY 281 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 46.80 2jer h GLY 281 CO 0.62 -0.01 0.00 -1.14 0.00 0.00 0.00 176.54 176.01 2jer n SER 282 N -4.37 0.50 -4.76 0.19 3.41 -1.26 -4.79 113.62 102.54 2jer n SER 282 Ca 0.19 0.64 -0.41 0.00 -0.26 0.00 0.00 58.87 59.03 2jer n SER 282 Cb 0.86 -0.74 -0.01 0.00 -0.26 0.00 0.00 64.21 64.06 2jer n SER 282 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2jer n PHE 283 N -2.08 2.93 -3.12 7.33 0.99 -0.07 -4.91 117.46 118.54 2jer n PHE 283 Ca 0.02 0.31 -0.45 0.00 -0.00 0.00 0.00 57.45 57.33 2jer n PHE 283 Cb 0.18 -2.58 -0.01 0.00 -1.00 0.00 0.00 39.48 36.07 2jer n PHE 283 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 2jer s LYS 284 N -1.03 3.85 -0.07 -1.08 -0.14 -1.26 -4.97 119.74 115.04 2jer s LYS 284 Ca 0.60 -2.44 0.03 0.00 -1.36 0.00 0.00 55.97 52.80 2jer s LYS 284 Cb -0.48 -4.76 0.01 0.00 -1.68 0.00 0.00 37.83 30.91 2jer s LYS 284 CO 0.53 -1.54 -0.17 0.42 -0.76 0.00 0.00 175.35 173.83 2jer s ILE 285 N 0.97 1.47 0.33 2.17 1.01 -1.26 -1.46 121.20 124.43 2jer s ILE 285 Ca 0.31 -0.69 -0.28 0.00 0.00 0.00 0.00 60.65 59.99 2jer s ILE 285 Cb -0.07 -1.29 -0.10 0.00 0.01 0.00 0.00 42.46 41.01 2jer s ILE 285 CO -0.07 0.43 1.19 -1.81 0.00 0.00 0.00 174.94 174.69 2jer s ASP 286 N 0.40 6.91 -0.14 3.58 1.11 0.03 -4.98 116.67 123.59 2jer s ASP 286 Ca -0.13 2.45 -0.15 0.00 0.18 0.00 0.00 52.55 54.90 2jer s ASP 286 Cb -0.15 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.16 2jer s ASP 286 CO 0.05 -0.41 0.36 0.12 1.18 0.00 0.00 175.17 176.47 2jer s PHE 287 N -1.21 3.49 -0.05 4.23 5.36 -1.26 -4.33 117.98 124.20 2jer s PHE 287 Ca 0.49 0.71 -0.00 0.00 -0.96 0.00 0.00 56.93 57.17 2jer s PHE 287 Cb -0.35 -2.41 0.03 0.00 -0.34 0.00 0.00 43.02 39.95 2jer s PHE 287 CO 0.45 0.23 -0.01 0.08 -1.46 0.00 0.00 175.22 174.52 2jer s VAL 288 N 0.46 0.34 0.08 3.12 1.01 -1.26 -5.09 120.40 119.06 2jer s VAL 288 Ca 0.20 0.08 -0.34 0.00 0.00 0.00 0.00 61.98 61.92 2jer s VAL 288 Cb -0.14 -0.46 -0.13 0.00 0.00 0.00 0.00 36.38 35.65 2jer s VAL 288 CO 0.06 0.22 1.71 1.21 0.00 0.00 0.00 175.10 178.31 2jer n GLU 289 N 4.70 2.24 0.00 2.72 4.07 -1.26 -0.84 120.64 132.26 2jer n GLU 289 Ca -0.15 0.81 0.00 0.00 -0.06 0.00 0.00 57.16 57.76 2jer n GLU 289 Cb 0.50 -2.62 0.00 0.00 -0.06 0.00 0.00 31.44 29.26 2jer n GLU 289 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2jer n GLY 290 N 3.83 2.37 3.77 8.31 0.00 -1.26 -4.98 105.19 117.22 2jer n GLY 290 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.65 5.38 -0.34 2.61 2.01 -0.02 -3.56 115.64 119.06 2jer s THR 291 Ca 0.00 0.34 -0.40 0.00 0.31 0.00 0.00 61.69 61.94 2jer s THR 291 Cb 0.00 -3.52 -0.15 0.00 0.01 0.00 0.00 72.50 68.84 2jer s THR 291 CO 0.00 0.47 1.89 0.80 -0.69 0.00 0.00 174.62 177.09 2jer n MET 292 N 3.12 0.91 -1.93 4.92 1.56 -0.14 -4.66 117.12 120.90 2jer n MET 292 Ca -0.15 0.31 -0.37 0.00 -0.27 0.00 0.00 57.70 57.22 2jer n MET 292 Cb 0.53 -2.07 0.04 0.00 2.15 0.00 0.00 33.22 33.87 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 4.44 2.91 -0.41 2.12 0.02 -1.26 -4.91 135.00 137.92 2jer s PRO 293 Ca 1.04 1.93 0.02 0.00 0.02 0.00 0.00 61.00 64.02 2jer s PRO 293 Cb -1.11 -1.96 0.11 0.00 0.02 0.00 0.00 34.50 31.57 2jer s PRO 293 CO 0.63 -1.28 0.15 1.03 -0.33 0.00 0.00 177.00 177.20 2jer s ARG 294 N -3.27 1.75 0.11 5.54 1.81 -1.26 -5.10 118.95 118.53 2jer s ARG 294 Ca 0.78 -2.07 0.06 0.00 -1.72 0.00 0.00 55.73 52.78 2jer s ARG 294 Cb -0.33 -3.34 -0.04 0.00 -0.45 0.00 0.00 34.95 30.79 2jer s ARG 294 CO 0.36 -1.02 -0.01 -1.21 -0.68 0.00 0.00 175.30 172.74 2jer s GLU 295 N 0.63 2.45 0.07 3.54 2.02 -1.26 -4.97 118.70 121.19 2jer s GLU 295 Ca 0.12 -0.92 -0.37 0.00 0.02 0.00 0.00 54.97 53.82 2jer s GLU 295 Cb -0.21 -2.47 -0.17 0.00 0.10 0.00 0.00 34.13 31.38 2jer s GLU 295 CO -0.05 0.52 1.36 -3.47 0.02 0.00 0.00 175.26 173.63 2jer n ASP 296 N 0.43 1.67 0.00 -0.19 2.03 -1.26 -1.29 116.55 117.94 2jer n ASP 296 Ca -0.11 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.32 2jer n ASP 296 Cb 0.53 -1.19 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 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 2.59 1.60 3.67 0.27 0.00 0.18 -4.88 105.19 108.62 2jer n GLY 297 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 2jer n GLY 297 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jer n ASP 298 N 0.00 3.19 -4.67 1.61 8.00 -0.41 -4.72 116.55 119.55 2jer n ASP 298 Ca 0.00 1.05 -0.43 0.00 0.71 0.00 0.00 54.79 56.13 2jer n ASP 298 Cb 0.00 -1.41 -0.02 0.00 -0.02 0.00 0.00 41.12 39.66 2jer n ASP 298 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2jer s ILE 299 N 1.74 4.73 0.25 0.53 1.01 -1.26 -1.04 121.20 127.16 2jer s ILE 299 Ca 0.82 2.00 -0.13 0.00 0.00 0.00 0.00 60.65 63.34 2jer s ILE 299 Cb -0.68 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 37.41 2jer s ILE 299 CO 0.41 -0.10 0.63 0.00 0.00 0.00 0.00 174.94 175.89 2jer n ILE 301 N 0.00 3.75 -3.02 0.00 2.08 -1.26 -4.52 119.36 116.40 2jer n ILE 301 Ca 0.00 -3.73 -0.44 0.00 0.56 0.00 0.00 62.75 59.14 2jer n ILE 301 Cb 0.52 -2.42 -0.03 0.00 -0.75 0.00 0.00 39.64 36.96 2jer n ILE 301 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jer s ALA 302 N 4.07 3.40 -0.09 -1.39 0.00 -1.26 -4.78 121.76 121.70 2jer s ALA 302 Ca 0.52 -2.41 0.02 0.00 0.00 0.00 0.00 51.96 50.09 2jer s ALA 302 Cb 0.07 -3.76 -0.02 0.00 0.00 0.00 0.00 23.12 19.41 2jer s ALA 302 CO 0.03 -2.64 -0.17 0.45 0.00 0.00 0.00 175.76 173.44 2jer s SER 303 N 3.50 3.75 0.19 0.00 0.15 -1.26 -4.44 113.70 115.59 2jer s SER 303 Ca 0.21 -0.35 0.22 0.00 0.70 0.00 0.00 55.95 56.73 2jer s SER 303 Cb -0.15 -1.25 0.89 0.00 -1.71 0.00 0.00 66.02 63.80 2jer s SER 303 CO 0.01 0.23 1.68 -1.22 1.20 0.00 0.00 173.24 175.13 2jer n TYR 304 N 3.10 0.62 0.28 3.44 4.02 -1.26 -3.10 117.16 124.26 2jer n TYR 304 Ca -0.18 0.23 0.18 0.00 -0.01 0.00 0.00 57.90 58.12 2jer n TYR 304 Cb 0.52 -0.87 0.74 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 -2.40 -0.72 4.05 -1.86 -3.34 114.93 110.66 2jer h MET 305 Ca 0.00 0.00 -0.39 0.00 -0.28 0.00 0.00 59.70 59.03 2jer h MET 305 Cb 0.39 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.16 2jer h MET 305 CO 0.00 0.00 1.34 -1.71 0.23 0.00 0.00 176.91 176.77 2jer n ASN 306 N -3.09 6.70 -4.91 1.39 2.85 -1.18 -4.81 115.26 112.20 2jer n ASN 306 Ca 0.00 -2.53 -0.21 0.00 -0.11 0.00 0.00 54.58 51.73 2jer n ASN 306 Cb 0.28 -1.47 -0.03 0.00 1.24 0.00 0.00 39.78 39.80 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 1.40 3.21 -0.19 1.20 -0.12 -1.25 -1.19 117.98 121.04 2jer s PHE 307 Ca 0.68 -0.12 -0.03 0.00 -0.05 0.00 0.00 56.93 57.41 2jer s PHE 307 Cb 0.26 -1.62 -0.01 0.00 -0.63 0.00 0.00 43.02 41.02 2jer s PHE 307 CO -0.03 0.35 -0.06 -1.17 -0.05 0.00 0.00 175.22 174.27 2jer s LEU 308 N -3.97 2.96 -0.10 -1.99 2.96 -0.65 -4.37 118.68 113.52 2jer s LEU 308 Ca 0.36 -0.31 -0.23 0.00 -0.22 0.00 0.00 54.13 53.73 2jer s LEU 308 Cb -0.08 -1.73 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 2jer s LEU 308 CO 0.28 0.06 0.70 -0.63 -1.32 0.00 0.00 176.35 175.44 2jer s ILE 309 N 0.98 5.03 -0.30 6.68 1.01 -1.26 -0.52 121.20 132.82 2jer s ILE 309 Ca -0.00 1.42 0.00 0.00 0.00 0.00 0.00 60.65 62.07 2jer s ILE 309 Cb -0.15 -4.03 0.14 0.00 0.01 0.00 0.00 42.46 38.43 2jer s ILE 309 CO 0.00 0.21 0.30 0.28 0.00 0.00 0.00 174.94 175.73 2jer s THR 310 N 1.09 -0.38 0.00 2.92 -1.32 -0.25 -4.77 115.64 112.94 2jer s THR 310 Ca 0.36 -0.59 0.00 0.00 -1.21 0.00 0.00 61.69 60.25 2jer s THR 310 Cb -0.17 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.87 2jer s THR 310 CO 0.16 -0.50 0.00 0.59 -2.21 0.00 0.00 174.62 172.66 2jer n ASN 311 N 5.14 0.00 -0.56 8.08 5.03 -1.26 -1.36 115.26 130.32 2jer n ASN 311 Ca -0.00 0.00 0.05 0.00 0.87 0.00 0.00 54.58 55.50 2jer n ASN 311 Cb 0.46 0.00 0.16 0.00 -1.02 0.00 0.00 39.78 39.38 2jer n ASN 311 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2jer n ASP 312 N 6.05 1.62 -4.35 6.41 8.00 -1.26 -4.87 116.55 128.16 2jer n ASP 312 Ca 0.00 -1.97 -0.19 0.00 0.71 0.00 0.00 54.79 53.35 2jer n ASP 312 Cb 0.00 -0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 40.81 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 -1.06 1.44 -0.05 0.44 0.00 -0.47 -0.63 107.32 106.99 2jer s GLY 313 Ca 0.22 -1.66 0.00 0.00 0.00 0.00 0.00 44.72 43.28 2jer s GLY 313 CO 0.15 -1.75 -0.02 0.14 0.00 0.00 0.00 173.10 171.62 2jer s VAL 314 N -2.91 0.43 -0.32 1.40 1.01 -0.21 -1.09 120.40 118.70 2jer s VAL 314 Ca 0.22 -0.01 -0.09 0.00 0.00 0.00 0.00 61.98 62.10 2jer s VAL 314 Cb -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.85 2jer s VAL 314 CO 0.07 0.23 0.15 -0.63 0.00 0.00 0.00 175.10 174.92 2jer s ILE 315 N 1.32 4.51 -0.07 2.22 -1.09 0.33 -0.58 121.20 127.83 2jer s ILE 315 Ca -0.05 -0.53 0.04 0.00 -2.23 0.00 0.00 60.65 57.87 2jer s ILE 315 Cb -0.13 -3.34 -0.02 0.00 -1.58 0.00 0.00 42.46 37.39 2jer s ILE 315 CO -0.02 0.02 -0.18 -0.69 -1.23 0.00 0.00 174.94 172.84 2jer s VAL 316 N 1.59 2.72 0.47 2.92 1.01 0.02 -1.64 120.40 127.50 2jer s VAL 316 Ca 0.04 -0.83 -0.24 0.00 0.00 0.00 0.00 61.98 60.95 2jer s VAL 316 Cb -0.17 -2.06 -0.08 0.00 0.00 0.00 0.00 36.38 34.07 2jer s VAL 316 CO 0.06 0.57 1.32 -2.65 0.00 0.00 0.00 175.10 174.39 2jer n PRO 317 N 2.77 1.90 -4.27 2.72 -0.02 -1.26 -1.66 135.00 135.17 2jer n PRO 317 Ca -0.17 0.68 -0.24 0.00 -2.02 0.00 0.00 63.50 61.75 2jer n PRO 317 Cb 0.52 -2.48 -0.17 0.00 -0.02 0.00 0.00 33.50 31.35 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 -2.46 1.38 0.00 -0.52 -1.52 -0.35 -4.75 119.66 111.44 2jer s GLN 318 Ca 0.64 -0.27 0.12 0.00 -1.95 0.00 0.00 55.36 53.91 2jer s GLN 318 Cb -0.46 -1.28 0.11 0.00 -0.22 0.00 0.00 33.01 31.15 2jer s GLN 318 CO 0.55 -0.09 0.91 0.66 -0.25 0.00 0.00 175.29 177.07 2jer n TYR 319 N 4.22 0.03 -1.10 0.91 4.02 -1.26 -1.17 117.16 122.82 2jer n TYR 319 Ca -0.20 -0.03 -0.00 0.00 -0.01 0.00 0.00 57.90 57.66 2jer n TYR 319 Cb 0.51 -0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.83 2jer n TYR 319 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jer n GLY 320 N 0.67 0.38 3.92 2.72 0.00 -1.26 -4.78 105.19 106.84 2jer n GLY 320 Ca 0.07 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 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 -3.00 6.40 0.57 1.61 2.15 -1.26 -4.99 116.67 118.15 2jer s ASP 321 Ca 0.00 0.55 0.27 0.00 0.43 0.00 0.00 52.55 53.80 2jer s ASP 321 Cb 0.00 -2.07 1.57 0.00 -0.30 0.00 0.00 42.92 42.12 2jer s ASP 321 CO 0.00 -0.16 2.08 1.05 -0.17 0.00 0.00 175.17 177.97 2jer h GLU 322 N 1.62 0.00 -0.15 4.34 4.11 -1.97 -1.47 114.58 121.06 2jer h GLU 322 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2jer h GLU 322 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2jer h GLU 322 CO 0.66 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.83 2jer n ASN 323 N -3.97 1.11 -0.11 3.06 5.03 -1.26 -4.41 115.26 114.71 2jer n ASN 323 Ca 0.03 -1.75 -0.07 0.00 0.87 0.00 0.00 54.58 53.65 2jer n ASN 323 Cb 0.36 -0.10 0.01 0.00 -1.02 0.00 0.00 39.78 39.03 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 1.37 0.30 -0.39 6.41 3.32 -1.66 -0.89 116.42 124.89 2jer h ASP 324 Ca 0.00 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 2jer h ASP 324 Cb 0.30 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2jer h ASP 324 CO 0.00 0.22 -0.09 -0.09 -1.72 0.00 0.00 179.24 177.56 2jer h ARG 325 N 0.40 0.74 -0.62 3.56 2.43 -1.82 -2.84 114.38 116.23 2jer h ARG 325 Ca 0.15 -0.28 0.10 0.00 -0.81 0.00 0.00 59.98 59.14 2jer h ARG 325 Cb 0.04 -0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.47 2jer h ARG 325 CO -0.09 0.88 0.23 1.25 -1.51 0.00 0.00 179.97 180.73 2jer h LEU 326 N 0.55 0.21 -0.45 3.80 5.85 -1.79 -0.81 115.31 122.68 2jer h LEU 326 Ca 0.10 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2jer h LEU 326 Cb 0.60 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 2jer h LEU 326 CO 0.04 0.12 0.17 0.00 -0.34 0.00 0.00 178.44 178.43 2jer h ALA 327 N 1.43 0.54 -0.72 1.25 0.00 -1.03 0.32 119.26 121.05 2jer h ALA 327 Ca 0.32 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 2jer h ALA 327 Cb 0.41 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2jer h ALA 327 CO -0.32 -0.21 0.26 -0.07 0.00 0.00 0.00 179.25 178.90 2jer h LEU 328 N 0.35 1.02 -0.38 0.00 3.38 -1.15 -0.40 115.31 118.13 2jer h LEU 328 Ca 0.21 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2jer h LEU 328 Cb 0.19 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2jer h LEU 328 CO -0.20 0.94 0.20 -0.33 0.09 0.00 0.00 178.44 179.14 2jer h GLU 329 N 1.05 0.40 -0.39 1.13 5.08 -0.60 -0.18 114.58 121.06 2jer h GLU 329 Ca 0.24 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.51 2jer h GLU 329 Cb 0.26 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2jer h GLU 329 CO -0.01 0.26 0.01 1.96 -1.00 0.00 0.00 179.01 180.23 2jer h GLN 330 N 0.41 0.69 -0.44 2.33 4.20 -0.62 -2.41 115.11 119.27 2jer h GLN 330 Ca 0.16 -0.22 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 2jer h GLN 330 Cb 0.05 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 2jer h GLN 330 CO -0.10 0.78 0.04 0.28 -0.67 0.00 0.00 178.83 179.16 2jer h VAL 331 N 0.52 1.22 -0.64 -0.54 2.07 -1.00 -2.24 116.25 115.64 2jer h VAL 331 Ca 0.11 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.81 2jer h VAL 331 Cb 0.46 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 2jer h VAL 331 CO 0.02 0.31 0.38 -0.61 0.02 0.00 0.00 177.57 177.68 2jer h GLN 332 N 0.67 0.71 -0.02 1.57 5.75 -0.72 -1.46 115.11 121.61 2jer h GLN 332 Ca 0.14 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.51 2jer h GLN 332 Cb 0.35 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.73 2jer h GLN 332 CO 0.01 0.47 -0.39 1.79 -2.65 0.00 0.00 178.83 178.06 2jer h THR 333 N 0.73 1.29 -0.06 2.39 1.35 -0.98 -1.67 112.91 115.96 2jer h THR 333 Ca 0.27 -1.37 -0.08 0.00 -0.55 0.00 0.00 66.41 64.68 2jer h THR 333 Cb 0.08 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 2jer h THR 333 CO -0.13 0.40 -0.33 0.24 -0.25 0.00 0.00 175.52 175.44 2jer h MET 334 N 0.04 0.11 -2.13 4.72 2.86 -0.81 -3.34 114.93 116.38 2jer h MET 334 Ca 0.00 -0.04 -0.58 0.00 -2.06 0.00 0.00 59.70 57.02 2jer h MET 334 Cb 0.71 -0.01 -0.40 0.00 0.06 0.00 0.00 31.60 31.96 2jer h MET 334 CO 0.05 0.43 -0.88 1.19 1.06 0.00 0.00 176.91 178.77 2jer n PHE 335 N -4.12 1.37 0.31 -0.22 3.01 -0.61 -4.98 117.46 112.21 2jer n PHE 335 Ca -0.02 -3.82 0.18 0.00 1.01 0.00 0.00 57.45 54.80 2jer n PHE 335 Cb 0.39 -0.42 0.99 0.00 -0.01 0.00 0.00 39.48 40.43 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 4.19 0.00 -0.38 -1.08 0.13 -1.46 -1.67 132.00 131.72 2jer h PRO 336 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2jer h PRO 336 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2jer h PRO 336 CO 0.62 0.02 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 2jer n ASP 337 N -3.53 3.21 -4.89 1.44 9.92 -1.26 -4.97 116.55 116.47 2jer n ASP 337 Ca -0.03 -1.92 -0.21 0.00 -0.53 0.00 0.00 54.79 52.10 2jer n ASP 337 Cb 0.11 -0.24 -0.03 0.00 -0.64 0.00 0.00 41.12 40.31 2jer n ASP 337 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2jer s LYS 338 N -1.23 2.92 -0.26 -1.24 1.02 -0.63 -5.00 119.74 115.31 2jer s LYS 338 Ca 0.33 -1.14 -0.14 0.00 0.02 0.00 0.00 55.97 55.05 2jer s LYS 338 Cb 0.19 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 2jer s LYS 338 CO 0.26 0.16 0.31 0.21 -0.92 0.00 0.00 175.35 175.37 2jer s LYS 339 N -4.01 4.03 -0.25 1.68 2.20 0.20 -4.96 119.74 118.62 2jer s LYS 339 Ca 0.40 -0.06 -0.14 0.00 -0.36 0.00 0.00 55.97 55.80 2jer s LYS 339 Cb -0.07 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.58 2jer s LYS 339 CO 0.28 -0.19 0.35 0.42 -0.36 0.00 0.00 175.35 175.85 2jer s ILE 340 N 1.79 5.21 -0.21 5.43 -1.09 -1.26 -1.05 121.20 130.01 2jer s ILE 340 Ca 0.13 0.54 0.02 0.00 -2.23 0.00 0.00 60.65 59.10 2jer s ILE 340 Cb -0.15 -3.68 0.04 0.00 -1.58 0.00 0.00 42.46 37.09 2jer s ILE 340 CO 0.09 0.20 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.17 2jer s VAL 341 N 1.80 1.99 0.22 2.92 1.01 0.26 -4.96 120.40 123.63 2jer s VAL 341 Ca 0.15 -1.21 -0.27 0.00 0.00 0.00 0.00 61.98 60.65 2jer s VAL 341 Cb -0.15 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.17 2jer s VAL 341 CO 0.09 0.24 0.85 -0.83 0.00 0.00 0.00 175.10 175.45 2jer s GLY 342 N 1.25 2.95 -0.03 4.51 0.00 -1.26 -0.80 107.32 113.95 2jer s GLY 342 Ca -0.02 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.19 2jer s GLY 342 CO -0.09 0.96 -0.12 0.14 0.00 0.00 0.00 173.10 174.00 2jer s VAL 343 N -1.25 0.99 -0.39 1.40 1.01 -0.66 -4.91 120.40 116.58 2jer s VAL 343 Ca 0.40 -0.48 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 2jer s VAL 343 Cb -0.23 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 2jer s VAL 343 CO 0.27 0.29 1.67 0.20 0.00 0.00 0.00 175.10 177.54 2jer s ASN 344 N 0.06 5.99 -0.10 3.32 0.01 -1.26 -1.21 114.94 121.75 2jer s ASN 344 Ca -0.02 1.03 0.14 0.00 -0.71 0.00 0.00 52.86 53.30 2jer s ASN 344 Cb -0.09 -2.53 0.27 0.00 0.41 0.00 0.00 41.25 39.31 2jer s ASN 344 CO 0.01 -1.68 1.13 0.35 -1.51 0.00 0.00 177.10 175.40 2jer n THR 345 N 7.27 1.30 -0.11 1.60 -2.24 -0.32 -4.73 114.28 117.06 2jer n THR 345 Ca 0.20 -1.82 0.07 0.00 -2.27 0.00 0.00 64.05 60.23 2jer n THR 345 Cb 0.48 0.08 0.41 0.00 -2.10 0.00 0.00 70.33 69.20 2jer n THR 345 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2jer h VAL 346 N 2.67 1.01 0.00 2.28 3.04 -1.87 -1.03 116.25 122.36 2jer h VAL 346 Ca -0.03 -0.21 -0.04 0.00 -1.01 0.00 0.00 66.70 65.41 2jer h VAL 346 Cb 1.20 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 30.82 2jer h VAL 346 CO 0.01 0.11 -0.19 -0.33 -1.01 0.00 0.00 177.57 176.17 2jer h GLU 347 N 0.61 0.00 -0.07 4.17 4.39 -1.92 -1.95 114.58 119.80 2jer h GLU 347 Ca 0.26 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.71 2jer h GLU 347 Cb 0.24 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.91 2jer h GLU 347 CO -0.08 0.19 -0.91 0.28 -1.16 0.00 0.00 179.01 177.33 2jer h VAL 348 N 0.00 1.28 0.00 3.13 2.07 -1.51 -3.30 116.25 117.92 2jer h VAL 348 Ca -0.00 -2.11 -0.04 0.00 0.82 0.00 0.00 66.70 65.36 2jer h VAL 348 Cb 0.37 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 2jer h VAL 348 CO 0.02 0.66 -0.21 1.62 0.02 0.00 0.00 177.57 179.68 2jer h VAL 349 N 0.45 1.09 -0.25 2.57 3.04 -0.72 -1.31 116.25 121.13 2jer h VAL 349 Ca -0.09 -0.73 0.07 0.00 -1.01 0.00 0.00 66.70 64.93 2jer h VAL 349 Cb 1.55 1.40 -0.01 0.00 -2.01 0.00 0.00 31.29 32.23 2jer h VAL 349 CO 0.18 0.21 0.22 1.88 -1.01 0.00 0.00 177.57 179.05 2jer h TYR 350 N 0.00 0.00 -0.31 3.17 0.99 -1.54 -1.74 116.97 117.54 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 -1.49 1.10 0.00 3.88 0.00 -0.49 -4.95 105.19 103.23 2jer n GLY 351 Ca 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 1.33 1.13 0.00 -0.02 0.00 -0.65 -5.06 105.19 101.92 2jer n GLY 352 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2jer n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jer n GLY 353 N -0.60 1.80 0.00 -0.02 0.00 -1.25 -4.86 105.19 100.26 2jer n GLY 353 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.18 1.61 5.15 -1.26 -2.65 115.26 117.92 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 0.74 0.00 -1.44 2.04 -1.91 -1.79 117.51 115.15 2jer h ILE 355 Ca 0.00 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 2jer h ILE 355 Cb 0.00 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2jer h ILE 355 CO 0.00 0.06 0.00 1.57 0.00 0.00 0.00 178.15 179.78 2jer n HIS 356 N -5.05 0.00 0.00 1.37 -0.00 -0.33 -3.15 115.22 108.05 2jer n HIS 356 Ca 0.07 -0.03 0.00 0.00 0.46 0.00 0.00 57.72 58.22 2jer n HIS 356 Cb 0.26 -0.10 0.00 0.00 -0.12 0.00 0.00 29.99 30.04 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 0.90 0.00 -4.26 3.57 -5.35 -0.68 -4.55 119.36 109.00 2jer n ILE 358 Ca 0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.32 2jer n ILE 358 Cb 0.04 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 37.83 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 1.29 -0.12 7.28 -4.23 -1.19 -4.28 115.64 114.40 2jer s THR 359 Ca 0.00 -1.98 -0.04 0.00 -1.18 0.00 0.00 61.69 58.49 2jer s THR 359 Cb 0.00 -1.78 0.06 0.00 1.34 0.00 0.00 72.50 72.12 2jer s THR 359 CO 0.00 -0.63 0.18 -1.58 -0.54 0.00 0.00 174.62 172.05 2jer s GLN 360 N -3.42 0.08 0.57 3.99 2.00 -0.58 -2.35 119.66 119.95 2jer s GLN 360 Ca 0.15 0.47 -0.16 0.00 -2.00 0.00 0.00 55.36 53.82 2jer s GLN 360 Cb -0.00 -0.53 -0.05 0.00 0.80 0.00 0.00 33.01 33.24 2jer s GLN 360 CO 0.02 -0.39 1.04 1.14 -0.50 0.00 0.00 175.29 176.60 2jer s GLN 361 N 2.30 3.47 -0.22 1.67 0.00 -1.26 -1.19 119.66 124.43 2jer s GLN 361 Ca 0.04 1.17 0.02 0.00 -0.00 0.00 0.00 55.36 56.58 2jer s GLN 361 Cb -0.13 -2.06 0.04 0.00 0.00 0.00 0.00 33.01 30.87 2jer s GLN 361 CO -0.07 -0.69 -0.13 -2.00 0.00 0.00 0.00 175.29 172.40 2jer s GLU 362 N -4.01 2.37 0.62 9.60 2.12 0.74 -4.69 118.70 125.45 2jer s GLU 362 Ca 0.63 -1.03 -0.16 0.00 0.36 0.00 0.00 54.97 54.77 2jer s GLU 362 Cb -0.15 -2.64 -0.02 0.00 0.26 0.00 0.00 34.13 31.58 2jer s GLU 362 CO 0.35 -0.42 1.10 -1.25 -0.54 0.00 0.00 175.26 174.49 2jer s PRO 363 N 1.26 3.03 0.44 4.30 0.04 -1.26 0.17 135.00 142.97 2jer s PRO 363 Ca -0.02 1.40 -0.25 0.00 0.04 0.00 0.00 61.00 62.16 2jer s PRO 363 Cb -0.17 -1.98 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 2jer s PRO 363 CO -0.08 -1.07 1.29 0.15 0.04 0.00 0.00 177.00 177.32 2jer s LYS 364 N -3.91 3.80 0.28 4.56 1.02 -0.29 -4.21 119.74 120.98 2jer s LYS 364 Ca 0.67 2.10 -0.30 0.00 0.02 0.00 0.00 55.97 58.46 2jer s LYS 364 Cb -0.20 -2.61 -0.11 0.00 -0.52 0.00 0.00 37.83 34.39 2jer s LYS 364 CO 0.37 -0.61 1.55 1.03 -0.92 0.00 0.00 175.35 176.77 2jer s ARG 365 N -2.43 4.16 0.03 1.68 0.52 -1.26 -4.94 118.95 116.70 2jer s ARG 365 Ca 0.60 2.50 0.08 0.00 -0.52 0.00 0.00 55.73 58.39 2jer s ARG 365 Cb -0.37 -3.05 -0.02 0.00 0.52 0.00 0.00 34.95 32.04 2jer s ARG 365 CO 0.46 -0.57 -0.22 0.14 0.02 0.00 0.00 175.30 175.12 2jer s VAL 366 N -0.03 1.80 0.00 3.52 -7.23 -1.26 -4.91 120.40 112.29 2jer s VAL 366 Ca 0.62 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 59.62 2jer s VAL 366 Cb -0.46 -1.54 0.00 0.00 0.56 0.00 0.00 36.38 34.94 2jer s VAL 366 CO 0.47 0.32 0.00 0.61 -0.31 0.00 0.00 175.10 176.19 2jer n GLY 367 N 2.02 1.75 0.07 2.32 0.00 -1.26 -0.07 105.19 110.02 2jer n GLY 367 Ca -0.17 -1.93 0.16 0.00 0.00 0.00 0.00 46.02 44.08 2jer n GLY 367 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93